A0A077Z758_TRITR Loading...

GPI alpha-1,4-mannosyltransferase I, catalytic subunit

Catalytic subunit of the glycosylphosphatidylinositol-mannosyltransferase I complex which catalyzes the transfer of the first mannose, via an alpha-1,4 bond from a dolichol-phosphate-mannose (Dol-P-Man) to the glucosaminyl acyl phosphatidylinositol (GlcN-(acyl)PI) intermediate to generate alpha-D-Man-(1->4)-alpha-D-GlcN-(1->6)-(1-radyl,2-acyl-sn-glycero-3-phospho)-2-acyl-inositol and participates in the sixth step of the glycosylphosphatidylinositol-anchor biosynthesis. S-adenosyl-L-methionine-dependent methyltransferase that catalyzes four methylations of the modified target histidine residue in translation elongation factor 2 (EF-2), to form an intermediate called diphthine methyl ester. The four successive methylation reactions represent the second step of diphthamide biosynthesis.

AlphaFold DB , UniProt , Accession A0A077Z758, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 988 aa.

						>A0A077Z758_TRITR|A0A077Z758
MFIEMADPFATRKPTRLFEQRYPKLREVLQSSEICSTDVGFSWLAKFMNSPNAESFGGQPDWRKLPQATTMYNNSMSRDGQSKMTDSTIYRGKRDCLDRIGIYGWRKRCLYAMILLLVVLIVANISLTFWIMSVLGFSLQGIGGLRISKDKLVVTGHAEFVNTVYLQKLSSPEKTPLMVESNRGVRLTARDQTGNVSSRLILNDGKVQALCDRFDVVNKEGKTVFSALEDEVAVRVENLRIISEGGSVFEGSIQTSIIRPEQDAPLLLESPTRGMDVDVAQDIEILSRAGDFKAEALHNILLESAAGEIALSSRKVYVDRLSRGSERGHMHDIQDRFMEVKFTDVDYVVMTDAARLVASGQSPFGRPTYRYTPLFAWLLLPANRWLCFGKMLFNCFDLLTGWLCVQLAGRYDAFIWYLALLNPFTMIISSRGNAEPLLTCLTLLALFLFVRKRQRAWLGAAVLGAAIHVKLYPIIYIPSVFCHQFLKGLKKRNATSYRRSFVLNAFVRSVLTVFLACCVFLALTTLCYICYGEAYLNEALLYHVGRTDIRHNFSAYFFPLYLLGEEEALLLKTLLSYSAFVLQFMLIAAIAIVYAENDLEFCWFLTTYSFVTFNKVCTSQYFVWYLTFLPVVSGRLSLSTSMAIRMSLIWLFAQAQWLLPAYLLEFHGFNVYLWLWLASVIFHSVNVSIMCTLVVAYNLMLYLIGLGLGGPDDLTLRGLRAGQRCSKLYFEMYTSLLPDGQDMSQLELHFGKEILPCDRELLESGCGKVSNDFGRSRNFFLIEEQIIEEAKNEDVGILVVGDPLGATTHCSLYLQAKEYHIPVEVIHNASVLSAIGCCGLQLYNFGKTVSIVFWTAEYKPESFFDQIEVNLKNGFHTLCLLDLKVKERSVENIIRDRKIYEPPRFMLANEAARILMDIWERRRKMGNPTVLQSTTRCVGLARIGWHSQQIVCRSLKDMCHVNLGPPLHSVAIVGETHELEDSMLSLWE
					

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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	35.3	Very low	35	Very low	199 Å²	199	139.7 Å²	139.7	98%	0.98	75%	0.75	S	S	*	*				0	-65.2	0	-115.5	-172.9	-76.5	0	0	112.2	I3 E4	M1-I3 VanDerWaalsContact C-N 3.34Å; M1-I3 PolarHBondContact O-N 3.1Å; M1-E4 PolarHBondContact O-N 2.85Å
2	F	31.4	Very low	34.8	Very low	185 Å²	185	147.5 Å²	147.5	81%	0.811	76%	0.761	S	S	*	*	H	α-helix	trans	-65.5	-31.7	178.2	-96.6	-84.9	0	0	0	114.6	E4 M5	F2-E4 VanDerWaalsContact C-N 3.32Å; F2-E4 PolarHBondContact O-N 2.94Å; F2-M5 PolarHBondContact O-N 2.96Å
3	I	36.6	Very low	34.6	Very low	158 Å²	158	151.2 Å²	151.2	81%	0.81	77%	0.768	S	S	*	*	H	α-helix	trans	-69	-29.2	179.5	-62.5	175.3	0	0	0	112	M1	M1-I3 VanDerWaalsContact C-N 3.34Å; M1-I3 PolarHBondContact O-N 3.1Å
4	E	36.3	Very low	34.5	Very low	164 Å²	164	148.4 Å²	148.4	77%	0.766	77%	0.765	S	S	*	*	H	α-helix	trans	-81.6	-18.7	178.1	-76.6	178.2	148.4	0	0	113.3	M1 F2	M1-E4 PolarHBondContact O-N 2.85Å; F2-E4 VanDerWaalsContact C-N 3.32Å; F2-E4 PolarHBondContact O-N 2.94Å
5	M	32.9	Very low	34.7	Very low	166 Å²	166	145.7 Å²	145.7	82%	0.818	76%	0.758	S	S	*	*	H	α-helix	trans	-83.9	-13.6	174.8	-76.5	-174.6	161.8	0	0	113.2	F2	F2-M5 PolarHBondContact O-N 2.96Å
6	A	34.3	Very low	34.9	Very low	76 Å²	76	149.5 Å²	149.5	63%	0.628	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	7	-174.1	0	0	0	0	0	113.9	P8	A6-P8 WeakPolarHBondContact O-CD 3.29Å
7	D	38.9	Very low	35.3	Very low	94 Å²	94	148.5 Å²	148.5	50%	0.503	76%	0.756	S	S	.	*			trans	-93.5	101.6	176.9	-165.3	-10	0	0	0	111.1	F9 A10	D7-F9 PolarHBondContact O-N 2.63Å; D7-F9 VanDerWaalsContact O-N 3.07Å; D7-F9 PolarHBondContact OD1-N 3.04Å; D7-A10 PolarHBondContact O-N 3.01Å
8	P	37	Very low	35.6	Very low	112 Å²	112	149.1 Å²	149.1	73%	0.727	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-2.5	178.9	28.3	-34.6	0	0	0	113.7	A6	A6-P8 WeakPolarHBondContact O-CD 3.29Å
9	F	34.6	Very low	35.7	Very low	173 Å²	173	149.5 Å²	149.5	76%	0.759	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	3.8	178.5	-70.3	-77.9	0	0	0	115.1	D7 T11	D7-F9 PolarHBondContact O-N 2.63Å; D7-F9 VanDerWaalsContact O-N 3.07Å; D7-F9 PolarHBondContact OD1-N 3.04Å; F9-T11 VanDerWaalsContact C-N 3.26Å; F9-T11 PolarHBondContact O-N 3.17Å
10	A	34.6	Very low	36.3	Very low	77 Å²	77	150.2 Å²	150.2	64%	0.636	75%	0.752	S	S	*	*			trans	-80.2	62.1	177.6	0	0	0	0	0	113.3	D7 R12	D7-A10 PolarHBondContact O-N 3.01Å; A10-R12 PolarHBondContact O-N 3.35Å
11	T	33.2	Very low	36.9	Very low	133 Å²	133	151.8 Å²	151.8	82%	0.816	75%	0.749	S	S	*	*			trans	-74.6	66.2	169.4	49.1	0	0	0	0	111.8	F9	F9-T11 VanDerWaalsContact C-N 3.26Å; F9-T11 PolarHBondContact O-N 3.17Å
12	R	32.8	Very low	37.6	Very low	233 Å²	233	148.3 Å²	148.3	88%	0.879	73%	0.726	S	S	*	*	S	Bend	trans	-139.4	108.5	165.3	-73.8	-168.4	177.1	-179.4	0.3	111.6	A10	A10-R12 PolarHBondContact O-N 3.35Å
13	K	32.1	Very low	38.1	Very low	196 Å²	196	144 Å²	144	85%	0.852	72%	0.716	S	S	*	*			trans	-18.5	106.9	171.1	-67.8	176.5	175.8	178.9	0	115.2
14	P	33.1	Very low	38.5	Very low	111 Å²	111	144.2 Å²	144.2	72%	0.721	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-7.3	-178.6	-10.4	27.1	0	0	0	115.3	R16	P14-R16 PolarHBondContact O-N 2.93Å
15	T	37.2	Very low	38.6	Very low	109 Å²	109	141.6 Å²	141.6	67%	0.669	70%	0.702	S	S	*	*	H	α-helix	trans	-72.4	-22.5	-169.7	26.2	0	0	0	0	115
16	R	38.7	Very low	38.7	Very low	206 Å²	206	142.7 Å²	142.7	78%	0.777	70%	0.697	S	S	*	*	H	α-helix	trans	-84	-24.2	-178	-95.7	-175.4	176.2	178.6	-1.3	115.5	P14	P14-R16 PolarHBondContact O-N 2.93Å
17	L	42	Very low	39	Very low	132 Å²	132	145.5 Å²	145.5	69%	0.691	70%	0.697	S	S	*	*	H	α-helix	trans	-79	-27.4	-176.6	-122.4	100	0	0	0	112.7
18	F	39.1	Very low	39	Very low	159 Å²	159	146 Å²	146	70%	0.697	70%	0.703	S	S	*	*	H	α-helix	trans	-76.1	-35.4	-178.7	-145.4	-93.6	0	0	0	112	Y22	F18-Y22 HydrophobicContact CE1-CD2 4.43Å; F18-Y22 HydrophobicContact CZ-CE2 4.41Å
19	E	39.2	Very low	38.8	Very low	157 Å²	157	147 Å²	147	73%	0.734	70%	0.702	S	S	*	*	H	α-helix	trans	-72	-30	178.3	-69.8	-176.7	160.4	0	0	113.3
20	Q	47.2	Very low	38.9	Very low	163 Å²	163	146.3 Å²	146.3	76%	0.762	70%	0.701	S	S	*	*	H	α-helix	trans	-76.8	-24.5	178.2	-80.1	-172.3	-17.7	0	0	113.8
21	R	49.4	Very low	38.7	Very low	184 Å²	184	147 Å²	147	69%	0.694	70%	0.702	S	S	*	*	H	α-helix	trans	-88.7	-16.2	-170	-146	168.2	-170.2	161.8	1.3	114
22	Y	49.6	Very low	38.5	Very low	127 Å²	127	144.7 Å²	144.7	50%	0.498	69%	0.691	S	S	.	*			trans	-135.7	55.1	-175.5	-54.6	-76.5	0	0	0	114.3	F18 K24 L25	F18-Y22 HydrophobicContact CE1-CD2 4.43Å; F18-Y22 HydrophobicContact CZ-CE2 4.41Å; Y22-K24 PolarHBondContact O-N 2.83Å; Y22-K24 VanDerWaalsContact O-N 3.17Å; Y22-L25 PolarHBondContact O-N 3.12Å; Y22-L25 VanDerWaalsContact O-N 3.15Å
23	P	42	Very low	38.3	Very low	93 Å²	93	142.4 Å²	142.4	60%	0.604	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-29.4	179.2	22.5	-31.4	0	0	0	113.1	L25 R26	P23-L25 VanDerWaalsContact C-N 3.27Å; P23-L25 PolarHBondContact O-N 3.31Å; P23-R26 PolarHBondContact O-N 2.72Å
24	K	45.4	Very low	38.1	Very low	163 Å²	163	140.4 Å²	140.4	71%	0.709	69%	0.687	S	S	*	*	H	α-helix	trans	-69.3	-16.1	179.2	-77	-173	173.7	-174.3	0	115	Y22 R26 V28	Y22-K24 PolarHBondContact O-N 2.83Å; Y22-K24 VanDerWaalsContact O-N 3.17Å; K24-R26 VanDerWaalsContact C-N 3.27Å; K24-R26 PolarHBondContact O-N 3.01Å; K24-V28 PolarHBondContact O-N 2.84Å
25	L	38	Very low	37.8	Very low	110 Å²	110	139.7 Å²	139.7	58%	0.576	68%	0.684	S	S	*	*	H	α-helix	trans	-73.6	-22.5	176.6	-117.8	112.4	0	0	0	112.4	Y22 P23 L29	Y22-L25 PolarHBondContact O-N 3.12Å; Y22-L25 VanDerWaalsContact O-N 3.15Å; P23-L25 VanDerWaalsContact C-N 3.27Å; P23-L25 PolarHBondContact O-N 3.31Å; L25-L29 PolarHBondContact O-N 3.28Å
26	R	35.3	Very low	37.2	Very low	189 Å²	189	139.8 Å²	139.8	71%	0.713	69%	0.688	S	S	*	*	H	α-helix	trans	-72.3	-36.9	176	-156.1	179.7	-163	175.4	5	112	P23 K24 L29 Q30	P23-R26 PolarHBondContact O-N 2.72Å; K24-R26 VanDerWaalsContact C-N 3.27Å; K24-R26 PolarHBondContact O-N 3.01Å; R26-L29 PolarHBondContact O-N 3.3Å; R26-Q30 PolarHBondContact O-N 3.34Å
27	E	40.1	Very low	36.6	Very low	134 Å²	134	135.4 Å²	135.4	63%	0.626	69%	0.685	S	S	*	*	H	α-helix	trans	-66.8	-41.5	176.2	-79.2	179.2	158.5	0	0	111.5	L29 Q30 S31	E27-L29 VanDerWaalsContact C-N 3.28Å; E27-L29 PolarHBondContact O-N 2.88Å; E27-Q30 PolarHBondContact O-N 2.84Å; E27-S31 WeakPolarHBondContact O-CB 3.39Å; E27-S31 PolarHBondContact O-N 2.85Å; E27-S31 PolarHBondContact O-OG 2.94Å
28	V	38.7	Very low	36	Very low	104 Å²	104	136.7 Å²	136.7	63%	0.63	69%	0.693	S	S	*	*	H	α-helix	trans	-65.9	-31.9	178.8	178.5	0	0	0	0	112.2	K24	K24-V28 PolarHBondContact O-N 2.84Å
29	L	33.1	Very low	35.6	Very low	135 Å²	135	134.3 Å²	134.3	71%	0.707	69%	0.691	S	S	*	*	H	α-helix	trans	-81.9	-14.8	177.5	-74.3	169.7	0	0	0	113.9	L25 R26 E27	L25-L29 PolarHBondContact O-N 3.28Å; R26-L29 PolarHBondContact O-N 3.3Å; E27-L29 VanDerWaalsContact C-N 3.28Å; E27-L29 PolarHBondContact O-N 2.88Å
30	Q	35.9	Very low	35	Very low	158 Å²	158	130.2 Å²	130.2	74%	0.738	69%	0.691	S	S	*	*	H	α-helix	trans	-106	-12.9	178.5	-74.2	-170.5	-34.8	0	0	114.3	R26 E27	R26-Q30 PolarHBondContact O-N 3.34Å; E27-Q30 PolarHBondContact O-N 2.84Å
31	S	31.2	Very low	34.3	Very low	92 Å²	92	130.3 Å²	130.3	64%	0.643	69%	0.689	S	S	*	*			trans	-105.1	14.4	-176.6	77.1	0	0	0	0	115.4	E27 E33	E27-S31 WeakPolarHBondContact O-CB 3.39Å; E27-S31 PolarHBondContact O-N 2.85Å; E27-S31 PolarHBondContact O-OG 2.94Å; S31-E33 PolarHBondContact O-N 2.86Å
32	S	29.2	Very low	33.4	Very low	83 Å²	83	125.9 Å²	125.9	58%	0.58	69%	0.686	S	S	*	*			trans	-84	63.7	173.6	64.6	0	0	0	0	111.7	I34	S32-I34 PolarHBondContact O-N 2.58Å
33	E	28.4	Very low	32.5	Very low	186 Å²	186	129.6 Å²	129.6	87%	0.869	70%	0.699	S	S	*	*			trans	-72.5	72.4	148.2	-79	-176.4	156.3	0	0	107	S31 C35	S31-E33 PolarHBondContact O-N 2.86Å; E33-C35 VanDerWaalsContact C-N 3.31Å; E33-C35 PolarHBondContact O-N 2.75Å
34	I	27.8	Very low	31.9	Very low	154 Å²	154	130.1 Å²	130.1	79%	0.79	70%	0.696	S	S	*	*			trans	-77.4	98	168.6	-64.3	175.7	0	0	0	105.7	S32 S36	S32-I34 PolarHBondContact O-N 2.58Å; I34-S36 PolarHBondContact O-N 2.87Å
35	C	26.6	Very low	31.3	Very low	96 Å²	96	124.8 Å²	124.8	65%	0.649	68%	0.683	S	S	*	*			trans	-30.7	130.9	169.2	-71.8	0	0	0	0	112.4	E33 T37	E33-C35 VanDerWaalsContact C-N 3.31Å; E33-C35 PolarHBondContact O-N 2.75Å; C35-T37 PolarHBondContact O-N 2.82Å
36	S	25.1	Very low	31.1	Very low	110 Å²	110	127.6 Å²	127.6	77%	0.769	69%	0.69	S	S	*	*			trans	-49.6	87.1	155.5	52.7	0	0	0	0	110.2	I34 D38	I34-S36 PolarHBondContact O-N 2.87Å; S36-D38 PolarHBondContact O-N 2.68Å
37	T	26.2	Very low	30.8	Very low	114 Å²	114	126.5 Å²	126.5	70%	0.699	69%	0.691	S	S	*	*			trans	-78.8	99.9	163.2	41.3	0	0	0	0	107.3	C35 V39	C35-T37 PolarHBondContact O-N 2.82Å; T37-V39 PolarHBondContact O-N 2.89Å
38	D	28.2	Very low	30.3	Very low	160 Å²	160	127.3 Å²	127.3	86%	0.856	70%	0.697	S	S	*	*			trans	-56.1	75.6	163.2	-80.1	-42.2	0	0	0	110	S36 G40	S36-D38 PolarHBondContact O-N 2.68Å; D38-G40 PolarHBondContact O-N 3.13Å
39	V	30.3	Very low	30	Very low	109 Å²	109	128.8 Å²	128.8	66%	0.661	70%	0.701	S	S	*	*			trans	-83.8	97.4	167.4	-174.8	0	0	0	0	106.4	T37 F41	T37-V39 PolarHBondContact O-N 2.89Å; V39-F41 VanDerWaalsContact O-CD2 3.32Å; V39-F41 WeakPolarHBondContact O-CD2 3.49Å; V39-F41 PolarHBondContact O-N 2.78Å; V39-F41 VanDerWaalsContact O-N 3.1Å
40	G	28.1	Very low	29.7	Very low	71 Å²	71	125.8 Å²	125.8	73%	0.732	69%	0.692	S	S	*	*			trans	-49.8	109.2	-172.4	0	0	0	0	0	114.7	D38 S42	D38-G40 PolarHBondContact O-N 3.13Å; G40-S42 PolarHBondContact O-N 2.79Å; G40-S42 VanDerWaalsContact O-N 3.14Å
41	F	31.8	Very low	29.5	Very low	164 Å²	164	123.7 Å²	123.7	72%	0.719	69%	0.691	S	S	*	*			trans	-81.6	41.7	164.4	-76.1	-84.2	0	0	0	112.1	V39 W43 L44	V39-F41 VanDerWaalsContact O-CD2 3.32Å; V39-F41 WeakPolarHBondContact O-CD2 3.49Å; V39-F41 PolarHBondContact O-N 2.78Å; V39-F41 VanDerWaalsContact O-N 3.1Å; F41-W43 PolarHBondContact O-N 3.2Å; F41-L44 HydrophobicContact CD1-CD1 3.97Å; F41-L44 PolarHBondContact O-N 3.41Å
42	S	31.2	Very low	29.3	Very low	91 Å²	91	126.3 Å²	126.3	64%	0.636	70%	0.698	S	S	*	*	H	α-helix	trans	-71.2	-16.4	-174.4	111.5	0	0	0	0	113.6	G40	G40-S42 PolarHBondContact O-N 2.79Å; G40-S42 VanDerWaalsContact O-N 3.14Å
43	W	31	Very low	29.1	Very low	205 Å²	205	127.1 Å²	127.1	78%	0.777	71%	0.71	S	S	*	*	H	α-helix	trans	-81.4	-26.3	177.6	-155.3	73.9	0	0	0	113.6	F41	F41-W43 PolarHBondContact O-N 3.2Å
44	L	28.3	Very low	29	Very low	104 Å²	104	126.4 Å²	126.4	55%	0.545	71%	0.707	S	S	.	*	H	α-helix	trans	-76.7	-32.7	175.8	-99.3	148.5	0	0	0	112.4	F41 F47 M48	F41-L44 HydrophobicContact CD1-CD1 3.97Å; F41-L44 PolarHBondContact O-N 3.41Å; L44-F47 PolarHBondContact O-N 2.78Å; L44-M48 PolarHBondContact O-N 2.75Å
45	A	33.8	Very low	28.9	Very low	51 Å²	51	124.3 Å²	124.3	42%	0.421	71%	0.706	S	S	.	*	H	α-helix	trans	-70.6	-29	175.4	0	0	0	0	0	113.3	N49	A45-N49 PolarHBondContact O-N 2.79Å
46	K	33.3	Very low	28.8	Very low	170 Å²	170	130.4 Å²	130.4	74%	0.739	72%	0.722	S	S	*	*	H	α-helix	trans	-74.1	-27.7	175.5	-95.3	-176	175.8	179.4	0	113.6
47	F	28.2	Very low	28.7	Very low	166 Å²	166	129.1 Å²	129.1	73%	0.728	73%	0.726	S	S	*	*	H	α-helix	trans	-77.4	-28	176	-144.7	-91.9	0	0	0	112.2	L44	L44-F47 PolarHBondContact O-N 2.78Å
48	M	30.1	Very low	28.7	Very low	150 Å²	150	127 Å²	127	74%	0.739	73%	0.726	S	S	*	*	H	α-helix	trans	-81.6	-15.7	177.5	-66.5	-160.8	-61.7	0	0	114.6	L44	L44-M48 PolarHBondContact O-N 2.75Å
49	N	32.4	Very low	28.5	Very low	136 Å²	136	127.2 Å²	127.2	73%	0.727	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	24.6	-177.7	-78.2	-12.4	0	0	0	114.5	A45 P51	A45-N49 PolarHBondContact O-N 2.79Å; N49-P51 WeakPolarHBondContact O-CD 3.49Å
50	S	27.7	Very low	28.3	Very low	72 Å²	72	126.4 Å²	126.4	50%	0.503	72%	0.719	S	S	.	*			trans	-82.4	117.4	167.1	155.1	0	0	0	0	109.6	N52	S50-N52 PolarHBondContact O-N 2.85Å
51	P	30.2	Very low	28.3	Very low	113 Å²	113	128.5 Å²	128.5	73%	0.734	71%	0.713	S	S	*	*	S	Bend	trans	-70.5	10.3	-175.1	-16.3	30.6	0	0	0	116.4	N49 A53	N49-P51 WeakPolarHBondContact O-CD 3.49Å; P51-A53 VanDerWaalsContact C-N 3.35Å; P51-A53 PolarHBondContact O-N 2.87Å
52	N	28.2	Very low	28	Very low	147 Å²	147	130 Å²	130	79%	0.786	71%	0.714	S	S	*	*			trans	-94.5	25.9	-172.3	-72.3	-8.2	0	0	0	114.6	S50	S50-N52 PolarHBondContact O-N 2.85Å
53	A	24.3	Very low	27.9	Very low	101 Å²	101	136 Å²	136	84%	0.835	72%	0.723	S	S	*	*			trans	-105.5	40	172.9	0	0	0	0	0	111.6	P51	P51-A53 VanDerWaalsContact C-N 3.35Å; P51-A53 PolarHBondContact O-N 2.87Å
54	E	26.5	Very low	27.6	Very low	171 Å²	171	134.9 Å²	134.9	80%	0.799	72%	0.723	S	S	*	*			trans	-109.3	142.8	164	-71.3	-175.1	168.8	0	0	108.2
55	S	25.1	Very low	27.5	Very low	109 Å²	109	137.9 Å²	137.9	76%	0.762	74%	0.739	S	S	*	*			trans	80	67.2	177	88	0	0	0	0	118.5
56	F	25.2	Very low	27.3	Very low	225 Å²	225	141.1 Å²	141.1	99%	0.987	76%	0.756	S	S	*	*			trans	-132.9	52.1	143	-87.9	-80.9	0	0	0	109.8
57	G	23.7	Very low	27	Very low	83 Å²	83	141.9 Å²	141.9	86%	0.856	76%	0.762	S	S	*	*			trans	-111	56.4	168	0	0	0	0	0	109.8
58	G	24.4	Very low	26.9	Very low	68 Å²	68	138.3 Å²	138.3	70%	0.701	76%	0.764	S	S	*	*			trans	-102.3	99.8	173.5	0	0	0	0	0	109
59	Q	24.3	Very low	26.7	Very low	166 Å²	166	137.2 Å²	137.2	78%	0.776	77%	0.765	S	S	*	*			trans	-57.5	128.5	169.8	-131.6	175.9	-6.6	0	0	108.6	D61 W62	Q59-D61 PolarHBondContact O-N 2.69Å; Q59-W62 HydrophobicContact CG-CH2 4.33Å
60	P	27.2	Very low	26.4	Very low	92 Å²	92	136.8 Å²	136.8	60%	0.597	77%	0.768	S	S	*	*			trans	-67	118.4	-179.7	-13.3	26.6	0	0	0	109.8	W62	P60-W62 HydrophobicContact CB-CE3 4.47Å; P60-W62 VanDerWaalsContact O-CD2 3.26Å; P60-W62 WeakPolarHBondContact O-CZ3 3.07Å; P60-W62 PolarHBondContact O-N 2.74Å; P60-W62 VanDerWaalsContact O-N 3.11Å
61	D	27.7	Very low	26.3	Very low	114 Å²	114	141.3 Å²	141.3	61%	0.61	78%	0.783	S	S	*	*			trans	-76.4	98	174.3	-171.2	4.2	0	0	0	109.6	Q59 R63	Q59-D61 PolarHBondContact O-N 2.69Å; D61-R63 PolarHBondContact O-N 3.28Å
62	W	25.6	Very low	26	Very low	196 Å²	196	146.5 Å²	146.5	74%	0.742	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	19.6	-178.8	28.8	72.1	0	0	0	114.8	Q59 P60	Q59-W62 HydrophobicContact CG-CH2 4.33Å; P60-W62 HydrophobicContact CB-CE3 4.47Å; P60-W62 VanDerWaalsContact O-CD2 3.26Å; P60-W62 WeakPolarHBondContact O-CZ3 3.07Å; P60-W62 PolarHBondContact O-N 2.74Å; P60-W62 VanDerWaalsContact O-N 3.11Å
63	R	28.2	Very low	25.9	Very low	218 Å²	218	147 Å²	147	82%	0.823	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	11.6	178	-71.9	-172.6	173.5	179.5	0.6	115.4	D61	D61-R63 PolarHBondContact O-N 3.28Å
64	K	26	Very low	26.1	Very low	180 Å²	180	149.5 Å²	149.5	78%	0.783	79%	0.792	S	S	*	*			trans	-129.1	67.8	178.2	-66.2	-174.5	-177.8	174.7	0	113.2
65	L	24.8	Very low	26	Very low	167 Å²	167	145.5 Å²	145.5	87%	0.874	78%	0.783	S	S	*	*			trans	-95.9	109.5	153.8	-88.9	157.4	0	0	0	108	Q67	L65-Q67 PolarHBondContact O-N 2.82Å
66	P	29.7	Very low	26	Very low	120 Å²	120	149 Å²	149	78%	0.779	79%	0.789	S	S	*	*			trans	-72	114.6	170.6	-2	17.7	0	0	0	108.3	A68	P66-A68 PolarHBondContact O-N 2.89Å
67	Q	28.4	Very low	26.1	Very low	185 Å²	185	143.9 Å²	143.9	86%	0.864	78%	0.781	S	S	*	*			trans	-64.2	122.2	163.2	-81.5	-175.7	-10.1	0	0	108.3	L65 T69	L65-Q67 PolarHBondContact O-N 2.82Å; Q67-T69 PolarHBondContact O-N 3.21Å
68	A	24.6	Very low	26.1	Very low	92 Å²	92	150.3 Å²	150.3	76%	0.76	78%	0.78	S	S	*	*			trans	-52.8	103.4	176.5	0	0	0	0	0	110.6	P66 T70	P66-A68 PolarHBondContact O-N 2.89Å; A68-T70 PolarHBondContact O-N 2.98Å; A68-T70 VanDerWaalsContact O-N 3.11Å
69	T	26.4	Very low	26.2	Very low	126 Å²	126	154.6 Å²	154.6	77%	0.773	79%	0.786	S	S	*	*			trans	-69.3	97.4	160.1	36	0	0	0	0	108.1	Q67 M71	Q67-T69 PolarHBondContact O-N 3.21Å; T69-M71 VanDerWaalsContact C-N 3.34Å; T69-M71 PolarHBondContact O-N 3.05Å
70	T	26.5	Very low	26.1	Very low	127 Å²	127	149.8 Å²	149.8	78%	0.779	78%	0.782	S	S	*	*			trans	-68.1	96	165.4	-39	0	0	0	0	107.8	A68 Y72	A68-T70 PolarHBondContact O-N 2.98Å; A68-T70 VanDerWaalsContact O-N 3.11Å; T70-Y72 PolarHBondContact O-N 3.12Å
71	M	24.6	Very low	26	Very low	168 Å²	168	154.6 Å²	154.6	83%	0.828	80%	0.796	S	S	*	*			trans	-64.7	114.1	164.7	-74.9	-171.2	-169	0	0	108.9	T69	T69-M71 VanDerWaalsContact C-N 3.34Å; T69-M71 PolarHBondContact O-N 3.05Å
72	Y	25.2	Very low	25.8	Very low	222 Å²	222	154.2 Å²	154.2	87%	0.871	80%	0.803	S	S	*	*			trans	-138	83.2	149.3	-104.8	-84.2	0	0	0	108	T70	T70-Y72 PolarHBondContact O-N 3.12Å
73	N	25.2	Very low	25.7	Very low	156 Å²	156	154.1 Å²	154.1	83%	0.834	81%	0.808	S	S	*	*			trans	-120.3	106.6	158.6	-97.7	-16.7	0	0	0	106.2
74	N	29.3	Very low	25.4	Very low	154 Å²	154	152.5 Å²	152.5	82%	0.824	81%	0.811	S	S	*	*			trans	-160.2	96.6	147.4	-97.8	-15.2	0	0	0	109
75	S	24.9	Very low	25.4	Very low	88 Å²	88	149.5 Å²	149.5	62%	0.615	81%	0.808	S	S	*	*				42.6	133.9	124.3	65.3	0	0	0	0	120.8
76	M	24.8	Very low	25.5	Very low	182 Å²	182	148.7 Å²	148.7	90%	0.897	81%	0.805	S	S	*	*			trans	77.3	127.7	151.4	-65.3	161	160.2	0	0	113.9
77	S	27.5	Very low	25.4	Very low	118 Å²	118	148.9 Å²	148.9	83%	0.825	81%	0.809	S	S	*	*			cis	-161	149.3	33.1	41.6	0	0	0	0	111.6
78	R	23.1	Very low	25.3	Very low	218 Å²	218	145.6 Å²	145.6	82%	0.823	80%	0.802	S	S	*	*			trans	-44.3	159.1	159.7	-106.9	174.7	-177	172.6	0.6	115.2
79	D	25.9	Very low	25.5	Very low	157 Å²	157	147.4 Å²	147.4	84%	0.84	80%	0.797	S	S	*	*			trans	74.7	122.6	156.8	-50.8	-29.7	0	0	0	113.7
80	G	23.4	Very low	25.5	Very low	66 Å²	66	151.2 Å²	151.2	68%	0.68	80%	0.799	S	S	*	*			cis	148.2	163.2	22	0	0	0	0	0	106.2
81	Q	23.7	Very low	25.5	Very low	193 Å²	193	156.9 Å²	156.9	90%	0.902	81%	0.806	S	S	*	*			trans	83.1	134.3	161.5	-59.3	-175.2	-17.8	0	0	120.4
82	S	24.2	Very low	26	Very low	106 Å²	106	152.4 Å²	152.4	74%	0.741	80%	0.803	S	S	*	*			trans	101.5	99.2	142.8	79.4	0	0	0	0	114.1
83	K	23	Very low	26.1	Very low	194 Å²	194	148.9 Å²	148.9	84%	0.843	79%	0.792	S	S	*	*				65	92	90.8	-78.6	-175.7	174	179.5	0	109.5
84	M	21.8	Very low	26.3	Very low	183 Å²	183	152.8 Å²	152.8	90%	0.901	80%	0.795	S	S	*	*				68.6	94	82.7	-167	178.2	-161.5	0	0	111.7
85	T	27.2	Very low	26.5	Very low	117 Å²	117	151.4 Å²	151.4	72%	0.718	79%	0.787	S	S	*	*			trans	-161.5	108.7	155.5	38	0	0	0	0	106.2
86	D	26.5	Very low	27.2	Very low	150 Å²	150	152.9 Å²	152.9	80%	0.802	80%	0.796	S	S	*	*				97	87.6	100.5	-74.8	-24.9	0	0	0	111.5
87	S	27.2	Very low	27.2	Very low	124 Å²	124	149.5 Å²	149.5	87%	0.867	78%	0.782	S	S	*	*			trans	-110.5	111.9	155.2	64.4	0	0	0	0	109.5
88	T	26.4	Very low	27.7	Very low	116 Å²	116	151.5 Å²	151.5	71%	0.712	78%	0.783	S	S	*	*			trans	-76	148.1	171.8	-9.8	0	0	0	0	110.8
89	I	28.1	Very low	28	Very low	130 Å²	130	151.9 Å²	151.9	67%	0.667	79%	0.785	S	S	*	*			trans	98.8	130	146.3	-48.4	146.7	0	0	0	119.1
90	Y	28.1	Very low	28.6	Very low	206 Å²	206	152 Å²	152	81%	0.808	78%	0.783	S	S	*	*			trans	89.5	91.7	171.1	-62.6	-65.9	0	0	0	116.7
91	R	26.2	Very low	29.3	Very low	247 Å²	247	151.6 Å²	151.6	93%	0.932	78%	0.779	S	S	*	*				45.8	127.5	77.9	-76	-176.1	170.9	177	-2.2	112.4
92	G	33.8	Very low	30.4	Very low	73 Å²	73	148.9 Å²	148.9	75%	0.753	77%	0.769	S	S	*	*			cis	175	139.4	5.4	0	0	0	0	0	108.7	R94	G92-R94 PolarHBondContact O-N 3.17Å
93	K	27.9	Very low	31.2	Very low	148 Å²	148	154.6 Å²	154.6	64%	0.643	78%	0.776	S	S	*	*			trans	-60.5	127	162.4	-103.1	177.2	166.3	-163.8	0	108.3	D95 C96 L97	K93-D95 PolarHBondContact O-N 3.48Å; K93-C96 PolarHBondContact NZ-O 2.88Å; K93-L97 HydrophobicContact CD-CD1 3.58Å
94	R	29.1	Very low	32.8	Very low	238 Å²	238	146.9 Å²	146.9	90%	0.898	75%	0.752	S	S	*	*			trans	-78.2	105.2	145.6	-97	-179.6	176.3	161	-1.7	106.2	G92	G92-R94 PolarHBondContact O-N 3.17Å
95	D	34	Very low	34.5	Very low	125 Å²	125	147.3 Å²	147.3	67%	0.668	74%	0.744	S	S	*	*	S	Bend	trans	71	157.9	157.1	-47.1	-31.3	0	0	0	116.6	K93	K93-D95 PolarHBondContact O-N 3.48Å
96	C	39.6	Very low	36.2	Very low	119 Å²	119	150.3 Å²	150.3	80%	0.804	74%	0.742	S	S	*	*			trans	74.1	69.5	172	-51.9	0	0	0	0	116.5	K93	K93-C96 PolarHBondContact NZ-O 2.88Å
97	L	25.5	Very low	37.6	Very low	112 Å²	112	148.4 Å²	148.4	59%	0.586	73%	0.727	S	S	*	*			trans	-126.6	76.8	-178.2	-163.8	111.3	0	0	0	110.4	K93	K93-L97 HydrophobicContact CD-CD1 3.58Å
98	D	37.6	Very low	39.6	Very low	160 Å²	160	152.2 Å²	152.2	86%	0.856	72%	0.722	S	S	*	*			trans	-106.7	113.9	156	-84.2	-35.9	0	0	0	108.8	I100	D98-I100 PolarHBondContact O-N 2.97Å
99	R	29.1	Very low	41.8	Very low	226 Å²	226	150.3 Å²	150.3	85%	0.853	71%	0.712	S	S	*	*			trans	-75.4	101.8	178.1	-69.6	-179.1	-176.1	-169.3	1.6	109.1
100	I	37.9	Very low	44	Very low	159 Å²	159	148.2 Å²	148.2	82%	0.815	70%	0.702	S	S	*	*			trans	-116.1	63.5	157.7	-52.4	176.7	0	0	0	107.4	D98	D98-I100 PolarHBondContact O-N 2.97Å
101	G	37.7	Very low	46.4	Very low	58 Å²	58	144.8 Å²	144.8	60%	0.598	69%	0.689	S	S	*	*			trans	-87.6	110.3	172.1	0	0	0	0	0	109.3	Y103	G101-Y103 PolarHBondContact O-N 2.8Å
102	I	47	Very low	49	Very low	135 Å²	135	135.8 Å²	135.8	69%	0.692	67%	0.667	S	S	*	*			trans	-67.4	79	164.7	-58.6	172.3	0	0	0	107.2
103	Y	42.1	Very low	51.3	Low	226 Å²	226	137.7 Å²	137.7	89%	0.886	66%	0.658	S	S	*	*			trans	-85.3	113.4	169.7	-116.1	-99.2	0	0	0	106.4	G101	G101-Y103 PolarHBondContact O-N 2.8Å
104	G	55.5	Low	53.9	Low	32 Å²	32	134.7 Å²	134.7	33%	0.33	65%	0.648	S	S	.	*	S	Bend	trans	178.7	148	-179.9	0	0	0	0	0	110.1	R106 K107	G104-R106 PolarHBondContact O-N 2.85Å; G104-K107 PolarHBondContact O-N 3.42Å
105	W	57.9	Low	56.5	Low	192 Å²	192	128.9 Å²	128.9	73%	0.727	63%	0.634	S	S	*	*	H	α-helix	trans	-38.5	-29.3	175.2	63.6	-78.7	0	0	0	114.3	K107 R108 C109	W105-K107 VanDerWaalsContact C-N 3.34Å; W105-K107 PolarHBondContact O-N 2.76Å; W105-R108 PolarHBondContact O-N 3.19Å; W105-C109 WeakPolarHBondContact O-CB 3.37Å; W105-C109 PolarHBondContact O-N 3.41Å
106	R	62.6	Low	59.1	Low	180 Å²	180	128.2 Å²	128.2	68%	0.679	63%	0.63	S	S	*	*	H	α-helix	trans	-50.8	-42.3	170.8	-67.1	-174.7	178.4	-178.7	-0.3	114.5	G104 C109 L110	G104-R106 PolarHBondContact O-N 2.85Å; R106-C109 PolarHBondContact O-N 3.42Å; R106-L110 WeakPolarHBondContact O-CB 3.42Å; R106-L110 PolarHBondContact O-N 3.22Å
107	K	57.3	Low	61.4	Low	111 Å²	111	127.5 Å²	127.5	48%	0.483	62%	0.617	S	S	.	*	H	α-helix	trans	-73.8	-36.5	179.6	-143.7	179.8	-171.3	-179.9	0	111.8	G104 W105 L110 Y111	G104-K107 PolarHBondContact O-N 3.42Å; W105-K107 VanDerWaalsContact C-N 3.34Å; W105-K107 PolarHBondContact O-N 2.76Å; K107-L110 PolarHBondContact O-N 2.61Å; K107-Y111 HydrophobicContact CD-CE2 4.06Å; K107-Y111 WeakPolarHBondContact CE-OH 3.42Å; K107-Y111 HydrophobicContact CG-CD2 4.31Å; K107-Y111 HydrophobicContact CG-CE2 3.77Å; K107-Y111 WeakPolarHBondContact O-CB 3.32Å; K107-Y111 WeakPolarHBondContact O-CD2 3.31Å; K107-Y111 VanDerWaalsContact O-CG 3.28Å; K107-Y111 PolarHBondContact O-N 3.36Å
108	R	69.2	Low	64.4	Low	203 Å²	203	125.7 Å²	125.7	77%	0.766	61%	0.611	S	S	*	*	H	α-helix	trans	-68.1	-38.5	173.1	-67.3	-175.2	179.5	175.9	-0.8	111.5	W105 Y111 A112	W105-R108 PolarHBondContact O-N 3.19Å; R108-Y111 PolarHBondContact O-N 2.9Å; R108-A112 WeakPolarHBondContact O-CB 3.43Å; R108-A112 PolarHBondContact O-N 3.36Å
109	C	72	Confident	66.8	Low	76 Å²	76	122.2 Å²	122.2	51%	0.514	60%	0.595	S	S	.	*	H	α-helix	trans	-66.4	-43.4	174.8	-153.3	0	0	0	0	110.8	W105 R106 A112 M113	W105-C109 WeakPolarHBondContact O-CB 3.37Å; W105-C109 PolarHBondContact O-N 3.41Å; R106-C109 PolarHBondContact O-N 3.42Å; C109-A112 PolarHBondContact O-N 3.06Å; C109-M113 VanDerWaalsContact O-CB 3.26Å; C109-M113 WeakPolarHBondContact O-CB 3.29Å; C109-M113 PolarHBondContact O-N 3.29Å
110	L	74.5	Confident	69.7	Low	86 Å²	86	115.8 Å²	115.8	45%	0.45	58%	0.578	S	S	.	*	H	α-helix	trans	-61.5	-46.6	173.8	-173.7	72.6	0	0	0	111.7	R106 K107 M113 I114	R106-L110 WeakPolarHBondContact O-CB 3.42Å; R106-L110 PolarHBondContact O-N 3.22Å; K107-L110 PolarHBondContact O-N 2.61Å; L110-M113 HydrophobicContact CD1-CE 4.22Å; L110-M113 PolarHBondContact O-N 3.05Å; L110-I114 HydrophobicContact CD1-CD1 4.42Å; L110-I114 HydrophobicContact CG-CD1 3.96Å; L110-I114 WeakPolarHBondContact O-CB 3.42Å; L110-I114 VanDerWaalsContact O-CG1 3.24Å; L110-I114 WeakPolarHBondContact O-CG1 3.42Å; L110-I114 PolarHBondContact O-N 3.21Å
111	Y	77.6	Confident	72.1	Confident	134 Å²	134	112.1 Å²	112.1	53%	0.525	56%	0.559	S	S	.	*	H	α-helix	trans	-66.3	-38.6	176.4	-68.7	-43.1	0	0	0	112.7	K107 R108 M113 I114 L115	K107-Y111 HydrophobicContact CD-CE2 4.06Å; K107-Y111 WeakPolarHBondContact CE-OH 3.42Å; K107-Y111 HydrophobicContact CG-CD2 4.31Å; K107-Y111 HydrophobicContact CG-CE2 3.77Å; K107-Y111 WeakPolarHBondContact O-CB 3.32Å; K107-Y111 WeakPolarHBondContact O-CD2 3.31Å; K107-Y111 VanDerWaalsContact O-CG 3.28Å; K107-Y111 PolarHBondContact O-N 3.36Å; R108-Y111 PolarHBondContact O-N 2.9Å; Y111-M113 VanDerWaalsContact C-N 3.34Å; Y111-I114 PolarHBondContact O-N 3.19Å; Y111-L115 WeakPolarHBondContact O-CB 3.33Å; Y111-L115 PolarHBondContact O-N 3.05Å
112	A	81.3	Confident	74.5	Confident	58 Å²	58	113.2 Å²	113.2	48%	0.479	55%	0.554	S	S	.	*	H	α-helix	trans	-64.9	-38.7	174.2	0	0	0	0	0	111.6	R108 C109 L115 L116	R108-A112 WeakPolarHBondContact O-CB 3.43Å; R108-A112 PolarHBondContact O-N 3.36Å; C109-A112 PolarHBondContact O-N 3.06Å; A112-L115 PolarHBondContact O-N 2.77Å; A112-L116 VanDerWaalsContact O-CB 3.32Å; A112-L116 WeakPolarHBondContact O-CB 3.24Å; A112-L116 PolarHBondContact O-N 3.3Å
113	M	81.6	Confident	76.4	Confident	114 Å²	114	109.2 Å²	109.2	56%	0.562	54%	0.54	S	S	*	.	H	α-helix	trans	-69.1	-43.3	176.2	-170.2	176.4	78.8	0	0	111.7	C109 L110 Y111 L115 L116 L117	C109-M113 VanDerWaalsContact O-CB 3.26Å; C109-M113 WeakPolarHBondContact O-CB 3.29Å; C109-M113 PolarHBondContact O-N 3.29Å; L110-M113 HydrophobicContact CD1-CE 4.22Å; L110-M113 PolarHBondContact O-N 3.05Å; Y111-M113 VanDerWaalsContact C-N 3.34Å; M113-L115 VanDerWaalsContact C-N 3.33Å; M113-L116 PolarHBondContact O-N 3.33Å; M113-L117 WeakPolarHBondContact O-CB 3.37Å; M113-L117 PolarHBondContact O-N 3.15Å
114	I	82.3	Confident	78.4	Confident	84 Å²	84	103.2 Å²	103.2	43%	0.431	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-43.8	173.7	-69.3	167.1	0	0	0	110	L110 Y111 L117 V118	L110-I114 HydrophobicContact CD1-CD1 4.42Å; L110-I114 HydrophobicContact CG-CD1 3.96Å; L110-I114 WeakPolarHBondContact O-CB 3.42Å; L110-I114 VanDerWaalsContact O-CG1 3.24Å; L110-I114 WeakPolarHBondContact O-CG1 3.42Å; L110-I114 PolarHBondContact O-N 3.21Å; Y111-I114 PolarHBondContact O-N 3.19Å; I114-L117 PolarHBondContact O-N 3.15Å; I114-V118 HydrophobicContact CG2-CG2 4.39Å; I114-V118 WeakPolarHBondContact O-CB 3.33Å; I114-V118 VanDerWaalsContact O-CG2 3.25Å; I114-V118 WeakPolarHBondContact O-CG2 3.38Å; I114-V118 PolarHBondContact O-N 2.88Å
115	L	84.4	Confident	80	Confident	117 Å²	117	105.6 Å²	105.6	61%	0.613	53%	0.528	S	S	*	.	H	α-helix	trans	-62.3	-45.3	176.8	-172.9	73.3	0	0	0	111.4	Y111 A112 M113 L117 V118 V119	Y111-L115 WeakPolarHBondContact O-CB 3.33Å; Y111-L115 PolarHBondContact O-N 3.05Å; A112-L115 PolarHBondContact O-N 2.77Å; M113-L115 VanDerWaalsContact C-N 3.33Å; L115-L117 VanDerWaalsContact C-N 3.34Å; L115-L117 PolarHBondContact O-N 2.81Å; L115-V118 PolarHBondContact O-N 3.35Å; L115-V119 WeakPolarHBondContact O-CB 3.4Å; L115-V119 VanDerWaalsContact O-CG2 3.26Å; L115-V119 WeakPolarHBondContact O-CG2 3.47Å; L115-V119 PolarHBondContact O-N 3.35Å
116	L	87.7	Confident	81.5	Confident	111 Å²	111	99.6 Å²	99.6	58%	0.581	52%	0.515	S	S	*	.	H	α-helix	trans	-61.3	-42.8	175.9	-170.2	89.4	0	0	0	111.3	A112 M113 V119 L120	A112-L116 VanDerWaalsContact O-CB 3.32Å; A112-L116 WeakPolarHBondContact O-CB 3.24Å; A112-L116 PolarHBondContact O-N 3.3Å; M113-L116 PolarHBondContact O-N 3.33Å; L116-V119 PolarHBondContact O-N 2.94Å; L116-L120 HydrophobicContact CD2-CD1 4.42Å; L116-L120 HydrophobicContact CG-CD1 4.36Å; L116-L120 WeakPolarHBondContact O-CB 3.39Å; L116-L120 WeakPolarHBondContact O-CG 3.49Å; L116-L120 PolarHBondContact O-N 3.11Å
117	L	88.3	Confident	82.6	Confident	103 Å²	103	95.6 Å²	95.6	54%	0.539	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-43.4	178	-154.7	103.1	0	0	0	110.9	M113 I114 L115 L120 I121	M113-L117 WeakPolarHBondContact O-CB 3.37Å; M113-L117 PolarHBondContact O-N 3.15Å; I114-L117 PolarHBondContact O-N 3.15Å; L115-L117 VanDerWaalsContact C-N 3.34Å; L115-L117 PolarHBondContact O-N 2.81Å; L117-L120 PolarHBondContact O-N 3.24Å; L117-I121 HydrophobicContact CD2-CD1 3.86Å; L117-I121 HydrophobicContact CG-CD1 4.23Å; L117-I121 WeakPolarHBondContact O-CB 3.27Å; L117-I121 WeakPolarHBondContact O-CD1 3.19Å; L117-I121 WeakPolarHBondContact O-CG1 3.45Å; L117-I121 PolarHBondContact O-N 3.31Å
118	V	87.8	Confident	83.9	Confident	74 Å²	74	94.1 Å²	94.1	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-62.7	-43.4	174.7	170.3	0	0	0	0	110.6	I114 L115 I121 V122	I114-V118 HydrophobicContact CG2-CG2 4.39Å; I114-V118 WeakPolarHBondContact O-CB 3.33Å; I114-V118 VanDerWaalsContact O-CG2 3.25Å; I114-V118 WeakPolarHBondContact O-CG2 3.38Å; I114-V118 PolarHBondContact O-N 2.88Å; L115-V118 PolarHBondContact O-N 3.35Å; V118-I121 PolarHBondContact O-N 2.7Å; V118-V122 HydrophobicContact CG1-CG2 4.26Å; V118-V122 WeakPolarHBondContact O-CB 3.35Å; V118-V122 WeakPolarHBondContact O-CG2 3.35Å; V118-V122 PolarHBondContact O-N 2.89Å
119	V	89.4	Confident	84.6	Confident	87 Å²	87	91 Å²	91	53%	0.527	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-43.6	176.3	169.8	0	0	0	0	111.4	L115 L116 V122 A123	L115-V119 WeakPolarHBondContact O-CB 3.4Å; L115-V119 VanDerWaalsContact O-CG2 3.26Å; L115-V119 WeakPolarHBondContact O-CG2 3.47Å; L115-V119 PolarHBondContact O-N 3.35Å; L116-V119 PolarHBondContact O-N 2.94Å; V119-V122 PolarHBondContact O-N 3.17Å; V119-A123 VanDerWaalsContact O-CB 3.24Å; V119-A123 WeakPolarHBondContact O-CB 3.4Å; V119-A123 PolarHBondContact O-N 2.97Å
120	L	88.7	Confident	85.2	Confident	92 Å²	92	95.2 Å²	95.2	48%	0.482	51%	0.505	S	S	.	.	H	α-helix	trans	-65.1	-41	176.2	-79.1	168.8	0	0	0	112.3	L116 L117 A123 N124	L116-L120 HydrophobicContact CD2-CD1 4.42Å; L116-L120 HydrophobicContact CG-CD1 4.36Å; L116-L120 WeakPolarHBondContact O-CB 3.39Å; L116-L120 WeakPolarHBondContact O-CG 3.49Å; L116-L120 PolarHBondContact O-N 3.11Å; L117-L120 PolarHBondContact O-N 3.24Å; L120-A123 PolarHBondContact O-N 3.31Å; L120-N124 VanDerWaalsContact O-CB 3.32Å; L120-N124 WeakPolarHBondContact O-CB 3.39Å; L120-N124 PolarHBondContact O-N 3.29Å; L120-N124 PolarHBondContact O-ND2 3.35Å
121	I	88.6	Confident	85.6	Confident	82 Å²	82	94.6 Å²	94.6	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-63.2	-47.7	175.4	-71.5	165.5	0	0	0	109.8	L117 V118 A123 N124 I125	L117-I121 HydrophobicContact CD2-CD1 3.86Å; L117-I121 HydrophobicContact CG-CD1 4.23Å; L117-I121 WeakPolarHBondContact O-CB 3.27Å; L117-I121 WeakPolarHBondContact O-CD1 3.19Å; L117-I121 WeakPolarHBondContact O-CG1 3.45Å; L117-I121 PolarHBondContact O-N 3.31Å; V118-I121 PolarHBondContact O-N 2.7Å; I121-A123 PolarHBondContact O-N 3.05Å; I121-N124 PolarHBondContact O-N 2.94Å; I121-I125 HydrophobicContact CG2-CD1 3.61Å; I121-I125 HydrophobicContact CG2-CG1 4.36Å; I121-I125 VanDerWaalsContact O-CB 3.31Å; I121-I125 WeakPolarHBondContact O-CB 3.5Å; I121-I125 WeakPolarHBondContact O-CG1 2.96Å; I121-I125 PolarHBondContact O-N 2.91Å
122	V	87.8	Confident	85.7	Confident	81 Å²	81	92.2 Å²	92.2	49%	0.491	50%	0.496	S	S	.	.	H	α-helix	trans	-63.4	-41.3	178.2	171.3	0	0	0	0	111.1	V118 V119 I125 S126	V118-V122 HydrophobicContact CG1-CG2 4.26Å; V118-V122 WeakPolarHBondContact O-CB 3.35Å; V118-V122 WeakPolarHBondContact O-CG2 3.35Å; V118-V122 PolarHBondContact O-N 2.89Å; V119-V122 PolarHBondContact O-N 3.17Å; V122-I125 PolarHBondContact O-N 3.44Å; V122-S126 VanDerWaalsContact O-CB 3.24Å; V122-S126 WeakPolarHBondContact O-CB 3.24Å; V122-S126 PolarHBondContact O-N 3.4Å; V122-S126 PolarHBondContact O-OG 3.17Å
123	A	87	Confident	85.5	Confident	50 Å²	50	93.4 Å²	93.4	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-65.2	-45.7	176.8	0	0	0	0	0	111.9	V119 L120 I121 S126 L127	V119-A123 VanDerWaalsContact O-CB 3.24Å; V119-A123 WeakPolarHBondContact O-CB 3.4Å; V119-A123 PolarHBondContact O-N 2.97Å; L120-A123 PolarHBondContact O-N 3.31Å; I121-A123 PolarHBondContact O-N 3.05Å; A123-S126 PolarHBondContact O-N 2.92Å; A123-L127 WeakPolarHBondContact O-CB 3.14Å; A123-L127 PolarHBondContact O-N 2.88Å
124	N	85.4	Confident	85.3	Confident	101 Å²	101	92.5 Å²	92.5	54%	0.54	50%	0.501	S	S	.	.	H	α-helix	trans	-64	-42.4	176.6	-77.8	-19.5	0	0	0	111.7	L120 I121 L127 T128	L120-N124 VanDerWaalsContact O-CB 3.32Å; L120-N124 WeakPolarHBondContact O-CB 3.39Å; L120-N124 PolarHBondContact O-N 3.29Å; L120-N124 PolarHBondContact O-ND2 3.35Å; I121-N124 PolarHBondContact O-N 2.94Å; N124-L127 PolarHBondContact O-N 3.38Å; N124-T128 WeakPolarHBondContact O-CB 3.36Å; N124-T128 PolarHBondContact O-N 2.59Å; N124-T128 PolarHBondContact O-OG1 3.39Å
125	I	88.2	Confident	84.9	Confident	82 Å²	82	92.8 Å²	92.8	42%	0.421	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-45.6	175	-72.2	172.7	0	0	0	110.1	I121 V122 T128 F129	I121-I125 HydrophobicContact CG2-CD1 3.61Å; I121-I125 HydrophobicContact CG2-CG1 4.36Å; I121-I125 VanDerWaalsContact O-CB 3.31Å; I121-I125 WeakPolarHBondContact O-CB 3.5Å; I121-I125 WeakPolarHBondContact O-CG1 2.96Å; I121-I125 PolarHBondContact O-N 2.91Å; V122-I125 PolarHBondContact O-N 3.44Å; I125-T128 PolarHBondContact O-N 3.34Å; I125-F129 HydrophobicContact CG2-CD2 3.5Å; I125-F129 VanDerWaalsContact CG2-CD2 3.5Å; I125-F129 HydrophobicContact CG2-CE2 3.34Å; I125-F129 WeakPolarHBondContact O-CD2 3.3Å; I125-F129 PolarHBondContact O-N 3.02Å
126	S	89	Confident	84.1	Confident	65 Å²	65	88.7 Å²	88.7	46%	0.455	49%	0.489	S	S	.	.	H	α-helix	trans	-64.2	-42.7	179	-57.3	0	0	0	0	112	V122 A123 F129 W130	V122-S126 VanDerWaalsContact O-CB 3.24Å; V122-S126 WeakPolarHBondContact O-CB 3.24Å; V122-S126 PolarHBondContact O-N 3.4Å; V122-S126 PolarHBondContact O-OG 3.17Å; A123-S126 PolarHBondContact O-N 2.92Å; S126-F129 PolarHBondContact O-N 2.84Å; S126-W130 VanDerWaalsContact O-CB 3.26Å; S126-W130 WeakPolarHBondContact O-CB 3.45Å; S126-W130 PolarHBondContact O-N 2.83Å
127	L	87.2	Confident	83.3	Confident	97 Å²	97	88 Å²	88	51%	0.508	48%	0.482	S	S	.	.	H	α-helix	trans	-65.7	-39	176.5	-160.2	99.8	0	0	0	111.2	A123 N124 W130 I131	A123-L127 WeakPolarHBondContact O-CB 3.14Å; A123-L127 PolarHBondContact O-N 2.88Å; N124-L127 PolarHBondContact O-N 3.38Å; L127-W130 PolarHBondContact O-N 3.39Å; L127-I131 HydrophobicContact CD2-CD1 3.86Å; L127-I131 HydrophobicContact CG-CD1 4.14Å; L127-I131 WeakPolarHBondContact O-CB 3.48Å; L127-I131 VanDerWaalsContact O-CG1 3.27Å; L127-I131 WeakPolarHBondContact O-CG1 3.26Å; L127-I131 PolarHBondContact O-N 2.85Å
128	T	84.1	Confident	82.5	Confident	80 Å²	80	85.8 Å²	85.8	49%	0.491	48%	0.475	S	S	.	.	H	α-helix	trans	-65.9	-45.2	176.8	-51.2	0	0	0	0	110.8	N124 I125 W130 I131 M132	N124-T128 WeakPolarHBondContact O-CB 3.36Å; N124-T128 PolarHBondContact O-N 2.59Å; N124-T128 PolarHBondContact O-OG1 3.39Å; I125-T128 PolarHBondContact O-N 3.34Å; T128-W130 VanDerWaalsContact C-N 3.32Å; T128-W130 PolarHBondContact O-N 3.36Å; T128-I131 PolarHBondContact O-N 3.44Å; T128-M132 WeakPolarHBondContact O-CB 3.27Å; T128-M132 WeakPolarHBondContact O-CG 3.07Å; T128-M132 PolarHBondContact O-N 3.28Å
129	F	83.6	Confident	81.7	Confident	136 Å²	136	91.4 Å²	91.4	60%	0.596	50%	0.501	S	S	*	.	H	α-helix	trans	-64	-37	173.9	-79.5	-58.8	0	0	0	112.3	I125 S126 S133	I125-F129 HydrophobicContact CG2-CD2 3.5Å; I125-F129 VanDerWaalsContact CG2-CD2 3.5Å; I125-F129 HydrophobicContact CG2-CE2 3.34Å; I125-F129 WeakPolarHBondContact O-CD2 3.3Å; I125-F129 PolarHBondContact O-N 3.02Å; S126-F129 PolarHBondContact O-N 2.84Å; F129-S133 VanDerWaalsContact O-CB 3.31Å; F129-S133 WeakPolarHBondContact O-CB 3.28Å; F129-S133 PolarHBondContact O-N 3.44Å; F129-S133 PolarHBondContact O-OG 3.47Å
130	W	84.6	Confident	80.5	Confident	165 Å²	165	92.7 Å²	92.7	63%	0.625	50%	0.502	S	S	*	.	H	α-helix	trans	-68.4	-43.4	176.2	-174.9	71.9	0	0	0	112.2	S126 L127 T128 S133 V134	S126-W130 VanDerWaalsContact O-CB 3.26Å; S126-W130 WeakPolarHBondContact O-CB 3.45Å; S126-W130 PolarHBondContact O-N 2.83Å; L127-W130 PolarHBondContact O-N 3.39Å; T128-W130 VanDerWaalsContact C-N 3.32Å; T128-W130 PolarHBondContact O-N 3.36Å; W130-S133 WeakPolarHBondContact CA-OG 3.08Å; W130-S133 PolarHBondContact O-N 2.87Å; W130-S133 PolarHBondContact O-OG 2.68Å; W130-V134 HydrophobicContact CD2-CG2 4.07Å; W130-V134 HydrophobicContact CG-CG2 4.38Å; W130-V134 HydrophobicContact CZ2-CG2 4.05Å; W130-V134 WeakPolarHBondContact O-CB 3.21Å; W130-V134 WeakPolarHBondContact O-CG2 3.34Å; W130-V134 PolarHBondContact O-N 3.26Å
131	I	83.5	Confident	79.4	Confident	74 Å²	74	89 Å²	89	38%	0.379	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-43.7	174.2	-70.5	166.3	0	0	0	110.4	L127 T128 S133 V134 L135	L127-I131 HydrophobicContact CD2-CD1 3.86Å; L127-I131 HydrophobicContact CG-CD1 4.14Å; L127-I131 WeakPolarHBondContact O-CB 3.48Å; L127-I131 VanDerWaalsContact O-CG1 3.27Å; L127-I131 WeakPolarHBondContact O-CG1 3.26Å; L127-I131 PolarHBondContact O-N 2.85Å; T128-I131 PolarHBondContact O-N 3.44Å; I131-S133 VanDerWaalsContact C-N 3.31Å; I131-S133 PolarHBondContact O-N 3.42Å; I131-V134 PolarHBondContact O-N 2.92Å; I131-L135 HydrophobicContact CG2-CD1 3.55Å; I131-L135 HydrophobicContact CG2-CG 4.22Å; I131-L135 VanDerWaalsContact O-CB 3.28Å; I131-L135 WeakPolarHBondContact O-CB 3.31Å; I131-L135 WeakPolarHBondContact O-CG 3.26Å; I131-L135 PolarHBondContact O-N 2.84Å
132	M	78.8	Confident	78.7	Confident	83 Å²	83	89.6 Å²	89.6	41%	0.409	49%	0.489	S	S	.	.	H	α-helix	trans	-61.6	-39	175.2	-82.6	-172.7	45.2	0	0	112.2	T128 G136 F137	T128-M132 WeakPolarHBondContact O-CB 3.27Å; T128-M132 WeakPolarHBondContact O-CG 3.07Å; T128-M132 PolarHBondContact O-N 3.28Å; M132-G136 CarbonylContact O-C 3.58Å; M132-G136 WeakPolarHBondContact O-CA 3.19Å; M132-G136 PolarHBondContact O-N 2.9Å; M132-F137 HydrophobicContact CB-CB 4.34Å; M132-F137 HydrophobicContact CG-CB 4.12Å; M132-F137 PolarHBondContact O-N 3.45Å
133	S	78.5	Confident	77.9	Confident	84 Å²	84	87.7 Å²	87.7	59%	0.587	49%	0.486	S	S	*	.	H	α-helix	trans	-72.8	-38.3	178.2	71.6	0	0	0	0	112.1	F129 W130 I131 G136	F129-S133 VanDerWaalsContact O-CB 3.31Å; F129-S133 WeakPolarHBondContact O-CB 3.28Å; F129-S133 PolarHBondContact O-N 3.44Å; F129-S133 PolarHBondContact O-OG 3.47Å; W130-S133 WeakPolarHBondContact CA-OG 3.08Å; W130-S133 PolarHBondContact O-N 2.87Å; W130-S133 PolarHBondContact O-OG 2.68Å; I131-S133 VanDerWaalsContact C-N 3.31Å; I131-S133 PolarHBondContact O-N 3.42Å; S133-G136 PolarHBondContact O-N 3.43Å
134	V	76.3	Confident	77.1	Confident	94 Å²	94	86.1 Å²	86.1	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-70.1	-43.4	177.3	171.2	0	0	0	0	111.8	W130 I131 G136	W130-V134 HydrophobicContact CD2-CG2 4.07Å; W130-V134 HydrophobicContact CG-CG2 4.38Å; W130-V134 HydrophobicContact CZ2-CG2 4.05Å; W130-V134 WeakPolarHBondContact O-CB 3.21Å; W130-V134 WeakPolarHBondContact O-CG2 3.34Å; W130-V134 PolarHBondContact O-N 3.26Å; I131-V134 PolarHBondContact O-N 2.92Å; V134-G136 PolarHBondContact O-N 3.33Å
135	L	74	Confident	76.6	Confident	90 Å²	90	83.8 Å²	83.8	47%	0.471	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-8	176	-67.3	174.7	0	0	0	112.8	I131 F137 G143	I131-L135 HydrophobicContact CG2-CD1 3.55Å; I131-L135 HydrophobicContact CG2-CG 4.22Å; I131-L135 VanDerWaalsContact O-CB 3.28Å; I131-L135 WeakPolarHBondContact O-CB 3.31Å; I131-L135 WeakPolarHBondContact O-CG 3.26Å; I131-L135 PolarHBondContact O-N 2.84Å; L135-F137 VanDerWaalsContact C-N 3.3Å; L135-F137 HydrophobicContact CB-CD2 3.71Å; L135-F137 HydrophobicContact CB-CE2 4.08Å; L135-F137 HydrophobicContact CD1-CD2 4.07Å; L135-F137 HydrophobicContact CD1-CE2 3.77Å; L135-F137 PolarHBondContact O-N 2.64Å; L135-G143 PolarHBondContact O-N 2.76Å
136	G	68.1	Low	76	Confident	31 Å²	31	84.7 Å²	84.7	32%	0.32	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.2	35.6	-177.5	0	0	0	0	0	113.3	M132 S133 V134 S138 G143	M132-G136 CarbonylContact O-C 3.58Å; M132-G136 WeakPolarHBondContact O-CA 3.19Å; M132-G136 PolarHBondContact O-N 2.9Å; S133-G136 PolarHBondContact O-N 3.43Å; V134-G136 PolarHBondContact O-N 3.33Å; G136-S138 PolarHBondContact O-N 2.81Å; G136-G143 PolarHBondContact O-N 2.81Å
137	F	71.2	Confident	75.3	Confident	96 Å²	96	87.9 Å²	87.9	42%	0.421	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	125.3	176.2	-96.1	-80	0	0	0	110.3	M132 L135 I142	M132-F137 HydrophobicContact CB-CB 4.34Å; M132-F137 HydrophobicContact CG-CB 4.12Å; M132-F137 PolarHBondContact O-N 3.45Å; L135-F137 VanDerWaalsContact C-N 3.3Å; L135-F137 HydrophobicContact CB-CD2 3.71Å; L135-F137 HydrophobicContact CB-CE2 4.08Å; L135-F137 HydrophobicContact CD1-CD2 4.07Å; L135-F137 HydrophobicContact CD1-CE2 3.77Å; L135-F137 PolarHBondContact O-N 2.64Å; F137-I142 HydrophobicContact CD1-CG1 3.92Å; F137-I142 HydrophobicContact CE1-CD1 3.59Å; F137-I142 HydrophobicContact CE1-CG1 3.45Å; F137-I142 VanDerWaalsContact CE1-CG1 3.45Å; F137-I142 HydrophobicContact CE2-CG2 4.42Å; F137-I142 HydrophobicContact CZ-CD1 3.59Å; F137-I142 HydrophobicContact CZ-CG1 3.85Å; F137-I142 HydrophobicContact CZ-CG2 4.39Å
138	S	71	Confident	74.5	Confident	57 Å²	57	85.8 Å²	85.8	40%	0.399	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	161.8	171.4	72.8	0	0	0	0	109.9	G136 Q140 G141	G136-S138 PolarHBondContact O-N 2.81Å; S138-Q140 PolarHBondContact O-N 3.31Å; S138-Q140 PolarHBondContact OG-N 2.89Å; S138-G141 PolarHBondContact N-O 3.48Å; S138-G141 PolarHBondContact O-N 3.49Å; S138-G141 VanDerWaalsContact O-O 3.05Å; S138-G141 PolarHBondContact OG-N 2.86Å; S138-G141 PolarHBondContact OG-O 3.12Å
139	L	71	Confident	74.1	Confident	192 Å²	192	92.1 Å²	92.1	100%	1.005	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-14.3	171.6	-106.6	139	0	0	0	113.5
140	Q	63.9	Low	73.6	Confident	115 Å²	115	93.5 Å²	93.5	54%	0.537	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-7.7	-178.3	-61.8	-178.9	-1.3	0	0	113.3	S138 R146 I147	S138-Q140 PolarHBondContact O-N 3.31Å; S138-Q140 PolarHBondContact OG-N 2.89Å; Q140-R146 HydrophobicContact CB-CG 4.45Å; Q140-R146 VanDerWaalsContact O-CA 3.31Å; Q140-R146 WeakPolarHBondContact O-CA 3.28Å; Q140-I147 PolarHBondContact O-N 3.44Å
141	G	66.5	Low	73.2	Confident	14 Å²	14	92.2 Å²	92.2	14%	0.144	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150.1	-171.8	-179.2	0	0	0	0	0	115	S138 L145	S138-G141 PolarHBondContact N-O 3.48Å; S138-G141 PolarHBondContact O-N 3.49Å; S138-G141 VanDerWaalsContact O-O 3.05Å; S138-G141 PolarHBondContact OG-N 2.86Å; S138-G141 PolarHBondContact OG-O 3.12Å; G141-L145 CarbonylContact C-O 3.55Å; G141-L145 VanDerWaalsContact CA-O 3.26Å; G141-L145 WeakPolarHBondContact CA-O 3.41Å
142	I	72.2	Confident	73	Confident	94 Å²	94	92.7 Å²	92.7	48%	0.482	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	116.8	-175.3	-52.5	-178.1	0	0	0	109.1	F137 G144 L145	F137-I142 HydrophobicContact CD1-CG1 3.92Å; F137-I142 HydrophobicContact CE1-CD1 3.59Å; F137-I142 HydrophobicContact CE1-CG1 3.45Å; F137-I142 VanDerWaalsContact CE1-CG1 3.45Å; F137-I142 HydrophobicContact CE2-CG2 4.42Å; F137-I142 HydrophobicContact CZ-CD1 3.59Å; F137-I142 HydrophobicContact CZ-CG1 3.85Å; F137-I142 HydrophobicContact CZ-CG2 4.39Å; I142-G144 PolarHBondContact O-N 3.2Å; I142-L145 PolarHBondContact N-O 3.41Å; I142-L145 PolarHBondContact O-N 3.33Å
143	G	70.9	Confident	72.9	Confident	41 Å²	41	90.8 Å²	90.8	42%	0.423	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	-120	176.8	0	0	0	0	0	112	L135 G136 L145	L135-G143 PolarHBondContact O-N 2.76Å; G136-G143 PolarHBondContact O-N 2.81Å; G143-L145 VanDerWaalsContact C-N 3.33Å
144	G	70.1	Confident	72.9	Confident	17 Å²	17	89.7 Å²	89.7	18%	0.175	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-5.2	177.2	0	0	0	0	0	115.3	I142 V154 T155	I142-G144 PolarHBondContact O-N 3.2Å; G144-V154 CarbonylContact O-C 3.52Å; G144-V154 VanDerWaalsContact O-CA 3.28Å; G144-V154 WeakPolarHBondContact O-CA 3.27Å; G144-T155 PolarHBondContact O-N 2.81Å; G144-T155 PolarHBondContact O-OG1 3.45Å
145	L	76.1	Confident	72.7	Confident	52 Å²	52	89.2 Å²	89.2	27%	0.272	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	113.9	-175.4	-87.5	149.9	0	0	0	111.1	G141 I142 G143 L152 V154 A158 F160	G141-L145 CarbonylContact C-O 3.55Å; G141-L145 VanDerWaalsContact CA-O 3.26Å; G141-L145 WeakPolarHBondContact CA-O 3.41Å; I142-L145 PolarHBondContact N-O 3.41Å; I142-L145 PolarHBondContact O-N 3.33Å; G143-L145 VanDerWaalsContact C-N 3.33Å; L145-L152 HydrophobicContact CD2-CD1 3.85Å; L145-L152 HydrophobicContact CD2-CD2 3.79Å; L145-L152 HydrophobicContact CD2-CG 3.85Å; L145-V154 HydrophobicContact CD2-CG2 3.69Å; L145-V154 HydrophobicContact CG-CG2 4.31Å; L145-A158 HydrophobicContact CD1-CB 3.96Å; L145-A158 HydrophobicContact CG-CB 4.07Å; L145-F160 HydrophobicContact CD2-CZ 4.15Å
146	R	74.5	Confident	72.8	Confident	101 Å²	101	86.8 Å²	86.8	38%	0.381	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	123	174.3	-64.9	-172.3	-178.1	-166	2.3	111	Q140 V153 T155	Q140-R146 HydrophobicContact CB-CG 4.45Å; Q140-R146 VanDerWaalsContact O-CA 3.31Å; Q140-R146 WeakPolarHBondContact O-CA 3.28Å; R146-V153 HydrophobicContact CB-CB 4.27Å; R146-V153 PolarHBondContact N-O 3.47Å; R146-V153 PolarHBondContact O-N 2.84Å; R146-T155 HydrophobicContact CG-CG2 4.44Å
147	I	74.5	Confident	73	Confident	132 Å²	132	94.8 Å²	94.8	68%	0.677	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	110.9	178.8	-60.2	165.1	0	0	0	107.6	Q140 L152	Q140-I147 PolarHBondContact O-N 3.44Å; I147-L152 HydrophobicContact CG1-CD1 3.68Å
148	S	71.8	Confident	73.3	Confident	53 Å²	53	92 Å²	92	37%	0.371	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	165.1	168.2	-61.1	0	0	0	0	109.9	D150 K151	S148-D150 PolarHBondContact O-N 3.44Å; S148-K151 WeakPolarHBondContact CB-O 2.9Å; S148-K151 PolarHBondContact N-O 3.3Å; S148-K151 PolarHBondContact O-N 2.67Å
149	K	75	Confident	73.6	Confident	213 Å²	213	98.2 Å²	98.2	93%	0.926	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.6	-41.1	-175.7	-71.2	-174.2	177.3	-178.1	0	114.2
150	D	73.4	Confident	74.1	Confident	165 Å²	165	93.8 Å²	93.8	88%	0.882	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.7	5.5	-175.3	-52.7	-38.6	0	0	0	114.1	S148	S148-D150 PolarHBondContact O-N 3.44Å
151	K	75.3	Confident	75	Confident	138 Å²	138	94.9 Å²	94.9	60%	0.6	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.5	140.8	-175.6	61.7	178.9	-177.9	-178.2	0	113	S148 V153	S148-K151 WeakPolarHBondContact CB-O 2.9Å; S148-K151 PolarHBondContact N-O 3.3Å; S148-K151 PolarHBondContact O-N 2.67Å; K151-V153 HydrophobicContact CD-CG2 3.84Å; K151-V153 HydrophobicContact CG-CG2 3.91Å
152	L	79.5	Confident	75.9	Confident	84 Å²	84	100.6 Å²	100.6	44%	0.44	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	115.6	167.1	-168.6	75.4	0	0	0	108.2	L145 I147 F160	L145-L152 HydrophobicContact CD2-CD1 3.85Å; L145-L152 HydrophobicContact CD2-CD2 3.79Å; L145-L152 HydrophobicContact CD2-CG 3.85Å; I147-L152 HydrophobicContact CG1-CD1 3.68Å; L152-F160 HydrophobicContact CD2-CE1 4.38Å; L152-F160 HydrophobicContact CD2-CZ 4.23Å
153	V	76.8	Confident	76.5	Confident	44 Å²	44	101.4 Å²	101.4	27%	0.267	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	118	179.5	-178.4	0	0	0	0	108.8	R146 K151 T155	R146-V153 HydrophobicContact CB-CB 4.27Å; R146-V153 PolarHBondContact N-O 3.47Å; R146-V153 PolarHBondContact O-N 2.84Å; K151-V153 HydrophobicContact CD-CG2 3.84Å; K151-V153 HydrophobicContact CG-CG2 3.91Å; V153-T155 HydrophobicContact CG1-CG2 4.06Å
154	V	78.9	Confident	77	Confident	60 Å²	60	102.3 Å²	102.3	36%	0.364	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	110.3	175.4	179.5	0	0	0	0	108.4	G144 L145 G156 A158 F160	G144-V154 CarbonylContact O-C 3.52Å; G144-V154 VanDerWaalsContact O-CA 3.28Å; G144-V154 WeakPolarHBondContact O-CA 3.27Å; L145-V154 HydrophobicContact CD2-CG2 3.69Å; L145-V154 HydrophobicContact CG-CG2 4.31Å; V154-G156 WeakPolarHBondContact CG1-O 3.41Å; V154-A158 HydrophobicContact CG1-CB 3.61Å; V154-A158 HydrophobicContact CG2-CB 4.32Å; V154-F160 HydrophobicContact CG2-CZ 4.43Å
155	T	72.5	Confident	77.5	Confident	85 Å²	85	111.3 Å²	111.3	52%	0.521	57%	0.573	S	S	.	*			trans	-95	-7.5	179.5	58.8	0	0	0	0	113.8	G144 R146 V153	G144-T155 PolarHBondContact O-N 2.81Å; G144-T155 PolarHBondContact O-OG1 3.45Å; R146-T155 HydrophobicContact CG-CG2 4.44Å; V153-T155 HydrophobicContact CG1-CG2 4.06Å
156	G	74.8	Confident	77.8	Confident	38 Å²	38	113.2 Å²	113.2	39%	0.392	58%	0.583	S	S	.	*	S	Bend	trans	-149.3	-162.9	-178.7	0	0	0	0	0	112.3	V154 A158	V154-G156 WeakPolarHBondContact CG1-O 3.41Å; G156-A158 PolarHBondContact O-N 2.87Å
157	H	73.8	Confident	78	Confident	200 Å²	200	118.5 Å²	118.5	93%	0.926	61%	0.612	S	S	*	*			trans	-65.2	121.8	174.5	-64.6	-71.3	0	0	0	110.3
158	A	77.2	Confident	78.2	Confident	36 Å²	36	120.2 Å²	120.2	30%	0.298	62%	0.615	S	S	.	*			trans	-129.6	126.2	171.8	0	0	0	0	0	108.4	L145 V154 G156 F160	L145-A158 HydrophobicContact CD1-CB 3.96Å; L145-A158 HydrophobicContact CG-CB 4.07Å; V154-A158 HydrophobicContact CG1-CB 3.61Å; V154-A158 HydrophobicContact CG2-CB 4.32Å; G156-A158 PolarHBondContact O-N 2.87Å; A158-F160 HydrophobicContact CB-CE2 4.14Å; A158-F160 HydrophobicContact CB-CZ 4.41Å
159	E	77.4	Confident	78.8	Confident	188 Å²	188	122.8 Å²	122.8	88%	0.879	62%	0.624	S	S	*	*			trans	-107.5	127.8	177.1	-168.3	175.2	-179.5	0	0	108.8
160	F	81.3	Confident	79.1	Confident	99 Å²	99	116.4 Å²	116.4	43%	0.434	61%	0.606	S	S	.	*			trans	-108.4	116.4	177.6	-61.7	-88.6	0	0	0	108.5	L145 L152 V154 A158 N162 V164	L145-F160 HydrophobicContact CD2-CZ 4.15Å; L152-F160 HydrophobicContact CD2-CE1 4.38Å; L152-F160 HydrophobicContact CD2-CZ 4.23Å; V154-F160 HydrophobicContact CG2-CZ 4.43Å; A158-F160 HydrophobicContact CB-CE2 4.14Å; A158-F160 HydrophobicContact CB-CZ 4.41Å; F160-N162 PolarHBondContact O-N 3.39Å; F160-V164 HydrophobicContact CB-CG2 3.47Å; F160-V164 VanDerWaalsContact CB-CG2 3.47Å; F160-V164 HydrophobicContact CD1-CG2 3.63Å; F160-V164 HydrophobicContact CD2-CG2 3.8Å; F160-V164 HydrophobicContact CE1-CG2 4.27Å; F160-V164 HydrophobicContact CE2-CG2 4.42Å; F160-V164 HydrophobicContact CG-CG2 3.35Å
161	V	83.3	Confident	79.5	Confident	138 Å²	138	110.5 Å²	110.5	84%	0.836	58%	0.577	S	S	*	*	S	Bend	trans	-65.7	-30.1	-177.9	-179.6	0	0	0	0	112.1
162	N	84.6	Confident	79.5	Confident	135 Å²	135	108 Å²	108	72%	0.722	58%	0.575	S	S	*	*	S	Bend	trans	-120.2	170.5	-177.8	-72.2	-23	0	0	0	111.4	F160 V164	F160-N162 PolarHBondContact O-N 3.39Å; N162-V164 PolarHBondContact O-N 2.84Å
163	T	84.5	Confident	79.1	Confident	111 Å²	111	112.9 Å²	112.9	68%	0.681	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-58.3	131.4	177.1	-49.6	0	0	0	0	112	Y165	T163-Y165 HydrophobicContact CG2-CE2 4.31Å
164	V	82.8	Confident	78.8	Confident	60 Å²	60	120.8 Å²	120.8	36%	0.364	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-97.2	121.6	178.5	-169.8	0	0	0	0	109.5	F160 N162 L166	F160-V164 HydrophobicContact CB-CG2 3.47Å; F160-V164 VanDerWaalsContact CB-CG2 3.47Å; F160-V164 HydrophobicContact CD1-CG2 3.63Å; F160-V164 HydrophobicContact CD2-CG2 3.8Å; F160-V164 HydrophobicContact CE1-CG2 4.27Å; F160-V164 HydrophobicContact CE2-CG2 4.42Å; F160-V164 HydrophobicContact CG-CG2 3.35Å; N162-V164 PolarHBondContact O-N 2.84Å; V164-L166 HydrophobicContact CG1-CD1 4.12Å; V164-L166 HydrophobicContact CG1-CD2 3.66Å; V164-L166 HydrophobicContact CG1-CG 3.75Å
165	Y	80.7	Confident	78.7	Confident	206 Å²	206	121.3 Å²	121.3	81%	0.808	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-96.4	122.4	173.6	-63	-86.6	0	0	0	109.4	T163	T163-Y165 HydrophobicContact CG2-CE2 4.31Å
166	L	81.9	Confident	78.9	Confident	92 Å²	92	122.1 Å²	122.1	48%	0.482	64%	0.637	S	S	.	*			trans	-131.5	132.9	-177.1	-56.1	166.2	0	0	0	108.5	V164 K168 L169	V164-L166 HydrophobicContact CG1-CD1 4.12Å; V164-L166 HydrophobicContact CG1-CD2 3.66Å; V164-L166 HydrophobicContact CG1-CG 3.75Å; L166-K168 VanDerWaalsContact C-N 3.32Å; L166-L169 HydrophobicContact CD1-CB 4.15Å; L166-L169 HydrophobicContact CD1-CD1 3.85Å; L166-L169 HydrophobicContact CD1-CG 4.44Å
167	Q	77.3	Confident	79.4	Confident	211 Å²	211	124.5 Å²	124.5	99%	0.986	64%	0.64	S	S	*	*	S	Bend	trans	-70.7	-33.8	170.9	-70.8	-174.9	-6.1	0	0	111.6
168	K	80.4	Confident	79.7	Confident	168 Å²	168	121.4 Å²	121.4	73%	0.73	63%	0.628	S	S	*	*			trans	-144.3	123	179.1	-177.3	176.2	178.5	177.7	0	108.4	L166	L166-K168 VanDerWaalsContact C-N 3.32Å
169	L	84.2	Confident	80.1	Confident	108 Å²	108	123.9 Å²	123.9	57%	0.565	64%	0.639	S	S	*	*			trans	-101.8	118	167.6	177.4	61.5	0	0	0	107.6	L166 L177	L166-L169 HydrophobicContact CD1-CB 4.15Å; L166-L169 HydrophobicContact CD1-CD1 3.85Å; L166-L169 HydrophobicContact CD1-CG 4.44Å; L169-L177 HydrophobicContact CD1-CD1 4.28Å; L169-L177 HydrophobicContact CD2-CD1 4.07Å; L169-L177 HydrophobicContact CD2-CD2 3.85Å; L169-L177 HydrophobicContact CG-CD1 3.99Å; L169-L177 HydrophobicContact CG-CD2 3.98Å
170	S	80.9	Confident	80.3	Confident	79 Å²	79	123.2 Å²	123.2	55%	0.552	64%	0.636	S	S	*	*			trans	-137.9	134.2	176.5	57.8	0	0	0	0	109.4
171	S	81.3	Confident	80.4	Confident	40 Å²	40	121.3 Å²	121.3	28%	0.28	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-70.2	159.3	164.2	47.8	0	0	0	0	110.5	T175	S171-T175 VanDerWaalsContact CB-O 3.26Å; S171-T175 WeakPolarHBondContact CB-O 3.38Å; S171-T175 PolarHBondContact OG-O 3.41Å
172	P	74.8	Confident	80.4	Confident	86 Å²	86	122.4 Å²	122.4	56%	0.558	64%	0.636	S	S	*	*	S	Bend	trans	-48.6	152.9	168.8	-26.4	31.7	0	0	0	112.8	K174 T175	P172-K174 PolarHBondContact O-N 2.87Å; P172-T175 VanDerWaalsContact CD-OG1 3.27Å; P172-T175 WeakPolarHBondContact CD-OG1 3.42Å; P172-T175 PolarHBondContact O-N 3.34Å; P172-T175 PolarHBondContact O-OG1 2.93Å; P172-T175 VanDerWaalsContact O-OG1 3.05Å
173	E	72.3	Confident	80.4	Confident	186 Å²	186	126.5 Å²	126.5	87%	0.869	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	128.9	176.7	-75.2	-169.3	177.7	0	0	110.5
174	K	70.1	Confident	80.4	Confident	210 Å²	210	122.4 Å²	122.4	91%	0.913	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	73.6	8.1	-178.8	-48.4	178	180	179.4	0	116.7	P172	P172-K174 PolarHBondContact O-N 2.87Å
175	T	75.8	Confident	80.6	Confident	71 Å²	71	120.9 Å²	120.9	44%	0.436	61%	0.612	S	S	.	*			trans	-106.1	137	167.9	58.4	0	0	0	0	111.1	S171 P172	S171-T175 VanDerWaalsContact CB-O 3.26Å; S171-T175 WeakPolarHBondContact CB-O 3.38Å; S171-T175 PolarHBondContact OG-O 3.41Å; P172-T175 VanDerWaalsContact CD-OG1 3.27Å; P172-T175 WeakPolarHBondContact CD-OG1 3.42Å; P172-T175 PolarHBondContact O-N 3.34Å; P172-T175 PolarHBondContact O-OG1 2.93Å; P172-T175 VanDerWaalsContact O-OG1 3.05Å
176	P	77.7	Confident	80.9	Confident	102 Å²	102	119.1 Å²	119.1	66%	0.662	60%	0.604	S	S	*	*			trans	-69.7	144.9	175	28.5	-32.9	0	0	0	110.4	M178	P176-M178 PolarHBondContact O-N 3.22Å
177	L	84.7	Confident	81.2	Confident	88 Å²	88	119.8 Å²	119.8	46%	0.461	61%	0.607	S	S	.	*			trans	-75.2	105.7	170.4	178.5	65.7	0	0	0	108.7	L169 V179	L169-L177 HydrophobicContact CD1-CD1 4.28Å; L169-L177 HydrophobicContact CD2-CD1 4.07Å; L169-L177 HydrophobicContact CD2-CD2 3.85Å; L169-L177 HydrophobicContact CG-CD1 3.99Å; L169-L177 HydrophobicContact CG-CD2 3.98Å; L177-V179 HydrophobicContact CG-CG2 4.3Å
178	M	81.1	Confident	81.7	Confident	136 Å²	136	112.5 Å²	112.5	67%	0.67	58%	0.577	S	S	*	*			trans	-91.6	127	176.4	-70	-66.6	-69	0	0	110.3	P176	P176-M178 PolarHBondContact O-N 3.22Å
179	V	85.1	Confident	81.9	Confident	88 Å²	88	106.5 Å²	106.5	53%	0.533	56%	0.559	S	S	.	*			trans	-126.6	111.7	174	-177.4	0	0	0	0	107.9	L177 V185	L177-V179 HydrophobicContact CG-CG2 4.3Å; V179-V185 HydrophobicContact CG1-CG1 4.01Å; V179-V185 HydrophobicContact CG1-CG2 3.91Å
180	E	81.5	Confident	82	Confident	174 Å²	174	109.9 Å²	109.9	81%	0.813	56%	0.564	S	S	*	*			trans	-107.4	132.2	178	-68.7	-174.9	173.3	0	0	110.5
181	S	84.5	Confident	82	Confident	59 Å²	59	109.2 Å²	109.2	41%	0.413	55%	0.554	S	S	.	*			trans	-150	127.4	175.4	172.8	0	0	0	0	109.3	R183 G184	S181-R183 PolarHBondContact O-N 3.19Å; S181-R183 PolarHBondContact OG-N 2.96Å; S181-G184 VanDerWaalsContact CB-O 3.24Å; S181-G184 WeakPolarHBondContact CB-O 3.33Å; S181-G184 PolarHBondContact OG-N 2.85Å; S181-G184 PolarHBondContact OG-O 2.91Å
182	N	82.9	Confident	82.2	Confident	160 Å²	160	116.9 Å²	116.9	86%	0.856	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-6.3	173.3	64.3	-12.2	0	0	0	113.3
183	R	83.8	Confident	82.6	Confident	222 Å²	222	117.3 Å²	117.3	84%	0.838	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	10.9	176.6	-64.3	-171.9	179.7	-171.3	0.5	112.9	S181	S181-R183 PolarHBondContact O-N 3.19Å; S181-R183 PolarHBondContact OG-N 2.96Å
184	G	84.1	Confident	83.2	Confident	24 Å²	24	110 Å²	110	25%	0.247	56%	0.561	C	S	.	*			trans	85	164.2	-173.6	0	0	0	0	0	113.8	S181 L202	S181-G184 VanDerWaalsContact CB-O 3.24Å; S181-G184 WeakPolarHBondContact CB-O 3.33Å; S181-G184 PolarHBondContact OG-N 2.85Å; S181-G184 PolarHBondContact OG-O 2.91Å; G184-L202 CarbonylContact C-O 3.55Å; G184-L202 WeakPolarHBondContact CA-O 3.33Å
185	V	87.8	Confident	83.9	Confident	28 Å²	28	105 Å²	105	17%	0.17	55%	0.545	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.5	179.8	179.7	0	0	0	0	108.4	V179 L202	V179-V185 HydrophobicContact CG1-CG1 4.01Å; V179-V185 HydrophobicContact CG1-CG2 3.91Å; V185-L202 HydrophobicContact CB-CB 4.25Å; V185-L202 HydrophobicContact CB-CD1 4.05Å; V185-L202 HydrophobicContact CG1-CD1 4.28Å; V185-L202 PolarHBondContact N-O 3.03Å; V185-L202 PolarHBondContact O-N 3.1Å
186	R	87.3	Confident	84.1	Confident	170 Å²	170	104.3 Å²	104.3	64%	0.642	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	115.3	178.5	-175.4	-177.1	-69.2	165.4	-1.3	110.3	R199 L200 I201	R186-R199 HydrophobicContact CG-CG 4.25Å; R186-L200 CarbonylContact C-O 3.57Å; R186-L200 WeakPolarHBondContact CA-O 3.26Å; R186-I201 HydrophobicContact CG-CG1 4.29Å
187	L	87.4	Confident	84.5	Confident	106 Å²	106	102.2 Å²	102.2	56%	0.555	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	124.5	169.8	-56.1	175.3	0	0	0	108.1	R199 L200	L187-R199 CarbonylContact O-C 3.57Å; L187-R199 WeakPolarHBondContact O-CA 3.18Å; L187-L200 HydrophobicContact CB-CB 4.3Å; L187-L200 HydrophobicContact CD1-CD2 4.25Å; L187-L200 PolarHBondContact N-O 3.18Å; L187-L200 PolarHBondContact O-N 2.72Å
188	T	88.2	Confident	84.6	Confident	58 Å²	58	100.2 Å²	100.2	36%	0.356	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	114.8	-179.3	-51.7	0	0	0	0	108.4	V196	T188-V196 HydrophobicContact CG2-CB 4.21Å; T188-V196 HydrophobicContact CG2-CG1 3.55Å; T188-V196 HydrophobicContact CG2-CG2 3.68Å
189	A	84.8	Confident	85	Confident	42 Å²	42	97.5 Å²	97.5	35%	0.347	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	138.5	166.6	0	0	0	0	0	108.6	V196 S197 S198	A189-V196 WeakPolarHBondContact O-CA 3.46Å; A189-S197 PolarHBondContact O-N 3.35Å; A189-S197 PolarHBondContact O-OG 3.47Å; A189-S198 WeakPolarHBondContact CB-OG 3.31Å; A189-S198 PolarHBondContact N-O 2.85Å
190	R	85.6	Confident	85.2	Confident	179 Å²	179	95.7 Å²	95.7	68%	0.675	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.3	142.9	172.4	-67	179.5	-176.5	-140.4	10.4	109.1	G194 N195 V196	R190-G194 WeakPolarHBondContact CD-O 3.27Å; R190-G194 PolarHBondContact NH1-O 2.86Å; R190-N195 CarbonylContact C-O 3.44Å; R190-N195 WeakPolarHBondContact CA-O 3.43Å; R190-N195 WeakPolarHBondContact CB-O 3.49Å; R190-V196 HydrophobicContact CG-CG2 4.27Å
191	D	82.4	Confident	85.6	Confident	64 Å²	64	88.9 Å²	88.9	34%	0.342	46%	0.46	S	S	.	.			trans	-73.4	176.9	171.5	67.6	20.4	0	0	0	111.5	T193 G194 N195	D191-T193 PolarHBondContact O-N 3.33Å; D191-T193 VanDerWaalsContact OD1-CA 3.29Å; D191-T193 WeakPolarHBondContact OD1-CA 3.43Å; D191-T193 WeakPolarHBondContact OD1-CB 3.35Å; D191-T193 PolarHBondContact OD1-N 2.76Å; D191-T193 PolarHBondContact OD1-OG1 2.86Å; D191-T193 PolarHBondContact OD2-OG1 2.86Å; D191-T193 VanDerWaalsContact OD2-OG1 3.1Å; D191-G194 PolarHBondContact O-N 3.48Å; D191-G194 PolarHBondContact OD1-N 3.35Å; D191-N195 PolarHBondContact N-O 3.32Å; D191-N195 PolarHBondContact OD1-N 3.31Å
192	Q	84.4	Confident	85.8	Confident	202 Å²	202	89.3 Å²	89.3	94%	0.944	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.5	176.9	64.4	-171.6	-3.9	0	0	114.3	G194	Q192-G194 VanDerWaalsContact C-N 3.33Å
193	T	84.3	Confident	85.8	Confident	94 Å²	94	85 Å²	85	58%	0.577	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-6.8	176.1	73.1	0	0	0	0	112.2	D191 N195	D191-T193 PolarHBondContact O-N 3.33Å; D191-T193 VanDerWaalsContact OD1-CA 3.29Å; D191-T193 WeakPolarHBondContact OD1-CA 3.43Å; D191-T193 WeakPolarHBondContact OD1-CB 3.35Å; D191-T193 PolarHBondContact OD1-N 2.76Å; D191-T193 PolarHBondContact OD1-OG1 2.86Å; D191-T193 PolarHBondContact OD2-OG1 2.86Å; D191-T193 VanDerWaalsContact OD2-OG1 3.1Å; T193-N195 VanDerWaalsContact C-N 3.34Å; T193-N195 PolarHBondContact OG1-ND2 2.85Å
194	G	83.2	Confident	85.6	Confident	33 Å²	33	81 Å²	81	34%	0.34	43%	0.429	S	S	.	.	S	Bend	trans	87.2	0.8	-177.8	0	0	0	0	0	114.1	R190 D191 Q192	R190-G194 WeakPolarHBondContact CD-O 3.27Å; R190-G194 PolarHBondContact NH1-O 2.86Å; D191-G194 PolarHBondContact O-N 3.48Å; D191-G194 PolarHBondContact OD1-N 3.35Å; Q192-G194 VanDerWaalsContact C-N 3.33Å
195	N	85.4	Confident	85.4	Confident	106 Å²	106	84.1 Å²	84.1	57%	0.567	46%	0.461	S	S	*	.			trans	-76.9	151.5	175.2	-71.3	-37.3	0	0	0	110.7	R190 D191 T193 S197	R190-N195 CarbonylContact C-O 3.44Å; R190-N195 WeakPolarHBondContact CA-O 3.43Å; R190-N195 WeakPolarHBondContact CB-O 3.49Å; D191-N195 PolarHBondContact N-O 3.32Å; D191-N195 PolarHBondContact OD1-N 3.31Å; T193-N195 VanDerWaalsContact C-N 3.34Å; T193-N195 PolarHBondContact OG1-ND2 2.85Å; N195-S197 PolarHBondContact O-N 2.84Å
196	V	81	Confident	85.1	Confident	55 Å²	55	89.5 Å²	89.5	33%	0.333	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	112.4	179.3	175.6	0	0	0	0	108.9	T188 A189 R190 R199	T188-V196 HydrophobicContact CG2-CB 4.21Å; T188-V196 HydrophobicContact CG2-CG1 3.55Å; T188-V196 HydrophobicContact CG2-CG2 3.68Å; A189-V196 WeakPolarHBondContact O-CA 3.46Å; R190-V196 HydrophobicContact CG-CG2 4.27Å; V196-R199 HydrophobicContact CG1-CB 4.26Å
197	S	84.6	Confident	85	Confident	58 Å²	58	86.3 Å²	86.3	41%	0.406	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-42.8	179.4	55.8	0	0	0	0	112	A189 N195	A189-S197 PolarHBondContact O-N 3.35Å; A189-S197 PolarHBondContact O-OG 3.47Å; N195-S197 PolarHBondContact O-N 2.84Å
198	S	87.2	Confident	84.9	Confident	47 Å²	47	86.6 Å²	86.6	33%	0.329	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	145.6	176.7	59.7	0	0	0	0	111.5	A189 L210	A189-S198 WeakPolarHBondContact CB-OG 3.31Å; A189-S198 PolarHBondContact N-O 2.85Å; S198-L210 CarbonylContact C-O 3.52Å; S198-L210 WeakPolarHBondContact CA-O 3.2Å
199	R	89.5	Confident	84.8	Confident	79 Å²	79	86.1 Å²	86.1	30%	0.298	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	128.7	-179.7	-170.5	-177.6	-70.4	157.4	1.8	110.5	R186 L187 V196 I201 A209 L210	R186-R199 HydrophobicContact CG-CG 4.25Å; L187-R199 CarbonylContact O-C 3.57Å; L187-R199 WeakPolarHBondContact O-CA 3.18Å; V196-R199 HydrophobicContact CG1-CB 4.26Å; R199-I201 HydrophobicContact CG-CD1 4.23Å; R199-I201 HydrophobicContact CG-CG1 3.8Å; R199-A209 CarbonylContact O-C 3.53Å; R199-A209 WeakPolarHBondContact O-CA 3.32Å; R199-L210 HydrophobicContact CB-CB 4.23Å; R199-L210 PolarHBondContact N-O 3.45Å; R199-L210 PolarHBondContact O-N 2.85Å
200	L	89.2	Confident	84.9	Confident	50 Å²	50	89.6 Å²	89.6	26%	0.262	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	120.6	169.6	-172.3	69.6	0	0	0	108.6	R186 L187 L202 V207 Q208 A209	R186-L200 CarbonylContact C-O 3.57Å; R186-L200 WeakPolarHBondContact CA-O 3.26Å; L187-L200 HydrophobicContact CB-CB 4.3Å; L187-L200 HydrophobicContact CD1-CD2 4.25Å; L187-L200 PolarHBondContact N-O 3.18Å; L187-L200 PolarHBondContact O-N 2.72Å; L200-L202 HydrophobicContact CD2-CD1 4.25Å; L200-L202 HydrophobicContact CG-CD1 4.18Å; L200-V207 HydrophobicContact CD1-CG1 3.75Å; L200-Q208 CarbonylContact C-O 3.54Å; L200-Q208 WeakPolarHBondContact CA-O 3.31Å; L200-A209 HydrophobicContact CD1-CB 3.75Å
201	I	89.3	Confident	84.9	Confident	31 Å²	31	83.2 Å²	83.2	16%	0.159	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.3	-179.1	-51.9	173.9	0	0	0	108.1	R186 R199 N203 V207 Q208	R186-I201 HydrophobicContact CG-CG1 4.29Å; R199-I201 HydrophobicContact CG-CD1 4.23Å; R199-I201 HydrophobicContact CG-CG1 3.8Å; I201-N203 HydrophobicContact CG2-CB 4.13Å; I201-V207 CarbonylContact O-C 3.55Å; I201-V207 WeakPolarHBondContact O-CA 3.35Å; I201-Q208 HydrophobicContact CB-CB 4.33Å; I201-Q208 PolarHBondContact N-O 2.98Å; I201-Q208 PolarHBondContact O-N 3.3Å
202	L	88.8	Confident	84.9	Confident	67 Å²	67	87.7 Å²	87.7	35%	0.351	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	108.3	167.5	-60.9	94.5	0	0	0	107.2	G184 V185 L200 K206 V207	G184-L202 CarbonylContact C-O 3.55Å; G184-L202 WeakPolarHBondContact CA-O 3.33Å; V185-L202 HydrophobicContact CB-CB 4.25Å; V185-L202 HydrophobicContact CB-CD1 4.05Å; V185-L202 HydrophobicContact CG1-CD1 4.28Å; V185-L202 PolarHBondContact N-O 3.03Å; V185-L202 PolarHBondContact O-N 3.1Å; L200-L202 HydrophobicContact CD2-CD1 4.25Å; L200-L202 HydrophobicContact CG-CD1 4.18Å; L202-K206 WeakPolarHBondContact CA-O 3.16Å; L202-V207 HydrophobicContact CD2-CG2 3.93Å; L202-V207 HydrophobicContact CG-CG1 4.33Å; L202-V207 HydrophobicContact CG-CG2 4.07Å
203	N	83.3	Confident	85	Confident	70 Å²	70	84.7 Å²	84.7	37%	0.374	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	143.1	178.1	-171.2	38.4	0	0	0	111	I201 G205 K206	I201-N203 HydrophobicContact CG2-CB 4.13Å; N203-G205 VanDerWaalsContact C-N 3.3Å; N203-G205 PolarHBondContact O-N 2.67Å; N203-K206 PolarHBondContact N-O 3.03Å; N203-K206 PolarHBondContact O-N 3.5Å; N203-K206 VanDerWaalsContact O-O 3.06Å
204	D	79.9	Confident	85.1	Confident	138 Å²	138	84 Å²	84	74%	0.738	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	46.1	172.7	-60.5	-39	0	0	0	114.7	K206	D204-K206 PolarHBondContact O-N 3.02Å
205	G	79.8	Confident	85.2	Confident	89 Å²	89	84.9 Å²	84.9	92%	0.918	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.1	7.7	-180	0	0	0	0	0	114.8	N203	N203-G205 VanDerWaalsContact C-N 3.3Å; N203-G205 PolarHBondContact O-N 2.67Å
206	K	81.6	Confident	85	Confident	141 Å²	141	83 Å²	83	61%	0.613	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114	136.2	176.5	-62.5	-178.4	-177	179.3	0	110.4	L202 N203 D204	L202-K206 WeakPolarHBondContact CA-O 3.16Å; N203-K206 PolarHBondContact N-O 3.03Å; N203-K206 PolarHBondContact O-N 3.5Å; N203-K206 VanDerWaalsContact O-O 3.06Å; D204-K206 PolarHBondContact O-N 3.02Å
207	V	85	Confident	84.9	Confident	103 Å²	103	84 Å²	84	62%	0.624	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.4	166.7	-178.2	0	0	0	0	107	L200 I201 L202	L200-V207 HydrophobicContact CD1-CG1 3.75Å; I201-V207 CarbonylContact O-C 3.55Å; I201-V207 WeakPolarHBondContact O-CA 3.35Å; L202-V207 HydrophobicContact CD2-CG2 3.93Å; L202-V207 HydrophobicContact CG-CG1 4.33Å; L202-V207 HydrophobicContact CG-CG2 4.07Å
208	Q	85.6	Confident	84.6	Confident	113 Å²	113	83 Å²	83	53%	0.528	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.3	177.5	-64.7	-179.2	-27.1	0	0	108.9	L200 I201	L200-Q208 CarbonylContact C-O 3.54Å; L200-Q208 WeakPolarHBondContact CA-O 3.31Å; I201-Q208 HydrophobicContact CB-CB 4.33Å; I201-Q208 PolarHBondContact N-O 2.98Å; I201-Q208 PolarHBondContact O-N 3.3Å
209	A	86.4	Confident	83.8	Confident	47 Å²	47	91.4 Å²	91.4	39%	0.388	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	121.1	168.6	0	0	0	0	0	108.7	R199 L200 F214	R199-A209 CarbonylContact O-C 3.53Å; R199-A209 WeakPolarHBondContact O-CA 3.32Å; L200-A209 HydrophobicContact CD1-CB 3.75Å; A209-F214 HydrophobicContact CB-CD2 3.8Å; A209-F214 HydrophobicContact CB-CE2 4.12Å; A209-F214 HydrophobicContact CB-CG 4.47Å
210	L	86.5	Confident	83.2	Confident	116 Å²	116	93.7 Å²	93.7	61%	0.607	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	101.6	171.6	-170	80.7	0	0	0	107.5	S198 R199	S198-L210 CarbonylContact C-O 3.52Å; S198-L210 WeakPolarHBondContact CA-O 3.2Å; R199-L210 HydrophobicContact CB-CB 4.23Å; R199-L210 PolarHBondContact N-O 3.45Å; R199-L210 PolarHBondContact O-N 2.85Å
211	C	84.9	Confident	82.4	Confident	44 Å²	44	94.1 Å²	94.1	30%	0.297	52%	0.516	S	S	.	.	S	Bend	trans	-161.8	155.3	-179.4	51.5	0	0	0	0	109.2	R213	C211-R213 PolarHBondContact O-N 2.81Å
212	D	83.6	Confident	81.6	Confident	159 Å²	159	96.4 Å²	96.4	85%	0.85	53%	0.525	S	S	*	.	S	Bend	trans	-65	-27.6	178.4	-56	-23.2	0	0	0	112.6
213	R	85.4	Confident	80.8	Confident	139 Å²	139	95.5 Å²	95.5	53%	0.525	52%	0.522	S	S	.	.			trans	-152	129.8	179.8	178	171.6	170.6	179.8	-5.4	110.9	C211 D215 L228	C211-R213 PolarHBondContact O-N 2.81Å; R213-D215 IonicContact CZ-OD1 3.91Å; R213-D215 IonicContact CZ-OD2 3.12Å; R213-D215 VanDerWaalsContact NE-CG 3.32Å; R213-D215 IonicContact NE-OD1 3.12Å; R213-D215 PolarHBondContact NE-OD1 3.36Å; R213-D215 VanDerWaalsContact NE-OD1 3.12Å; R213-D215 IonicContact NE-OD2 2.83Å; R213-D215 PolarHBondContact NE-OD2 2.81Å; R213-D215 IonicContact NH2-OD1 3.78Å; R213-D215 IonicContact NH2-OD2 2.72Å; R213-D215 PolarHBondContact NH2-OD2 3.33Å; R213-L228 HydrophobicContact CG-CG 4.26Å
214	F	86.3	Confident	80.3	Confident	79 Å²	79	94.5 Å²	94.5	35%	0.346	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	105.9	176.9	-176.7	-97.3	0	0	0	110.7	A209 V216 F225 S226 A227	A209-F214 HydrophobicContact CB-CD2 3.8Å; A209-F214 HydrophobicContact CB-CE2 4.12Å; A209-F214 HydrophobicContact CB-CG 4.47Å; F214-V216 HydrophobicContact CE1-CG2 3.74Å; F214-V216 HydrophobicContact CZ-CG2 4.21Å; F214-F225 AromaticContact CD1-CD1 3.95Å; F214-F225 HydrophobicContact CD1-CD1 3.95Å; F214-F225 AromaticContact CD1-CE1 3.8Å; F214-F225 HydrophobicContact CD1-CE1 3.8Å; F214-F225 HydrophobicContact CE1-CD1 4.05Å; F214-F225 HydrophobicContact CE1-CE1 4.05Å; F214-S226 CarbonylContact O-C 3.44Å; F214-S226 WeakPolarHBondContact O-CA 3.48Å; F214-A227 HydrophobicContact CB-CB 4.4Å; F214-A227 PolarHBondContact N-O 3.04Å; F214-A227 PolarHBondContact O-N 3.44Å
215	D	85.2	Confident	80.2	Confident	51 Å²	51	91.2 Å²	91.2	27%	0.273	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	131.2	177.4	-71.7	-9.8	0	0	0	111.2	R213 V217 T223 F225 S226	R213-D215 IonicContact CZ-OD1 3.91Å; R213-D215 IonicContact CZ-OD2 3.12Å; R213-D215 VanDerWaalsContact NE-CG 3.32Å; R213-D215 IonicContact NE-OD1 3.12Å; R213-D215 PolarHBondContact NE-OD1 3.36Å; R213-D215 VanDerWaalsContact NE-OD1 3.12Å; R213-D215 IonicContact NE-OD2 2.83Å; R213-D215 PolarHBondContact NE-OD2 2.81Å; R213-D215 IonicContact NH2-OD1 3.78Å; R213-D215 IonicContact NH2-OD2 2.72Å; R213-D215 PolarHBondContact NH2-OD2 3.33Å; D215-V217 HydrophobicContact CB-CG2 4.27Å; D215-T223 HydrophobicContact CB-CG2 4.27Å; D215-F225 CarbonylContact C-O 3.59Å; D215-F225 WeakPolarHBondContact CA-O 3.17Å; D215-S226 VanDerWaalsContact OD1-CB 3.29Å; D215-S226 WeakPolarHBondContact OD1-CB 3.06Å; D215-S226 PolarHBondContact OD1-OG 3.32Å
216	V	81.5	Confident	80.3	Confident	68 Å²	68	87.4 Å²	87.4	41%	0.412	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	115.7	162	-172.6	0	0	0	0	107.4	F214 V224 F225	F214-V216 HydrophobicContact CE1-CG2 3.74Å; F214-V216 HydrophobicContact CZ-CG2 4.21Å; V216-V224 PolarHBondContact O-N 2.83Å; V216-F225 HydrophobicContact CB-CB 3.84Å; V216-F225 HydrophobicContact CG2-CB 3.87Å; V216-F225 HydrophobicContact CG2-CD1 4.05Å; V216-F225 HydrophobicContact CG2-CG 4.32Å; V216-F225 PolarHBondContact N-O 3.07Å; V216-F225 PolarHBondContact O-N 2.86Å
217	V	80.1	Confident	80.3	Confident	74 Å²	74	81.9 Å²	81.9	45%	0.448	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	137.3	-175.4	-146	0	0	0	0	109.1	D215 G221 K222	D215-V217 HydrophobicContact CB-CG2 4.27Å; V217-G221 VanDerWaalsContact CG1-O 3.24Å; V217-G221 WeakPolarHBondContact CG1-O 3.4Å; V217-K222 CarbonylContact C-O 3.56Å; V217-K222 WeakPolarHBondContact CA-O 3.47Å; V217-K222 WeakPolarHBondContact CG1-O 3.48Å
218	N	77.1	Confident	80.1	Confident	39 Å²	39	80.1 Å²	80.1	21%	0.209	42%	0.424	C	S	.	.			trans	-72.4	175.7	171.5	73.5	3.7	0	0	0	110.9	E220 G221 K222 V224	N218-E220 PolarHBondContact O-N 2.88Å; N218-E220 VanDerWaalsContact O-N 3.12Å; N218-E220 WeakPolarHBondContact OD1-CA 3.24Å; N218-E220 WeakPolarHBondContact OD1-CB 3.24Å; N218-E220 PolarHBondContact OD1-N 2.87Å; N218-G221 PolarHBondContact O-N 3.48Å; N218-G221 PolarHBondContact OD1-N 3.47Å; N218-K222 PolarHBondContact N-O 2.74Å; N218-K222 WeakPolarHBondContact OD1-CB 3.47Å; N218-K222 PolarHBondContact OD1-N 3.32Å; N218-K222 PolarHBondContact OD1-O 3.23Å; N218-V224 HydrophobicContact CB-CG2 3.59Å
219	K	71.3	Confident	79.6	Confident	222 Å²	222	83.7 Å²	83.7	97%	0.965	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.1	178	-67.3	-178	-179.9	175.3	0	114	G221	K219-G221 VanDerWaalsContact C-N 3.3Å
220	E	75.7	Confident	78.8	Confident	127 Å²	127	88.8 Å²	88.8	59%	0.593	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	0.4	179.6	-51.8	-179.3	167.4	0	0	112.4	N218 K222	N218-E220 PolarHBondContact O-N 2.88Å; N218-E220 VanDerWaalsContact O-N 3.12Å; N218-E220 WeakPolarHBondContact OD1-CA 3.24Å; N218-E220 WeakPolarHBondContact OD1-CB 3.24Å; N218-E220 PolarHBondContact OD1-N 2.87Å; E220-K222 VanDerWaalsContact C-N 3.29Å; E220-K222 HydrophobicContact CB-CG 4.43Å; E220-K222 VanDerWaalsContact OE2-CE 3.27Å; E220-K222 WeakPolarHBondContact OE2-CE 3.19Å; E220-K222 IonicContact OE2-NZ 2.69Å; E220-K222 PolarHBondContact OE2-NZ 3.11Å
221	G	72.6	Confident	77.9	Confident	60 Å²	60	89 Å²	89	62%	0.619	46%	0.46	S	S	*	.	S	Bend	trans	78.4	10.4	-176.1	0	0	0	0	0	113.9	V217 N218 K219	V217-G221 VanDerWaalsContact CG1-O 3.24Å; V217-G221 WeakPolarHBondContact CG1-O 3.4Å; N218-G221 PolarHBondContact O-N 3.48Å; N218-G221 PolarHBondContact OD1-N 3.47Å; K219-G221 VanDerWaalsContact C-N 3.3Å
222	K	74.3	Confident	77.2	Confident	79 Å²	79	91.7 Å²	91.7	34%	0.343	47%	0.474	S	S	.	.			trans	-86.8	135.4	173.5	-60.9	172.5	-179.7	155.4	0	110.9	V217 N218 E220 V224 E237	V217-K222 CarbonylContact C-O 3.56Å; V217-K222 WeakPolarHBondContact CA-O 3.47Å; V217-K222 WeakPolarHBondContact CG1-O 3.48Å; N218-K222 PolarHBondContact N-O 2.74Å; N218-K222 WeakPolarHBondContact OD1-CB 3.47Å; N218-K222 PolarHBondContact OD1-N 3.32Å; N218-K222 PolarHBondContact OD1-O 3.23Å; E220-K222 VanDerWaalsContact C-N 3.29Å; E220-K222 HydrophobicContact CB-CG 4.43Å; E220-K222 VanDerWaalsContact OE2-CE 3.27Å; E220-K222 WeakPolarHBondContact OE2-CE 3.19Å; E220-K222 IonicContact OE2-NZ 2.69Å; E220-K222 PolarHBondContact OE2-NZ 3.11Å; K222-V224 PolarHBondContact O-N 2.66Å; K222-E237 WeakPolarHBondContact CD-OE1 3.32Å; K222-E237 IonicContact NZ-OE1 2.74Å; K222-E237 PolarHBondContact NZ-OE1 2.93Å
223	T	71	Confident	76.3	Confident	47 Å²	47	86.4 Å²	86.4	29%	0.288	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	124.2	173.4	47.6	0	0	0	0	110.6	D215 R235	D215-T223 HydrophobicContact CB-CG2 4.27Å; T223-R235 WeakPolarHBondContact O-CB 3.25Å; T223-R235 WeakPolarHBondContact O-CD 3.45Å
224	V	73.1	Confident	75.5	Confident	50 Å²	50	84.2 Å²	84.2	30%	0.303	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-35	177.7	-175.2	0	0	0	0	110.6	V216 N218 K222 V234 R235	V216-V224 PolarHBondContact O-N 2.83Å; N218-V224 HydrophobicContact CB-CG2 3.59Å; K222-V224 PolarHBondContact O-N 2.66Å; V224-V234 CarbonylContact O-C 3.42Å; V224-V234 WeakPolarHBondContact O-CA 3.49Å; V224-R235 PolarHBondContact O-N 3.04Å
225	F	77.8	Confident	74.1	Confident	68 Å²	68	87.4 Å²	87.4	30%	0.298	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	132.7	171.9	-180	-87.7	0	0	0	107	F214 D215 V216 A227 V232 A233 V234	F214-F225 AromaticContact CD1-CD1 3.95Å; F214-F225 HydrophobicContact CD1-CD1 3.95Å; F214-F225 AromaticContact CD1-CE1 3.8Å; F214-F225 HydrophobicContact CD1-CE1 3.8Å; F214-F225 HydrophobicContact CE1-CD1 4.05Å; F214-F225 HydrophobicContact CE1-CE1 4.05Å; D215-F225 CarbonylContact C-O 3.59Å; D215-F225 WeakPolarHBondContact CA-O 3.17Å; V216-F225 HydrophobicContact CB-CB 3.84Å; V216-F225 HydrophobicContact CG2-CB 3.87Å; V216-F225 HydrophobicContact CG2-CD1 4.05Å; V216-F225 HydrophobicContact CG2-CG 4.32Å; V216-F225 PolarHBondContact N-O 3.07Å; V216-F225 PolarHBondContact O-N 2.86Å; F225-A227 HydrophobicContact CE1-CB 3.78Å; F225-A227 HydrophobicContact CZ-CB 4.23Å; F225-V232 HydrophobicContact CD2-CG1 4.44Å; F225-V232 HydrophobicContact CE2-CG1 3.63Å; F225-V232 HydrophobicContact CZ-CG1 3.78Å; F225-A233 CarbonylContact C-O 3.54Å; F225-A233 VanDerWaalsContact CA-O 3.31Å; F225-A233 WeakPolarHBondContact CA-O 3.26Å; F225-V234 HydrophobicContact CD2-CG2 3.91Å; F225-V234 HydrophobicContact CE2-CG2 4.29Å
226	S	81.2	Confident	72.7	Confident	10 Å²	10	88.5 Å²	88.5	7%	0.07	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	129.3	172.6	-173.7	0	0	0	0	107.9	F214 D215 V232 A233	F214-S226 CarbonylContact O-C 3.44Å; F214-S226 WeakPolarHBondContact O-CA 3.48Å; D215-S226 VanDerWaalsContact OD1-CB 3.29Å; D215-S226 WeakPolarHBondContact OD1-CB 3.06Å; D215-S226 PolarHBondContact OD1-OG 3.32Å; S226-V232 CarbonylContact O-C 3.36Å; S226-V232 VanDerWaalsContact O-CA 3.32Å; S226-V232 WeakPolarHBondContact O-CA 3.37Å; S226-A233 PolarHBondContact N-O 3.44Å; S226-A233 PolarHBondContact O-N 3.1Å
227	A	82	Confident	71.4	Confident	24 Å²	24	90.4 Å²	90.4	20%	0.198	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	116.8	172.7	0	0	0	0	0	108.8	F214 F225 E231 V232	F214-A227 HydrophobicContact CB-CB 4.4Å; F214-A227 PolarHBondContact N-O 3.04Å; F214-A227 PolarHBondContact O-N 3.44Å; F225-A227 HydrophobicContact CE1-CB 3.78Å; F225-A227 HydrophobicContact CZ-CB 4.23Å; A227-E231 WeakPolarHBondContact CA-O 3.22Å; A227-V232 HydrophobicContact CB-CG2 4.28Å
228	L	80.6	Confident	69.8	Low	66 Å²	66	90.1 Å²	90.1	35%	0.346	47%	0.473	S	S	.	.			trans	-106.5	-178.5	169.2	-68	102.2	0	0	0	109.2	R213 D230 E231	R213-L228 HydrophobicContact CG-CG 4.26Å; L228-D230 PolarHBondContact O-N 3.03Å; L228-E231 HydrophobicContact CB-CG 4.14Å; L228-E231 HydrophobicContact CD1-CG 3.79Å; L228-E231 PolarHBondContact N-O 3.45Å
229	E	75.4	Confident	68.6	Low	188 Å²	188	91.1 Å²	91.1	88%	0.879	48%	0.478	S	S	*	.	S	Bend	trans	-57.7	-36.9	174.9	-165.9	170.9	-175.8	0	0	112.2
230	D	69.4	Low	67.4	Low	154 Å²	154	90.6 Å²	90.6	82%	0.824	47%	0.47	S	S	*	.	S	Bend	trans	-110.7	-12	-169.9	-54.6	-28.4	0	0	0	114.9	L228	L228-D230 PolarHBondContact O-N 3.03Å
231	E	68	Low	66.1	Low	122 Å²	122	91.7 Å²	91.7	57%	0.57	48%	0.479	S	S	*	.			trans	-147.8	148.1	-172.9	63.6	175.7	-175.7	0	0	114.4	A227 L228	A227-E231 WeakPolarHBondContact CA-O 3.22Å; L228-E231 HydrophobicContact CB-CG 4.14Å; L228-E231 HydrophobicContact CD1-CG 3.79Å; L228-E231 PolarHBondContact N-O 3.45Å
232	V	69	Low	64.9	Low	99 Å²	99	94.3 Å²	94.3	60%	0.6	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123	114.5	168.8	-179.1	0	0	0	0	108.9	F225 S226 A227	F225-V232 HydrophobicContact CD2-CG1 4.44Å; F225-V232 HydrophobicContact CE2-CG1 3.63Å; F225-V232 HydrophobicContact CZ-CG1 3.78Å; S226-V232 CarbonylContact O-C 3.36Å; S226-V232 VanDerWaalsContact O-CA 3.32Å; S226-V232 WeakPolarHBondContact O-CA 3.37Å; A227-V232 HydrophobicContact CB-CG2 4.28Å
233	A	65.6	Low	63.5	Low	48 Å²	48	95.4 Å²	95.4	40%	0.397	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.8	177.9	0	0	0	0	0	110.6	F225 S226	F225-A233 CarbonylContact C-O 3.54Å; F225-A233 VanDerWaalsContact CA-O 3.31Å; F225-A233 WeakPolarHBondContact CA-O 3.26Å; S226-A233 PolarHBondContact N-O 3.44Å; S226-A233 PolarHBondContact O-N 3.1Å
234	V	68.3	Low	62.5	Low	94 Å²	94	103.2 Å²	103.2	57%	0.57	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	115.2	170	-172.5	0	0	0	0	108.8	V224 F225 V236	V224-V234 CarbonylContact O-C 3.42Å; V224-V234 WeakPolarHBondContact O-CA 3.49Å; F225-V234 HydrophobicContact CD2-CG2 3.91Å; F225-V234 HydrophobicContact CE2-CG2 4.29Å; V234-V236 HydrophobicContact CG1-CG2 4.25Å
235	R	56.2	Low	61.5	Low	146 Å²	146	104.5 Å²	104.5	55%	0.551	55%	0.551	S	S	*	*			trans	-110.3	94.5	178.8	-172.5	-177.5	-170.2	-175.7	3	109	T223 V224	T223-R235 WeakPolarHBondContact O-CB 3.25Å; T223-R235 WeakPolarHBondContact O-CD 3.45Å; V224-R235 PolarHBondContact O-N 3.04Å
236	V	57.6	Low	60.5	Low	73 Å²	73	104.5 Å²	104.5	44%	0.442	57%	0.571	S	S	.	*	B	Isolated β-bridge	trans	-85.5	133.8	164.1	-172.4	0	0	0	0	106.7	V234 N238 L239	V234-V236 HydrophobicContact CG1-CG2 4.25Å; V236-N238 PolarHBondContact O-N 3.2Å; V236-L239 HydrophobicContact CB-CB 3.44Å; V236-L239 VanDerWaalsContact CB-CB 3.44Å; V236-L239 HydrophobicContact CG1-CB 3.74Å; V236-L239 HydrophobicContact CG2-CB 3.82Å; V236-L239 PolarHBondContact O-N 3.48Å; V236-L239 VanDerWaalsContact O-N 3.13Å
237	E	53.3	Low	59.5	Low	108 Å²	108	107.3 Å²	107.3	51%	0.505	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.4	-16.4	-174.2	-73.5	-165.9	132.7	0	0	114.4	K222	K222-E237 WeakPolarHBondContact CD-OE1 3.32Å; K222-E237 IonicContact NZ-OE1 2.74Å; K222-E237 PolarHBondContact NZ-OE1 2.93Å
238	N	47.3	Very low	58.2	Low	69 Å²	69	112.6 Å²	112.6	37%	0.369	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-141	24	172.4	-72.6	-41.7	0	0	0	113.8	V236	V236-N238 PolarHBondContact O-N 3.2Å
239	L	50.1	Low	57	Low	59 Å²	59	113.9 Å²	113.9	31%	0.309	62%	0.623	S	S	.	*	B	Isolated β-bridge	trans	-123.8	90	172.1	-147.9	99.8	0	0	0	108.8	V236 I241 F249	V236-L239 HydrophobicContact CB-CB 3.44Å; V236-L239 VanDerWaalsContact CB-CB 3.44Å; V236-L239 HydrophobicContact CG1-CB 3.74Å; V236-L239 HydrophobicContact CG2-CB 3.82Å; V236-L239 PolarHBondContact O-N 3.48Å; V236-L239 VanDerWaalsContact O-N 3.13Å; L239-I241 HydrophobicContact CD2-CD1 4.04Å; L239-I241 HydrophobicContact CD2-CG1 3.57Å; L239-I241 HydrophobicContact CG-CG1 4.31Å; L239-F249 HydrophobicContact CD1-CD1 4.35Å; L239-F249 HydrophobicContact CD1-CE1 3.7Å; L239-F249 HydrophobicContact CD1-CZ 4.5Å
240	R	46.7	Very low	55.9	Low	211 Å²	211	112.9 Å²	112.9	80%	0.796	62%	0.618	S	S	*	*			trans	-86.5	107.2	154.5	-158.2	176.3	-168.9	-169	2.4	104.5	I242	R240-I242 HydrophobicContact CB-CD1 4.48Å; R240-I242 HydrophobicContact CB-CG1 4.09Å; R240-I242 HydrophobicContact CG-CD1 4.48Å; R240-I242 HydrophobicContact CG-CG1 3.94Å; R240-I242 PolarHBondContact O-N 3.13Å
241	I	48.5	Very low	55.5	Low	151 Å²	151	107.8 Å²	107.8	77%	0.774	60%	0.602	S	S	*	*			trans	-66.4	95.4	167.6	-59.2	176.8	0	0	0	105.3	L239	L239-I241 HydrophobicContact CD2-CD1 4.04Å; L239-I241 HydrophobicContact CD2-CG1 3.57Å; L239-I241 HydrophobicContact CG-CG1 4.31Å
242	I	47	Very low	55.3	Low	114 Å²	114	108.1 Å²	108.1	59%	0.585	62%	0.617	S	S	*	*			trans	-90.5	137.9	165.6	-52.5	175.6	0	0	0	104.8	R240	R240-I242 HydrophobicContact CB-CD1 4.48Å; R240-I242 HydrophobicContact CB-CG1 4.09Å; R240-I242 HydrophobicContact CG-CD1 4.48Å; R240-I242 HydrophobicContact CG-CG1 3.94Å; R240-I242 PolarHBondContact O-N 3.13Å
243	S	45.2	Very low	54.9	Low	103 Å²	103	108.1 Å²	108.1	72%	0.72	61%	0.613	S	S	*	*	S	Bend	trans	-44.1	147.5	-176.7	61.2	0	0	0	0	114	G245	S243-G245 PolarHBondContact O-N 3.37Å
244	E	50	Low	54.8	Low	210 Å²	210	115.3 Å²	115.3	98%	0.981	64%	0.639	S	S	*	*	S	Bend	trans	30.3	-11.4	164.8	-67.8	-167.6	168.2	0	0	123.5	G246	E244-G246 PolarHBondContact O-N 3.48Å
245	G	51.5	Low	54.6	Low	77 Å²	77	114.2 Å²	114.2	79%	0.794	63%	0.632	S	S	*	*	S	Bend	trans	-92.2	10.4	-172.5	0	0	0	0	0	116.7	S243	S243-G245 PolarHBondContact O-N 3.37Å
246	G	57.6	Low	54.9	Low	69 Å²	69	113.4 Å²	113.4	71%	0.711	65%	0.649	S	S	*	*			trans	78	170.1	-171.6	0	0	0	0	0	113.3	E244	E244-G246 PolarHBondContact O-N 3.48Å
247	S	59.6	Low	55.5	Low	68 Å²	68	114.2 Å²	114.2	48%	0.476	65%	0.65	S	S	.	*			trans	-119.2	132.8	-168.8	48.7	0	0	0	0	112.3	F249	S247-F249 WeakPolarHBondContact O-CD2 3.32Å; S247-F249 VanDerWaalsContact O-CE2 3.3Å; S247-F249 WeakPolarHBondContact O-CE2 3.24Å; S247-F249 WeakPolarHBondContact OG-CE2 3.45Å; S247-F249 WeakPolarHBondContact OG-CZ 3.26Å
248	V	54.9	Low	56.5	Low	135 Å²	135	113.3 Å²	113.3	82%	0.818	65%	0.648	S	S	*	*			trans	-95.4	132.9	171.8	179.6	0	0	0	0	108.6
249	F	56.6	Low	57.6	Low	94 Å²	94	119.5 Å²	119.5	41%	0.412	67%	0.666	S	S	.	*			trans	-114.8	128.8	-177.9	-54.3	-93.8	0	0	0	109.8	L239 S247 G251 I253	L239-F249 HydrophobicContact CD1-CD1 4.35Å; L239-F249 HydrophobicContact CD1-CE1 3.7Å; L239-F249 HydrophobicContact CD1-CZ 4.5Å; S247-F249 WeakPolarHBondContact O-CD2 3.32Å; S247-F249 VanDerWaalsContact O-CE2 3.3Å; S247-F249 WeakPolarHBondContact O-CE2 3.24Å; S247-F249 WeakPolarHBondContact OG-CE2 3.45Å; S247-F249 WeakPolarHBondContact OG-CZ 3.26Å; F249-G251 VanDerWaalsContact C-N 3.33Å; F249-I253 HydrophobicContact CB-CD1 4.14Å; F249-I253 HydrophobicContact CB-CG1 4.41Å; F249-I253 HydrophobicContact CD1-CD1 3.5Å; F249-I253 HydrophobicContact CD1-CG1 3.88Å; F249-I253 HydrophobicContact CD2-CD1 3.45Å; F249-I253 VanDerWaalsContact CD2-CD1 3.45Å; F249-I253 HydrophobicContact CE1-CD1 3.58Å; F249-I253 HydrophobicContact CE1-CG1 4.19Å; F249-I253 HydrophobicContact CE2-CD1 3.51Å; F249-I253 HydrophobicContact CG-CD1 3.43Å; F249-I253 VanDerWaalsContact CG-CD1 3.43Å; F249-I253 HydrophobicContact CG-CG1 4.05Å; F249-I253 HydrophobicContact CZ-CD1 3.57Å
250	E	51.4	Low	58.7	Low	167 Å²	167	119.4 Å²	119.4	78%	0.78	67%	0.669	S	S	*	*	S	Bend	trans	-88.4	5.6	175.2	-58.8	-169.2	162.8	0	0	113.5
251	G	60.1	Low	59.8	Low	46 Å²	46	117.2 Å²	117.2	47%	0.474	67%	0.668	S	S	.	*	S	Bend	trans	-147.1	176.2	-176.7	0	0	0	0	0	114.5	F249	F249-G251 VanDerWaalsContact C-N 3.33Å
252	S	64.5	Low	60.8	Low	129 Å²	129	118.9 Å²	118.9	90%	0.902	67%	0.672	S	S	*	*			trans	-65.4	128.4	178.8	50	0	0	0	0	111.9
253	I	61.4	Low	61.6	Low	100 Å²	100	121.7 Å²	121.7	51%	0.513	69%	0.688	S	S	.	*			trans	-95.2	127.6	173	-66.7	170.2	0	0	0	109	F249 T255	F249-I253 HydrophobicContact CB-CD1 4.14Å; F249-I253 HydrophobicContact CB-CG1 4.41Å; F249-I253 HydrophobicContact CD1-CD1 3.5Å; F249-I253 HydrophobicContact CD1-CG1 3.88Å; F249-I253 HydrophobicContact CD2-CD1 3.45Å; F249-I253 VanDerWaalsContact CD2-CD1 3.45Å; F249-I253 HydrophobicContact CE1-CD1 3.58Å; F249-I253 HydrophobicContact CE1-CG1 4.19Å; F249-I253 HydrophobicContact CE2-CD1 3.51Å; F249-I253 HydrophobicContact CG-CD1 3.43Å; F249-I253 VanDerWaalsContact CG-CD1 3.43Å; F249-I253 HydrophobicContact CG-CG1 4.05Å; F249-I253 HydrophobicContact CZ-CD1 3.57Å; I253-T255 HydrophobicContact CG2-CG2 4.22Å
254	Q	62.7	Low	62.6	Low	199 Å²	199	118.9 Å²	118.9	93%	0.93	67%	0.671	S	S	*	*			trans	-104	115.1	165.4	-168.4	176.1	3.7	0	0	108.2
255	T	64.7	Low	63.5	Low	70 Å²	70	114.4 Å²	114.4	43%	0.429	66%	0.66	S	S	.	*			trans	-129.3	148	175.6	175.5	0	0	0	0	109.4	I253 I257 I258	I253-T255 HydrophobicContact CG2-CG2 4.22Å; T255-I257 VanDerWaalsContact C-N 3.3Å; T255-I257 PolarHBondContact OG1-N 3.39Å; T255-I257 PolarHBondContact OG1-O 3.32Å; T255-I258 HydrophobicContact CG2-CD1 3.91Å; T255-I258 HydrophobicContact CG2-CG1 3.34Å
256	S	62	Low	64.7	Low	129 Å²	129	114.9 Å²	114.9	90%	0.902	64%	0.644	S	S	*	*	S	Bend	trans	-73.6	-23.8	175.8	49.7	0	0	0	0	112.6
257	I	69.9	Low	65.3	Low	90 Å²	90	118 Å²	118	46%	0.462	64%	0.644	S	S	.	*			trans	-152.7	138	178.7	-159.1	165.8	0	0	0	111	T255 R259	T255-I257 VanDerWaalsContact C-N 3.3Å; T255-I257 PolarHBondContact OG1-N 3.39Å; T255-I257 PolarHBondContact OG1-O 3.32Å; I257-R259 HydrophobicContact CD1-CG 4.19Å; I257-R259 VanDerWaalsContact CD1-CZ 3.41Å; I257-R259 VanDerWaalsContact CD1-NH2 3.35Å; I257-R259 HydrophobicContact CG1-CG 4.13Å
258	I	74.7	Confident	66	Low	90 Å²	90	119.1 Å²	119.1	46%	0.462	64%	0.644	S	S	.	*			trans	-115.2	121.9	167.1	-54.2	175.3	0	0	0	106.5	T255 L266 L268	T255-I258 HydrophobicContact CG2-CD1 3.91Å; T255-I258 HydrophobicContact CG2-CG1 3.34Å; I258-L266 HydrophobicContact CB-CD1 4.38Å; I258-L266 HydrophobicContact CG2-CD1 3.47Å; I258-L266 VanDerWaalsContact CG2-CD1 3.47Å; I258-L266 HydrophobicContact CG2-CD2 4.48Å; I258-L268 HydrophobicContact CD1-CD2 4.4Å
259	R	70.2	Confident	66.6	Low	198 Å²	198	119.4 Å²	119.4	75%	0.747	64%	0.636	S	S	*	*			trans	-123.7	133.5	173.3	-73.5	-175.9	176.5	148.1	1.2	108.9	I257	I257-R259 HydrophobicContact CD1-CG 4.19Å; I257-R259 VanDerWaalsContact CD1-CZ 3.41Å; I257-R259 VanDerWaalsContact CD1-NH2 3.35Å; I257-R259 HydrophobicContact CG1-CG 4.13Å
260	P	73.7	Confident	67.2	Low	57 Å²	57	117.1 Å²	117.1	37%	0.37	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-70.3	172.4	167.4	33.9	-34	0	0	0	109.8	A264 L266	P260-A264 HydrophobicContact CB-CB 4.31Å; P260-A264 WeakPolarHBondContact CB-O 3.49Å; P260-A264 WeakPolarHBondContact CG-O 3.46Å; P260-L266 HydrophobicContact CB-CB 4.43Å; P260-L266 HydrophobicContact CG-CB 4.09Å
261	E	70.1	Confident	67.6	Low	166 Å²	166	114.3 Å²	114.3	78%	0.776	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-61.7	159.8	168.2	-143.9	170.2	-162.3	0	0	110.9	D263 A264	E261-D263 PolarHBondContact O-N 2.97Å; E261-A264 HydrophobicContact CB-CB 4.3Å; E261-A264 PolarHBondContact O-N 3.29Å; E261-A264 VanDerWaalsContact O-N 3.15Å
262	Q	68.3	Low	68.1	Low	185 Å²	185	118.2 Å²	118.2	86%	0.864	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	131.8	173.1	-98.1	-179.3	-23	0	0	109.4	A264	Q262-A264 VanDerWaalsContact C-N 3.27Å; Q262-A264 PolarHBondContact O-N 3Å
263	D	63.5	Low	68.2	Low	174 Å²	174	122.1 Å²	122.1	93%	0.93	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.7	14	-178.6	-55.7	-36.6	0	0	0	116.6	E261	E261-D263 PolarHBondContact O-N 2.97Å
264	A	68.2	Low	68.6	Low	44 Å²	44	120.7 Å²	120.7	36%	0.364	65%	0.649	S	S	.	*			trans	-108.4	139.5	169.3	0	0	0	0	0	111.8	P260 E261 Q262	P260-A264 HydrophobicContact CB-CB 4.31Å; P260-A264 WeakPolarHBondContact CB-O 3.49Å; P260-A264 WeakPolarHBondContact CG-O 3.46Å; E261-A264 HydrophobicContact CB-CB 4.3Å; E261-A264 PolarHBondContact O-N 3.29Å; E261-A264 VanDerWaalsContact O-N 3.15Å; Q262-A264 VanDerWaalsContact C-N 3.27Å; Q262-A264 PolarHBondContact O-N 3Å
265	P	68.7	Low	69	Low	116 Å²	116	116.3 Å²	116.3	75%	0.753	63%	0.629	S	S	*	*			trans	-71.1	146.3	171.7	29.3	-32.8	0	0	0	110.9	L267	P265-L267 PolarHBondContact O-N 2.9Å; P265-L267 VanDerWaalsContact O-N 3.15Å
266	L	75.4	Confident	69.3	Low	86 Å²	86	119.4 Å²	119.4	45%	0.45	64%	0.643	S	S	.	*			trans	-71.7	106.2	170.3	179.9	61.5	0	0	0	109.3	I258 P260 L268	I258-L266 HydrophobicContact CB-CD1 4.38Å; I258-L266 HydrophobicContact CG2-CD1 3.47Å; I258-L266 VanDerWaalsContact CG2-CD1 3.47Å; I258-L266 HydrophobicContact CG2-CD2 4.48Å; P260-L266 HydrophobicContact CB-CB 4.43Å; P260-L266 HydrophobicContact CG-CB 4.09Å; L266-L268 HydrophobicContact CD1-CD2 4.43Å; L266-L268 HydrophobicContact CG-CG 4.32Å
267	L	70.1	Confident	69.9	Low	136 Å²	136	116.9 Å²	116.9	71%	0.712	62%	0.622	S	S	*	*			trans	-99	116.8	175.3	-174.1	70	0	0	0	110.1	P265	P265-L267 PolarHBondContact O-N 2.9Å; P265-L267 VanDerWaalsContact O-N 3.15Å
268	L	75.4	Confident	69.9	Low	90 Å²	90	119.5 Å²	119.5	47%	0.471	64%	0.637	S	S	.	*			trans	-112.9	104.8	170.8	-62.6	173.8	0	0	0	108.2	I258 L266 M275	I258-L268 HydrophobicContact CD1-CD2 4.4Å; L266-L268 HydrophobicContact CD1-CD2 4.43Å; L266-L268 HydrophobicContact CG-CG 4.32Å; L268-M275 HydrophobicContact CB-CE 3.91Å; L268-M275 HydrophobicContact CB-SD 3.62Å; L268-M275 HydrophobicContact CD1-CE 4.22Å; L268-M275 HydrophobicContact CD1-SD 4.16Å; L268-M275 HydrophobicContact CG-SD 4.4Å
269	E	66.6	Low	69.6	Low	141 Å²	141	119.1 Å²	119.1	66%	0.659	64%	0.639	S	S	*	*			trans	-119.4	133.2	-178.6	-169.9	178.2	-176.8	0	0	110.3	P271	E269-P271 HydrophobicContact CG-CG 4.31Å
270	S	70.3	Confident	69.6	Low	47 Å²	47	114.7 Å²	114.7	33%	0.329	65%	0.645	S	S	.	*			trans	-116.2	93	170.2	-170.8	0	0	0	0	108.6	T272 R273 G274	S270-T272 VanDerWaalsContact C-N 3.3Å; S270-T272 PolarHBondContact O-N 3.23Å; S270-R273 WeakPolarHBondContact CB-O 3.45Å; S270-R273 VanDerWaalsContact OG-C 3.28Å; S270-R273 PolarHBondContact OG-O 3.25Å; S270-G274 PolarHBondContact OG-O 2.96Å; S270-G274 VanDerWaalsContact OG-O 3.11Å
271	P	60	Low	69.2	Low	108 Å²	108	120.4 Å²	120.4	70%	0.701	67%	0.666	S	S	*	*	S	Bend	trans	-67.9	-29	-172	-20.5	31.2	0	0	0	113.7	E269	E269-P271 HydrophobicContact CG-CG 4.31Å
272	T	68.9	Low	69.2	Low	128 Å²	128	119 Å²	119	79%	0.785	66%	0.664	S	S	*	*	S	Bend	trans	-114.3	-10.9	-169.8	56.9	0	0	0	0	114.2	S270	S270-T272 VanDerWaalsContact C-N 3.3Å; S270-T272 PolarHBondContact O-N 3.23Å
273	R	68.2	Low	69.3	Low	210 Å²	210	114.7 Å²	114.7	79%	0.792	65%	0.646	S	S	*	*	S	Bend	trans	-147.9	-178.1	-170.1	-68.1	-171.9	-179.8	148.1	1.6	111	S270	S270-R273 WeakPolarHBondContact CB-O 3.45Å; S270-R273 VanDerWaalsContact OG-C 3.28Å; S270-R273 PolarHBondContact OG-O 3.25Å
274	G	69.4	Low	69.6	Low	71 Å²	71	113.8 Å²	113.8	73%	0.732	64%	0.636	S	S	*	*			trans	-73.4	161.8	164.5	0	0	0	0	0	111.6	S270	S270-G274 PolarHBondContact OG-O 2.96Å; S270-G274 VanDerWaalsContact OG-O 3.11Å
275	M	70.8	Confident	69.9	Low	107 Å²	107	116.9 Å²	116.9	53%	0.527	65%	0.646	S	S	.	*			trans	-112.1	124.5	162.6	-179.6	175.3	71.5	0	0	106.9	L268 V277	L268-M275 HydrophobicContact CB-CE 3.91Å; L268-M275 HydrophobicContact CB-SD 3.62Å; L268-M275 HydrophobicContact CD1-CE 4.22Å; L268-M275 HydrophobicContact CD1-SD 4.16Å; L268-M275 HydrophobicContact CG-SD 4.4Å; M275-V277 HydrophobicContact CE-CG2 4.38Å; M275-V277 HydrophobicContact CG-CG2 4.34Å
276	D	70.7	Confident	69.8	Low	135 Å²	135	116.6 Å²	116.6	72%	0.722	64%	0.637	S	S	*	*			trans	-111	133.1	178.3	-159.4	-2.1	0	0	0	109.2
277	V	74.5	Confident	69.6	Low	76 Å²	76	115.5 Å²	115.5	46%	0.461	64%	0.637	S	S	.	*			trans	-125.5	93	-176.5	-176.9	0	0	0	0	108.2	M275 V279 I283	M275-V277 HydrophobicContact CE-CG2 4.38Å; M275-V277 HydrophobicContact CG-CG2 4.34Å; V277-V279 HydrophobicContact CG1-CG2 4.36Å; V277-I283 HydrophobicContact CG1-CD1 4.27Å; V277-I283 WeakPolarHBondContact O-CD1 3.46Å
278	D	69.6	Low	69.2	Low	144 Å²	144	120.5 Å²	120.5	77%	0.77	65%	0.646	S	S	*	*			trans	-93.6	126.4	175.9	-78.2	-39.9	0	0	0	111.2
279	V	69.1	Low	68.7	Low	83 Å²	83	120.8 Å²	120.8	50%	0.503	66%	0.661	S	S	.	*			trans	-129.7	144.8	174.4	-175.9	0	0	0	0	109.8	V277 Q281 D282 I283	V277-V279 HydrophobicContact CG1-CG2 4.36Å; V279-Q281 PolarHBondContact O-N 3.24Å; V279-D282 WeakPolarHBondContact CG1-O 3.21Å; V279-I283 HydrophobicContact CB-CD1 4.42Å; V279-I283 HydrophobicContact CB-CG1 3.7Å; V279-I283 HydrophobicContact CG2-CD1 4.19Å; V279-I283 HydrophobicContact CG2-CG1 3.64Å
280	A	69.6	Low	68.7	Low	105 Å²	105	117 Å²	117	87%	0.868	66%	0.66	S	S	*	*	S	Bend	trans	-71.5	-20.2	-168.5	0	0	0	0	0	116
281	Q	67	Low	68.6	Low	176 Å²	176	122.4 Å²	122.4	82%	0.822	69%	0.685	S	S	*	*	S	Bend	trans	-131.6	-73.2	-179.5	-77.9	-177	-31.2	0	0	110.2	V279	V279-Q281 PolarHBondContact O-N 3.24Å
282	D	68	Low	69.2	Low	137 Å²	137	123.9 Å²	123.9	73%	0.733	68%	0.681	S	S	*	*			trans	-136.6	144.8	-174.6	-59.2	-52.1	0	0	0	110.8	V279	V279-D282 WeakPolarHBondContact CG1-O 3.21Å
283	I	71.8	Confident	69.3	Low	94 Å²	94	125.3 Å²	125.3	48%	0.482	68%	0.676	S	S	.	*			trans	-102.8	104.2	169.8	-58.8	176	0	0	0	107.5	V277 V279 I285	V277-I283 HydrophobicContact CG1-CD1 4.27Å; V277-I283 WeakPolarHBondContact O-CD1 3.46Å; V279-I283 HydrophobicContact CB-CD1 4.42Å; V279-I283 HydrophobicContact CB-CG1 3.7Å; V279-I283 HydrophobicContact CG2-CD1 4.19Å; V279-I283 HydrophobicContact CG2-CG1 3.64Å; I283-I285 HydrophobicContact CG2-CG1 4.12Å
284	E	69.6	Low	69.7	Low	155 Å²	155	117.8 Å²	117.8	72%	0.724	66%	0.659	S	S	*	*			trans	-98.2	113.2	175.9	-158.4	-173.4	177.6	0	0	110.3	L286	E284-L286 HydrophobicContact CG-CD1 4.29Å; E284-L286 HydrophobicContact CG-CD2 4.44Å; E284-L286 HydrophobicContact CG-CG 4.02Å
285	I	74.4	Confident	69.9	Low	109 Å²	109	121.5 Å²	121.5	56%	0.559	66%	0.657	S	S	*	*			trans	-99.4	103.3	176.7	-55.9	177.3	0	0	0	108.8	I283 F292	I283-I285 HydrophobicContact CG2-CG1 4.12Å; I285-F292 HydrophobicContact CD1-CE2 4.07Å; I285-F292 HydrophobicContact CD1-CZ 4.11Å; I285-F292 HydrophobicContact CG2-CD2 3.67Å; I285-F292 HydrophobicContact CG2-CE2 3.74Å; I285-F292 HydrophobicContact CG2-CG 4.4Å
286	L	67	Low	70	Confident	111 Å²	111	119 Å²	119	58%	0.581	65%	0.653	S	S	*	*			trans	-108.2	114.6	-180	-69.5	167.3	0	0	0	111.2	E284	E284-L286 HydrophobicContact CG-CD1 4.29Å; E284-L286 HydrophobicContact CG-CD2 4.44Å; E284-L286 HydrophobicContact CG-CG 4.02Å
287	S	70.4	Confident	69.9	Low	62 Å²	62	120.8 Å²	120.8	43%	0.434	66%	0.662	S	S	.	*			trans	-96.1	99.5	165.7	-172.6	0	0	0	0	109.9	A289 G290	S287-A289 VanDerWaalsContact C-N 3.33Å; S287-A289 PolarHBondContact OG-O 2.79Å; S287-G290 PolarHBondContact OG-O 3.49Å
288	R	63	Low	69.9	Low	241 Å²	241	125 Å²	125	91%	0.909	68%	0.677	S	S	*	*	S	Bend	trans	-76.6	-22.3	176.1	-70.8	-172.7	179.7	-178.4	0.6	112.9
289	A	63.4	Low	69.8	Low	96 Å²	96	125 Å²	125	79%	0.793	68%	0.676	S	S	*	*	S	Bend	trans	-150.1	123.1	175.9	0	0	0	0	0	108.5	S287	S287-A289 VanDerWaalsContact C-N 3.33Å; S287-A289 PolarHBondContact OG-O 2.79Å
290	G	66.6	Low	70.2	Confident	61 Å²	61	125.9 Å²	125.9	63%	0.629	68%	0.677	S	S	*	*	S	Bend	trans	100.4	176.6	-179.6	0	0	0	0	0	114.7	S287	S287-G290 PolarHBondContact OG-O 3.49Å
291	D	69.6	Low	70.6	Confident	162 Å²	162	127 Å²	127	87%	0.866	67%	0.668	S	S	*	*			trans	-92	138.3	-177.3	-60.8	-26.8	0	0	0	110.9
292	F	72.2	Confident	71.2	Confident	139 Å²	139	124 Å²	124	61%	0.61	66%	0.657	S	S	*	*			trans	-83	115.6	163.8	173.3	-103.6	0	0	0	108.7	I285 A294	I285-F292 HydrophobicContact CD1-CE2 4.07Å; I285-F292 HydrophobicContact CD1-CZ 4.11Å; I285-F292 HydrophobicContact CG2-CD2 3.67Å; I285-F292 HydrophobicContact CG2-CE2 3.74Å; I285-F292 HydrophobicContact CG2-CG 4.4Å; F292-A294 HydrophobicContact CE1-CB 3.99Å; F292-A294 HydrophobicContact CZ-CB 4.02Å
293	K	71.1	Confident	71.6	Confident	158 Å²	158	125.2 Å²	125.2	69%	0.687	66%	0.658	S	S	*	*			trans	-116.9	116.6	177.2	-159.8	-172.8	-163.2	-166.7	0	109.6	E295	K293-E295 HydrophobicContact CD-CG 4.21Å; K293-E295 WeakPolarHBondContact CE-OE1 3.18Å; K293-E295 HydrophobicContact CG-CG 4.22Å; K293-E295 IonicContact NZ-OE1 2.59Å; K293-E295 PolarHBondContact NZ-OE1 3.19Å
294	A	76.6	Confident	71.8	Confident	51 Å²	51	123 Å²	123	42%	0.421	65%	0.651	S	S	.	*			trans	-104.2	121.5	168.6	0	0	0	0	0	108.6	F292 I300	F292-A294 HydrophobicContact CE1-CB 3.99Å; F292-A294 HydrophobicContact CZ-CB 4.02Å; A294-I300 HydrophobicContact CB-CD1 3.96Å; A294-I300 VanDerWaalsContact O-CD1 3.27Å; A294-I300 WeakPolarHBondContact O-CD1 3.32Å
295	E	73.2	Confident	71.7	Confident	150 Å²	150	121.4 Å²	121.4	70%	0.701	66%	0.664	S	S	*	*			trans	-119.1	137.7	174.3	-66.6	-171.6	162.6	0	0	109.6	K293	K293-E295 HydrophobicContact CD-CG 4.21Å; K293-E295 WeakPolarHBondContact CE-OE1 3.18Å; K293-E295 HydrophobicContact CG-CG 4.22Å; K293-E295 IonicContact NZ-OE1 2.59Å; K293-E295 PolarHBondContact NZ-OE1 3.19Å
296	A	71.7	Confident	71.6	Confident	54 Å²	54	120.4 Å²	120.4	45%	0.446	67%	0.673	S	S	.	*			trans	-133.8	143.2	174.3	0	0	0	0	0	109.6	H298 N299 I300	A296-H298 PolarHBondContact O-N 3.33Å; A296-N299 WeakPolarHBondContact CB-O 3.32Å; A296-I300 HydrophobicContact CB-CG1 3.77Å
297	L	70.5	Confident	71.5	Confident	172 Å²	172	118.6 Å²	118.6	90%	0.901	68%	0.681	S	S	*	*	S	Bend	trans	-62.9	-28.6	175.7	-104	155.3	0	0	0	113
298	H	72.7	Confident	71.3	Confident	166 Å²	166	122.9 Å²	122.9	77%	0.769	69%	0.694	S	S	*	*	S	Bend	trans	-119.6	-80.3	-179.2	-66.1	-52.5	0	0	0	111.6	A296	A296-H298 PolarHBondContact O-N 3.33Å
299	N	68.4	Low	72	Confident	143 Å²	143	115.9 Å²	115.9	77%	0.765	67%	0.673	S	S	*	*			trans	-136	147.6	-172.6	-59.6	-40.2	0	0	0	110.5	A296	A296-N299 WeakPolarHBondContact CB-O 3.32Å
300	I	78.3	Confident	72.5	Confident	101 Å²	101	115.6 Å²	115.6	52%	0.518	67%	0.671	S	S	.	*			trans	-100.9	112.5	162.4	-60.1	173.4	0	0	0	106.1	A294 A296 L302	A294-I300 HydrophobicContact CB-CD1 3.96Å; A294-I300 VanDerWaalsContact O-CD1 3.27Å; A294-I300 WeakPolarHBondContact O-CD1 3.32Å; A296-I300 HydrophobicContact CB-CG1 3.77Å; I300-L302 HydrophobicContact CG2-CD2 4.31Å; I300-L302 HydrophobicContact CG2-CG 4.48Å
301	L	76.9	Confident	73.2	Confident	130 Å²	130	118.7 Å²	118.7	68%	0.681	67%	0.673	S	S	*	*			trans	-97.7	117	178.7	179.6	64.4	0	0	0	108.7	E303	L301-E303 HydrophobicContact CD1-CG 4.04Å; L301-E303 HydrophobicContact CD2-CG 4.23Å; L301-E303 WeakPolarHBondContact CD2-OE1 3.19Å; L301-E303 HydrophobicContact CG-CG 3.93Å
302	L	80.2	Confident	73.2	Confident	112 Å²	112	117 Å²	117	59%	0.586	67%	0.673	S	S	*	*			trans	-104.5	110.9	171.8	-59.3	176.1	0	0	0	107.5	I300 I309	I300-L302 HydrophobicContact CG2-CD2 4.31Å; I300-L302 HydrophobicContact CG2-CG 4.48Å; L302-I309 HydrophobicContact CB-CD1 3.83Å; L302-I309 WeakPolarHBondContact O-CD1 3.17Å
303	E	76	Confident	73.5	Confident	162 Å²	162	114.2 Å²	114.2	76%	0.757	67%	0.672	S	S	*	*			trans	-114.6	137.9	176.2	-78.4	-178.8	174.5	0	0	110.1	L301	L301-E303 HydrophobicContact CD1-CG 4.04Å; L301-E303 HydrophobicContact CD2-CG 4.23Å; L301-E303 WeakPolarHBondContact CD2-OE1 3.19Å; L301-E303 HydrophobicContact CG-CG 3.93Å
304	S	75.9	Confident	73.6	Confident	47 Å²	47	118.9 Å²	118.9	33%	0.329	69%	0.685	S	S	.	*			trans	-120.6	123.2	176	175.3	0	0	0	0	109.3	A306 G307 E308	S304-A306 PolarHBondContact O-N 2.87Å; S304-A306 PolarHBondContact OG-N 3.37Å; S304-G307 PolarHBondContact O-N 2.82Å; S304-G307 PolarHBondContact OG-N 3.03Å; S304-E308 WeakPolarHBondContact CB-O 3.05Å; S304-E308 PolarHBondContact OG-N 3.15Å; S304-E308 PolarHBondContact OG-O 3.14Å
305	A	68.3	Low	72.9	Confident	122 Å²	122	123.2 Å²	123.2	100%	1.008	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-25.5	175.3	0	0	0	0	0	112.5
306	A	71.1	Confident	73.1	Confident	89 Å²	89	119.9 Å²	119.9	74%	0.736	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-4.7	178.6	0	0	0	0	0	113.3	S304	S304-A306 PolarHBondContact O-N 2.87Å; S304-A306 PolarHBondContact OG-N 3.37Å
307	G	66.3	Low	72.7	Confident	73 Å²	73	126.1 Å²	126.1	75%	0.753	70%	0.697	S	S	*	*	S	Bend	trans	83.1	5.6	176.3	0	0	0	0	0	115.5	S304	S304-G307 PolarHBondContact O-N 2.82Å; S304-G307 PolarHBondContact OG-N 3.03Å
308	E	64.2	Low	72.9	Confident	151 Å²	151	122.5 Å²	122.5	71%	0.706	68%	0.682	S	S	*	*			trans	-127.3	141.2	175.1	67.3	175.1	-168.8	0	0	113.3	S304	S304-E308 WeakPolarHBondContact CB-O 3.05Å; S304-E308 PolarHBondContact OG-N 3.15Å; S304-E308 PolarHBondContact OG-O 3.14Å
309	I	78.3	Confident	72.1	Confident	94 Å²	94	120.9 Å²	120.9	48%	0.482	68%	0.679	S	S	.	*			trans	-129.3	110.3	171.7	-61.3	168.6	0	0	0	106.5	L302	L302-I309 HydrophobicContact CB-CD1 3.83Å; L302-I309 WeakPolarHBondContact O-CD1 3.17Å
310	A	73.8	Confident	71.6	Confident	90 Å²	90	124.5 Å²	124.5	74%	0.744	68%	0.682	S	S	*	*			trans	-102.3	118.2	-178.9	0	0	0	0	0	111
311	L	80.9	Confident	70.3	Confident	126 Å²	126	125.9 Å²	125.9	66%	0.66	69%	0.69	S	S	*	*			trans	-100.5	100.3	172.3	-60.9	176	0	0	0	109.1
312	S	69.9	Low	68.8	Low	126 Å²	126	124.5 Å²	124.5	88%	0.881	69%	0.691	S	S	*	*			trans	-102.7	112.9	-179.4	-171.9	0	0	0	0	111.5
313	S	78.9	Confident	67.1	Low	82 Å²	82	128.7 Å²	128.7	57%	0.573	70%	0.699	S	S	*	*			trans	-159.5	154.7	173.9	174	0	0	0	0	109.9	K315	S313-K315 PolarHBondContact O-N 3.24Å; S313-K315 PolarHBondContact OG-N 3.38Å; S313-K315 PolarHBondContact OG-O 3.29Å
314	R	73.8	Confident	65.4	Low	256 Å²	256	124 Å²	124	97%	0.966	69%	0.693	S	S	*	*	S	Bend	trans	-60.4	-25.1	170.7	-72	-175.3	-179.4	169.9	1	112.4
315	K	60.8	Low	63.7	Low	142 Å²	142	126.2 Å²	126.2	62%	0.617	71%	0.709	S	S	*	*			trans	-144.6	118.4	178.7	-68.2	179.2	171.3	-172.2	0	109.4	S313 Y317	S313-K315 PolarHBondContact O-N 3.24Å; S313-K315 PolarHBondContact OG-N 3.38Å; S313-K315 PolarHBondContact OG-O 3.29Å; K315-Y317 HydrophobicContact CB-CD2 4.25Å; K315-Y317 HydrophobicContact CB-CE2 3.67Å; K315-Y317 HydrophobicContact CD-CE2 3.91Å; K315-Y317 WeakPolarHBondContact CD-OH 3.34Å; K315-Y317 HydrophobicContact CG-CE2 4.25Å
316	V	77.6	Confident	62.4	Low	79 Å²	79	126 Å²	126	48%	0.479	69%	0.688	S	S	.	*			trans	-113.4	116.6	169.6	-179.5	0	0	0	0	106.8	V318	V316-V318 HydrophobicContact CG1-CG2 4.33Å
317	Y	63.4	Low	60.9	Low	185 Å²	185	133.7 Å²	133.7	73%	0.725	70%	0.697	S	S	*	*			trans	-108.3	120	176.8	-67.6	-80.7	0	0	0	109	K315	K315-Y317 HydrophobicContact CB-CD2 4.25Å; K315-Y317 HydrophobicContact CB-CE2 3.67Å; K315-Y317 HydrophobicContact CD-CE2 3.91Å; K315-Y317 WeakPolarHBondContact CD-OH 3.34Å; K315-Y317 HydrophobicContact CG-CE2 4.25Å
318	V	74.9	Confident	59.7	Low	96 Å²	96	132.6 Å²	132.6	58%	0.582	69%	0.686	S	S	*	*			trans	-110.2	85.6	169.9	-166.4	0	0	0	0	107.3	V316 L321	V316-V318 HydrophobicContact CG1-CG2 4.33Å; V318-L321 HydrophobicContact CB-CD1 4.25Å; V318-L321 HydrophobicContact CG1-CB 4.32Å; V318-L321 HydrophobicContact CG1-CD1 3.39Å; V318-L321 HydrophobicContact CG1-CG 4.49Å
319	D	56.6	Low	58.7	Low	133 Å²	133	130.4 Å²	130.4	71%	0.711	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	144.5	-179.8	-170.5	24.4	0	0	0	110.5	L321	D319-L321 PolarHBondContact O-N 3.14Å; D319-L321 VanDerWaalsContact O-N 3.12Å
320	R	58.1	Low	57.1	Low	219 Å²	219	132.6 Å²	132.6	83%	0.826	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	52.4	30.3	179.9	-46.8	-177.1	-163.1	-164.4	3.3	115.1	S322	R320-S322 VanDerWaalsContact C-N 3.3Å; R320-S322 PolarHBondContact O-N 3.12Å
321	L	50.6	Low	55.8	Low	130 Å²	130	131.3 Å²	131.3	68%	0.681	66%	0.664	S	S	*	*			trans	-54.4	106	161.9	-153.2	98.3	0	0	0	105.9	V318 D319 R323	V318-L321 HydrophobicContact CB-CD1 4.25Å; V318-L321 HydrophobicContact CG1-CB 4.32Å; V318-L321 HydrophobicContact CG1-CD1 3.39Å; V318-L321 HydrophobicContact CG1-CG 4.49Å; D319-L321 PolarHBondContact O-N 3.14Å; D319-L321 VanDerWaalsContact O-N 3.12Å; L321-R323 PolarHBondContact O-N 2.92Å
322	S	44.7	Very low	54.8	Low	100 Å²	100	127.5 Å²	127.5	70%	0.699	64%	0.644	S	S	*	*			trans	-57.1	112.1	176	50.2	0	0	0	0	104.4	R320 G324	R320-S322 VanDerWaalsContact C-N 3.3Å; R320-S322 PolarHBondContact O-N 3.12Å; S322-G324 PolarHBondContact O-N 3.37Å
323	R	44.4	Very low	54.6	Low	200 Å²	200	128 Å²	128	76%	0.755	64%	0.635	S	S	*	*			trans	-43.6	118.4	165.9	-85	-176.2	174.7	179.2	-0	104.5	L321 S325	L321-R323 PolarHBondContact O-N 2.92Å; R323-S325 PolarHBondContact O-N 2.97Å
324	G	41.5	Very low	54	Low	63 Å²	63	126.7 Å²	126.7	65%	0.649	62%	0.621	S	S	*	*			trans	-41.7	119.7	-175.4	0	0	0	0	0	107.3	S322 E326	S322-G324 PolarHBondContact O-N 3.37Å; G324-E326 PolarHBondContact O-N 3.3Å
325	S	39	Very low	53.7	Low	94 Å²	94	116 Å²	116	66%	0.657	58%	0.582	S	S	*	*			trans	-41.6	118.3	-164	54.4	0	0	0	0	110	R323 R327	R323-S325 PolarHBondContact O-N 2.97Å; S325-R327 PolarHBondContact O-N 2.97Å
326	E	40.8	Very low	54.1	Low	119 Å²	119	118.5 Å²	118.5	56%	0.556	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-58.3	4.3	-173.4	-70.2	-177.3	165.6	0	0	114.4	G324 G328 H329	G324-E326 PolarHBondContact O-N 3.3Å; E326-G328 PolarHBondContact O-N 3.38Å; E326-G328 VanDerWaalsContact O-N 3.1Å; E326-H329 PolarHBondContact O-N 2.91Å
327	R	39.8	Very low	53.7	Low	250 Å²	250	122.1 Å²	122.1	94%	0.943	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-66.2	-8.4	-179	-77.2	-172.7	171.8	-173.5	-1.5	115	S325	S325-R327 PolarHBondContact O-N 2.97Å
328	G	40.9	Very low	53.9	Low	50 Å²	50	118.3 Å²	118.3	52%	0.515	59%	0.588	S	S	.	*	G	3₁₀ helix	trans	-106.3	-17.2	171.4	0	0	0	0	0	115.2	E326	E326-G328 PolarHBondContact O-N 3.38Å; E326-G328 VanDerWaalsContact O-N 3.1Å
329	H	44.3	Very low	53.5	Low	105 Å²	105	123 Å²	123	49%	0.486	60%	0.603	S	S	.	*			trans	-115.9	82.2	-172.8	-58.8	-69	0	0	0	108.7	E326 H331	E326-H329 PolarHBondContact O-N 2.91Å; H329-H331 PolarHBondContact O-CD2 3.37Å; H329-H331 PolarHBondContact O-N 2.58Å
330	M	44.1	Very low	54	Low	140 Å²	140	120.2 Å²	120.2	69%	0.69	59%	0.591	S	S	*	*			trans	-65.2	85.4	156.5	-166.2	174.4	162	0	0	105.8	D332 L386	M330-D332 PolarHBondContact O-N 2.81Å; M330-L386 HydrophobicContact CB-CD2 3.63Å; M330-L386 HydrophobicContact SD-CD2 4.47Å
331	H	47.9	Very low	54.4	Low	63 Å²	63	115.2 Å²	115.2	29%	0.292	58%	0.575	S	S	.	*			trans	-54.5	129.4	178.6	-75.6	-75.1	0	0	0	107.4	H329 I333 D335 R336	H329-H331 PolarHBondContact O-CD2 3.37Å; H329-H331 PolarHBondContact O-N 2.58Å; H331-I333 PolarHBondContact O-N 3.47Å; H331-D335 HydrophobicContact CB-CB 4.14Å; H331-R336 HydrophobicContact CB-CB 4.37Å
332	D	58.9	Low	55.1	Low	46 Å²	46	111.5 Å²	111.5	25%	0.246	55%	0.554	C	S	.	*			trans	-51.6	146	163.2	-81.9	-24	0	0	0	107.7	M330 Q334 D335 R336 K390	M330-D332 PolarHBondContact O-N 2.81Å; D332-Q334 CarbonylContact O-C 3.58Å; D332-Q334 PolarHBondContact O-N 3.34Å; D332-D335 PolarHBondContact O-N 2.9Å; D332-R336 PolarHBondContact O-N 3.33Å; D332-R336 VanDerWaalsContact O-N 3.14Å; D332-K390 IonicContact OD1-NZ 3.42Å; D332-K390 PolarHBondContact OD1-NZ 3.16Å; D332-K390 IonicContact OD2-NZ 3.7Å; D332-K390 PolarHBondContact OD2-NZ 2.92Å
333	I	65.6	Low	55.8	Low	135 Å²	135	110.8 Å²	110.8	69%	0.692	55%	0.545	S	S	*	.	H	α-helix	trans	-45.9	-37.9	176.4	-70.8	172.9	0	0	0	110.2	H331 R336 F337	H331-I333 PolarHBondContact O-N 3.47Å; I333-R336 WeakPolarHBondContact O-CB 3.41Å; I333-R336 PolarHBondContact O-N 2.81Å; I333-F337 HydrophobicContact CG2-CD2 3.64Å; I333-F337 HydrophobicContact CG2-CE2 3.79Å; I333-F337 WeakPolarHBondContact O-CD2 3.36Å; I333-F337 PolarHBondContact O-N 3.26Å; I333-F337 VanDerWaalsContact O-N 3.15Å
334	Q	67.3	Low	56.5	Low	56 Å²	56	104.3 Å²	104.3	26%	0.262	53%	0.526	S	S	.	.	H	α-helix	trans	-59.5	-54.9	175.1	-170.5	-78.9	-18.1	0	0	113	D332 R336 F337 M338 V340 F342	D332-Q334 CarbonylContact O-C 3.58Å; D332-Q334 PolarHBondContact O-N 3.34Å; Q334-R336 PolarHBondContact O-N 3.34Å; Q334-R336 VanDerWaalsContact O-N 3.12Å; Q334-F337 PolarHBondContact O-N 2.86Å; Q334-M338 HydrophobicContact CG-CB 4.49Å; Q334-M338 HydrophobicContact CG-CG 3.83Å; Q334-M338 VanDerWaalsContact NE2-CB 3.32Å; Q334-M338 VanDerWaalsContact O-CB 3.32Å; Q334-M338 WeakPolarHBondContact O-CB 3.38Å; Q334-M338 WeakPolarHBondContact O-CG 3.5Å; Q334-M338 PolarHBondContact O-N 3.46Å; Q334-V340 PolarHBondContact NE2-O 3.25Å; Q334-F342 HydrophobicContact CB-CE2 4.15Å; Q334-F342 HydrophobicContact CG-CE2 3.97Å; Q334-F342 HydrophobicContact CG-CZ 4.11Å; Q334-F342 VanDerWaalsContact OE1-CD2 3.31Å
335	D	66.8	Low	57.9	Low	31 Å²	31	105.1 Å²	105.1	17%	0.166	52%	0.518	C	S	.	.	H	α-helix	trans	-63.7	-22.2	-178	-77.9	-34.9	0	0	0	112.3	H331 D332 K341 F342	H331-D335 HydrophobicContact CB-CB 4.14Å; D332-D335 PolarHBondContact O-N 2.9Å; D335-K341 WeakPolarHBondContact OD1-CA 3.42Å; D335-F342 PolarHBondContact OD1-N 2.9Å
336	R	68.2	Low	59.9	Low	194 Å²	194	102 Å²	102	73%	0.732	49%	0.493	S	S	*	.	H	α-helix	trans	-77.2	-35.8	174.9	-175.3	176.2	-179.7	171.8	1.8	112.9	H331 D332 I333 Q334	H331-R336 HydrophobicContact CB-CB 4.37Å; D332-R336 PolarHBondContact O-N 3.33Å; D332-R336 VanDerWaalsContact O-N 3.14Å; I333-R336 WeakPolarHBondContact O-CB 3.41Å; I333-R336 PolarHBondContact O-N 2.81Å; Q334-R336 PolarHBondContact O-N 3.34Å; Q334-R336 VanDerWaalsContact O-N 3.12Å
337	F	69.2	Low	62.2	Low	155 Å²	155	97.1 Å²	97.1	68%	0.68	47%	0.47	S	S	*	.	H	α-helix	trans	-103.6	-19	-173.3	-72	-66.5	0	0	0	114.3	I333 Q334	I333-F337 HydrophobicContact CG2-CD2 3.64Å; I333-F337 HydrophobicContact CG2-CE2 3.79Å; I333-F337 WeakPolarHBondContact O-CD2 3.36Å; I333-F337 PolarHBondContact O-N 3.26Å; I333-F337 VanDerWaalsContact O-N 3.15Å; Q334-F337 PolarHBondContact O-N 2.86Å
338	M	68.5	Low	64.3	Low	105 Å²	105	87.6 Å²	87.6	52%	0.517	44%	0.44	S	S	.	.			trans	-101	137.5	-176.9	-62.9	-66.7	-69	0	0	111.4	Q334	Q334-M338 HydrophobicContact CG-CB 4.49Å; Q334-M338 HydrophobicContact CG-CG 3.83Å; Q334-M338 VanDerWaalsContact NE2-CB 3.32Å; Q334-M338 VanDerWaalsContact O-CB 3.32Å; Q334-M338 WeakPolarHBondContact O-CB 3.38Å; Q334-M338 WeakPolarHBondContact O-CG 3.5Å; Q334-M338 PolarHBondContact O-N 3.46Å
339	E	65.6	Low	66.6	Low	194 Å²	194	85.4 Å²	85.4	91%	0.907	42%	0.416	S	S	*	.	S	Bend	trans	-67.7	-38.2	177.1	-170.2	171.9	-168.1	0	0	111.7	K341	E339-K341 PolarHBondContact O-N 3.12Å
340	V	66.8	Low	68.8	Low	76 Å²	76	80.4 Å²	80.4	46%	0.461	39%	0.393	S	S	.	.	S	Bend	trans	-86.8	100.6	171.7	-173.9	0	0	0	0	109	Q334 F666	Q334-V340 PolarHBondContact NE2-O 3.25Å; V340-F666 HydrophobicContact CG1-CZ 4.4Å
341	K	66.8	Low	71	Confident	113 Å²	113	73.8 Å²	73.8	49%	0.491	36%	0.361	S	S	.	.			trans	-71.5	156.7	174.2	-62.3	-178.8	-178.9	179.6	0	111	D335 E339 T343	D335-K341 WeakPolarHBondContact OD1-CA 3.42Å; E339-K341 PolarHBondContact O-N 3.12Å; K341-T343 PolarHBondContact O-N 3.3Å
342	F	66.1	Low	73	Confident	52 Å²	52	72.1 Å²	72.1	23%	0.228	35%	0.354	C	S	.	.			trans	-61	122.9	167.8	-70.9	-56	0	0	0	110.1	Q334 D335 I427 R431	Q334-F342 HydrophobicContact CB-CE2 4.15Å; Q334-F342 HydrophobicContact CG-CE2 3.97Å; Q334-F342 HydrophobicContact CG-CZ 4.11Å; Q334-F342 VanDerWaalsContact OE1-CD2 3.31Å; D335-F342 PolarHBondContact OD1-N 2.9Å; F342-I427 HydrophobicContact CE1-CG2 4.11Å; F342-I427 HydrophobicContact CZ-CG2 4.17Å; F342-R431 HydrophobicContact CD1-CG 4.09Å; F342-R431 VanDerWaalsContact CD1-NE 3.32Å; F342-R431 HydrophobicContact CD2-CG 3.94Å; F342-R431 HydrophobicContact CE1-CG 3.97Å; F342-R431 HydrophobicContact CE2-CG 3.77Å; F342-R431 HydrophobicContact CG-CG 4.09Å; F342-R431 HydrophobicContact CZ-CG 3.79Å
343	T	59.1	Low	74.6	Confident	86 Å²	86	70 Å²	70	53%	0.528	34%	0.342	S	S	.	.			trans	-77.2	-26.5	176.2	48.1	0	0	0	0	112.4	K341 V345 F666	K341-T343 PolarHBondContact O-N 3.3Å; T343-V345 PolarHBondContact O-N 3.23Å; T343-F666 HydrophobicContact CG2-CZ 3.96Å
344	D	59.3	Low	75.9	Confident	64 Å²	64	63.5 Å²	63.5	34%	0.342	31%	0.309	S	S	.	.			trans	-79.8	112.1	179.6	-86.8	-21.6	0	0	0	111.6	Q620	D344-Q620 PolarHBondContact OD2-NE2 2.89Å
345	V	71.1	Confident	77.1	Confident	79 Å²	79	66 Å²	66	48%	0.479	32%	0.316	S	S	.	.			trans	-95.9	13.4	179.7	-69.4	0	0	0	0	113.6	T343 Y347 V348 V349	T343-V345 PolarHBondContact O-N 3.23Å; V345-Y347 VanDerWaalsContact C-N 3.26Å; V345-Y347 PolarHBondContact O-N 3.15Å; V345-Y347 VanDerWaalsContact O-N 3.12Å; V345-V348 HydrophobicContact CB-CB 4.47Å; V345-V348 WeakPolarHBondContact O-CA 3.08Å; V345-V348 WeakPolarHBondContact O-CB 3.45Å; V345-V348 PolarHBondContact O-N 3Å; V345-V349 HydrophobicContact CG2-CG2 3.99Å; V345-V349 PolarHBondContact O-N 3.06Å
346	D	81.5	Confident	78.4	Confident	28 Å²	28	66.2 Å²	66.2	15%	0.15	32%	0.317	C	S	.	.	H	α-helix	trans	-50.3	-43	-172.6	-68.9	-11.6	0	0	0	113	V348 V349 M350 Y371 Q620	D346-V348 PolarHBondContact O-N 3.46Å; D346-V349 PolarHBondContact O-N 2.95Å; D346-M350 WeakPolarHBondContact O-CB 3.45Å; D346-M350 VanDerWaalsContact O-CG 3.31Å; D346-M350 WeakPolarHBondContact O-CG 3.5Å; D346-M350 PolarHBondContact O-N 3.18Å; D346-Y371 WeakPolarHBondContact CB-OH 3.45Å; D346-Y371 PolarHBondContact OD1-OH 3.16Å; D346-Y371 PolarHBondContact OD2-OH 3.33Å; D346-Q620 PolarHBondContact OD2-NE2 3.42Å
347	Y	87.4	Confident	79.6	Confident	18 Å²	18	57.6 Å²	57.6	7%	0.071	29%	0.286	C	S	.	.	H	α-helix	trans	-65.3	-37.9	177.7	-170.7	-112.9	0	0	0	112.9	V345 M350 T351 L386 G389 K390 F393 G432	V345-Y347 VanDerWaalsContact C-N 3.26Å; V345-Y347 PolarHBondContact O-N 3.15Å; V345-Y347 VanDerWaalsContact O-N 3.12Å; Y347-M350 HydrophobicContact CD2-CE 4.39Å; Y347-M350 PolarHBondContact O-N 2.84Å; Y347-T351 HydrophobicContact CD1-CG2 4.26Å; Y347-T351 HydrophobicContact CD2-CG2 4.4Å; Y347-T351 HydrophobicContact CE1-CG2 3.85Å; Y347-T351 HydrophobicContact CE2-CG2 4.03Å; Y347-T351 WeakPolarHBondContact O-CB 3.28Å; Y347-T351 VanDerWaalsContact O-CG2 3.32Å; Y347-T351 WeakPolarHBondContact O-CG2 3.39Å; Y347-T351 PolarHBondContact O-N 3.3Å; Y347-T351 PolarHBondContact O-OG1 3.38Å; Y347-L386 WeakPolarHBondContact CE1-O 3.4Å; Y347-L386 PolarHBondContact OH-O 2.91Å; Y347-G389 WeakPolarHBondContact OH-CA 3.33Å; Y347-G389 PolarHBondContact OH-N 3.49Å; Y347-K390 HydrophobicContact CD1-CG 4.29Å; Y347-K390 HydrophobicContact CD2-CG 4.45Å; Y347-K390 HydrophobicContact CE1-CD 4.32Å; Y347-K390 HydrophobicContact CE1-CG 3.84Å; Y347-K390 HydrophobicContact CE2-CG 4Å; Y347-K390 PolarHBondContact OH-N 3.49Å; Y347-F393 HydrophobicContact CD2-CE2 4.44Å; Y347-F393 HydrophobicContact CE2-CE2 4.38Å; Y347-G432 WeakPolarHBondContact CD2-O 3.42Å
348	V	84.4	Confident	80.7	Confident	49 Å²	49	53.1 Å²	53.1	30%	0.297	28%	0.278	S	S	.	.	H	α-helix	trans	-67.8	-44.9	175.5	-179.1	0	0	0	0	109.9	V345 D346 M350 T351 D352	V345-V348 HydrophobicContact CB-CB 4.47Å; V345-V348 WeakPolarHBondContact O-CA 3.08Å; V345-V348 WeakPolarHBondContact O-CB 3.45Å; V345-V348 PolarHBondContact O-N 3Å; D346-V348 PolarHBondContact O-N 3.46Å; V348-M350 VanDerWaalsContact C-N 3.29Å; V348-M350 PolarHBondContact O-N 3.13Å; V348-T351 WeakPolarHBondContact CA-OG1 3.39Å; V348-T351 PolarHBondContact O-N 3.25Å; V348-T351 PolarHBondContact O-OG1 3.31Å; V348-D352 VanDerWaalsContact O-CB 3.3Å; V348-D352 WeakPolarHBondContact O-CB 3.4Å; V348-D352 PolarHBondContact O-N 3.17Å
349	V	89.5	Confident	81.9	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.024	28%	0.277	C	S	.	.	H	α-helix	trans	-57.7	-43.1	176.2	172.7	0	0	0	0	111	V345 D346 A353 R366 Y369 Y371	V345-V349 HydrophobicContact CG2-CG2 3.99Å; V345-V349 PolarHBondContact O-N 3.06Å; D346-V349 PolarHBondContact O-N 2.95Å; V349-A353 WeakPolarHBondContact O-CB 3.37Å; V349-A353 PolarHBondContact O-N 3.25Å; V349-A353 VanDerWaalsContact O-N 3.13Å; V349-R366 HydrophobicContact CG1-CG 4.49Å; V349-Y369 HydrophobicContact CG1-CD2 3.88Å; V349-Y369 HydrophobicContact CG1-CG 4.46Å; V349-Y371 HydrophobicContact CG1-CE2 4.43Å
350	M	90.6	Very high	83.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69.8	-40.9	177.9	-71.2	-172.7	-71.8	0	0	113.5	D346 Y347 V348 A353 A354 Y369 Y371 F375 L379 F393 G432 A434	D346-M350 WeakPolarHBondContact O-CB 3.45Å; D346-M350 VanDerWaalsContact O-CG 3.31Å; D346-M350 WeakPolarHBondContact O-CG 3.5Å; D346-M350 PolarHBondContact O-N 3.18Å; Y347-M350 HydrophobicContact CD2-CE 4.39Å; Y347-M350 PolarHBondContact O-N 2.84Å; V348-M350 VanDerWaalsContact C-N 3.29Å; V348-M350 PolarHBondContact O-N 3.13Å; M350-A353 PolarHBondContact O-N 3.28Å; M350-A354 PolarHBondContact O-N 2.88Å; M350-Y369 HydrophobicContact CG-CE2 4.4Å; M350-Y371 HydrophobicContact CG-CD2 3.97Å; M350-Y371 HydrophobicContact CG-CE2 4.1Å; M350-F375 HydrophobicContact SD-CB 4.38Å; M350-F375 HydrophobicContact SD-CD2 3.87Å; M350-F375 HydrophobicContact SD-CE2 4.47Å; M350-F375 HydrophobicContact SD-CG 4.33Å; M350-L379 HydrophobicContact CB-CD1 3.61Å; M350-L379 HydrophobicContact CG-CD1 4.47Å; M350-L379 HydrophobicContact SD-CD1 4.26Å; M350-F393 HydrophobicContact CE-CE2 4.22Å; M350-G432 WeakPolarHBondContact CE-O 3.5Å; M350-A434 HydrophobicContact CE-CB 4.31Å; M350-A434 HydrophobicContact SD-CB 4.17Å
351	T	89.7	Confident	84.4	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-74.1	-33.8	178.8	53.8	0	0	0	0	112.7	Y347 V348 A353 A354 R355 A382	Y347-T351 HydrophobicContact CD1-CG2 4.26Å; Y347-T351 HydrophobicContact CD2-CG2 4.4Å; Y347-T351 HydrophobicContact CE1-CG2 3.85Å; Y347-T351 HydrophobicContact CE2-CG2 4.03Å; Y347-T351 WeakPolarHBondContact O-CB 3.28Å; Y347-T351 VanDerWaalsContact O-CG2 3.32Å; Y347-T351 WeakPolarHBondContact O-CG2 3.39Å; Y347-T351 PolarHBondContact O-N 3.3Å; Y347-T351 PolarHBondContact O-OG1 3.38Å; V348-T351 WeakPolarHBondContact CA-OG1 3.39Å; V348-T351 PolarHBondContact O-N 3.25Å; V348-T351 PolarHBondContact O-OG1 3.31Å; T351-A353 VanDerWaalsContact C-N 3.35Å; T351-A354 WeakPolarHBondContact O-CB 3.1Å; T351-A354 PolarHBondContact O-N 3.14Å; T351-R355 PolarHBondContact O-N 3.42Å; T351-A382 HydrophobicContact CG2-CB 3.94Å
352	D	89.8	Confident	85.7	Confident	28 Å²	28	44.1 Å²	44.1	15%	0.15	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-44.7	170.6	-71.7	-9.1	0	0	0	110.6	V348 A354 R355 L356 R366	V348-D352 VanDerWaalsContact O-CB 3.3Å; V348-D352 WeakPolarHBondContact O-CB 3.4Å; V348-D352 PolarHBondContact O-N 3.17Å; D352-A354 VanDerWaalsContact C-N 3.32Å; D352-A354 PolarHBondContact O-N 2.88Å; D352-R355 WeakPolarHBondContact O-CB 3.46Å; D352-R355 PolarHBondContact O-N 3.35Å; D352-R355 VanDerWaalsContact O-N 3.1Å; D352-R355 IonicContact OD1-CZ 3.09Å; D352-R355 IonicContact OD1-NH1 2.66Å; D352-R355 PolarHBondContact OD1-NH1 3.4Å; D352-R355 IonicContact OD1-NH2 2.83Å; D352-R355 PolarHBondContact OD1-NH2 2.97Å; D352-L356 PolarHBondContact O-N 3.29Å; D352-R366 HydrophobicContact CB-CG 4.01Å; D352-R366 IonicContact OD2-CZ 3.14Å; D352-R366 IonicContact OD2-NE 3.34Å; D352-R366 PolarHBondContact OD2-NE 3.27Å; D352-R366 IonicContact OD2-NH2 2.7Å
353	A	93.1	Very high	87	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.9	-37.5	175.1	0	0	0	0	0	112.5	V349 M350 T351 R355 L356 V357 P363 Y369 A376	V349-A353 WeakPolarHBondContact O-CB 3.37Å; V349-A353 PolarHBondContact O-N 3.25Å; V349-A353 VanDerWaalsContact O-N 3.13Å; M350-A353 PolarHBondContact O-N 3.28Å; T351-A353 VanDerWaalsContact C-N 3.35Å; A353-R355 VanDerWaalsContact C-N 3.3Å; A353-R355 PolarHBondContact O-N 2.76Å; A353-L356 WeakPolarHBondContact O-CB 3.3Å; A353-L356 PolarHBondContact O-N 3.34Å; A353-V357 WeakPolarHBondContact O-CG2 3.32Å; A353-V357 PolarHBondContact O-N 2.76Å; A353-P363 HydrophobicContact CB-CB 3.82Å; A353-Y369 HydrophobicContact CB-CD2 3.26Å; A353-Y369 HydrophobicContact CB-CE2 3.27Å; A353-Y369 HydrophobicContact CB-CG 3.96Å; A353-A376 HydrophobicContact CB-CB 4.06Å
354	A	93.4	Very high	88.7	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.3	-33.9	172.4	0	0	0	0	0	112.6	M350 T351 D352 A358 A376 L379 L380 N383	M350-A354 PolarHBondContact O-N 2.88Å; T351-A354 WeakPolarHBondContact O-CB 3.1Å; T351-A354 PolarHBondContact O-N 3.14Å; D352-A354 VanDerWaalsContact C-N 3.32Å; D352-A354 PolarHBondContact O-N 2.88Å; A354-A358 WeakPolarHBondContact O-CB 3.07Å; A354-A358 PolarHBondContact O-N 3.24Å; A354-A376 VanDerWaalsContact CB-O 3.3Å; A354-A376 WeakPolarHBondContact CB-O 3.46Å; A354-L379 HydrophobicContact CB-CB 4Å; A354-L380 WeakPolarHBondContact O-CD2 3.32Å; A354-N383 PolarHBondContact O-ND2 3.24Å
355	R	92.8	Very high	90.1	Very high	109 Å²	109	38.5 Å²	38.5	41%	0.411	24%	0.244	S	C	.	.	H	α-helix	trans	-66.9	-41.3	172.3	-69.8	-177.3	-129.7	120.8	14.8	111.7	T351 D352 A353 A358 S359 N383	T351-R355 PolarHBondContact O-N 3.42Å; D352-R355 WeakPolarHBondContact O-CB 3.46Å; D352-R355 PolarHBondContact O-N 3.35Å; D352-R355 VanDerWaalsContact O-N 3.1Å; D352-R355 IonicContact OD1-CZ 3.09Å; D352-R355 IonicContact OD1-NH1 2.66Å; D352-R355 PolarHBondContact OD1-NH1 3.4Å; D352-R355 IonicContact OD1-NH2 2.83Å; D352-R355 PolarHBondContact OD1-NH2 2.97Å; A353-R355 VanDerWaalsContact C-N 3.3Å; A353-R355 PolarHBondContact O-N 2.76Å; R355-A358 PolarHBondContact O-N 3.41Å; R355-S359 PolarHBondContact O-N 3.12Å; R355-S359 PolarHBondContact O-OG 2.9Å; R355-N383 HydrophobicContact CG-CB 4.47Å; R355-N383 WeakPolarHBondContact CG-OD1 3.32Å; R355-N383 PolarHBondContact N-OD1 2.74Å
356	L	92.6	Very high	90.9	Very high	35 Å²	35	38 Å²	38	18%	0.183	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-47.7	175.3	-66.5	177.5	0	0	0	111.4	D352 A353 A358 S359 G360 Q361 R366	D352-L356 PolarHBondContact O-N 3.29Å; A353-L356 WeakPolarHBondContact O-CB 3.3Å; A353-L356 PolarHBondContact O-N 3.34Å; L356-A358 VanDerWaalsContact C-N 3.32Å; L356-A358 PolarHBondContact O-N 2.96Å; L356-S359 WeakPolarHBondContact CA-OG 3.49Å; L356-S359 CarbonylContact O-C 3.55Å; L356-S359 WeakPolarHBondContact O-CA 3.42Å; L356-S359 PolarHBondContact O-N 2.83Å; L356-S359 PolarHBondContact O-OG 3.39Å; L356-G360 PolarHBondContact O-N 3.29Å; L356-Q361 CarbonylContact C-O 3.55Å; L356-Q361 HydrophobicContact CB-CB 4.22Å; L356-Q361 WeakPolarHBondContact O-CB 3.41Å; L356-Q361 PolarHBondContact O-N 3.19Å; L356-R366 HydrophobicContact CD1-CB 3.77Å
357	V	94.4	Very high	91.2	Very high	12 Å²	12	40.9 Å²	40.9	7%	0.073	25%	0.254	C	S	.	.	H	α-helix	trans	-60.2	-41.9	176.5	174.6	0	0	0	0	111.4	A353 S359 G360 Q361 P363 A376 W377 L380	A353-V357 WeakPolarHBondContact O-CG2 3.32Å; A353-V357 PolarHBondContact O-N 2.76Å; V357-S359 PolarHBondContact O-N 3.05Å; V357-G360 PolarHBondContact O-N 3.41Å; V357-Q361 WeakPolarHBondContact CA-O 3.41Å; V357-P363 HydrophobicContact CG2-CB 3.86Å; V357-P363 HydrophobicContact CG2-CG 4.06Å; V357-A376 HydrophobicContact CG2-CB 3.75Å; V357-W377 HydrophobicContact CG1-CD2 3.83Å; V357-W377 HydrophobicContact CG1-CE3 4.15Å; V357-W377 HydrophobicContact CG1-CG 4.39Å; V357-W377 HydrophobicContact CG1-CH2 4.05Å; V357-W377 HydrophobicContact CG1-CZ2 3.76Å; V357-W377 HydrophobicContact CG1-CZ3 4.25Å; V357-L380 HydrophobicContact CB-CD2 4.32Å; V357-L380 HydrophobicContact CG1-CD2 4.1Å
358	A	92.9	Very high	91.1	Very high	62 Å²	62	43.7 Å²	43.7	51%	0.512	27%	0.273	S	S	.	.	H	α-helix	trans	-63.3	-28.6	175.5	0	0	0	0	0	113.5	A354 R355 L356 G360 L380 N383	A354-A358 WeakPolarHBondContact O-CB 3.07Å; A354-A358 PolarHBondContact O-N 3.24Å; R355-A358 PolarHBondContact O-N 3.41Å; L356-A358 VanDerWaalsContact C-N 3.32Å; L356-A358 PolarHBondContact O-N 2.96Å; A358-G360 VanDerWaalsContact C-N 3.25Å; A358-G360 PolarHBondContact O-N 3.37Å; A358-L380 HydrophobicContact CB-CD2 3.82Å; A358-N383 WeakPolarHBondContact CB-ND2 3.41Å
359	S	92.9	Very high	91.5	Very high	70 Å²	70	41.5 Å²	41.5	49%	0.49	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	4.4	173	71.5	0	0	0	0	114.2	R355 L356 V357 Q361	R355-S359 PolarHBondContact O-N 3.12Å; R355-S359 PolarHBondContact O-OG 2.9Å; L356-S359 WeakPolarHBondContact CA-OG 3.49Å; L356-S359 CarbonylContact O-C 3.55Å; L356-S359 WeakPolarHBondContact O-CA 3.42Å; L356-S359 PolarHBondContact O-N 2.83Å; L356-S359 PolarHBondContact O-OG 3.39Å; V357-S359 PolarHBondContact O-N 3.05Å; S359-Q361 VanDerWaalsContact C-N 3.33Å; S359-Q361 WeakPolarHBondContact OG-CG 3.3Å
360	G	91.6	Very high	91.6	Very high	74 Å²	74	44.4 Å²	44.4	76%	0.763	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	16.1	-177.1	0	0	0	0	0	114.2	L356 V357 A358	L356-G360 PolarHBondContact O-N 3.29Å; V357-G360 PolarHBondContact O-N 3.41Å; A358-G360 VanDerWaalsContact C-N 3.25Å; A358-G360 PolarHBondContact O-N 3.37Å
361	Q	92.8	Very high	91.7	Very high	112 Å²	112	46.4 Å²	46.4	52%	0.523	28%	0.278	S	S	.	.	S	Bend	trans	-101.7	166.3	179.4	-60.7	-176.8	10.9	0	0	111.7	L356 V357 S359	L356-Q361 CarbonylContact C-O 3.55Å; L356-Q361 HydrophobicContact CB-CB 4.22Å; L356-Q361 WeakPolarHBondContact O-CB 3.41Å; L356-Q361 PolarHBondContact O-N 3.19Å; V357-Q361 WeakPolarHBondContact CA-O 3.41Å; S359-Q361 VanDerWaalsContact C-N 3.33Å; S359-Q361 WeakPolarHBondContact OG-CG 3.3Å
362	S	93.8	Very high	91.9	Very high	43 Å²	43	46.6 Å²	46.6	30%	0.301	28%	0.279	S	S	.	.			trans	-70.1	137.2	175.2	179.4	0	0	0	0	111.2	F364 G365	S362-F364 PolarHBondContact O-N 3.48Å; S362-F364 PolarHBondContact OG-N 2.86Å; S362-G365 PolarHBondContact O-N 3.29Å
363	P	94.3	Very high	92.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-62.1	-27.3	173.1	26.3	-31.6	0	0	0	111.8	A353 V357 G365 R366 Y369 P373 A376 Y531	A353-P363 HydrophobicContact CB-CB 3.82Å; V357-P363 HydrophobicContact CG2-CB 3.86Å; V357-P363 HydrophobicContact CG2-CG 4.06Å; P363-G365 PolarHBondContact O-N 3.22Å; P363-R366 WeakPolarHBondContact O-CB 3.3Å; P363-R366 PolarHBondContact O-N 2.93Å; P363-R366 VanDerWaalsContact O-N 3.13Å; P363-Y369 HydrophobicContact CB-CD1 4.18Å; P363-Y369 HydrophobicContact CB-CE1 3.94Å; P363-Y369 HydrophobicContact CG-CE1 4.38Å; P363-P373 HydrophobicContact CG-CB 4.15Å; P363-A376 HydrophobicContact CB-CB 3.81Å; P363-A376 HydrophobicContact CG-CB 4.49Å; P363-Y531 HydrophobicContact CG-CD1 4.36Å; P363-Y531 HydrophobicContact CG-CE1 3.96Å
364	F	94.2	Very high	92.2	Very high	29 Å²	29	48.4 Å²	48.4	13%	0.127	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-71.7	-5	174.6	-56.1	-73.2	0	0	0	113.3	S362 R366 Y369 P373 Y531 A534 Y535 E538 A539	S362-F364 PolarHBondContact O-N 3.48Å; S362-F364 PolarHBondContact OG-N 2.86Å; F364-R366 PolarHBondContact O-N 3.39Å; F364-Y369 AromaticContact CD1-CD1 3.91Å; F364-Y369 HydrophobicContact CD1-CD1 3.91Å; F364-Y369 AromaticContact CE1-CD1 3.77Å; F364-Y369 HydrophobicContact CE1-CD1 3.77Å; F364-Y369 HydrophobicContact CE1-CE1 4.14Å; F364-Y369 HydrophobicContact CZ-CD1 4.42Å; F364-Y369 HydrophobicContact CZ-CE1 4.38Å; F364-P373 HydrophobicContact CE2-CG 3.76Å; F364-P373 HydrophobicContact CZ-CG 3.78Å; F364-Y531 HydrophobicContact CD2-CG 4.41Å; F364-Y531 HydrophobicContact CE2-CD2 4.49Å; F364-Y531 HydrophobicContact CE2-CG 4.09Å; F364-A534 HydrophobicContact CB-CB 4.1Å; F364-A534 HydrophobicContact CD2-CB 4.11Å; F364-A534 HydrophobicContact CG-CB 4.13Å; F364-Y535 HydrophobicContact CE2-CD2 4.39Å; F364-Y535 HydrophobicContact CE2-CG 4.48Å; F364-Y535 AromaticContact CZ-CD2 3.78Å; F364-Y535 HydrophobicContact CZ-CD2 3.78Å; F364-Y535 HydrophobicContact CZ-CG 4.26Å; F364-E538 HydrophobicContact CD1-CB 3.78Å; F364-E538 HydrophobicContact CD1-CG 4.14Å; F364-E538 HydrophobicContact CE1-CB 3.96Å; F364-A539 HydrophobicContact CE1-CB 4.36Å
365	G	89	Confident	92.1	Very high	54 Å²	54	48.9 Å²	48.9	56%	0.557	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-65.4	-20.1	166.2	0	0	0	0	0	112.4	S362 P363 P367	S362-G365 PolarHBondContact O-N 3.29Å; P363-G365 PolarHBondContact O-N 3.22Å; G365-P367 WeakPolarHBondContact O-CD 3.19Å
366	R	88.9	Confident	92.1	Very high	68 Å²	68	43.7 Å²	43.7	26%	0.257	27%	0.271	S	S	.	.	S	Bend	trans	-81.2	117.7	170.8	179.6	60.2	179.1	91.9	-12.2	108.7	V349 D352 L356 P363 F364 T368 Y369	V349-R366 HydrophobicContact CG1-CG 4.49Å; D352-R366 HydrophobicContact CB-CG 4.01Å; D352-R366 IonicContact OD2-CZ 3.14Å; D352-R366 IonicContact OD2-NE 3.34Å; D352-R366 PolarHBondContact OD2-NE 3.27Å; D352-R366 IonicContact OD2-NH2 2.7Å; L356-R366 HydrophobicContact CD1-CB 3.77Å; P363-R366 WeakPolarHBondContact O-CB 3.3Å; P363-R366 PolarHBondContact O-N 2.93Å; P363-R366 VanDerWaalsContact O-N 3.13Å; F364-R366 PolarHBondContact O-N 3.39Å; R366-T368 PolarHBondContact O-N 2.91Å; R366-Y369 WeakPolarHBondContact O-CB 3.47Å; R366-Y369 PolarHBondContact O-N 2.87Å
367	P	86.4	Confident	92.2	Very high	89 Å²	89	48.4 Å²	48.4	58%	0.578	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	144	174.6	-26.3	35.2	0	0	0	110.5	G365 Y369	G365-P367 WeakPolarHBondContact O-CD 3.19Å; P367-Y369 PolarHBondContact O-N 2.61Å
368	T	86.6	Confident	92.2	Very high	78 Å²	78	51 Å²	51	48%	0.479	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	10.4	-178.8	72.5	0	0	0	0	116.5	R366 R370	R366-T368 PolarHBondContact O-N 2.91Å; T368-R370 PolarHBondContact O-N 2.69Å
369	Y	92.2	Very high	92.2	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.008	28%	0.275	C	S	.	.			trans	-72.5	105.7	169.8	-174.1	-90.5	0	0	0	110.7	V349 M350 A353 P363 F364 R366 P367 Y371 T372 A376	V349-Y369 HydrophobicContact CG1-CD2 3.88Å; V349-Y369 HydrophobicContact CG1-CG 4.46Å; M350-Y369 HydrophobicContact CG-CE2 4.4Å; A353-Y369 HydrophobicContact CB-CD2 3.26Å; A353-Y369 HydrophobicContact CB-CE2 3.27Å; A353-Y369 HydrophobicContact CB-CG 3.96Å; P363-Y369 HydrophobicContact CB-CD1 4.18Å; P363-Y369 HydrophobicContact CB-CE1 3.94Å; P363-Y369 HydrophobicContact CG-CE1 4.38Å; F364-Y369 AromaticContact CD1-CD1 3.91Å; F364-Y369 HydrophobicContact CD1-CD1 3.91Å; F364-Y369 AromaticContact CE1-CD1 3.77Å; F364-Y369 HydrophobicContact CE1-CD1 3.77Å; F364-Y369 HydrophobicContact CE1-CE1 4.14Å; F364-Y369 HydrophobicContact CZ-CD1 4.42Å; F364-Y369 HydrophobicContact CZ-CE1 4.38Å; R366-Y369 WeakPolarHBondContact O-CB 3.47Å; R366-Y369 PolarHBondContact O-N 2.87Å; P367-Y369 PolarHBondContact O-N 2.61Å; Y369-Y371 HydrophobicContact CD2-CD2 4.23Å; Y369-Y371 WeakPolarHBondContact CE1-O 3.42Å; Y369-Y371 HydrophobicContact CE2-CD2 4.12Å; Y369-T372 PolarHBondContact OH-O 3.34Å; Y369-A376 PolarHBondContact OH-N 2.91Å
370	R	91.4	Very high	92.3	Very high	66 Å²	66	47.2 Å²	47.2	25%	0.249	27%	0.265	C	S	.	.			trans	-118.1	21.5	-173.4	-65.2	166.2	179.4	167.9	0.3	113.4	T368 Y542	T368-R370 PolarHBondContact O-N 2.69Å; R370-Y542 VanDerWaalsContact CD-CE1 3.47Å; R370-Y542 HydrophobicContact CG-CD1 4.24Å; R370-Y542 VanDerWaalsContact NE-CE1 3.33Å; R370-Y542 PolarHBondContact NH1-OH 3.43Å; R370-Y542 PolarHBondContact NH2-OH 3.47Å
371	Y	92.5	Very high	92.4	Very high	42 Å²	42	46.5 Å²	46.5	17%	0.165	25%	0.246	C	C	.	.	S	Bend	trans	-105	168.3	-177.4	-55.7	-84	0	0	0	111.6	D346 V349 M350 Y369 F375	D346-Y371 WeakPolarHBondContact CB-OH 3.45Å; D346-Y371 PolarHBondContact OD1-OH 3.16Å; D346-Y371 PolarHBondContact OD2-OH 3.33Å; V349-Y371 HydrophobicContact CG1-CE2 4.43Å; M350-Y371 HydrophobicContact CG-CD2 3.97Å; M350-Y371 HydrophobicContact CG-CE2 4.1Å; Y369-Y371 HydrophobicContact CD2-CD2 4.23Å; Y369-Y371 WeakPolarHBondContact CE1-O 3.42Å; Y369-Y371 HydrophobicContact CE2-CD2 4.12Å; Y371-F375 HydrophobicContact CD1-CD2 4.05Å; Y371-F375 AromaticContact CD1-CE2 4Å; Y371-F375 HydrophobicContact CD1-CE2 4Å; Y371-F375 HydrophobicContact CG-CD2 4.04Å; Y371-F375 HydrophobicContact CG-CE2 4.45Å
372	T	94.5	Very high	92.2	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.031	22%	0.223	C	C	.	.			trans	-57.2	139	169.1	174	0	0	0	0	110.5	Y369 L374 F375 H468	Y369-T372 PolarHBondContact OH-O 3.34Å; T372-L374 HydrophobicContact CG2-CB 4.06Å; T372-L374 PolarHBondContact O-N 3.06Å; T372-L374 PolarHBondContact OG1-N 2.87Å; T372-F375 HydrophobicContact CG2-CD1 4.32Å; T372-F375 HydrophobicContact CG2-CD2 4.28Å; T372-F375 HydrophobicContact CG2-CG 4.17Å; T372-F375 PolarHBondContact O-N 3.25Å; T372-F375 VanDerWaalsContact O-N 3.08Å; T372-H468 PolarHBondContact OG1-NE2 2.85Å
373	P	94.9	Very high	91.8	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-55.9	-23	172.8	-25.3	34.4	0	0	0	113.5	P363 F364 F375 A376 W377 C527 Y531 Y535	P363-P373 HydrophobicContact CG-CB 4.15Å; F364-P373 HydrophobicContact CE2-CG 3.76Å; F364-P373 HydrophobicContact CZ-CG 3.78Å; P373-F375 PolarHBondContact O-N 3Å; P373-A376 WeakPolarHBondContact O-CB 3.3Å; P373-A376 PolarHBondContact O-N 3.02Å; P373-A376 VanDerWaalsContact O-N 3.1Å; P373-W377 VanDerWaalsContact O-CD1 3.27Å; P373-W377 PolarHBondContact O-N 3.23Å; P373-W377 VanDerWaalsContact O-N 3.11Å; P373-C527 HydrophobicContact CG-CB 4.22Å; P373-Y531 HydrophobicContact CB-CD2 3.64Å; P373-Y531 HydrophobicContact CB-CE2 3.19Å; P373-Y531 HydrophobicContact CG-CD2 3.46Å; P373-Y531 VanDerWaalsContact CG-CD2 3.46Å; P373-Y531 HydrophobicContact CG-CE2 3.61Å; P373-Y531 HydrophobicContact CG-CG 4.32Å; P373-Y535 HydrophobicContact CG-CD2 4.03Å; P373-Y535 HydrophobicContact CG-CE2 4.5Å; P373-Y535 HydrophobicContact CG-CG 4.47Å
374	L	93.5	Very high	91.4	Very high	65 Å²	65	52.2 Å²	52.2	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-59.9	-28	177	-62.7	-177.4	0	0	0	112.7	T372 W377 L378 H468	T372-L374 HydrophobicContact CG2-CB 4.06Å; T372-L374 PolarHBondContact O-N 3.06Å; T372-L374 PolarHBondContact OG1-N 2.87Å; L374-W377 PolarHBondContact O-N 2.93Å; L374-L378 WeakPolarHBondContact O-CB 3.38Å; L374-L378 PolarHBondContact O-N 2.98Å; L374-H468 WeakPolarHBondContact CD1-NE2 3.36Å
375	F	92.1	Very high	91.1	Very high	10 Å²	10	59.2 Å²	59.2	4%	0.044	29%	0.288	C	S	.	.	H	α-helix	trans	-68.6	-42.9	173	-75.6	-19	0	0	0	112.5	M350 Y371 T372 P373 W377 L378 L379 A434 L437 V469	M350-F375 HydrophobicContact SD-CB 4.38Å; M350-F375 HydrophobicContact SD-CD2 3.87Å; M350-F375 HydrophobicContact SD-CE2 4.47Å; M350-F375 HydrophobicContact SD-CG 4.33Å; Y371-F375 HydrophobicContact CD1-CD2 4.05Å; Y371-F375 AromaticContact CD1-CE2 4Å; Y371-F375 HydrophobicContact CD1-CE2 4Å; Y371-F375 HydrophobicContact CG-CD2 4.04Å; Y371-F375 HydrophobicContact CG-CE2 4.45Å; T372-F375 HydrophobicContact CG2-CD1 4.32Å; T372-F375 HydrophobicContact CG2-CD2 4.28Å; T372-F375 HydrophobicContact CG2-CG 4.17Å; T372-F375 PolarHBondContact O-N 3.25Å; T372-F375 VanDerWaalsContact O-N 3.08Å; P373-F375 PolarHBondContact O-N 3Å; F375-W377 VanDerWaalsContact C-N 3.27Å; F375-W377 PolarHBondContact O-N 3.33Å; F375-L378 PolarHBondContact O-N 3.3Å; F375-L379 WeakPolarHBondContact O-CB 3.39Å; F375-L379 VanDerWaalsContact O-CG 3.32Å; F375-L379 WeakPolarHBondContact O-CG 3.25Å; F375-L379 PolarHBondContact O-N 2.94Å; F375-A434 HydrophobicContact CD2-CB 4.35Å; F375-A434 HydrophobicContact CE1-CB 4.09Å; F375-A434 HydrophobicContact CE2-CB 3.69Å; F375-A434 HydrophobicContact CZ-CB 3.52Å; F375-L437 HydrophobicContact CD1-CD2 4.5Å; F375-L437 HydrophobicContact CE1-CD2 3.69Å; F375-V469 HydrophobicContact CE1-CG1 3.86Å; F375-V469 HydrophobicContact CE2-CG1 4.32Å; F375-V469 HydrophobicContact CZ-CG1 3.42Å; F375-V469 VanDerWaalsContact CZ-CG1 3.42Å
376	A	93.1	Very high	90.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.2	-40.3	174.8	0	0	0	0	0	111.4	A353 A354 V357 P363 Y369 P373 L380	A353-A376 HydrophobicContact CB-CB 4.06Å; A354-A376 VanDerWaalsContact CB-O 3.3Å; A354-A376 WeakPolarHBondContact CB-O 3.46Å; V357-A376 HydrophobicContact CG2-CB 3.75Å; P363-A376 HydrophobicContact CB-CB 3.81Å; P363-A376 HydrophobicContact CG-CB 4.49Å; Y369-A376 PolarHBondContact OH-N 2.91Å; P373-A376 WeakPolarHBondContact O-CB 3.3Å; P373-A376 PolarHBondContact O-N 3.02Å; P373-A376 VanDerWaalsContact O-N 3.1Å; A376-L380 PolarHBondContact O-N 3.25Å
377	W	94.5	Very high	90.5	Very high	135 Å²	135	58.9 Å²	58.9	51%	0.511	28%	0.282	S	S	.	.	H	α-helix	trans	-66.2	-45.2	173.5	-77.9	103.3	0	0	0	113.1	V357 P373 L374 F375 L379 L380 Y531	V357-W377 HydrophobicContact CG1-CD2 3.83Å; V357-W377 HydrophobicContact CG1-CE3 4.15Å; V357-W377 HydrophobicContact CG1-CG 4.39Å; V357-W377 HydrophobicContact CG1-CH2 4.05Å; V357-W377 HydrophobicContact CG1-CZ2 3.76Å; V357-W377 HydrophobicContact CG1-CZ3 4.25Å; P373-W377 VanDerWaalsContact O-CD1 3.27Å; P373-W377 PolarHBondContact O-N 3.23Å; P373-W377 VanDerWaalsContact O-N 3.11Å; L374-W377 PolarHBondContact O-N 2.93Å; F375-W377 VanDerWaalsContact C-N 3.27Å; F375-W377 PolarHBondContact O-N 3.33Å; W377-L379 PolarHBondContact O-N 3.26Å; W377-L380 HydrophobicContact CD2-CD1 4.43Å; W377-L380 HydrophobicContact CE3-CD1 3.48Å; W377-L380 VanDerWaalsContact CE3-CD1 3.48Å; W377-L380 HydrophobicContact CZ3-CD1 3.87Å; W377-L380 VanDerWaalsContact O-CG 3.3Å; W377-L380 WeakPolarHBondContact O-CG 3.33Å; W377-L380 PolarHBondContact O-N 2.83Å; W377-Y531 AromaticContact NE1-CZ 3.94Å; W377-Y531 PolarHBondContact NE1-OH 3.11Å
378	L	93.9	Very high	90.7	Very high	67 Å²	67	57.3 Å²	57.3	35%	0.351	27%	0.266	S	S	.	.	H	α-helix	trans	-61.7	-32.6	179.3	-176.1	64.5	0	0	0	111.8	L374 F375 L392 L437	L374-L378 WeakPolarHBondContact O-CB 3.38Å; L374-L378 PolarHBondContact O-N 2.98Å; F375-L378 PolarHBondContact O-N 3.3Å; L378-L392 HydrophobicContact CD1-CD2 3.97Å; L378-L392 HydrophobicContact CD2-CD2 3.87Å; L378-L392 HydrophobicContact CG-CD2 3.72Å; L378-L437 HydrophobicContact CD2-CD2 3.98Å
379	L	94	Very high	90.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	9.7	-177.5	-65.6	173.2	0	0	0	114.1	M350 A354 F375 W377 P381 A382 F393	M350-L379 HydrophobicContact CB-CD1 3.61Å; M350-L379 HydrophobicContact CG-CD1 4.47Å; M350-L379 HydrophobicContact SD-CD1 4.26Å; A354-L379 HydrophobicContact CB-CB 4Å; F375-L379 WeakPolarHBondContact O-CB 3.39Å; F375-L379 VanDerWaalsContact O-CG 3.32Å; F375-L379 WeakPolarHBondContact O-CG 3.25Å; F375-L379 PolarHBondContact O-N 2.94Å; W377-L379 PolarHBondContact O-N 3.26Å; L379-P381 VanDerWaalsContact C-CD 3.4Å; L379-P381 VanDerWaalsContact C-N 3.29Å; L379-A382 HydrophobicContact CB-CB 4.36Å; L379-A382 WeakPolarHBondContact O-CA 3.42Å; L379-A382 WeakPolarHBondContact O-CB 3.18Å; L379-A382 PolarHBondContact O-N 3.48Å; L379-F393 HydrophobicContact CD1-CZ 4.3Å; L379-F393 HydrophobicContact CD2-CE2 4.38Å; L379-F393 HydrophobicContact CD2-CZ 4.11Å
380	L	94	Very high	90.6	Very high	51 Å²	51	55 Å²	55	27%	0.267	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-50.5	-41.2	173.9	-75.9	174.4	0	0	0	114.1	A354 V357 A358 A376 W377 A382 N383	A354-L380 WeakPolarHBondContact O-CD2 3.32Å; V357-L380 HydrophobicContact CB-CD2 4.32Å; V357-L380 HydrophobicContact CG1-CD2 4.1Å; A358-L380 HydrophobicContact CB-CD2 3.82Å; A376-L380 PolarHBondContact O-N 3.25Å; W377-L380 HydrophobicContact CD2-CD1 4.43Å; W377-L380 HydrophobicContact CE3-CD1 3.48Å; W377-L380 VanDerWaalsContact CE3-CD1 3.48Å; W377-L380 HydrophobicContact CZ3-CD1 3.87Å; W377-L380 VanDerWaalsContact O-CG 3.3Å; W377-L380 WeakPolarHBondContact O-CG 3.33Å; W377-L380 PolarHBondContact O-N 2.83Å; L380-A382 PolarHBondContact O-N 3.11Å; L380-N383 WeakPolarHBondContact O-CB 3.08Å; L380-N383 PolarHBondContact O-N 3.29Å; L380-N383 VanDerWaalsContact O-N 3.15Å; L380-N383 PolarHBondContact O-ND2 3.08Å
381	P	94	Very high	90.5	Very high	59 Å²	59	58 Å²	58	38%	0.383	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-63.7	-20.6	176.1	-21.8	34.7	0	0	0	113.5	L379 N383 R384 W385 F388	L379-P381 VanDerWaalsContact C-CD 3.4Å; L379-P381 VanDerWaalsContact C-N 3.29Å; P381-N383 PolarHBondContact O-N 3.39Å; P381-R384 PolarHBondContact O-N 3.06Å; P381-R384 VanDerWaalsContact O-N 3.07Å; P381-W385 PolarHBondContact O-N 3.4Å; P381-F388 HydrophobicContact CB-CD1 3.78Å; P381-F388 HydrophobicContact CB-CD2 4.07Å; P381-F388 HydrophobicContact CB-CE1 3.86Å; P381-F388 HydrophobicContact CB-CE2 4.14Å; P381-F388 HydrophobicContact CB-CG 3.89Å; P381-F388 HydrophobicContact CB-CZ 4.03Å; P381-F388 HydrophobicContact CG-CD1 4.17Å; P381-F388 HydrophobicContact CG-CE1 3.74Å; P381-F388 HydrophobicContact CG-CE2 4.34Å; P381-F388 HydrophobicContact CG-CZ 3.83Å
382	A	88	Confident	90.6	Very high	4 Å²	4	57.8 Å²	57.8	3%	0.033	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-65.1	-20.1	176.8	0	0	0	0	0	113	T351 L379 L380 R384 W385 L386 F388	T351-A382 HydrophobicContact CG2-CB 3.94Å; L379-A382 HydrophobicContact CB-CB 4.36Å; L379-A382 WeakPolarHBondContact O-CA 3.42Å; L379-A382 WeakPolarHBondContact O-CB 3.18Å; L379-A382 PolarHBondContact O-N 3.48Å; L380-A382 PolarHBondContact O-N 3.11Å; A382-R384 PolarHBondContact O-N 3.1Å; A382-W385 VanDerWaalsContact CA-O 3.32Å; A382-W385 WeakPolarHBondContact CA-O 3.46Å; A382-W385 CarbonylContact O-C 3.52Å; A382-L386 WeakPolarHBondContact O-CA 3.36Å; A382-L386 PolarHBondContact O-N 3.02Å; A382-F388 HydrophobicContact CB-CB 4.39Å; A382-F388 HydrophobicContact CB-CD1 4.5Å
383	N	85.1	Confident	90.5	Very high	61 Å²	61	57.6 Å²	57.6	33%	0.326	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-63.6	-29.9	173.2	-64	-17.4	0	0	0	112.2	A354 R355 A358 L380 P381	A354-N383 PolarHBondContact O-ND2 3.24Å; R355-N383 HydrophobicContact CG-CB 4.47Å; R355-N383 WeakPolarHBondContact CG-OD1 3.32Å; R355-N383 PolarHBondContact N-OD1 2.74Å; A358-N383 WeakPolarHBondContact CB-ND2 3.41Å; L380-N383 WeakPolarHBondContact O-CB 3.08Å; L380-N383 PolarHBondContact O-N 3.29Å; L380-N383 VanDerWaalsContact O-N 3.15Å; L380-N383 PolarHBondContact O-ND2 3.08Å; P381-N383 PolarHBondContact O-N 3.39Å
384	R	87.1	Confident	90.2	Very high	211 Å²	211	60.5 Å²	60.5	80%	0.796	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-41.5	174.9	-175.3	59.8	115.3	85.5	2.8	111.7	P381 A382	P381-R384 PolarHBondContact O-N 3.06Å; P381-R384 VanDerWaalsContact O-N 3.07Å; A382-R384 PolarHBondContact O-N 3.1Å
385	W	86.4	Confident	90.2	Very high	175 Å²	175	60.7 Å²	60.7	66%	0.663	29%	0.29	S	S	*	.			trans	-119.2	89	-177	-61	-9	0	0	0	109.6	P381 A382 C387 F388	P381-W385 PolarHBondContact O-N 3.4Å; A382-W385 VanDerWaalsContact CA-O 3.32Å; A382-W385 WeakPolarHBondContact CA-O 3.46Å; A382-W385 CarbonylContact O-C 3.52Å; W385-C387 PolarHBondContact O-N 3.36Å; W385-F388 HydrophobicContact CB-CB 4.1Å; W385-F388 WeakPolarHBondContact O-CB 3.37Å; W385-F388 PolarHBondContact O-N 2.95Å
386	L	82.3	Confident	90.3	Very high	60 Å²	60	62.5 Å²	62.5	31%	0.314	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-30.5	-170.9	-174.2	61.6	0	0	0	114.4	M330 Y347 A382	M330-L386 HydrophobicContact CB-CD2 3.63Å; M330-L386 HydrophobicContact SD-CD2 4.47Å; Y347-L386 WeakPolarHBondContact CE1-O 3.4Å; Y347-L386 PolarHBondContact OH-O 2.91Å; A382-L386 WeakPolarHBondContact O-CA 3.36Å; A382-L386 PolarHBondContact O-N 3.02Å
387	C	84.1	Confident	90.1	Very high	56 Å²	56	63.5 Å²	63.5	38%	0.378	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-3.8	177.6	-58.6	0	0	0	0	114.6	W385 G389 K390 M391	W385-C387 PolarHBondContact O-N 3.36Å; C387-G389 PolarHBondContact O-N 3Å; C387-K390 WeakPolarHBondContact O-CB 3.38Å; C387-K390 PolarHBondContact O-N 3.34Å; C387-K390 VanDerWaalsContact O-N 3.16Å; C387-M391 WeakPolarHBondContact O-CG 3.37Å; C387-M391 PolarHBondContact O-N 3.3Å
388	F	90.6	Very high	90	Very high	56 Å²	56	61.9 Å²	61.9	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-54.2	-48.4	-175.2	170	-98.2	0	0	0	112.5	P381 A382 W385 K390 M391 L392	P381-F388 HydrophobicContact CB-CD1 3.78Å; P381-F388 HydrophobicContact CB-CD2 4.07Å; P381-F388 HydrophobicContact CB-CE1 3.86Å; P381-F388 HydrophobicContact CB-CE2 4.14Å; P381-F388 HydrophobicContact CB-CG 3.89Å; P381-F388 HydrophobicContact CB-CZ 4.03Å; P381-F388 HydrophobicContact CG-CD1 4.17Å; P381-F388 HydrophobicContact CG-CE1 3.74Å; P381-F388 HydrophobicContact CG-CE2 4.34Å; P381-F388 HydrophobicContact CG-CZ 3.83Å; A382-F388 HydrophobicContact CB-CB 4.39Å; A382-F388 HydrophobicContact CB-CD1 4.5Å; W385-F388 HydrophobicContact CB-CB 4.1Å; W385-F388 WeakPolarHBondContact O-CB 3.37Å; W385-F388 PolarHBondContact O-N 2.95Å; F388-K390 PolarHBondContact O-N 3.34Å; F388-M391 PolarHBondContact O-N 3.32Å; F388-L392 HydrophobicContact CE1-CD2 4.09Å; F388-L392 HydrophobicContact CZ-CD2 4.32Å; F388-L392 WeakPolarHBondContact O-CB 3.22Å; F388-L392 PolarHBondContact O-N 3.25Å
389	G	88.6	Confident	89.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-40.4	-179.9	0	0	0	0	0	112.5	Y347 C387 M391 L392 F393	Y347-G389 WeakPolarHBondContact OH-CA 3.33Å; Y347-G389 PolarHBondContact OH-N 3.49Å; C387-G389 PolarHBondContact O-N 3Å; G389-M391 PolarHBondContact O-N 3.42Å; G389-L392 PolarHBondContact O-N 3.26Å; G389-F393 WeakPolarHBondContact O-CD2 3.49Å; G389-F393 VanDerWaalsContact O-CG 3.26Å; G389-F393 WeakPolarHBondContact O-CG 3.18Å; G389-F393 PolarHBondContact O-N 3.03Å
390	K	88.5	Confident	89.9	Confident	30 Å²	30	63.1 Å²	63.1	13%	0.13	31%	0.311	C	S	.	.	H	α-helix	trans	-58.5	-47.3	173.5	-57.5	-165.8	174.5	-174.8	0	111.2	D332 Y347 C387 F388 L392 F393 N394 R431	D332-K390 IonicContact OD1-NZ 3.42Å; D332-K390 PolarHBondContact OD1-NZ 3.16Å; D332-K390 IonicContact OD2-NZ 3.7Å; D332-K390 PolarHBondContact OD2-NZ 2.92Å; Y347-K390 HydrophobicContact CD1-CG 4.29Å; Y347-K390 HydrophobicContact CD2-CG 4.45Å; Y347-K390 HydrophobicContact CE1-CD 4.32Å; Y347-K390 HydrophobicContact CE1-CG 3.84Å; Y347-K390 HydrophobicContact CE2-CG 4Å; Y347-K390 PolarHBondContact OH-N 3.49Å; C387-K390 WeakPolarHBondContact O-CB 3.38Å; C387-K390 PolarHBondContact O-N 3.34Å; C387-K390 VanDerWaalsContact O-N 3.16Å; F388-K390 PolarHBondContact O-N 3.34Å; K390-L392 PolarHBondContact O-N 2.95Å; K390-F393 PolarHBondContact O-N 3.48Å; K390-N394 PolarHBondContact O-N 3.46Å; K390-N394 PolarHBondContact O-ND2 3.07Å; K390-R431 WeakPolarHBondContact CE-O 3.38Å
391	M	89.6	Confident	89.7	Confident	131 Å²	131	60.7 Å²	60.7	65%	0.645	30%	0.298	S	S	*	.	H	α-helix	trans	-62.5	-43.8	177.6	-66.1	177.6	71	0	0	111.6	C387 F388 G389 F393 N394 C395	C387-M391 WeakPolarHBondContact O-CG 3.37Å; C387-M391 PolarHBondContact O-N 3.3Å; F388-M391 PolarHBondContact O-N 3.32Å; G389-M391 PolarHBondContact O-N 3.42Å; M391-F393 PolarHBondContact O-N 3.44Å; M391-N394 PolarHBondContact O-N 2.91Å; M391-C395 PolarHBondContact O-N 2.86Å; M391-C395 PolarHBondContact O-SG 2.85Å; M391-C395 VanDerWaalsContact O-SG 3.33Å
392	L	93.1	Very high	89.6	Confident	37 Å²	37	63.8 Å²	63.8	19%	0.194	30%	0.302	C	S	.	.	H	α-helix	trans	-59.5	-47.4	178.3	179.5	65	0	0	0	111.9	L378 F388 G389 K390 C395 F396	L378-L392 HydrophobicContact CD1-CD2 3.97Å; L378-L392 HydrophobicContact CD2-CD2 3.87Å; L378-L392 HydrophobicContact CG-CD2 3.72Å; F388-L392 HydrophobicContact CE1-CD2 4.09Å; F388-L392 HydrophobicContact CZ-CD2 4.32Å; F388-L392 WeakPolarHBondContact O-CB 3.22Å; F388-L392 PolarHBondContact O-N 3.25Å; G389-L392 PolarHBondContact O-N 3.26Å; K390-L392 PolarHBondContact O-N 2.95Å; L392-C395 WeakPolarHBondContact O-CB 3.5Å; L392-C395 PolarHBondContact O-N 3.38Å; L392-F396 HydrophobicContact CD1-CE2 3.87Å; L392-F396 HydrophobicContact CG-CD2 4.4Å; L392-F396 HydrophobicContact CG-CE2 3.95Å; L392-F396 VanDerWaalsContact O-CD2 3.25Å; L392-F396 WeakPolarHBondContact O-CD2 3.4Å; L392-F396 PolarHBondContact O-N 3.35Å
393	F	92.1	Very high	89.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-67.1	-38.2	179.1	-59.2	-40.7	0	0	0	112.2	Y347 M350 L379 G389 K390 M391 C395 F396 D397 G432 N433 A434 P436 L437	Y347-F393 HydrophobicContact CD2-CE2 4.44Å; Y347-F393 HydrophobicContact CE2-CE2 4.38Å; M350-F393 HydrophobicContact CE-CE2 4.22Å; L379-F393 HydrophobicContact CD1-CZ 4.3Å; L379-F393 HydrophobicContact CD2-CE2 4.38Å; L379-F393 HydrophobicContact CD2-CZ 4.11Å; G389-F393 WeakPolarHBondContact O-CD2 3.49Å; G389-F393 VanDerWaalsContact O-CG 3.26Å; G389-F393 WeakPolarHBondContact O-CG 3.18Å; G389-F393 PolarHBondContact O-N 3.03Å; K390-F393 PolarHBondContact O-N 3.48Å; M391-F393 PolarHBondContact O-N 3.44Å; F393-C395 VanDerWaalsContact C-N 3.29Å; F393-C395 PolarHBondContact O-N 3.42Å; F393-F396 WeakPolarHBondContact O-CA 3.36Å; F393-F396 WeakPolarHBondContact O-CB 3.38Å; F393-F396 PolarHBondContact O-N 2.91Å; F393-D397 PolarHBondContact O-N 3.21Å; F393-D397 VanDerWaalsContact O-N 3.17Å; F393-G432 WeakPolarHBondContact CD2-O 3.47Å; F393-G432 WeakPolarHBondContact CE2-O 3.29Å; F393-N433 WeakPolarHBondContact CD2-O 3.37Å; F393-N433 WeakPolarHBondContact CG-O 3.35Å; F393-A434 HydrophobicContact CD1-CB 4.3Å; F393-A434 HydrophobicContact CE1-CB 3.72Å; F393-A434 HydrophobicContact CE2-CB 4.05Å; F393-A434 HydrophobicContact CZ-CB 3.58Å; F393-P436 HydrophobicContact CB-CB 4.45Å; F393-P436 HydrophobicContact CB-CG 4.33Å; F393-P436 WeakPolarHBondContact O-CB 3.47Å; F393-L437 HydrophobicContact CD1-CB 4.46Å
394	N	89.8	Confident	90.1	Very high	63 Å²	63	61 Å²	61	34%	0.337	29%	0.286	S	S	.	.	H	α-helix	trans	-63.8	-31.8	172.9	-77.1	-73.6	0	0	0	112.6	K390 M391 F396 D397 L398	K390-N394 PolarHBondContact O-N 3.46Å; K390-N394 PolarHBondContact O-ND2 3.07Å; M391-N394 PolarHBondContact O-N 2.91Å; N394-F396 VanDerWaalsContact C-N 3.29Å; N394-F396 PolarHBondContact O-N 2.91Å; N394-D397 WeakPolarHBondContact O-CB 3.14Å; N394-D397 PolarHBondContact O-N 3.03Å; N394-L398 PolarHBondContact O-N 3.18Å
395	C	92.7	Very high	90.2	Very high	69 Å²	69	51 Å²	51	47%	0.466	25%	0.249	S	C	.	.	H	α-helix	trans	-62.4	-36.9	170.7	-69.1	0	0	0	0	112	M391 L392 F393 D397 L398 L399	M391-C395 PolarHBondContact O-N 2.86Å; M391-C395 PolarHBondContact O-SG 2.85Å; M391-C395 VanDerWaalsContact O-SG 3.33Å; L392-C395 WeakPolarHBondContact O-CB 3.5Å; L392-C395 PolarHBondContact O-N 3.38Å; F393-C395 VanDerWaalsContact C-N 3.29Å; F393-C395 PolarHBondContact O-N 3.42Å; C395-D397 VanDerWaalsContact C-N 3.33Å; C395-L398 PolarHBondContact O-N 3.36Å; C395-L399 WeakPolarHBondContact O-CD1 3.31Å; C395-L399 PolarHBondContact O-N 3.24Å
396	F	93.8	Very high	90.2	Very high	47 Å²	47	45 Å²	45	21%	0.206	23%	0.228	C	C	.	.	H	α-helix	trans	-68.7	-28.5	175.2	-74.7	-68.3	0	0	0	113.1	L392 F393 N394 L399 T400 P436 L437 C440	L392-F396 HydrophobicContact CD1-CE2 3.87Å; L392-F396 HydrophobicContact CG-CD2 4.4Å; L392-F396 HydrophobicContact CG-CE2 3.95Å; L392-F396 VanDerWaalsContact O-CD2 3.25Å; L392-F396 WeakPolarHBondContact O-CD2 3.4Å; L392-F396 PolarHBondContact O-N 3.35Å; F393-F396 WeakPolarHBondContact O-CA 3.36Å; F393-F396 WeakPolarHBondContact O-CB 3.38Å; F393-F396 PolarHBondContact O-N 2.91Å; N394-F396 VanDerWaalsContact C-N 3.29Å; N394-F396 PolarHBondContact O-N 2.91Å; F396-L399 PolarHBondContact O-N 3.07Å; F396-T400 WeakPolarHBondContact O-CB 3.47Å; F396-T400 PolarHBondContact O-N 3.4Å; F396-T400 PolarHBondContact O-OG1 3.03Å; F396-P436 HydrophobicContact CB-CB 3.99Å; F396-L437 HydrophobicContact CD1-CD1 3.98Å; F396-L437 HydrophobicContact CD2-CB 3.96Å; F396-L437 HydrophobicContact CD2-CD1 4.16Å; F396-L437 HydrophobicContact CE1-CD1 3.66Å; F396-L437 HydrophobicContact CE2-CB 4.33Å; F396-L437 HydrophobicContact CE2-CD1 3.84Å; F396-L437 HydrophobicContact CE2-CD2 4.48Å; F396-L437 HydrophobicContact CE2-CG 4.45Å; F396-L437 HydrophobicContact CG-CB 4.17Å; F396-L437 HydrophobicContact CG-CD1 4.23Å; F396-L437 HydrophobicContact CZ-CD1 3.59Å; F396-C440 HydrophobicContact CB-CB 4.3Å; F396-C440 HydrophobicContact CD1-CB 4.03Å
397	D	91	Very high	90.5	Very high	21 Å²	21	42.1 Å²	42.1	11%	0.112	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-43.1	169.9	-82	-36.8	0	0	0	111.8	F393 N394 C395 L399 T400 G401 L420 S429 P436	F393-D397 PolarHBondContact O-N 3.21Å; F393-D397 VanDerWaalsContact O-N 3.17Å; N394-D397 WeakPolarHBondContact O-CB 3.14Å; N394-D397 PolarHBondContact O-N 3.03Å; C395-D397 VanDerWaalsContact C-N 3.33Å; D397-L399 VanDerWaalsContact C-N 3.3Å; D397-L399 PolarHBondContact O-N 2.85Å; D397-T400 CarbonylContact O-C 3.54Å; D397-T400 WeakPolarHBondContact O-CB 3.32Å; D397-T400 PolarHBondContact O-N 3.4Å; D397-T400 VanDerWaalsContact O-N 3.12Å; D397-G401 PolarHBondContact O-N 3.25Å; D397-L420 HydrophobicContact CB-CD2 4.25Å; D397-L420 VanDerWaalsContact O-CD2 3.26Å; D397-L420 WeakPolarHBondContact O-CD2 3.36Å; D397-S429 WeakPolarHBondContact OD2-CB 3.26Å; D397-S429 PolarHBondContact OD2-OG 3.43Å; D397-P436 WeakPolarHBondContact OD1-CB 3.22Å; D397-P436 WeakPolarHBondContact OD1-CG 3.46Å; D397-P436 WeakPolarHBondContact OD2-CG 3.33Å
398	L	90.9	Very high	90.5	Very high	102 Å²	102	39.8 Å²	39.8	53%	0.534	20%	0.198	S	C	.	.	H	α-helix	trans	-60.2	-41.8	176.3	-62.2	178.2	0	0	0	111.5	N394 C395 G401 W402 L420	N394-L398 PolarHBondContact O-N 3.18Å; C395-L398 PolarHBondContact O-N 3.36Å; L398-G401 PolarHBondContact O-N 3.37Å; L398-W402 PolarHBondContact O-N 3.06Å; L398-L420 HydrophobicContact CD2-CD1 4.01Å
399	L	92.9	Very high	89.7	Confident	86 Å²	86	38.5 Å²	38.5	45%	0.45	20%	0.2	S	C	.	.	H	α-helix	trans	-65.1	-41	173.9	-94.4	67.2	0	0	0	111.9	C395 F396 D397 W402 L403	C395-L399 WeakPolarHBondContact O-CD1 3.31Å; C395-L399 PolarHBondContact O-N 3.24Å; F396-L399 PolarHBondContact O-N 3.07Å; D397-L399 VanDerWaalsContact C-N 3.3Å; D397-L399 PolarHBondContact O-N 2.85Å; L399-W402 PolarHBondContact O-N 2.84Å; L399-L403 WeakPolarHBondContact O-CG 3.3Å; L399-L403 PolarHBondContact O-N 2.82Å
400	T	92.5	Very high	88.9	Confident	7 Å²	7	41.8 Å²	41.8	4%	0.043	21%	0.213	C	C	.	.	H	α-helix	trans	-59.7	-46.7	175.5	-61.3	0	0	0	0	110.1	F396 D397 W402 L403 C404 C440 L443 T627	F396-T400 WeakPolarHBondContact O-CB 3.47Å; F396-T400 PolarHBondContact O-N 3.4Å; F396-T400 PolarHBondContact O-OG1 3.03Å; D397-T400 CarbonylContact O-C 3.54Å; D397-T400 WeakPolarHBondContact O-CB 3.32Å; D397-T400 PolarHBondContact O-N 3.4Å; D397-T400 VanDerWaalsContact O-N 3.12Å; T400-W402 PolarHBondContact O-N 3.4Å; T400-L403 PolarHBondContact O-N 3.49Å; T400-C404 PolarHBondContact O-N 3.26Å; T400-C404 PolarHBondContact O-SG 2.89Å; T400-C440 WeakPolarHBondContact OG1-CA 3.39Å; T400-C440 WeakPolarHBondContact OG1-CB 3.37Å; T400-C440 PolarHBondContact OG1-N 2.67Å; T400-L443 HydrophobicContact CG2-CD1 3.54Å; T400-T627 HydrophobicContact CG2-CG2 3.56Å
401	G	90.7	Very high	87.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60	-42.7	174.7	0	0	0	0	0	113	D397 L398 C404 V405 W416	D397-G401 PolarHBondContact O-N 3.25Å; L398-G401 PolarHBondContact O-N 3.37Å; G401-C404 WeakPolarHBondContact O-CB 3.19Å; G401-C404 PolarHBondContact O-N 3.11Å; G401-V405 PolarHBondContact O-N 3.25Å; G401-W416 VanDerWaalsContact C-CZ3 3.47Å
402	W	91.2	Very high	87	Confident	124 Å²	124	43.8 Å²	43.8	47%	0.47	22%	0.219	S	C	.	.	H	α-helix	trans	-61.8	-44.7	174.1	175.4	80.2	0	0	0	112	L398 L399 T400 C404 V405 Q406 W416	L398-W402 PolarHBondContact O-N 3.06Å; L399-W402 PolarHBondContact O-N 2.84Å; T400-W402 PolarHBondContact O-N 3.4Å; W402-C404 VanDerWaalsContact C-N 3.33Å; W402-C404 PolarHBondContact O-N 3.14Å; W402-V405 PolarHBondContact O-N 3.44Å; W402-Q406 HydrophobicContact CD2-CG 4.1Å; W402-Q406 HydrophobicContact CH2-CG 4.29Å; W402-Q406 HydrophobicContact CZ2-CG 3.82Å; W402-Q406 WeakPolarHBondContact O-CG 3.5Å; W402-Q406 PolarHBondContact O-N 2.98Å; W402-W416 HydrophobicContact CB-CH2 3.91Å
403	L	93.1	Very high	85.8	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-39.5	176.1	-73.3	167.6	0	0	0	111.9	L399 T400 V405 Q406 L407 L443 L444 F447	L399-L403 WeakPolarHBondContact O-CG 3.3Å; L399-L403 PolarHBondContact O-N 2.82Å; T400-L403 PolarHBondContact O-N 3.49Å; L403-V405 VanDerWaalsContact C-N 3.32Å; L403-V405 PolarHBondContact O-N 3.46Å; L403-Q406 PolarHBondContact O-N 3.25Å; L403-L407 WeakPolarHBondContact O-CB 3.31Å; L403-L407 WeakPolarHBondContact O-CG 3.34Å; L403-L407 PolarHBondContact O-N 3.48Å; L403-L443 HydrophobicContact CB-CB 4.01Å; L403-L443 HydrophobicContact CB-CD1 4.1Å; L403-L443 HydrophobicContact CD1-CB 3.94Å; L403-L444 HydrophobicContact CD1-CB 3.99Å; L403-L444 HydrophobicContact CD2-CD1 4.17Å; L403-F447 HydrophobicContact CD2-CB 4.15Å; L403-F447 HydrophobicContact CD2-CG 4.22Å
404	C	91.7	Very high	85.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-57.3	-44.7	174.4	-71.3	0	0	0	0	111.7	T400 G401 W402 L407 A408 I415 A419 L443 P630 V631	T400-C404 PolarHBondContact O-N 3.26Å; T400-C404 PolarHBondContact O-SG 2.89Å; G401-C404 WeakPolarHBondContact O-CB 3.19Å; G401-C404 PolarHBondContact O-N 3.11Å; W402-C404 VanDerWaalsContact C-N 3.33Å; W402-C404 PolarHBondContact O-N 3.14Å; C404-L407 PolarHBondContact O-N 3.47Å; C404-A408 VanDerWaalsContact O-CB 3.22Å; C404-A408 WeakPolarHBondContact O-CB 3.45Å; C404-A408 PolarHBondContact O-N 3.33Å; C404-I415 HydrophobicContact CB-CG2 4.02Å; C404-A419 HydrophobicContact CB-CB 4.39Å; C404-L443 WeakPolarHBondContact SG-CD1 3.47Å; C404-P630 HydrophobicContact CB-CB 4.2Å; C404-V631 HydrophobicContact CB-CG2 4.09Å
405	V	88	Confident	84.6	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.012	24%	0.239	C	C	.	.	H	α-helix	trans	-65.1	-44.7	178.2	173.5	0	0	0	0	111.3	G401 W402 L403 L407 A408 G409 Y411 I415 W416	G401-V405 PolarHBondContact O-N 3.25Å; W402-V405 PolarHBondContact O-N 3.44Å; L403-V405 VanDerWaalsContact C-N 3.32Å; L403-V405 PolarHBondContact O-N 3.46Å; V405-L407 VanDerWaalsContact C-N 3.33Å; V405-L407 PolarHBondContact O-N 2.75Å; V405-A408 PolarHBondContact O-N 3.38Å; V405-G409 PolarHBondContact O-N 2.94Å; V405-Y411 HydrophobicContact CG1-CD1 3.72Å; V405-Y411 HydrophobicContact CG1-CE1 3.9Å; V405-Y411 HydrophobicContact CG1-CG 4.32Å; V405-I415 HydrophobicContact CG2-CB 4.26Å; V405-I415 HydrophobicContact CG2-CG2 3.7Å; V405-W416 HydrophobicContact CG2-CD2 4.03Å; V405-W416 HydrophobicContact CG2-CG 4.23Å; V405-W416 HydrophobicContact CG2-CZ2 4.08Å
406	Q	88	Confident	83.7	Confident	48 Å²	48	48 Å²	48	22%	0.224	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-39.3	178.4	-66	-57.3	-37.6	0	0	112.3	W402 L403 Y411 F447 R451	W402-Q406 HydrophobicContact CD2-CG 4.1Å; W402-Q406 HydrophobicContact CH2-CG 4.29Å; W402-Q406 HydrophobicContact CZ2-CG 3.82Å; W402-Q406 WeakPolarHBondContact O-CG 3.5Å; W402-Q406 PolarHBondContact O-N 2.98Å; L403-Q406 PolarHBondContact O-N 3.25Å; Q406-Y411 PolarHBondContact NE2-OH 3.45Å; Q406-F447 HydrophobicContact CB-CD2 4.05Å; Q406-F447 HydrophobicContact CB-CE2 3.74Å; Q406-R451 PolarHBondContact O-NH2 3.35Å
407	L	88.2	Confident	82.9	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-71.7	-42.4	176.5	-80.4	169	0	0	0	112.3	L403 C404 V405 G409 L443 L446 F447 V450 R451 E600 V631	L403-L407 WeakPolarHBondContact O-CB 3.31Å; L403-L407 WeakPolarHBondContact O-CG 3.34Å; L403-L407 PolarHBondContact O-N 3.48Å; C404-L407 PolarHBondContact O-N 3.47Å; V405-L407 VanDerWaalsContact C-N 3.33Å; V405-L407 PolarHBondContact O-N 2.75Å; L407-G409 VanDerWaalsContact C-N 3.25Å; L407-G409 PolarHBondContact O-N 2.91Å; L407-L443 HydrophobicContact CD1-CB 4.38Å; L407-L443 HydrophobicContact CD1-CD2 3.95Å; L407-L446 HydrophobicContact CD1-CB 4.43Å; L407-L446 HydrophobicContact CD1-CD2 3.96Å; L407-L446 HydrophobicContact CD1-CG 4.19Å; L407-L446 HydrophobicContact CD2-CG 4.17Å; L407-F447 HydrophobicContact CD1-CB 4.43Å; L407-F447 HydrophobicContact CD2-CB 4.06Å; L407-F447 HydrophobicContact CD2-CD2 4.29Å; L407-F447 HydrophobicContact CG-CB 4.17Å; L407-F447 HydrophobicContact CG-CD2 4.28Å; L407-V450 HydrophobicContact CD2-CB 4.42Å; L407-R451 PolarHBondContact O-NH2 3.34Å; L407-E600 HydrophobicContact CD2-CG 4.31Å; L407-V631 HydrophobicContact CB-CB 4.44Å; L407-V631 HydrophobicContact CB-CG1 3.65Å; L407-V631 HydrophobicContact CB-CG2 3.91Å; L407-V631 HydrophobicContact CD1-CG2 4.23Å
408	A	84.1	Confident	82.3	Confident	7 Å²	7	53.4 Å²	53.4	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-65.7	-29.4	177.7	0	0	0	0	0	112.4	C404 V405 R410 I415	C404-A408 VanDerWaalsContact O-CB 3.22Å; C404-A408 WeakPolarHBondContact O-CB 3.45Å; C404-A408 PolarHBondContact O-N 3.33Å; V405-A408 PolarHBondContact O-N 3.38Å; A408-R410 HydrophobicContact CB-CG 4.06Å; A408-R410 PolarHBondContact O-N 3.25Å; A408-I415 HydrophobicContact CB-CD1 3.47Å; A408-I415 VanDerWaalsContact CB-CD1 3.47Å; A408-I415 HydrophobicContact CB-CG1 4.42Å
409	G	73.2	Confident	81.8	Confident	29 Å²	29	49.2 Å²	49.2	30%	0.299	23%	0.234	S	C	.	.			trans	74.9	1.6	177.9	0	0	0	0	0	115.1	V405 L407	V405-G409 PolarHBondContact O-N 2.94Å; L407-G409 VanDerWaalsContact C-N 3.25Å; L407-G409 PolarHBondContact O-N 2.91Å
410	R	72.1	Confident	81.1	Confident	69 Å²	69	47.3 Å²	47.3	26%	0.26	22%	0.224	S	C	.	.			trans	-118.9	139.8	175.9	40.8	161.2	-169.1	-175.2	9.1	109.3	A408 D412 I415 S633	A408-R410 HydrophobicContact CB-CG 4.06Å; A408-R410 PolarHBondContact O-N 3.25Å; R410-D412 VanDerWaalsContact C-N 3.29Å; R410-D412 WeakPolarHBondContact CD-OD2 3.37Å; R410-D412 PolarHBondContact O-N 3.34Å; R410-I415 HydrophobicContact CB-CD1 4.42Å; R410-I415 HydrophobicContact CG-CD1 3.5Å; R410-I415 VanDerWaalsContact CG-CD1 3.5Å; R410-I415 WeakPolarHBondContact O-CD1 3.24Å; R410-S633 PolarHBondContact NH2-OG 3.23Å
411	Y	67.6	Low	80.4	Confident	129 Å²	129	52.2 Å²	52.2	51%	0.506	25%	0.249	S	C	.	.			trans	-98.5	43	-174.9	-71.6	-92.7	0	0	0	111.3	V405 Q406	V405-Y411 HydrophobicContact CG1-CD1 3.72Å; V405-Y411 HydrophobicContact CG1-CE1 3.9Å; V405-Y411 HydrophobicContact CG1-CG 4.32Å; Q406-Y411 PolarHBondContact NE2-OH 3.45Å
412	D	70.8	Confident	80.1	Confident	75 Å²	75	53.1 Å²	53.1	40%	0.401	25%	0.254	S	S	.	.			trans	-85.2	131.9	-176	-57.8	-10.3	0	0	0	109.2	R410 F414 I415	R410-D412 VanDerWaalsContact C-N 3.29Å; R410-D412 WeakPolarHBondContact CD-OD2 3.37Å; R410-D412 PolarHBondContact O-N 3.34Å; D412-F414 HydrophobicContact CB-CB 4.38Å; D412-F414 PolarHBondContact O-N 2.93Å; D412-I415 PolarHBondContact O-N 3.43Å
413	A	68.7	Low	79.8	Confident	53 Å²	53	50.8 Å²	50.8	44%	0.438	26%	0.255	S	S	.	.	H	α-helix	trans	-53.8	-28.1	175.4	0	0	0	0	0	112.2	I415 W416 Y417	A413-I415 VanDerWaalsContact C-N 3.26Å; A413-I415 PolarHBondContact O-N 2.98Å; A413-W416 WeakPolarHBondContact O-CB 3.33Å; A413-W416 PolarHBondContact O-N 3.11Å; A413-W416 VanDerWaalsContact O-N 3.16Å; A413-Y417 HydrophobicContact CB-CD2 4.29Å; A413-Y417 HydrophobicContact CB-CE2 3.73Å; A413-Y417 WeakPolarHBondContact O-CD2 3.39Å; A413-Y417 VanDerWaalsContact O-CG 3.3Å; A413-Y417 PolarHBondContact O-N 3.17Å
414	F	78	Confident	79.3	Confident	116 Å²	116	53.3 Å²	53.3	51%	0.509	27%	0.266	S	S	.	.	H	α-helix	trans	-53.7	-37.4	174	-176.8	-105	0	0	0	113.8	D412 Y417 L418	D412-F414 HydrophobicContact CB-CB 4.38Å; D412-F414 PolarHBondContact O-N 2.93Å; F414-Y417 PolarHBondContact O-N 2.93Å; F414-L418 HydrophobicContact CE1-CD2 4.21Å; F414-L418 HydrophobicContact CZ-CD2 4.38Å; F414-L418 WeakPolarHBondContact O-CB 3.28Å; F414-L418 PolarHBondContact O-N 3.36Å
415	I	78.3	Confident	78.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-44.1	178.9	-66.8	164.4	0	0	0	110.5	C404 V405 A408 R410 D412 A413 Y417 L418 A419 P630	C404-I415 HydrophobicContact CB-CG2 4.02Å; V405-I415 HydrophobicContact CG2-CB 4.26Å; V405-I415 HydrophobicContact CG2-CG2 3.7Å; A408-I415 HydrophobicContact CB-CD1 3.47Å; A408-I415 VanDerWaalsContact CB-CD1 3.47Å; A408-I415 HydrophobicContact CB-CG1 4.42Å; R410-I415 HydrophobicContact CB-CD1 4.42Å; R410-I415 HydrophobicContact CG-CD1 3.5Å; R410-I415 VanDerWaalsContact CG-CD1 3.5Å; R410-I415 WeakPolarHBondContact O-CD1 3.24Å; D412-I415 PolarHBondContact O-N 3.43Å; A413-I415 VanDerWaalsContact C-N 3.26Å; A413-I415 PolarHBondContact O-N 2.98Å; I415-Y417 VanDerWaalsContact C-N 3.3Å; I415-Y417 PolarHBondContact O-N 3.01Å; I415-L418 PolarHBondContact O-N 3.5Å; I415-A419 VanDerWaalsContact O-CB 3.28Å; I415-A419 WeakPolarHBondContact O-CB 3.2Å; I415-A419 PolarHBondContact O-N 3.46Å; I415-P630 HydrophobicContact CG2-CB 3.83Å
416	W	73	Confident	78.7	Confident	89 Å²	89	58.5 Å²	58.5	34%	0.337	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-43.2	174.6	-76.4	110.4	0	0	0	111.3	G401 W402 V405 A413 A419 L420	G401-W416 VanDerWaalsContact C-CZ3 3.47Å; W402-W416 HydrophobicContact CB-CH2 3.91Å; V405-W416 HydrophobicContact CG2-CD2 4.03Å; V405-W416 HydrophobicContact CG2-CG 4.23Å; V405-W416 HydrophobicContact CG2-CZ2 4.08Å; A413-W416 WeakPolarHBondContact O-CB 3.33Å; A413-W416 PolarHBondContact O-N 3.11Å; A413-W416 VanDerWaalsContact O-N 3.16Å; W416-A419 PolarHBondContact O-N 3.36Å; W416-L420 HydrophobicContact CE3-CD1 3.5Å; W416-L420 HydrophobicContact CE3-CG 4.11Å; W416-L420 HydrophobicContact CZ3-CD1 3.78Å; W416-L420 WeakPolarHBondContact O-CB 3.41Å; W416-L420 PolarHBondContact O-N 2.91Å
417	Y	76.7	Confident	78.4	Confident	138 Å²	138	59.5 Å²	59.5	54%	0.541	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-45	177.1	-63	-40.9	0	0	0	112.4	A413 F414 I415 A419 L421	A413-Y417 HydrophobicContact CB-CD2 4.29Å; A413-Y417 HydrophobicContact CB-CE2 3.73Å; A413-Y417 WeakPolarHBondContact O-CD2 3.39Å; A413-Y417 VanDerWaalsContact O-CG 3.3Å; A413-Y417 PolarHBondContact O-N 3.17Å; F414-Y417 PolarHBondContact O-N 2.93Å; I415-Y417 VanDerWaalsContact C-N 3.3Å; I415-Y417 PolarHBondContact O-N 3.01Å; Y417-A419 VanDerWaalsContact C-N 3.3Å; Y417-A419 PolarHBondContact O-N 2.96Å; Y417-L421 HydrophobicContact CD1-CD1 3.31Å; Y417-L421 HydrophobicContact CD1-CG 4.02Å; Y417-L421 HydrophobicContact CE1-CD1 3.82Å; Y417-L421 HydrophobicContact CG-CD1 4.27Å; Y417-L421 CarbonylContact O-C 3.4Å; Y417-L421 WeakPolarHBondContact O-CA 3.5Å; Y417-L421 WeakPolarHBondContact O-CB 3.22Å; Y417-L421 PolarHBondContact O-N 3.5Å
418	L	79.2	Confident	78.1	Confident	43 Å²	43	59.8 Å²	59.8	23%	0.225	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-30.6	-179.4	-165.2	62.4	0	0	0	112.5	F414 I415 L629 P630	F414-L418 HydrophobicContact CE1-CD2 4.21Å; F414-L418 HydrophobicContact CZ-CD2 4.38Å; F414-L418 WeakPolarHBondContact O-CB 3.28Å; F414-L418 PolarHBondContact O-N 3.36Å; I415-L418 PolarHBondContact O-N 3.5Å; L418-L629 HydrophobicContact CD1-CD2 4.4Å; L418-L629 HydrophobicContact CD2-CB 4.47Å; L418-L629 HydrophobicContact CD2-CD2 4.14Å; L418-L629 HydrophobicContact CD2-CG 3.97Å; L418-P630 HydrophobicContact CB-CB 4.28Å; L418-P630 HydrophobicContact CB-CG 3.98Å; L418-P630 HydrophobicContact CD2-CB 4.38Å; L418-P630 HydrophobicContact CD2-CG 4.19Å; L418-P630 HydrophobicContact CG-CG 3.95Å
419	A	79.4	Confident	78	Confident	14 Å²	14	59.6 Å²	59.6	12%	0.116	30%	0.298	C	S	.	.	H	α-helix	trans	-78.8	-51.1	177.2	0	0	0	0	0	112.6	C404 I415 W416 Y417 T425 P630	C404-A419 HydrophobicContact CB-CB 4.39Å; I415-A419 VanDerWaalsContact O-CB 3.28Å; I415-A419 WeakPolarHBondContact O-CB 3.2Å; I415-A419 PolarHBondContact O-N 3.46Å; W416-A419 PolarHBondContact O-N 3.36Å; Y417-A419 VanDerWaalsContact C-N 3.3Å; Y417-A419 PolarHBondContact O-N 2.96Å; A419-T425 PolarHBondContact O-OG1 3.48Å; A419-P630 HydrophobicContact CB-CB 4.38Å; A419-P630 HydrophobicContact CB-CG 3.89Å
420	L	79.2	Confident	78.3	Confident	45 Å²	45	60.8 Å²	60.8	24%	0.236	30%	0.301	C	S	.	.	H	α-helix	trans	-98.9	-33.6	-169.6	-62.1	-177.1	0	0	0	114.4	D397 L398 W416 N422	D397-L420 HydrophobicContact CB-CD2 4.25Å; D397-L420 VanDerWaalsContact O-CD2 3.26Å; D397-L420 WeakPolarHBondContact O-CD2 3.36Å; L398-L420 HydrophobicContact CD2-CD1 4.01Å; W416-L420 HydrophobicContact CE3-CD1 3.5Å; W416-L420 HydrophobicContact CE3-CG 4.11Å; W416-L420 HydrophobicContact CZ3-CD1 3.78Å; W416-L420 WeakPolarHBondContact O-CB 3.41Å; W416-L420 PolarHBondContact O-N 2.91Å; L420-N422 VanDerWaalsContact C-N 3.31Å
421	L	78.4	Confident	78.6	Confident	110 Å²	110	60.5 Å²	60.5	58%	0.576	30%	0.3	S	S	*	.	S	Bend	trans	-94.4	15.7	-179.2	-60	-172	0	0	0	112.8	Y417 P423	Y417-L421 HydrophobicContact CD1-CD1 3.31Å; Y417-L421 HydrophobicContact CD1-CG 4.02Å; Y417-L421 HydrophobicContact CE1-CD1 3.82Å; Y417-L421 HydrophobicContact CG-CD1 4.27Å; Y417-L421 CarbonylContact O-C 3.4Å; Y417-L421 WeakPolarHBondContact O-CA 3.5Å; Y417-L421 WeakPolarHBondContact O-CB 3.22Å; Y417-L421 PolarHBondContact O-N 3.5Å; L421-P423 WeakPolarHBondContact O-CD 3.42Å
422	N	83.9	Confident	79.3	Confident	20 Å²	20	54.3 Å²	54.3	11%	0.107	28%	0.276	C	S	.	.			trans	-70	121	170.2	-179.1	-23.1	0	0	0	108.9	L420 F424 T425 M426	L420-N422 VanDerWaalsContact C-N 3.31Å; N422-F424 PolarHBondContact O-N 3.26Å; N422-F424 VanDerWaalsContact O-N 3.16Å; N422-F424 PolarHBondContact OD1-N 3.33Å; N422-T425 HydrophobicContact CB-CG2 4.2Å; N422-T425 WeakPolarHBondContact CB-OG1 3.32Å; N422-T425 PolarHBondContact O-N 3.02Å; N422-T425 VanDerWaalsContact O-N 3.15Å; N422-T425 PolarHBondContact O-OG1 3.35Å; N422-M426 PolarHBondContact O-N 3.24Å
423	P	83.5	Confident	80.1	Confident	75 Å²	75	51.3 Å²	51.3	49%	0.487	26%	0.26	S	S	.	.	H	α-helix	trans	-60.1	-30	-176.1	23.4	-33.7	0	0	0	112.8	L421 I427	L421-P423 WeakPolarHBondContact O-CD 3.42Å; P423-I427 VanDerWaalsContact O-CB 3.31Å; P423-I427 WeakPolarHBondContact O-CB 3.24Å; P423-I427 WeakPolarHBondContact O-CD1 3.46Å; P423-I427 WeakPolarHBondContact O-CG1 3.2Å; P423-I427 PolarHBondContact O-N 2.97Å
424	F	83	Confident	81.2	Confident	56 Å²	56	49 Å²	49	25%	0.246	24%	0.241	C	C	.	.	H	α-helix	trans	-68	-46.2	176.6	-78.5	-96.1	0	0	0	112.1	N422 I428 L626 W650 L651	N422-F424 PolarHBondContact O-N 3.26Å; N422-F424 VanDerWaalsContact O-N 3.16Å; N422-F424 PolarHBondContact OD1-N 3.33Å; F424-I428 WeakPolarHBondContact O-CB 3.45Å; F424-I428 WeakPolarHBondContact O-CD1 3.41Å; F424-I428 VanDerWaalsContact O-CG1 3.26Å; F424-I428 WeakPolarHBondContact O-CG1 3.3Å; F424-I428 PolarHBondContact O-N 3.45Å; F424-L626 HydrophobicContact CB-CD1 4.4Å; F424-W650 HydrophobicContact CD1-CH2 4.46Å; F424-W650 HydrophobicContact CD2-CH2 4.1Å; F424-W650 HydrophobicContact CD2-CZ3 4.1Å; F424-W650 HydrophobicContact CE1-CH2 4.13Å; F424-W650 AromaticContact CE2-CH2 3.76Å; F424-W650 HydrophobicContact CE2-CH2 3.76Å; F424-W650 AromaticContact CE2-CZ3 3.49Å; F424-W650 HydrophobicContact CE2-CZ3 3.49Å; F424-W650 VanDerWaalsContact CE2-CZ3 3.49Å; F424-W650 HydrophobicContact CG-CH2 4.44Å; F424-W650 AromaticContact CZ-CH2 3.77Å; F424-W650 HydrophobicContact CZ-CH2 3.77Å; F424-W650 AromaticContact CZ-CZ3 3.74Å; F424-W650 HydrophobicContact CZ-CZ3 3.74Å; F424-L651 HydrophobicContact CE2-CD2 3.94Å; F424-L651 HydrophobicContact CZ-CD2 4.41Å
425	T	84.2	Confident	81.8	Confident	10 Å²	10	43.7 Å²	43.7	6%	0.061	22%	0.218	C	C	.	.	H	α-helix	trans	-66.6	-49.1	-179.9	58.9	0	0	0	0	110.1	A419 N422 I427 I428 S429 V623	A419-T425 PolarHBondContact O-OG1 3.48Å; N422-T425 HydrophobicContact CB-CG2 4.2Å; N422-T425 WeakPolarHBondContact CB-OG1 3.32Å; N422-T425 PolarHBondContact O-N 3.02Å; N422-T425 VanDerWaalsContact O-N 3.15Å; N422-T425 PolarHBondContact O-OG1 3.35Å; T425-I427 PolarHBondContact O-N 2.82Å; T425-I428 PolarHBondContact O-N 3.06Å; T425-S429 WeakPolarHBondContact O-CB 3.33Å; T425-S429 PolarHBondContact O-N 2.89Å; T425-S429 PolarHBondContact O-OG 3.36Å; T425-V623 HydrophobicContact CG2-CG1 4.31Å
426	M	83.4	Confident	82.4	Confident	103 Å²	103	43.8 Å²	43.8	51%	0.507	22%	0.218	S	C	.	.	H	α-helix	trans	-57.3	-45.7	179.7	-172.6	176.6	67	0	0	112.4	N422 S430	N422-M426 PolarHBondContact O-N 3.24Å; M426-S430 WeakPolarHBondContact O-CB 3.27Å; M426-S430 PolarHBondContact O-N 2.73Å; M426-S430 PolarHBondContact O-OG 3.47Å; M426-S430 VanDerWaalsContact O-OG 3.14Å
427	I	81.6	Confident	83.4	Confident	68 Å²	68	40.3 Å²	40.3	35%	0.349	21%	0.206	S	C	.	.	H	α-helix	trans	-69	-44.3	-179.4	-63.1	168.8	0	0	0	110.4	F342 P423 T425 S429 S430 R431	F342-I427 HydrophobicContact CE1-CG2 4.11Å; F342-I427 HydrophobicContact CZ-CG2 4.17Å; P423-I427 VanDerWaalsContact O-CB 3.31Å; P423-I427 WeakPolarHBondContact O-CB 3.24Å; P423-I427 WeakPolarHBondContact O-CD1 3.46Å; P423-I427 WeakPolarHBondContact O-CG1 3.2Å; P423-I427 PolarHBondContact O-N 2.97Å; T425-I427 PolarHBondContact O-N 2.82Å; I427-S429 PolarHBondContact O-N 3.28Å; I427-S430 WeakPolarHBondContact CA-OG 3.34Å; I427-S430 PolarHBondContact O-N 3.39Å; I427-S430 PolarHBondContact O-OG 2.91Å; I427-R431 VanDerWaalsContact O-CG 3.32Å; I427-R431 WeakPolarHBondContact O-CG 3.42Å; I427-R431 PolarHBondContact O-N 3.5Å; I427-R431 PolarHBondContact O-NE 2.98Å
428	I	82	Confident	84.3	Confident	6 Å²	6	33.9 Å²	33.9	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-41.8	-180	-71.1	167.1	0	0	0	111.4	F424 T425 R431 N433 E435 V623	F424-I428 WeakPolarHBondContact O-CB 3.45Å; F424-I428 WeakPolarHBondContact O-CD1 3.41Å; F424-I428 VanDerWaalsContact O-CG1 3.26Å; F424-I428 WeakPolarHBondContact O-CG1 3.3Å; F424-I428 PolarHBondContact O-N 3.45Å; T425-I428 PolarHBondContact O-N 3.06Å; I428-R431 PolarHBondContact O-N 2.69Å; I428-N433 HydrophobicContact CG2-CB 3.7Å; I428-N433 WeakPolarHBondContact O-CB 3.07Å; I428-N433 PolarHBondContact O-N 3.12Å; I428-E435 HydrophobicContact CG2-CG 4.45Å; I428-V623 HydrophobicContact CD1-CG2 3.41Å; I428-V623 VanDerWaalsContact CD1-CG2 3.41Å
429	S	81.4	Confident	85	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-69.9	-39.2	178.7	-58	0	0	0	0	112.8	D397 T425 I427 R431 G432 P436	D397-S429 WeakPolarHBondContact OD2-CB 3.26Å; D397-S429 PolarHBondContact OD2-OG 3.43Å; T425-S429 WeakPolarHBondContact O-CB 3.33Å; T425-S429 PolarHBondContact O-N 2.89Å; T425-S429 PolarHBondContact O-OG 3.36Å; I427-S429 PolarHBondContact O-N 3.28Å; S429-R431 PolarHBondContact O-N 3.5Å; S429-G432 PolarHBondContact O-N 3.17Å; S429-P436 WeakPolarHBondContact OG-CG 3.49Å
430	S	79	Confident	85.8	Confident	54 Å²	54	31.6 Å²	31.6	38%	0.378	17%	0.168	S	C	.	.	H	α-helix	trans	-62.1	-27.9	177.4	68.7	0	0	0	0	113.3	M426 I427 G432	M426-S430 WeakPolarHBondContact O-CB 3.27Å; M426-S430 PolarHBondContact O-N 2.73Å; M426-S430 PolarHBondContact O-OG 3.47Å; M426-S430 VanDerWaalsContact O-OG 3.14Å; I427-S430 WeakPolarHBondContact CA-OG 3.34Å; I427-S430 PolarHBondContact O-N 3.39Å; I427-S430 PolarHBondContact O-OG 2.91Å; S430-G432 PolarHBondContact O-N 2.97Å
431	R	80.3	Confident	86.7	Confident	63 Å²	63	30.9 Å²	30.9	24%	0.238	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-14.9	174.3	-64.6	171.7	-149.8	171.2	0.5	113.5	F342 K390 I427 I428 S429	F342-R431 HydrophobicContact CD1-CG 4.09Å; F342-R431 VanDerWaalsContact CD1-NE 3.32Å; F342-R431 HydrophobicContact CD2-CG 3.94Å; F342-R431 HydrophobicContact CE1-CG 3.97Å; F342-R431 HydrophobicContact CE2-CG 3.77Å; F342-R431 HydrophobicContact CG-CG 4.09Å; F342-R431 HydrophobicContact CZ-CG 3.79Å; K390-R431 WeakPolarHBondContact CE-O 3.38Å; I427-R431 VanDerWaalsContact O-CG 3.32Å; I427-R431 WeakPolarHBondContact O-CG 3.42Å; I427-R431 PolarHBondContact O-N 3.5Å; I427-R431 PolarHBondContact O-NE 2.98Å; I428-R431 PolarHBondContact O-N 2.69Å; S429-R431 PolarHBondContact O-N 3.5Å
432	G	82.3	Confident	87.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	22.2	-175.4	0	0	0	0	0	114.8	Y347 M350 F393 S429 S430	Y347-G432 WeakPolarHBondContact CD2-O 3.42Å; M350-G432 WeakPolarHBondContact CE-O 3.5Å; F393-G432 WeakPolarHBondContact CD2-O 3.47Å; F393-G432 WeakPolarHBondContact CE2-O 3.29Å; S429-G432 PolarHBondContact O-N 3.17Å; S430-G432 PolarHBondContact O-N 2.97Å
433	N	87.3	Confident	88.2	Confident	11 Å²	11	24.8 Å²	24.8	6%	0.059	13%	0.132	C	C	.	.			trans	-68.6	145.1	171.9	-161.8	-30.6	0	0	0	110.4	F393 I428 E435 P436 Q620	F393-N433 WeakPolarHBondContact CD2-O 3.37Å; F393-N433 WeakPolarHBondContact CG-O 3.35Å; I428-N433 HydrophobicContact CG2-CB 3.7Å; I428-N433 WeakPolarHBondContact O-CB 3.07Å; I428-N433 PolarHBondContact O-N 3.12Å; N433-E435 VanDerWaalsContact C-N 3.29Å; N433-E435 PolarHBondContact O-N 3.36Å; N433-E435 WeakPolarHBondContact OD1-CG 3.2Å; N433-E435 PolarHBondContact OD1-N 3.04Å; N433-P436 VanDerWaalsContact O-CD 3.27Å; N433-P436 WeakPolarHBondContact O-CD 3.3Å; N433-Q620 VanDerWaalsContact ND2-CD 3.32Å; N433-Q620 PolarHBondContact ND2-NE2 3.23Å
434	A	90.2	Very high	88.9	Confident	4 Å²	4	23.9 Å²	23.9	3%	0.033	12%	0.123	C	C	.	.	S	Bend	trans	-82	0.2	179	0	0	0	0	0	114	M350 F375 F393 P436 L437	M350-A434 HydrophobicContact CE-CB 4.31Å; M350-A434 HydrophobicContact SD-CB 4.17Å; F375-A434 HydrophobicContact CD2-CB 4.35Å; F375-A434 HydrophobicContact CE1-CB 4.09Å; F375-A434 HydrophobicContact CE2-CB 3.69Å; F375-A434 HydrophobicContact CZ-CB 3.52Å; F393-A434 HydrophobicContact CD1-CB 4.3Å; F393-A434 HydrophobicContact CE1-CB 3.72Å; F393-A434 HydrophobicContact CE2-CB 4.05Å; F393-A434 HydrophobicContact CZ-CB 3.58Å; A434-P436 VanDerWaalsContact C-N 3.3Å; A434-L437 WeakPolarHBondContact O-CB 3.32Å; A434-L437 PolarHBondContact O-N 2.93Å; A434-L437 VanDerWaalsContact O-N 3.09Å
435	E	90.8	Very high	89.6	Confident	5 Å²	5	21.2 Å²	21.2	2%	0.023	11%	0.111	C	C	.	.	H	α-helix	trans	-49.2	-40.2	176.9	-65.8	-54.7	143.6	0	0	114.4	I428 N433 L437 L438 T439 K470 W624	I428-E435 HydrophobicContact CG2-CG 4.45Å; N433-E435 VanDerWaalsContact C-N 3.29Å; N433-E435 PolarHBondContact O-N 3.36Å; N433-E435 WeakPolarHBondContact OD1-CG 3.2Å; N433-E435 PolarHBondContact OD1-N 3.04Å; E435-L437 VanDerWaalsContact C-N 3.27Å; E435-L437 PolarHBondContact O-N 3.1Å; E435-L438 WeakPolarHBondContact O-CA 3.28Å; E435-L438 WeakPolarHBondContact O-CB 3.06Å; E435-L438 PolarHBondContact O-N 3.49Å; E435-T439 PolarHBondContact O-N 3.16Å; E435-T439 PolarHBondContact O-OG1 2.94Å; E435-K470 IonicContact OE1-NZ 2.83Å; E435-K470 PolarHBondContact OE1-NZ 3.18Å; E435-K470 IonicContact OE2-NZ 2.79Å; E435-W624 PolarHBondContact OE2-NE1 3.45Å
436	P	91.8	Very high	90.2	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.013	11%	0.108	C	C	.	.	H	α-helix	trans	-56.1	-36	177	-32.5	41.1	0	0	0	115	F393 F396 D397 S429 N433 A434 T439 C440	F393-P436 HydrophobicContact CB-CB 4.45Å; F393-P436 HydrophobicContact CB-CG 4.33Å; F393-P436 WeakPolarHBondContact O-CB 3.47Å; F396-P436 HydrophobicContact CB-CB 3.99Å; D397-P436 WeakPolarHBondContact OD1-CB 3.22Å; D397-P436 WeakPolarHBondContact OD1-CG 3.46Å; D397-P436 WeakPolarHBondContact OD2-CG 3.33Å; S429-P436 WeakPolarHBondContact OG-CG 3.49Å; N433-P436 VanDerWaalsContact O-CD 3.27Å; N433-P436 WeakPolarHBondContact O-CD 3.3Å; A434-P436 VanDerWaalsContact C-N 3.3Å; P436-T439 VanDerWaalsContact C-OG1 3.31Å; P436-T439 VanDerWaalsContact CA-OG1 3.22Å; P436-T439 WeakPolarHBondContact CA-OG1 3.43Å; P436-T439 PolarHBondContact O-OG1 3.48Å; P436-C440 WeakPolarHBondContact O-CB 3.2Å; P436-C440 PolarHBondContact O-N 2.87Å
437	L	94.5	Very high	90.8	Very high	17 Å²	17	17.2 Å²	17.2	9%	0.089	9%	0.09	C	C	.	.	H	α-helix	trans	-66.8	-42	175.9	168.7	56.6	0	0	0	110.3	F375 L378 F393 F396 A434 E435 C440 L441	F375-L437 HydrophobicContact CD1-CD2 4.5Å; F375-L437 HydrophobicContact CE1-CD2 3.69Å; L378-L437 HydrophobicContact CD2-CD2 3.98Å; F393-L437 HydrophobicContact CD1-CB 4.46Å; F396-L437 HydrophobicContact CD1-CD1 3.98Å; F396-L437 HydrophobicContact CD2-CB 3.96Å; F396-L437 HydrophobicContact CD2-CD1 4.16Å; F396-L437 HydrophobicContact CE1-CD1 3.66Å; F396-L437 HydrophobicContact CE2-CB 4.33Å; F396-L437 HydrophobicContact CE2-CD1 3.84Å; F396-L437 HydrophobicContact CE2-CD2 4.48Å; F396-L437 HydrophobicContact CE2-CG 4.45Å; F396-L437 HydrophobicContact CG-CB 4.17Å; F396-L437 HydrophobicContact CG-CD1 4.23Å; F396-L437 HydrophobicContact CZ-CD1 3.59Å; A434-L437 WeakPolarHBondContact O-CB 3.32Å; A434-L437 PolarHBondContact O-N 2.93Å; A434-L437 VanDerWaalsContact O-N 3.09Å; E435-L437 VanDerWaalsContact C-N 3.27Å; E435-L437 PolarHBondContact O-N 3.1Å; L437-C440 PolarHBondContact O-N 3.37Å; L437-L441 HydrophobicContact CD1-CD1 4.11Å; L437-L441 HydrophobicContact CD1-CG 4.15Å; L437-L441 HydrophobicContact CG-CD1 4.39Å; L437-L441 VanDerWaalsContact O-CG 3.31Å; L437-L441 WeakPolarHBondContact O-CG 3.05Å; L437-L441 PolarHBondContact O-N 3.26Å
438	L	94.9	Very high	91.4	Very high	3 Å²	3	14.6 Å²	14.6	2%	0.016	8%	0.077	C	C	.	.	H	α-helix	trans	-68	-42.4	179.3	-179.3	58.3	0	0	0	112.3	E435 C440 L441 T442 V469 K470 Y472 P473	E435-L438 WeakPolarHBondContact O-CA 3.28Å; E435-L438 WeakPolarHBondContact O-CB 3.06Å; E435-L438 PolarHBondContact O-N 3.49Å; L438-C440 VanDerWaalsContact C-N 3.33Å; L438-L441 PolarHBondContact O-N 3.04Å; L438-T442 WeakPolarHBondContact O-CG2 3.34Å; L438-T442 PolarHBondContact O-N 3.48Å; L438-T442 PolarHBondContact O-OG1 3.04Å; L438-T442 VanDerWaalsContact O-OG1 3.1Å; L438-V469 HydrophobicContact CD1-CG1 4.35Å; L438-K470 HydrophobicContact CD1-CB 4.06Å; L438-K470 HydrophobicContact CD2-CB 3.52Å; L438-K470 HydrophobicContact CD2-CD 3.36Å; L438-K470 HydrophobicContact CD2-CG 4.01Å; L438-K470 HydrophobicContact CG-CB 4.45Å; L438-Y472 HydrophobicContact CD1-CE1 4.1Å; L438-Y472 HydrophobicContact CD2-CD1 3.99Å; L438-Y472 HydrophobicContact CD2-CE1 3.46Å; L438-Y472 VanDerWaalsContact CD2-CE1 3.46Å; L438-Y472 HydrophobicContact CG-CE1 3.77Å; L438-P473 HydrophobicContact CD1-CG 3.98Å
439	T	94.2	Very high	92	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-64.3	-39.1	173.9	53.9	0	0	0	0	111.9	E435 P436 T442 L443 V623 T627	E435-T439 PolarHBondContact O-N 3.16Å; E435-T439 PolarHBondContact O-OG1 2.94Å; P436-T439 VanDerWaalsContact C-OG1 3.31Å; P436-T439 VanDerWaalsContact CA-OG1 3.22Å; P436-T439 WeakPolarHBondContact CA-OG1 3.43Å; P436-T439 PolarHBondContact O-OG1 3.48Å; T439-T442 WeakPolarHBondContact CA-OG1 3.31Å; T439-T442 PolarHBondContact O-N 2.78Å; T439-T442 PolarHBondContact O-OG1 3.43Å; T439-L443 WeakPolarHBondContact O-CB 3.3Å; T439-L443 WeakPolarHBondContact O-CG 3.48Å; T439-L443 PolarHBondContact O-N 2.7Å; T439-V623 HydrophobicContact CG2-CG1 3.83Å; T439-T627 HydrophobicContact CG2-CG2 4.33Å; T439-T627 WeakPolarHBondContact CG2-OG1 3.38Å
440	C	96	Very high	92.3	Very high	7 Å²	7	16 Å²	16	5%	0.047	9%	0.085	C	C	.	.	H	α-helix	trans	-62	-45.5	174.3	-176.7	0	0	0	0	111.4	F396 T400 P436 L437 L438 L444	F396-C440 HydrophobicContact CB-CB 4.3Å; F396-C440 HydrophobicContact CD1-CB 4.03Å; T400-C440 WeakPolarHBondContact OG1-CA 3.39Å; T400-C440 WeakPolarHBondContact OG1-CB 3.37Å; T400-C440 PolarHBondContact OG1-N 2.67Å; P436-C440 WeakPolarHBondContact O-CB 3.2Å; P436-C440 PolarHBondContact O-N 2.87Å; L437-C440 PolarHBondContact O-N 3.37Å; L438-C440 VanDerWaalsContact C-N 3.33Å; C440-L444 WeakPolarHBondContact O-CB 3.4Å; C440-L444 PolarHBondContact O-N 3.46Å
441	L	97.8	Very high	92.7	Very high	31 Å²	31	17.3 Å²	17.3	16%	0.162	8%	0.082	C	C	.	.	H	α-helix	trans	-64.7	-41.8	179	-71.2	172.8	0	0	0	112	L437 L438 L444 A445 V462 A466 V469	L437-L441 HydrophobicContact CD1-CD1 4.11Å; L437-L441 HydrophobicContact CD1-CG 4.15Å; L437-L441 HydrophobicContact CG-CD1 4.39Å; L437-L441 VanDerWaalsContact O-CG 3.31Å; L437-L441 WeakPolarHBondContact O-CG 3.05Å; L437-L441 PolarHBondContact O-N 3.26Å; L438-L441 PolarHBondContact O-N 3.04Å; L441-L444 PolarHBondContact O-N 3.43Å; L441-A445 WeakPolarHBondContact O-CB 3.38Å; L441-A445 PolarHBondContact O-N 3.18Å; L441-V462 HydrophobicContact CB-CG1 4.46Å; L441-V462 HydrophobicContact CD2-CG1 4.1Å; L441-V462 VanDerWaalsContact O-CG1 3.28Å; L441-V462 WeakPolarHBondContact O-CG1 3.09Å; L441-A466 HydrophobicContact CB-CB 3.9Å; L441-V469 HydrophobicContact CD1-CG2 3.99Å
442	T	97.4	Very high	92.9	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.006	9%	0.092	C	C	.	.	H	α-helix	trans	-66.4	-46.8	177.9	52.8	0	0	0	0	111.6	L438 T439 L444 A445 L446 A466 P473 Y476 W603	L438-T442 WeakPolarHBondContact O-CG2 3.34Å; L438-T442 PolarHBondContact O-N 3.48Å; L438-T442 PolarHBondContact O-OG1 3.04Å; L438-T442 VanDerWaalsContact O-OG1 3.1Å; T439-T442 WeakPolarHBondContact CA-OG1 3.31Å; T439-T442 PolarHBondContact O-N 2.78Å; T439-T442 PolarHBondContact O-OG1 3.43Å; T442-L444 VanDerWaalsContact C-N 3.32Å; T442-L444 PolarHBondContact O-N 3.29Å; T442-A445 PolarHBondContact O-N 3.31Å; T442-L446 PolarHBondContact O-N 3.34Å; T442-A466 HydrophobicContact CG2-CB 4.4Å; T442-P473 HydrophobicContact CG2-CB 4.12Å; T442-P473 HydrophobicContact CG2-CG 3.88Å; T442-Y476 HydrophobicContact CG2-CE2 3.98Å; T442-W603 VanDerWaalsContact O-CZ3 3.28Å; T442-W603 WeakPolarHBondContact O-CZ3 3.5Å
443	L	97.2	Very high	92.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.8	-35.4	174.4	-72	-170.6	0	0	0	113.1	T400 L403 C404 L407 T439 L446 F447 T627 F628	T400-L443 HydrophobicContact CG2-CD1 3.54Å; L403-L443 HydrophobicContact CB-CB 4.01Å; L403-L443 HydrophobicContact CB-CD1 4.1Å; L403-L443 HydrophobicContact CD1-CB 3.94Å; C404-L443 WeakPolarHBondContact SG-CD1 3.47Å; L407-L443 HydrophobicContact CD1-CB 4.38Å; L407-L443 HydrophobicContact CD1-CD2 3.95Å; T439-L443 WeakPolarHBondContact O-CB 3.3Å; T439-L443 WeakPolarHBondContact O-CG 3.48Å; T439-L443 PolarHBondContact O-N 2.7Å; L443-L446 HydrophobicContact CD2-CD2 4.45Å; L443-L446 PolarHBondContact O-N 3.21Å; L443-F447 VanDerWaalsContact O-CB 3.31Å; L443-F447 WeakPolarHBondContact O-CB 3.43Å; L443-F447 PolarHBondContact O-N 3.23Å; L443-T627 HydrophobicContact CD1-CG2 3.59Å; L443-T627 HydrophobicContact CD2-CG2 4.19Å; L443-T627 HydrophobicContact CG-CG2 3.84Å; L443-F628 HydrophobicContact CD2-CD1 3.66Å; L443-F628 HydrophobicContact CD2-CE1 3.62Å
444	L	97.7	Very high	92.3	Very high	56 Å²	56	29.2 Å²	29.2	29%	0.293	14%	0.136	S	C	.	.	H	α-helix	trans	-66.2	-43.1	177	179.4	61.6	0	0	0	110.9	L403 C440 L441 T442 F447 L448 V462	L403-L444 HydrophobicContact CD1-CB 3.99Å; L403-L444 HydrophobicContact CD2-CD1 4.17Å; C440-L444 WeakPolarHBondContact O-CB 3.4Å; C440-L444 PolarHBondContact O-N 3.46Å; L441-L444 PolarHBondContact O-N 3.43Å; T442-L444 VanDerWaalsContact C-N 3.32Å; T442-L444 PolarHBondContact O-N 3.29Å; L444-F447 PolarHBondContact O-N 3.15Å; L444-L448 HydrophobicContact CD1-CD1 4.35Å; L444-L448 HydrophobicContact CD1-CG 4.43Å; L444-L448 HydrophobicContact CG-CD1 4.18Å; L444-L448 WeakPolarHBondContact O-CB 3.26Å; L444-L448 VanDerWaalsContact O-CG 3.25Å; L444-L448 WeakPolarHBondContact O-CG 3.38Å; L444-L448 PolarHBondContact O-N 3.17Å; L444-V462 HydrophobicContact CB-CG1 4.17Å; L444-V462 HydrophobicContact CD2-CG1 4.08Å; L444-V462 HydrophobicContact CD2-CG2 4.16Å; L444-V462 HydrophobicContact CG-CG1 4.12Å; L444-V462 HydrophobicContact CG-CG2 4.42Å
445	A	97.9	Very high	92.2	Very high	0 Å²	0	36 Å²	36	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-47.3	173.5	0	0	0	0	0	111	L441 T442 F447 L448 F449 V462 L463 W603	L441-A445 WeakPolarHBondContact O-CB 3.38Å; L441-A445 PolarHBondContact O-N 3.18Å; T442-A445 PolarHBondContact O-N 3.31Å; A445-F447 PolarHBondContact O-N 3.47Å; A445-L448 PolarHBondContact O-N 2.77Å; A445-F449 HydrophobicContact CB-CE2 4.42Å; A445-F449 WeakPolarHBondContact O-CD2 3.47Å; A445-F449 PolarHBondContact O-N 3.34Å; A445-V462 HydrophobicContact CB-CB 4.28Å; A445-V462 HydrophobicContact CB-CG1 4.01Å; A445-L463 HydrophobicContact CB-CB 4.15Å; A445-W603 HydrophobicContact CB-CH2 4.02Å; A445-W603 HydrophobicContact CB-CZ3 4.43Å
446	L	97.2	Very high	92.1	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-48.3	176.4	-178.5	59.7	0	0	0	111.7	L407 T442 L443 L448 F449 V450 L599 E600 W603 F628	L407-L446 HydrophobicContact CD1-CB 4.43Å; L407-L446 HydrophobicContact CD1-CD2 3.96Å; L407-L446 HydrophobicContact CD1-CG 4.19Å; L407-L446 HydrophobicContact CD2-CG 4.17Å; T442-L446 PolarHBondContact O-N 3.34Å; L443-L446 HydrophobicContact CD2-CD2 4.45Å; L443-L446 PolarHBondContact O-N 3.21Å; L446-L448 VanDerWaalsContact C-N 3.29Å; L446-L448 PolarHBondContact O-N 3.1Å; L446-F449 PolarHBondContact O-N 3.3Å; L446-V450 HydrophobicContact CD1-CG2 3.74Å; L446-V450 HydrophobicContact CG-CG2 4.27Å; L446-V450 WeakPolarHBondContact O-CB 3.37Å; L446-V450 VanDerWaalsContact O-CG2 3.32Å; L446-V450 WeakPolarHBondContact O-CG2 3.22Å; L446-V450 PolarHBondContact O-N 3.44Å; L446-L599 HydrophobicContact CD1-CB 4.23Å; L446-L599 HydrophobicContact CD1-CD2 3.96Å; L446-L599 HydrophobicContact CD1-CG 3.8Å; L446-E600 HydrophobicContact CD1-CG 4.32Å; L446-E600 HydrophobicContact CD2-CB 4.27Å; L446-E600 HydrophobicContact CD2-CG 4.04Å; L446-E600 HydrophobicContact CG-CG 4.3Å; L446-W603 HydrophobicContact CB-CD2 4.44Å; L446-W603 HydrophobicContact CB-CE3 3.84Å; L446-W603 HydrophobicContact CB-CH2 4.18Å; L446-W603 HydrophobicContact CB-CZ3 3.71Å; L446-W603 HydrophobicContact CD1-CD2 3.87Å; L446-W603 HydrophobicContact CD1-CE3 4.12Å; L446-W603 HydrophobicContact CD1-CG 4.16Å; L446-W603 HydrophobicContact CD2-CE3 4.28Å; L446-W603 HydrophobicContact CG-CE3 4.3Å; L446-F628 HydrophobicContact CD2-CD1 3.92Å; L446-F628 HydrophobicContact CD2-CE1 3.72Å
447	F	95	Very high	92.1	Very high	30 Å²	30	43.3 Å²	43.3	13%	0.132	19%	0.19	C	C	.	.	H	α-helix	trans	-56.8	-42.1	176.4	175.4	-94.5	0	0	0	112	L403 Q406 L407 L443 L444 A445 R451 K452	L403-F447 HydrophobicContact CD2-CB 4.15Å; L403-F447 HydrophobicContact CD2-CG 4.22Å; Q406-F447 HydrophobicContact CB-CD2 4.05Å; Q406-F447 HydrophobicContact CB-CE2 3.74Å; L407-F447 HydrophobicContact CD1-CB 4.43Å; L407-F447 HydrophobicContact CD2-CB 4.06Å; L407-F447 HydrophobicContact CD2-CD2 4.29Å; L407-F447 HydrophobicContact CG-CB 4.17Å; L407-F447 HydrophobicContact CG-CD2 4.28Å; L443-F447 VanDerWaalsContact O-CB 3.31Å; L443-F447 WeakPolarHBondContact O-CB 3.43Å; L443-F447 PolarHBondContact O-N 3.23Å; L444-F447 PolarHBondContact O-N 3.15Å; A445-F447 PolarHBondContact O-N 3.47Å; F447-R451 HydrophobicContact CD2-CB 3.97Å; F447-R451 HydrophobicContact CD2-CG 3.63Å; F447-R451 HydrophobicContact CE2-CB 3.72Å; F447-R451 HydrophobicContact CE2-CG 3.62Å; F447-R451 HydrophobicContact CG-CB 4.46Å; F447-R451 HydrophobicContact CG-CG 4.44Å; F447-R451 HydrophobicContact CZ-CB 4.03Å; F447-R451 HydrophobicContact CZ-CG 4.43Å; F447-R451 WeakPolarHBondContact O-CA 3.13Å; F447-R451 VanDerWaalsContact O-CB 3.27Å; F447-R451 WeakPolarHBondContact O-CB 3.37Å; F447-R451 PolarHBondContact O-N 2.8Å; F447-K452 HydrophobicContact CE1-CG 4.18Å
448	L	95.5	Very high	92.2	Very high	12 Å²	12	45.4 Å²	45.4	6%	0.063	20%	0.2	C	C	.	.	H	α-helix	trans	-67.1	-41.2	178	-70.7	168	0	0	0	112.1	L444 A445 L446 K452 L458 V462	L444-L448 HydrophobicContact CD1-CD1 4.35Å; L444-L448 HydrophobicContact CD1-CG 4.43Å; L444-L448 HydrophobicContact CG-CD1 4.18Å; L444-L448 WeakPolarHBondContact O-CB 3.26Å; L444-L448 VanDerWaalsContact O-CG 3.25Å; L444-L448 WeakPolarHBondContact O-CG 3.38Å; L444-L448 PolarHBondContact O-N 3.17Å; A445-L448 PolarHBondContact O-N 2.77Å; L446-L448 VanDerWaalsContact C-N 3.29Å; L446-L448 PolarHBondContact O-N 3.1Å; L448-K452 HydrophobicContact CD2-CB 4.17Å; L448-K452 HydrophobicContact CD2-CG 4.39Å; L448-K452 CarbonylContact O-C 3.39Å; L448-K452 WeakPolarHBondContact O-CA 2.97Å; L448-K452 PolarHBondContact O-N 3.14Å; L448-K452 VanDerWaalsContact O-N 3.15Å; L448-K452 VanDerWaalsContact O-O 3.08Å; L448-L458 HydrophobicContact CD1-CB 4.27Å; L448-L458 HydrophobicContact CD1-CD2 4.13Å; L448-L458 HydrophobicContact CD1-CG 3.87Å; L448-L458 HydrophobicContact CD2-CD2 3.99Å; L448-L458 HydrophobicContact CD2-CG 4.5Å; L448-V462 HydrophobicContact CD1-CB 4.47Å; L448-V462 HydrophobicContact CD1-CG2 3.87Å
449	F	93.6	Very high	92.2	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-67	-43.8	176.9	-72	-54.3	0	0	0	112.9	A445 L446 A456 A460 L463 V480 T512 L599 W603	A445-F449 HydrophobicContact CB-CE2 4.42Å; A445-F449 WeakPolarHBondContact O-CD2 3.47Å; A445-F449 PolarHBondContact O-N 3.34Å; L446-F449 PolarHBondContact O-N 3.3Å; F449-A456 HydrophobicContact CD1-CB 4.24Å; F449-A456 HydrophobicContact CE1-CB 4.38Å; F449-A456 WeakPolarHBondContact CE1-O 3.45Å; F449-A460 HydrophobicContact CZ-CB 4.23Å; F449-A460 VanDerWaalsContact CZ-N 3.33Å; F449-L463 HydrophobicContact CE2-CB 4.49Å; F449-L463 HydrophobicContact CE2-CD2 4.3Å; F449-V480 HydrophobicContact CD1-CG1 4.33Å; F449-V480 HydrophobicContact CD2-CG2 3.98Å; F449-V480 HydrophobicContact CE1-CG1 3.72Å; F449-V480 HydrophobicContact CE2-CG1 4.08Å; F449-V480 HydrophobicContact CE2-CG2 3.63Å; F449-V480 HydrophobicContact CZ-CB 4.48Å; F449-V480 HydrophobicContact CZ-CG1 3.56Å; F449-V480 HydrophobicContact CZ-CG2 4Å; F449-T512 HydrophobicContact CE1-CG2 3.78Å; F449-T512 HydrophobicContact CZ-CG2 4.31Å; F449-L599 HydrophobicContact CB-CD2 3.87Å; F449-W603 HydrophobicContact CD2-CH2 4.26Å; F449-W603 HydrophobicContact CD2-CZ2 4.09Å; F449-W603 HydrophobicContact CE2-CH2 4.42Å; F449-W603 HydrophobicContact CE2-CZ2 4.35Å
450	V	88.7	Confident	92.4	Very high	38 Å²	38	45.2 Å²	45.2	23%	0.23	20%	0.2	C	C	.	.	H	α-helix	trans	-78	-55.4	-176.3	174.2	0	0	0	0	111.3	L407 L446 L599 E600	L407-V450 HydrophobicContact CD2-CB 4.42Å; L446-V450 HydrophobicContact CD1-CG2 3.74Å; L446-V450 HydrophobicContact CG-CG2 4.27Å; L446-V450 WeakPolarHBondContact O-CB 3.37Å; L446-V450 VanDerWaalsContact O-CG2 3.32Å; L446-V450 WeakPolarHBondContact O-CG2 3.22Å; L446-V450 PolarHBondContact O-N 3.44Å; V450-L599 HydrophobicContact CG2-CB 4.06Å; V450-L599 HydrophobicContact CG2-CD2 4.17Å; V450-E600 VanDerWaalsContact CG1-OE1 3.24Å; V450-E600 WeakPolarHBondContact CG1-OE1 3.32Å; V450-E600 HydrophobicContact CG2-CG 4.19Å
451	R	85.7	Confident	92.5	Very high	82 Å²	82	46 Å²	46	31%	0.309	21%	0.207	S	C	.	.	H	α-helix	trans	-93	-26.1	-168.4	-57.5	-63.2	-173.4	143.4	-0.9	113.4	Q406 L407 F447	Q406-R451 PolarHBondContact O-NH2 3.35Å; L407-R451 PolarHBondContact O-NH2 3.34Å; F447-R451 HydrophobicContact CD2-CB 3.97Å; F447-R451 HydrophobicContact CD2-CG 3.63Å; F447-R451 HydrophobicContact CE2-CB 3.72Å; F447-R451 HydrophobicContact CE2-CG 3.62Å; F447-R451 HydrophobicContact CG-CB 4.46Å; F447-R451 HydrophobicContact CG-CG 4.44Å; F447-R451 HydrophobicContact CZ-CB 4.03Å; F447-R451 HydrophobicContact CZ-CG 4.43Å; F447-R451 WeakPolarHBondContact O-CA 3.13Å; F447-R451 VanDerWaalsContact O-CB 3.27Å; F447-R451 WeakPolarHBondContact O-CB 3.37Å; F447-R451 PolarHBondContact O-N 2.8Å
452	K	85.4	Confident	92.5	Very high	101 Å²	101	45.5 Å²	45.5	44%	0.439	21%	0.205	S	C	.	.			trans	-122.9	53.7	-177.5	-61.4	-65	-175.5	-173.4	0	111.7	F447 L448 Q454 R455 A456	F447-K452 HydrophobicContact CE1-CG 4.18Å; L448-K452 HydrophobicContact CD2-CB 4.17Å; L448-K452 HydrophobicContact CD2-CG 4.39Å; L448-K452 CarbonylContact O-C 3.39Å; L448-K452 WeakPolarHBondContact O-CA 2.97Å; L448-K452 PolarHBondContact O-N 3.14Å; L448-K452 VanDerWaalsContact O-N 3.15Å; L448-K452 VanDerWaalsContact O-O 3.08Å; K452-Q454 PolarHBondContact O-N 2.94Å; K452-R455 HydrophobicContact CB-CB 4.23Å; K452-R455 CarbonylContact O-C 3.54Å; K452-R455 VanDerWaalsContact O-CA 3.29Å; K452-R455 WeakPolarHBondContact O-CA 3.5Å; K452-R455 WeakPolarHBondContact O-CB 3.49Å; K452-R455 PolarHBondContact O-N 3.07Å; K452-A456 PolarHBondContact O-N 3.34Å
453	R	77.2	Confident	92.6	Very high	69 Å²	69	45.6 Å²	45.6	26%	0.26	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-48.8	-37	-178	-170.9	-178.4	175.9	88.6	1.1	115	R455 A456 K487	R453-R455 PolarHBondContact O-N 3.38Å; R453-A456 VanDerWaalsContact O-CB 3.28Å; R453-A456 WeakPolarHBondContact O-CB 3.37Å; R453-A456 PolarHBondContact O-N 3.39Å; R453-A456 VanDerWaalsContact O-N 3.12Å; R453-K487 VanDerWaalsContact CZ-CB 3.48Å; R453-K487 VanDerWaalsContact NH1-CD 3.29Å
454	Q	80.2	Confident	92.6	Very high	154 Å²	154	45.6 Å²	45.6	72%	0.72	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-65.3	-21	176.5	-60.2	-68	-3.8	0	0	113	K452	K452-Q454 PolarHBondContact O-N 2.94Å
455	R	87.3	Confident	92.6	Very high	145 Å²	145	44.2 Å²	44.2	55%	0.547	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-106.7	28.5	175.2	-56.1	-176.5	-179.8	178.9	-1.4	111.7	K452 R453 W457 L458 G459	K452-R455 HydrophobicContact CB-CB 4.23Å; K452-R455 CarbonylContact O-C 3.54Å; K452-R455 VanDerWaalsContact O-CA 3.29Å; K452-R455 WeakPolarHBondContact O-CA 3.5Å; K452-R455 WeakPolarHBondContact O-CB 3.49Å; K452-R455 PolarHBondContact O-N 3.07Å; R453-R455 PolarHBondContact O-N 3.38Å; R455-W457 PolarHBondContact O-N 2.94Å; R455-W457 VanDerWaalsContact O-N 3.15Å; R455-L458 HydrophobicContact CB-CB 4.33Å; R455-L458 WeakPolarHBondContact O-CA 3.42Å; R455-L458 WeakPolarHBondContact O-CB 3.49Å; R455-L458 PolarHBondContact O-N 3.28Å; R455-G459 PolarHBondContact O-N 2.95Å
456	A	88	Confident	92.6	Very high	10 Å²	10	44.2 Å²	44.2	8%	0.083	20%	0.202	C	C	.	.	H	α-helix	trans	-55.7	-30.3	176.5	0	0	0	0	0	113.1	F449 K452 R453 L458 G459 A460 Q484	F449-A456 HydrophobicContact CD1-CB 4.24Å; F449-A456 HydrophobicContact CE1-CB 4.38Å; F449-A456 WeakPolarHBondContact CE1-O 3.45Å; K452-A456 PolarHBondContact O-N 3.34Å; R453-A456 VanDerWaalsContact O-CB 3.28Å; R453-A456 WeakPolarHBondContact O-CB 3.37Å; R453-A456 PolarHBondContact O-N 3.39Å; R453-A456 VanDerWaalsContact O-N 3.12Å; A456-L458 VanDerWaalsContact C-N 3.27Å; A456-L458 PolarHBondContact O-N 2.96Å; A456-G459 PolarHBondContact O-N 3.02Å; A456-G459 VanDerWaalsContact O-N 3.16Å; A456-A460 PolarHBondContact O-N 3.06Å; A456-Q484 VanDerWaalsContact CB-NE2 3.3Å
457	W	92.7	Very high	92.6	Very high	152 Å²	152	44.5 Å²	44.5	58%	0.576	20%	0.204	S	C	*	.	H	α-helix	trans	-60.4	-36.3	173.1	67	-95.2	0	0	0	112.4	R455 A460 A461 L515	R455-W457 PolarHBondContact O-N 2.94Å; R455-W457 VanDerWaalsContact O-N 3.15Å; W457-A460 PolarHBondContact O-N 3.19Å; W457-A461 PolarHBondContact O-N 2.88Å; W457-L515 HydrophobicContact CB-CD2 3.75Å; W457-L515 VanDerWaalsContact O-CD2 3.24Å; W457-L515 WeakPolarHBondContact O-CD2 3.24Å
458	L	95.9	Very high	92.7	Very high	60 Å²	60	43.4 Å²	43.4	31%	0.314	20%	0.199	S	C	.	.	H	α-helix	trans	-70.8	-39.2	175.4	-171.4	65.5	0	0	0	110.3	L448 R455 A456 A460 A461 V462	L448-L458 HydrophobicContact CD1-CB 4.27Å; L448-L458 HydrophobicContact CD1-CD2 4.13Å; L448-L458 HydrophobicContact CD1-CG 3.87Å; L448-L458 HydrophobicContact CD2-CD2 3.99Å; L448-L458 HydrophobicContact CD2-CG 4.5Å; R455-L458 HydrophobicContact CB-CB 4.33Å; R455-L458 WeakPolarHBondContact O-CA 3.42Å; R455-L458 WeakPolarHBondContact O-CB 3.49Å; R455-L458 PolarHBondContact O-N 3.28Å; A456-L458 VanDerWaalsContact C-N 3.27Å; A456-L458 PolarHBondContact O-N 2.96Å; L458-A460 VanDerWaalsContact C-N 3.29Å; L458-A460 PolarHBondContact O-N 3.32Å; L458-A461 PolarHBondContact O-N 3.07Å; L458-V462 WeakPolarHBondContact O-CG2 3.47Å; L458-V462 PolarHBondContact O-N 2.92Å
459	G	96.7	Very high	92.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.3	-41.7	172.3	0	0	0	0	0	112.3	R455 A456 V462 L463	R455-G459 PolarHBondContact O-N 2.95Å; A456-G459 PolarHBondContact O-N 3.02Å; A456-G459 VanDerWaalsContact O-N 3.16Å; G459-V462 PolarHBondContact O-N 3.25Å; G459-L463 WeakPolarHBondContact O-CB 3.21Å; G459-L463 PolarHBondContact O-N 3.18Å
460	A	97.3	Very high	92.6	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-41.9	174.4	0	0	0	0	0	112.9	F449 A456 W457 L458 L463 G464 T512 L515 A516	F449-A460 HydrophobicContact CZ-CB 4.23Å; F449-A460 VanDerWaalsContact CZ-N 3.33Å; A456-A460 PolarHBondContact O-N 3.06Å; W457-A460 PolarHBondContact O-N 3.19Å; L458-A460 VanDerWaalsContact C-N 3.29Å; L458-A460 PolarHBondContact O-N 3.32Å; A460-L463 PolarHBondContact O-N 3.13Å; A460-G464 PolarHBondContact O-N 2.97Å; A460-T512 HydrophobicContact CB-CG2 3.79Å; A460-T512 VanDerWaalsContact CB-O 3.24Å; A460-T512 WeakPolarHBondContact CB-O 3.05Å; A460-L515 HydrophobicContact CB-CB 4.34Å; A460-L515 HydrophobicContact CB-CD2 4.27Å; A460-L515 HydrophobicContact CB-CG 4.38Å; A460-A516 HydrophobicContact CB-CB 4.22Å; A460-A516 WeakPolarHBondContact O-CA 3.28Å; A460-A516 WeakPolarHBondContact O-CB 3.21Å
461	A	98	Very high	92.8	Very high	24 Å²	24	47.4 Å²	47.4	20%	0.198	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-44.1	176.4	0	0	0	0	0	111.9	W457 L458 G464 A465 V519	W457-A461 PolarHBondContact O-N 2.88Å; L458-A461 PolarHBondContact O-N 3.07Å; A461-G464 PolarHBondContact O-N 2.54Å; A461-A465 PolarHBondContact O-N 3.32Å; A461-V519 HydrophobicContact CB-CG2 4.12Å
462	V	98.2	Very high	93.2	Very high	20 Å²	20	44 Å²	44	12%	0.121	20%	0.204	C	C	.	.	H	α-helix	trans	-63.7	-41.3	175.6	176.4	0	0	0	0	111.1	L441 L444 A445 L448 L458 G459 A465 A466	L441-V462 HydrophobicContact CB-CG1 4.46Å; L441-V462 HydrophobicContact CD2-CG1 4.1Å; L441-V462 VanDerWaalsContact O-CG1 3.28Å; L441-V462 WeakPolarHBondContact O-CG1 3.09Å; L444-V462 HydrophobicContact CB-CG1 4.17Å; L444-V462 HydrophobicContact CD2-CG1 4.08Å; L444-V462 HydrophobicContact CD2-CG2 4.16Å; L444-V462 HydrophobicContact CG-CG1 4.12Å; L444-V462 HydrophobicContact CG-CG2 4.42Å; A445-V462 HydrophobicContact CB-CB 4.28Å; A445-V462 HydrophobicContact CB-CG1 4.01Å; L448-V462 HydrophobicContact CD1-CB 4.47Å; L448-V462 HydrophobicContact CD1-CG2 3.87Å; L458-V462 WeakPolarHBondContact O-CG2 3.47Å; L458-V462 PolarHBondContact O-N 2.92Å; G459-V462 PolarHBondContact O-N 3.25Å; V462-A465 PolarHBondContact O-N 3.06Å; V462-A466 PolarHBondContact O-N 3.47Å
463	L	98.5	Very high	93.7	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.016	18%	0.184	C	C	.	.	H	α-helix	trans	-61.6	-44.5	175.2	-178.9	61.4	0	0	0	111.6	A445 F449 G459 A460 A465 A466 I467 P473 Y476 I477 V480 W603	A445-L463 HydrophobicContact CB-CB 4.15Å; F449-L463 HydrophobicContact CE2-CB 4.49Å; F449-L463 HydrophobicContact CE2-CD2 4.3Å; G459-L463 WeakPolarHBondContact O-CB 3.21Å; G459-L463 PolarHBondContact O-N 3.18Å; A460-L463 PolarHBondContact O-N 3.13Å; L463-A465 VanDerWaalsContact C-N 3.31Å; L463-A465 PolarHBondContact O-N 3.17Å; L463-A466 WeakPolarHBondContact O-CB 3.36Å; L463-A466 PolarHBondContact O-N 2.99Å; L463-A466 VanDerWaalsContact O-N 3.15Å; L463-I467 HydrophobicContact CD1-CD1 4.46Å; L463-I467 HydrophobicContact CD1-CG1 4.48Å; L463-I467 HydrophobicContact CG-CD1 4.13Å; L463-I467 VanDerWaalsContact O-CG1 3.28Å; L463-I467 WeakPolarHBondContact O-CG1 3.48Å; L463-I467 PolarHBondContact O-N 3.43Å; L463-P473 HydrophobicContact CD1-CB 4.01Å; L463-Y476 HydrophobicContact CD1-CD2 4.09Å; L463-I477 HydrophobicContact CD2-CG1 4.46Å; L463-V480 HydrophobicContact CD2-CG2 4.08Å; L463-W603 HydrophobicContact CD1-CH2 4.41Å
464	G	98.3	Very high	94.6	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.5	-40.6	175.2	0	0	0	0	0	112.8	A460 A461 I467 H468 A516	A460-G464 PolarHBondContact O-N 2.97Å; A461-G464 PolarHBondContact O-N 2.54Å; G464-I467 PolarHBondContact O-N 2.9Å; G464-H468 PolarHBondContact O-N 3.24Å; G464-H468 VanDerWaalsContact O-N 3.16Å; G464-A516 VanDerWaalsContact CA-O 3.32Å; G464-A516 WeakPolarHBondContact CA-O 3.23Å
465	A	97.8	Very high	95.4	Very high	27 Å²	27	33.2 Å²	33.2	22%	0.223	16%	0.161	C	C	.	.	H	α-helix	trans	-65.2	-41	173.3	0	0	0	0	0	112.2	A461 V462 L463 I467 H468 V469 L523	A461-A465 PolarHBondContact O-N 3.32Å; V462-A465 PolarHBondContact O-N 3.06Å; L463-A465 VanDerWaalsContact C-N 3.31Å; L463-A465 PolarHBondContact O-N 3.17Å; A465-I467 PolarHBondContact O-N 3.29Å; A465-H468 PolarHBondContact O-N 2.84Å; A465-V469 WeakPolarHBondContact O-CG2 3.44Å; A465-V469 PolarHBondContact O-N 3.27Å; A465-L523 HydrophobicContact CB-CD1 4.21Å
466	A	97.7	Very high	95.9	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-60.9	-43.7	176.2	0	0	0	0	0	111.9	L441 T442 V462 L463 H468 V469 K470 P473	L441-A466 HydrophobicContact CB-CB 3.9Å; T442-A466 HydrophobicContact CG2-CB 4.4Å; V462-A466 PolarHBondContact O-N 3.47Å; L463-A466 WeakPolarHBondContact O-CB 3.36Å; L463-A466 PolarHBondContact O-N 2.99Å; L463-A466 VanDerWaalsContact O-N 3.15Å; A466-H468 VanDerWaalsContact C-N 3.28Å; A466-H468 PolarHBondContact O-N 2.83Å; A466-V469 PolarHBondContact O-N 3.45Å; A466-K470 PolarHBondContact O-N 3.1Å; A466-P473 HydrophobicContact CB-CB 4.26Å; A466-P473 HydrophobicContact CB-CG 4.13Å
467	I	97.2	Very high	96.3	Very high	6 Å²	6	27.4 Å²	27.4	3%	0.031	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-36.7	176.6	-63.5	167.4	0	0	0	111.2	L463 G464 A465 K470 L471 P473 I474 I477 F520	L463-I467 HydrophobicContact CD1-CD1 4.46Å; L463-I467 HydrophobicContact CD1-CG1 4.48Å; L463-I467 HydrophobicContact CG-CD1 4.13Å; L463-I467 VanDerWaalsContact O-CG1 3.28Å; L463-I467 WeakPolarHBondContact O-CG1 3.48Å; L463-I467 PolarHBondContact O-N 3.43Å; G464-I467 PolarHBondContact O-N 2.9Å; A465-I467 PolarHBondContact O-N 3.29Å; I467-K470 CarbonylContact C-O 3.58Å; I467-K470 WeakPolarHBondContact CA-O 3.47Å; I467-K470 CarbonylContact O-C 3.59Å; I467-L471 HydrophobicContact CG2-CD1 4.02Å; I467-L471 WeakPolarHBondContact O-CA 3.49Å; I467-P473 HydrophobicContact CG1-CB 3.96Å; I467-I474 HydrophobicContact CD1-CB 4.45Å; I467-I474 HydrophobicContact CG2-CB 4.43Å; I467-I477 HydrophobicContact CD1-CD1 4.03Å; I467-I477 HydrophobicContact CD1-CG1 4.35Å; I467-F520 HydrophobicContact CB-CD2 4.13Å; I467-F520 HydrophobicContact CG2-CD2 3.6Å; I467-F520 HydrophobicContact CG2-CE2 3.88Å; I467-F520 HydrophobicContact CG2-CG 4.06Å
468	H	96.3	Very high	96.5	Very high	6 Å²	6	22.1 Å²	22.1	3%	0.028	12%	0.124	C	C	.	.	H	α-helix	trans	-69.3	-38.6	176.1	176.8	79.1	0	0	0	112.4	T372 L374 G464 A465 A466 F520 L523 T524 Y535	T372-H468 PolarHBondContact OG1-NE2 2.85Å; L374-H468 WeakPolarHBondContact CD1-NE2 3.36Å; G464-H468 PolarHBondContact O-N 3.24Å; G464-H468 VanDerWaalsContact O-N 3.16Å; A465-H468 PolarHBondContact O-N 2.84Å; A466-H468 VanDerWaalsContact C-N 3.28Å; A466-H468 PolarHBondContact O-N 2.83Å; H468-F520 HydrophobicContact CB-CD2 3.99Å; H468-L523 HydrophobicContact CB-CB 4.14Å; H468-L523 HydrophobicContact CB-CD1 3.91Å; H468-T524 PolarHBondContact ND1-N 3Å; H468-T524 PolarHBondContact ND1-OG1 3.49Å; H468-Y535 PolarHBondContact CE1-OH 2.87Å; H468-Y535 PolarHBondContact ND1-OH 3.41Å
469	V	94.1	Very high	96.5	Very high	23 Å²	23	19.2 Å²	19.2	14%	0.139	11%	0.109	C	C	.	.	H	α-helix	trans	-64.2	-43.2	176.9	170.4	0	0	0	0	111.2	F375 L438 L441 A465 A466	F375-V469 HydrophobicContact CE1-CG1 3.86Å; F375-V469 HydrophobicContact CE2-CG1 4.32Å; F375-V469 HydrophobicContact CZ-CG1 3.42Å; F375-V469 VanDerWaalsContact CZ-CG1 3.42Å; L438-V469 HydrophobicContact CD1-CG1 4.35Å; L441-V469 HydrophobicContact CD1-CG2 3.99Å; A465-V469 WeakPolarHBondContact O-CG2 3.44Å; A465-V469 PolarHBondContact O-N 3.27Å; A466-V469 PolarHBondContact O-N 3.45Å
470	K	93.5	Very high	96.5	Very high	49 Å²	49	19.4 Å²	19.4	21%	0.213	11%	0.109	C	C	.	.			trans	-152.3	140.3	172.6	-161.2	166.8	-166.4	164	0	108.4	E435 L438 A466 I467 Y472 P473 W624	E435-K470 IonicContact OE1-NZ 2.83Å; E435-K470 PolarHBondContact OE1-NZ 3.18Å; E435-K470 IonicContact OE2-NZ 2.79Å; L438-K470 HydrophobicContact CD1-CB 4.06Å; L438-K470 HydrophobicContact CD2-CB 3.52Å; L438-K470 HydrophobicContact CD2-CD 3.36Å; L438-K470 HydrophobicContact CD2-CG 4.01Å; L438-K470 HydrophobicContact CG-CB 4.45Å; A466-K470 PolarHBondContact O-N 3.1Å; I467-K470 CarbonylContact C-O 3.58Å; I467-K470 WeakPolarHBondContact CA-O 3.47Å; I467-K470 CarbonylContact O-C 3.59Å; K470-Y472 VanDerWaalsContact C-N 3.3Å; K470-Y472 HydrophobicContact CB-CD1 4.45Å; K470-Y472 HydrophobicContact CD-CD1 4.27Å; K470-Y472 HydrophobicContact CG-CD1 4.3Å; K470-Y472 PolarHBondContact O-N 3.02Å; K470-P473 WeakPolarHBondContact O-CD 3.42Å; K470-W624 HydrophobicContact CD-CZ2 4.03Å
471	L	93	Very high	96.4	Very high	63 Å²	63	22 Å²	22	33%	0.33	12%	0.121	S	C	.	.	S	Bend	trans	-68.5	-24	-167.9	-168.4	61.3	0	0	0	114.8	I467 I474 F520	I467-L471 HydrophobicContact CG2-CD1 4.02Å; I467-L471 WeakPolarHBondContact O-CA 3.49Å; L471-I474 WeakPolarHBondContact O-CB 3.18Å; L471-I474 WeakPolarHBondContact O-CG2 3.3Å; L471-I474 PolarHBondContact O-N 3.37Å; L471-F520 HydrophobicContact CD1-CE2 4.5Å; L471-F520 HydrophobicContact CD1-CZ 4.41Å
472	Y	93.7	Very high	96.2	Very high	12 Å²	12	22 Å²	22	5%	0.047	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-59.5	-33	-169.2	97.2	-93.7	0	0	0	116.4	L438 K470 I474 I475 Y476 T607 F610 W624	L438-Y472 HydrophobicContact CD1-CE1 4.1Å; L438-Y472 HydrophobicContact CD2-CD1 3.99Å; L438-Y472 HydrophobicContact CD2-CE1 3.46Å; L438-Y472 VanDerWaalsContact CD2-CE1 3.46Å; L438-Y472 HydrophobicContact CG-CE1 3.77Å; K470-Y472 VanDerWaalsContact C-N 3.3Å; K470-Y472 HydrophobicContact CB-CD1 4.45Å; K470-Y472 HydrophobicContact CD-CD1 4.27Å; K470-Y472 HydrophobicContact CG-CD1 4.3Å; K470-Y472 PolarHBondContact O-N 3.02Å; Y472-I474 PolarHBondContact O-N 3.22Å; Y472-I475 HydrophobicContact CD2-CD1 3.98Å; Y472-I475 HydrophobicContact CE2-CD1 4.43Å; Y472-I475 VanDerWaalsContact O-CG1 3.28Å; Y472-I475 WeakPolarHBondContact O-CG1 3.42Å; Y472-I475 WeakPolarHBondContact O-CG2 3.35Å; Y472-I475 PolarHBondContact O-N 3.3Å; Y472-I475 VanDerWaalsContact O-N 3.09Å; Y472-Y476 HydrophobicContact CE2-CE2 4.2Å; Y472-Y476 WeakPolarHBondContact CE2-OH 3.22Å; Y472-T607 HydrophobicContact CE2-CG2 4.37Å; Y472-F610 HydrophobicContact CD2-CE1 4.48Å; Y472-W624 HydrophobicContact CD1-CD2 4.13Å; Y472-W624 AromaticContact CD1-CE2 3.93Å; Y472-W624 HydrophobicContact CD1-CE3 4.36Å; Y472-W624 HydrophobicContact CD1-CH2 4.19Å; Y472-W624 AromaticContact CD1-CZ2 3.96Å; Y472-W624 HydrophobicContact CD1-CZ2 3.96Å; Y472-W624 HydrophobicContact CD1-CZ3 4.4Å; Y472-W624 HydrophobicContact CD2-CD2 4.38Å; Y472-W624 HydrophobicContact CD2-CE3 4.08Å; Y472-W624 HydrophobicContact CD2-CZ3 4.4Å; Y472-W624 AromaticContact CE1-CD2 3.93Å; Y472-W624 HydrophobicContact CE1-CD2 3.93Å; Y472-W624 AromaticContact CE1-CE2 3.85Å; Y472-W624 HydrophobicContact CE1-CG 4.09Å; Y472-W624 HydrophobicContact CE1-CZ2 4.33Å; Y472-W624 AromaticContact CE1-NE1 3.95Å; Y472-W624 HydrophobicContact CE2-CB 4.32Å; Y472-W624 HydrophobicContact CE2-CD2 4.21Å; Y472-W624 HydrophobicContact CE2-CE3 4.28Å; Y472-W624 HydrophobicContact CE2-CG 4.27Å; Y472-W624 HydrophobicContact CG-CD2 4.36Å; Y472-W624 HydrophobicContact CG-CE3 4.15Å; Y472-W624 HydrophobicContact CG-CH2 4.24Å; Y472-W624 HydrophobicContact CG-CZ2 4.46Å; Y472-W624 HydrophobicContact CG-CZ3 4.11Å; Y472-W624 AromaticContact CZ-CD2 4Å; Y472-W624 AromaticContact CZ-CG 3.85Å
473	P	96.6	Very high	95.9	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-61.8	-6.6	178.7	-22.7	36.6	0	0	0	114	L438 T442 L463 A466 I467 K470 I475 Y476	L438-P473 HydrophobicContact CD1-CG 3.98Å; T442-P473 HydrophobicContact CG2-CB 4.12Å; T442-P473 HydrophobicContact CG2-CG 3.88Å; L463-P473 HydrophobicContact CD1-CB 4.01Å; A466-P473 HydrophobicContact CB-CB 4.26Å; A466-P473 HydrophobicContact CB-CG 4.13Å; I467-P473 HydrophobicContact CG1-CB 3.96Å; K470-P473 WeakPolarHBondContact O-CD 3.42Å; P473-I475 PolarHBondContact O-N 3.18Å; P473-Y476 HydrophobicContact CB-CD2 3.84Å; P473-Y476 HydrophobicContact CB-CE2 3.94Å; P473-Y476 WeakPolarHBondContact O-CB 3.19Å; P473-Y476 VanDerWaalsContact O-CD2 3.28Å; P473-Y476 WeakPolarHBondContact O-CD2 3.28Å; P473-Y476 PolarHBondContact O-N 3.28Å
474	I	96	Very high	95.5	Very high	85 Å²	85	22 Å²	22	44%	0.436	12%	0.117	S	C	.	.	G	3₁₀ helix	trans	-55.1	-28.4	169.4	-160.9	173.1	0	0	0	112	I467 L471 Y472 Y476 I477	I467-I474 HydrophobicContact CD1-CB 4.45Å; I467-I474 HydrophobicContact CG2-CB 4.43Å; L471-I474 WeakPolarHBondContact O-CB 3.18Å; L471-I474 WeakPolarHBondContact O-CG2 3.3Å; L471-I474 PolarHBondContact O-N 3.37Å; Y472-I474 PolarHBondContact O-N 3.22Å; I474-Y476 PolarHBondContact O-N 3.3Å; I474-Y476 VanDerWaalsContact O-N 3.1Å; I474-I477 HydrophobicContact CG1-CD1 3.85Å; I474-I477 WeakPolarHBondContact O-CB 3.46Å; I474-I477 PolarHBondContact O-N 3.17Å; I474-I477 VanDerWaalsContact O-N 3.11Å
475	I	96.3	Very high	95.1	Very high	12 Å²	12	24.2 Å²	24.2	6%	0.062	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-61	-18.9	176.9	69.2	-174.8	0	0	0	113.2	Y472 P473 P478 I587 T606 F610	Y472-I475 HydrophobicContact CD2-CD1 3.98Å; Y472-I475 HydrophobicContact CE2-CD1 4.43Å; Y472-I475 VanDerWaalsContact O-CG1 3.28Å; Y472-I475 WeakPolarHBondContact O-CG1 3.42Å; Y472-I475 WeakPolarHBondContact O-CG2 3.35Å; Y472-I475 PolarHBondContact O-N 3.3Å; Y472-I475 VanDerWaalsContact O-N 3.09Å; P473-I475 PolarHBondContact O-N 3.18Å; I475-P478 WeakPolarHBondContact O-CD 3.25Å; I475-I587 HydrophobicContact CB-CD1 3.97Å; I475-I587 HydrophobicContact CG2-CD1 3.73Å; I475-I587 WeakPolarHBondContact O-CG2 3.31Å; I475-T606 HydrophobicContact CB-CG2 4.1Å; I475-T606 HydrophobicContact CD1-CG2 4.08Å; I475-T606 HydrophobicContact CG1-CG2 3.95Å; I475-F610 HydrophobicContact CD1-CB 3.82Å; I475-F610 HydrophobicContact CD1-CD1 4.05Å; I475-F610 HydrophobicContact CD1-CG 3.9Å; I475-F610 HydrophobicContact CG2-CD2 3.84Å; I475-F610 HydrophobicContact CG2-CE2 4.08Å; I475-F610 HydrophobicContact CG2-CG 4.21Å
476	Y	98	Very high	94.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-83.9	-16.1	179.1	-55.2	-48.8	0	0	0	113.3	T442 L463 Y472 P473 I474 S479 V480 W603 T606 T607 F628	T442-Y476 HydrophobicContact CG2-CE2 3.98Å; L463-Y476 HydrophobicContact CD1-CD2 4.09Å; Y472-Y476 HydrophobicContact CE2-CE2 4.2Å; Y472-Y476 WeakPolarHBondContact CE2-OH 3.22Å; P473-Y476 HydrophobicContact CB-CD2 3.84Å; P473-Y476 HydrophobicContact CB-CE2 3.94Å; P473-Y476 WeakPolarHBondContact O-CB 3.19Å; P473-Y476 VanDerWaalsContact O-CD2 3.28Å; P473-Y476 WeakPolarHBondContact O-CD2 3.28Å; P473-Y476 PolarHBondContact O-N 3.28Å; I474-Y476 PolarHBondContact O-N 3.3Å; I474-Y476 VanDerWaalsContact O-N 3.1Å; Y476-S479 PolarHBondContact O-N 3.23Å; Y476-S479 VanDerWaalsContact O-N 3.15Å; Y476-S479 PolarHBondContact O-OG 3.38Å; Y476-V480 WeakPolarHBondContact O-CG2 3.32Å; Y476-V480 PolarHBondContact O-N 3.39Å; Y476-W603 HydrophobicContact CD1-CB 4.18Å; Y476-W603 AromaticContact CD1-CD1 3.95Å; Y476-W603 AromaticContact CD1-CD2 3.58Å; Y476-W603 HydrophobicContact CD1-CD2 3.58Å; Y476-W603 AromaticContact CD1-CE2 3.92Å; Y476-W603 AromaticContact CD1-CE3 3.96Å; Y476-W603 HydrophobicContact CD1-CE3 3.96Å; Y476-W603 AromaticContact CD1-CG 3.66Å; Y476-W603 HydrophobicContact CD1-CG 3.66Å; Y476-W603 HydrophobicContact CD2-CD2 4.27Å; Y476-W603 AromaticContact CD2-CE3 3.91Å; Y476-W603 HydrophobicContact CD2-CE3 3.91Å; Y476-W603 HydrophobicContact CD2-CH2 4.13Å; Y476-W603 HydrophobicContact CD2-CZ2 4.46Å; Y476-W603 AromaticContact CD2-CZ3 3.82Å; Y476-W603 HydrophobicContact CD2-CZ3 3.82Å; Y476-W603 HydrophobicContact CE1-CB 3.95Å; Y476-W603 AromaticContact CE1-CD2 3.96Å; Y476-W603 HydrophobicContact CE1-CD2 3.96Å; Y476-W603 HydrophobicContact CE1-CE3 4.06Å; Y476-W603 AromaticContact CE1-CG 3.92Å; Y476-W603 HydrophobicContact CE1-CG 3.92Å; Y476-W603 AromaticContact CE2-CE3 4Å; Y476-W603 HydrophobicContact CE2-CE3 4Å; Y476-W603 HydrophobicContact CE2-CZ3 4.13Å; Y476-W603 AromaticContact CG-CD2 3.77Å; Y476-W603 HydrophobicContact CG-CD2 3.77Å; Y476-W603 AromaticContact CG-CE2 3.8Å; Y476-W603 AromaticContact CG-CE3 3.9Å; Y476-W603 HydrophobicContact CG-CE3 3.9Å; Y476-W603 HydrophobicContact CG-CG 4.33Å; Y476-W603 HydrophobicContact CG-CH2 4.17Å; Y476-W603 HydrophobicContact CG-CZ2 4.04Å; Y476-W603 HydrophobicContact CG-CZ3 4.08Å; Y476-T606 HydrophobicContact CD1-CG2 4.42Å; Y476-T607 WeakPolarHBondContact CE1-OG1 3.35Å; Y476-T607 PolarHBondContact OH-OG1 2.89Å; Y476-F628 WeakPolarHBondContact OH-CE2 3.43Å
477	I	96.9	Very high	93.8	Very high	33 Å²	33	28.8 Å²	28.8	17%	0.169	14%	0.144	C	C	.	.	H	α-helix	trans	-54.6	-48	-178.3	-69.8	179.2	0	0	0	112.5	L463 I467 I474 S479 V480 F481 V513	L463-I477 HydrophobicContact CD2-CG1 4.46Å; I467-I477 HydrophobicContact CD1-CD1 4.03Å; I467-I477 HydrophobicContact CD1-CG1 4.35Å; I474-I477 HydrophobicContact CG1-CD1 3.85Å; I474-I477 WeakPolarHBondContact O-CB 3.46Å; I474-I477 PolarHBondContact O-N 3.17Å; I474-I477 VanDerWaalsContact O-N 3.11Å; I477-S479 VanDerWaalsContact C-N 3.35Å; I477-S479 PolarHBondContact O-N 3.32Å; I477-V480 PolarHBondContact O-N 2.97Å; I477-F481 PolarHBondContact O-N 2.95Å; I477-V513 HydrophobicContact CG2-CB 4.49Å; I477-V513 HydrophobicContact CG2-CG1 3.61Å; I477-V513 HydrophobicContact CG2-CG2 4.06Å
478	P	96.3	Very high	92.9	Very high	40 Å²	40	29.1 Å²	29.1	26%	0.26	15%	0.149	S	C	.	.	H	α-helix	trans	-57.5	-45.8	177	-25.9	35.9	0	0	0	112.6	I475 V480 F481 C482 I587 A591	I475-P478 WeakPolarHBondContact O-CD 3.25Å; P478-V480 PolarHBondContact O-N 3.23Å; P478-F481 PolarHBondContact O-N 3Å; P478-C482 WeakPolarHBondContact O-CB 3.2Å; P478-C482 PolarHBondContact O-N 2.73Å; P478-C482 PolarHBondContact O-SG 2.59Å; P478-C482 VanDerWaalsContact O-SG 3.34Å; P478-I587 HydrophobicContact CG-CG2 4.15Å; P478-A591 HydrophobicContact CB-CB 4.13Å
479	S	96.6	Very high	92.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-39.1	178.9	72.6	0	0	0	0	112.6	Y476 I477 C482 H483 A595 W603	Y476-S479 PolarHBondContact O-N 3.23Å; Y476-S479 VanDerWaalsContact O-N 3.15Å; Y476-S479 PolarHBondContact O-OG 3.38Å; I477-S479 VanDerWaalsContact C-N 3.35Å; I477-S479 PolarHBondContact O-N 3.32Å; S479-C482 PolarHBondContact O-N 3.06Å; S479-H483 WeakPolarHBondContact O-CB 3.41Å; S479-H483 PolarHBondContact O-N 2.93Å; S479-A595 WeakPolarHBondContact O-CB 3.42Å; S479-W603 PolarHBondContact OG-NE1 3Å
480	V	95.8	Very high	90.9	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-65.7	-43.2	176.7	171.4	0	0	0	0	110.8	F449 L463 Y476 I477 P478 Q484 T512 W603	F449-V480 HydrophobicContact CD1-CG1 4.33Å; F449-V480 HydrophobicContact CD2-CG2 3.98Å; F449-V480 HydrophobicContact CE1-CG1 3.72Å; F449-V480 HydrophobicContact CE2-CG1 4.08Å; F449-V480 HydrophobicContact CE2-CG2 3.63Å; F449-V480 HydrophobicContact CZ-CB 4.48Å; F449-V480 HydrophobicContact CZ-CG1 3.56Å; F449-V480 HydrophobicContact CZ-CG2 4Å; L463-V480 HydrophobicContact CD2-CG2 4.08Å; Y476-V480 WeakPolarHBondContact O-CG2 3.32Å; Y476-V480 PolarHBondContact O-N 3.39Å; I477-V480 PolarHBondContact O-N 2.97Å; P478-V480 PolarHBondContact O-N 3.23Å; V480-Q484 WeakPolarHBondContact O-CB 3.38Å; V480-Q484 WeakPolarHBondContact O-CG 3.49Å; V480-Q484 PolarHBondContact O-N 3.09Å; V480-T512 HydrophobicContact CG1-CG2 4.02Å; V480-W603 HydrophobicContact CG2-CZ2 3.73Å
481	F	95.4	Very high	89.3	Confident	56 Å²	56	39 Å²	39	25%	0.246	19%	0.192	C	C	.	.	H	α-helix	trans	-60	-53.5	175.3	179.6	-91.6	0	0	0	111.1	I477 P478 H483 Q484 F485 F506 V510 V513	I477-F481 PolarHBondContact O-N 2.95Å; P478-F481 PolarHBondContact O-N 3Å; F481-H483 PolarHBondContact O-N 3.42Å; F481-Q484 PolarHBondContact O-N 2.9Å; F481-F485 HydrophobicContact CE1-CB 4.49Å; F481-F485 VanDerWaalsContact O-CB 3.25Å; F481-F485 WeakPolarHBondContact O-CB 3.38Å; F481-F485 PolarHBondContact O-N 3.47Å; F481-F506 HydrophobicContact CE2-CD2 4.42Å; F481-F506 HydrophobicContact CE2-CE2 4.27Å; F481-F506 AromaticContact CZ-CD2 3.86Å; F481-F506 HydrophobicContact CZ-CD2 3.86Å; F481-F506 AromaticContact CZ-CE2 3.73Å; F481-F506 HydrophobicContact CZ-CE2 3.73Å; F481-V510 HydrophobicContact CE2-CG2 3.88Å; F481-V513 HydrophobicContact CB-CG2 3.93Å; F481-V513 HydrophobicContact CD2-CG2 4.13Å
482	C	93.9	Very high	87.2	Confident	24 Å²	24	45.9 Å²	45.9	16%	0.162	21%	0.214	C	C	.	.	H	α-helix	trans	-57.9	-46.7	178.6	-71.9	0	0	0	0	111.4	P478 S479 Q484 F485 L486 A595	P478-C482 WeakPolarHBondContact O-CB 3.2Å; P478-C482 PolarHBondContact O-N 2.73Å; P478-C482 PolarHBondContact O-SG 2.59Å; P478-C482 VanDerWaalsContact O-SG 3.34Å; S479-C482 PolarHBondContact O-N 3.06Å; C482-Q484 PolarHBondContact O-N 2.88Å; C482-F485 PolarHBondContact O-N 3.02Å; C482-L486 HydrophobicContact CB-CD1 4.49Å; C482-L486 VanDerWaalsContact O-CB 3.32Å; C482-L486 WeakPolarHBondContact O-CB 3.13Å; C482-L486 VanDerWaalsContact O-CG 3.25Å; C482-L486 WeakPolarHBondContact O-CG 3.25Å; C482-L486 PolarHBondContact O-N 3.05Å; C482-A595 HydrophobicContact CB-CB 3.95Å
483	H	91.9	Very high	85	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.023	24%	0.24	C	C	.	.	H	α-helix	trans	-59.4	-47.7	178.7	-177.6	85.9	0	0	0	112.6	S479 F481 K487 A595 L599	S479-H483 WeakPolarHBondContact O-CB 3.41Å; S479-H483 PolarHBondContact O-N 2.93Å; F481-H483 PolarHBondContact O-N 3.42Å; H483-K487 WeakPolarHBondContact CE1-CE 2.88Å; H483-K487 WeakPolarHBondContact O-CB 3.44Å; H483-K487 PolarHBondContact O-N 3.29Å; H483-A595 HydrophobicContact CB-CB 4.28Å; H483-A595 WeakPolarHBondContact CB-O 3.25Å; H483-A595 PolarHBondContact ND1-O 3.4Å; H483-L599 HydrophobicContact CB-CD1 4.08Å; H483-L599 HydrophobicContact CB-CD2 4.42Å
484	Q	89.7	Confident	82.7	Confident	17 Å²	17	55.9 Å²	55.9	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-67	-39.4	179.5	-70.5	-63.6	-7.6	0	0	111.7	A456 V480 F481 C482 G488 S509 T512	A456-Q484 VanDerWaalsContact CB-NE2 3.3Å; V480-Q484 WeakPolarHBondContact O-CB 3.38Å; V480-Q484 WeakPolarHBondContact O-CG 3.49Å; V480-Q484 PolarHBondContact O-N 3.09Å; F481-Q484 PolarHBondContact O-N 2.9Å; C482-Q484 PolarHBondContact O-N 2.88Å; Q484-G488 WeakPolarHBondContact O-CA 3.32Å; Q484-G488 PolarHBondContact O-N 3.44Å; Q484-S509 VanDerWaalsContact C-OG 3.29Å; Q484-S509 WeakPolarHBondContact CB-OG 3.11Å; Q484-T512 HydrophobicContact CG-CG2 4.4Å
485	F	90.9	Very high	80.5	Confident	47 Å²	47	58.1 Å²	58.1	21%	0.206	30%	0.301	C	S	.	.	H	α-helix	trans	-68.8	-55.1	-178.4	-178.5	-114.7	0	0	0	111.3	F481 C482 G488 L489 V502 A505 F506 S509	F481-F485 HydrophobicContact CE1-CB 4.49Å; F481-F485 VanDerWaalsContact O-CB 3.25Å; F481-F485 WeakPolarHBondContact O-CB 3.38Å; F481-F485 PolarHBondContact O-N 3.47Å; C482-F485 PolarHBondContact O-N 3.02Å; F485-G488 CarbonylContact O-C 3.48Å; F485-G488 VanDerWaalsContact O-CA 3.29Å; F485-G488 WeakPolarHBondContact O-CA 3.4Å; F485-G488 PolarHBondContact O-N 3.2Å; F485-L489 HydrophobicContact CD1-CD1 4.3Å; F485-L489 HydrophobicContact CE1-CD1 3.82Å; F485-L489 HydrophobicContact CE2-CD1 4.45Å; F485-L489 HydrophobicContact CE2-CD2 4.49Å; F485-L489 HydrophobicContact CZ-CD1 3.9Å; F485-L489 HydrophobicContact CZ-CG 4.44Å; F485-L489 WeakPolarHBondContact O-CG 3.5Å; F485-L489 PolarHBondContact O-N 3.4Å; F485-V502 HydrophobicContact CE2-CG1 4.35Å; F485-V502 HydrophobicContact CZ-CG1 4.31Å; F485-A505 HydrophobicContact CD2-CB 4.13Å; F485-A505 HydrophobicContact CE2-CB 4.37Å; F485-F506 HydrophobicContact CD2-CB 4.23Å; F485-F506 HydrophobicContact CE2-CB 3.96Å; F485-F506 HydrophobicContact CE2-CD2 4.42Å; F485-S509 WeakPolarHBondContact CA-OG 3.15Å; F485-S509 PolarHBondContact N-OG 3.44Å
486	L	86.8	Confident	78.2	Confident	46 Å²	46	61.2 Å²	61.2	24%	0.241	32%	0.323	C	S	.	.	H	α-helix	trans	-64	-46.8	-176.3	-64.7	172.7	0	0	0	111.8	C482 G488 L489 K490 E596	C482-L486 HydrophobicContact CB-CD1 4.49Å; C482-L486 VanDerWaalsContact O-CB 3.32Å; C482-L486 WeakPolarHBondContact O-CB 3.13Å; C482-L486 VanDerWaalsContact O-CG 3.25Å; C482-L486 WeakPolarHBondContact O-CG 3.25Å; C482-L486 PolarHBondContact O-N 3.05Å; L486-G488 PolarHBondContact O-N 3.03Å; L486-L489 WeakPolarHBondContact O-CB 3.39Å; L486-L489 PolarHBondContact O-N 3.04Å; L486-L489 VanDerWaalsContact O-N 3.07Å; L486-K490 PolarHBondContact O-N 2.87Å; L486-E596 HydrophobicContact CB-CB 4.27Å; L486-E596 HydrophobicContact CB-CG 4Å; L486-E596 HydrophobicContact CD1-CB 3.88Å; L486-E596 HydrophobicContact CD1-CG 4.44Å
487	K	80.6	Confident	75.8	Confident	77 Å²	77	69.5 Å²	69.5	34%	0.335	36%	0.356	S	S	.	.	H	α-helix	trans	-68.2	-26.1	172.6	-69.9	-159.5	176.1	-172.6	0	112.7	R453 H483 L489 K490 E596	R453-K487 VanDerWaalsContact CZ-CB 3.48Å; R453-K487 VanDerWaalsContact NH1-CD 3.29Å; H483-K487 WeakPolarHBondContact CE1-CE 2.88Å; H483-K487 WeakPolarHBondContact O-CB 3.44Å; H483-K487 PolarHBondContact O-N 3.29Å; K487-L489 PolarHBondContact O-N 3.39Å; K487-K490 PolarHBondContact O-N 2.88Å; K487-E596 WeakPolarHBondContact CE-O 3.31Å
488	G	79.5	Confident	73.9	Confident	13 Å²	13	76.5 Å²	76.5	13%	0.134	38%	0.38	C	S	.	.	H	α-helix	trans	-61.2	-36.6	171.2	0	0	0	0	0	111.6	Q484 F485 L486 F501	Q484-G488 WeakPolarHBondContact O-CA 3.32Å; Q484-G488 PolarHBondContact O-N 3.44Å; F485-G488 CarbonylContact O-C 3.48Å; F485-G488 VanDerWaalsContact O-CA 3.29Å; F485-G488 WeakPolarHBondContact O-CA 3.4Å; F485-G488 PolarHBondContact O-N 3.2Å; L486-G488 PolarHBondContact O-N 3.03Å; G488-F501 VanDerWaalsContact O-CE2 3.26Å; G488-F501 WeakPolarHBondContact O-CE2 3.48Å; G488-F501 WeakPolarHBondContact O-CZ 3.28Å
489	L	79.9	Confident	72.1	Confident	43 Å²	43	85.9 Å²	85.9	23%	0.225	41%	0.41	C	S	.	.	H	α-helix	trans	-74.8	-20.5	178.8	-65.8	174.6	0	0	0	114.6	F485 L486 K487 F501 V502 A505	F485-L489 HydrophobicContact CD1-CD1 4.3Å; F485-L489 HydrophobicContact CE1-CD1 3.82Å; F485-L489 HydrophobicContact CE2-CD1 4.45Å; F485-L489 HydrophobicContact CE2-CD2 4.49Å; F485-L489 HydrophobicContact CZ-CD1 3.9Å; F485-L489 HydrophobicContact CZ-CG 4.44Å; F485-L489 WeakPolarHBondContact O-CG 3.5Å; F485-L489 PolarHBondContact O-N 3.4Å; L486-L489 WeakPolarHBondContact O-CB 3.39Å; L486-L489 PolarHBondContact O-N 3.04Å; L486-L489 VanDerWaalsContact O-N 3.07Å; K487-L489 PolarHBondContact O-N 3.39Å; L489-F501 VanDerWaalsContact C-CE1 3.45Å; L489-F501 VanDerWaalsContact C-CZ 3.43Å; L489-F501 HydrophobicContact CB-CE1 4.26Å; L489-F501 HydrophobicContact CD2-CD1 4.21Å; L489-F501 HydrophobicContact CD2-CE1 4.09Å; L489-F501 WeakPolarHBondContact O-CE1 3.24Å; L489-F501 VanDerWaalsContact O-CZ 3.22Å; L489-F501 WeakPolarHBondContact O-CZ 3.19Å; L489-V502 HydrophobicContact CD2-CB 4.34Å; L489-V502 HydrophobicContact CD2-CG1 4.45Å; L489-V502 HydrophobicContact CD2-CG2 3.99Å; L489-A505 HydrophobicContact CD2-CB 4.24Å
490	K	68.6	Low	70.8	Confident	124 Å²	124	89.2 Å²	89.2	54%	0.539	43%	0.434	S	S	.	.	H	α-helix	trans	-88.9	-13.5	178	-78.7	-178.3	168.9	171	0	114.3	L486 K487 R492 E596 E793	L486-K490 PolarHBondContact O-N 2.87Å; K487-K490 PolarHBondContact O-N 2.88Å; K490-R492 PolarHBondContact O-N 3.22Å; K490-E596 WeakPolarHBondContact CE-OE1 3.28Å; K490-E596 IonicContact NZ-OE1 2.85Å; K490-E596 PolarHBondContact NZ-OE1 3.38Å; K490-E793 IonicContact NZ-OE2 3.59Å
491	K	58.9	Low	69.5	Low	119 Å²	119	91.5 Å²	91.5	52%	0.517	44%	0.443	S	S	.	.	S	Bend	trans	-74.3	12.7	-164.2	-142.9	-171.4	-179.2	-175.5	0	116.8
492	R	49.7	Very low	68.9	Low	208 Å²	208	90.5 Å²	90.5	79%	0.785	44%	0.442	S	S	*	.	S	Bend	trans	-164.2	135.8	171.6	-113.9	168.7	-179.1	174.2	-0.9	111	K490	K490-R492 PolarHBondContact O-N 3.22Å
493	N	47.6	Very low	68.4	Low	113 Å²	113	94.2 Å²	94.2	60%	0.604	46%	0.46	S	S	*	.			trans	-15.4	123.8	-177.8	-61.5	8.6	0	0	0	115	T495	N493-T495 PolarHBondContact O-N 3.21Å
494	A	48.2	Very low	68.1	Low	108 Å²	108	98 Å²	98	89%	0.893	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-4.7	180	0	0	0	0	0	115	S496	A494-S496 PolarHBondContact O-N 3.48Å
495	T	48.1	Very low	68	Low	133 Å²	133	97.4 Å²	97.4	82%	0.816	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-2.2	-173.3	41.8	0	0	0	0	115.3	N493	N493-T495 PolarHBondContact O-N 3.21Å
496	S	48.5	Very low	68	Low	77 Å²	77	99.8 Å²	99.8	54%	0.538	49%	0.489	S	S	.	.			trans	-148.1	89.5	166.6	-155.9	0	0	0	0	112.7	A494 R498	A494-S496 PolarHBondContact O-N 3.48Å; S496-R498 PolarHBondContact O-N 3.16Å
497	Y	48.4	Very low	68.2	Low	173 Å²	173	101.2 Å²	101.2	68%	0.678	50%	0.499	S	S	*	.			trans	-65.7	77.3	167.7	-161.6	-97.5	0	0	0	109.9	V502	Y497-V502 HydrophobicContact CD1-CG2 4.47Å; Y497-V502 HydrophobicContact CE1-CG2 3.66Å; Y497-V502 HydrophobicContact CE2-CG2 3.97Å; Y497-V502 VanDerWaalsContact OH-CG2 3.28Å; Y497-V502 WeakPolarHBondContact OH-CG2 3.48Å
498	R	56.1	Low	68.6	Low	181 Å²	181	106 Å²	106	68%	0.683	52%	0.515	S	S	*	.			trans	-80.1	133.3	174.5	-74.3	-169.6	173.8	-165.8	-1.6	109.3	S496 S500 F501	S496-R498 PolarHBondContact O-N 3.16Å; R498-S500 PolarHBondContact O-N 3.47Å; R498-F501 WeakPolarHBondContact O-CB 3.42Å; R498-F501 PolarHBondContact O-N 2.95Å
499	R	59.9	Low	69.2	Low	236 Å²	236	105.5 Å²	105.5	89%	0.891	51%	0.509	S	S	*	.	H	α-helix	trans	-46.9	-35.2	174.1	-78	-176.3	174.5	176.6	-1.6	113.8	F501 V502 L503	R499-F501 PolarHBondContact O-N 3.35Å; R499-V502 PolarHBondContact O-N 2.83Å; R499-L503 PolarHBondContact O-N 3.48Å
500	S	67.8	Low	69.9	Low	71 Å²	71	106.3 Å²	106.3	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-58.9	-31.7	177.6	178.3	0	0	0	0	113.1	R498 N504	R498-S500 PolarHBondContact O-N 3.47Å; S500-N504 WeakPolarHBondContact O-CB 3.49Å; S500-N504 PolarHBondContact O-N 3.42Å; S500-N504 PolarHBondContact O-ND2 2.81Å; S500-N504 VanDerWaalsContact O-ND2 3.14Å
501	F	69.6	Low	71.1	Confident	50 Å²	50	105.5 Å²	105.5	22%	0.219	52%	0.517	C	S	.	.	H	α-helix	trans	-76.6	-43	-176.9	175.1	-104.3	0	0	0	112.9	G488 L489 R498 R499 L503 N504 A505	G488-F501 VanDerWaalsContact O-CE2 3.26Å; G488-F501 WeakPolarHBondContact O-CE2 3.48Å; G488-F501 WeakPolarHBondContact O-CZ 3.28Å; L489-F501 VanDerWaalsContact C-CE1 3.45Å; L489-F501 VanDerWaalsContact C-CZ 3.43Å; L489-F501 HydrophobicContact CB-CE1 4.26Å; L489-F501 HydrophobicContact CD2-CD1 4.21Å; L489-F501 HydrophobicContact CD2-CE1 4.09Å; L489-F501 WeakPolarHBondContact O-CE1 3.24Å; L489-F501 VanDerWaalsContact O-CZ 3.22Å; L489-F501 WeakPolarHBondContact O-CZ 3.19Å; R498-F501 WeakPolarHBondContact O-CB 3.42Å; R498-F501 PolarHBondContact O-N 2.95Å; R499-F501 PolarHBondContact O-N 3.35Å; F501-L503 VanDerWaalsContact C-N 3.28Å; F501-L503 PolarHBondContact O-N 3.49Å; F501-N504 PolarHBondContact O-N 3.03Å; F501-A505 PolarHBondContact O-N 3.35Å
502	V	81.4	Confident	72.8	Confident	35 Å²	35	100.6 Å²	100.6	21%	0.212	50%	0.497	C	S	.	.	H	α-helix	trans	-58.6	-44.9	171.9	-178.5	0	0	0	0	110.1	F485 L489 Y497 R499 N504 A505 F506	F485-V502 HydrophobicContact CE2-CG1 4.35Å; F485-V502 HydrophobicContact CZ-CG1 4.31Å; L489-V502 HydrophobicContact CD2-CB 4.34Å; L489-V502 HydrophobicContact CD2-CG1 4.45Å; L489-V502 HydrophobicContact CD2-CG2 3.99Å; Y497-V502 HydrophobicContact CD1-CG2 4.47Å; Y497-V502 HydrophobicContact CE1-CG2 3.66Å; Y497-V502 HydrophobicContact CE2-CG2 3.97Å; Y497-V502 VanDerWaalsContact OH-CG2 3.28Å; Y497-V502 WeakPolarHBondContact OH-CG2 3.48Å; R499-V502 PolarHBondContact O-N 2.83Å; V502-N504 PolarHBondContact O-N 3.44Å; V502-A505 PolarHBondContact O-N 3.39Å; V502-F506 VanDerWaalsContact O-CB 3.29Å; V502-F506 WeakPolarHBondContact O-CB 3.11Å; V502-F506 PolarHBondContact O-N 2.94Å
503	L	85.3	Confident	75	Confident	102 Å²	102	92 Å²	92	53%	0.534	47%	0.468	S	S	.	.	H	α-helix	trans	-61.4	-44.5	176.6	-175	63.5	0	0	0	111.6	R499 F501 F506 V507	R499-L503 PolarHBondContact O-N 3.48Å; F501-L503 VanDerWaalsContact C-N 3.28Å; F501-L503 PolarHBondContact O-N 3.49Å; L503-F506 PolarHBondContact O-N 3.4Å; L503-V507 HydrophobicContact CD1-CG2 4.14Å; L503-V507 HydrophobicContact CG-CG2 4.29Å; L503-V507 WeakPolarHBondContact O-CB 3.45Å; L503-V507 WeakPolarHBondContact O-CG2 3.44Å; L503-V507 PolarHBondContact O-N 3.36Å
504	N	85.5	Confident	77.3	Confident	84 Å²	84	92.7 Å²	92.7	45%	0.449	47%	0.466	S	S	.	.	H	α-helix	trans	-64.5	-42.1	178.3	-74.6	-25	0	0	0	112.8	S500 F501 V502 R508	S500-N504 WeakPolarHBondContact O-CB 3.49Å; S500-N504 PolarHBondContact O-N 3.42Å; S500-N504 PolarHBondContact O-ND2 2.81Å; S500-N504 VanDerWaalsContact O-ND2 3.14Å; F501-N504 PolarHBondContact O-N 3.03Å; V502-N504 PolarHBondContact O-N 3.44Å; N504-R508 WeakPolarHBondContact O-CB 3.42Å; N504-R508 WeakPolarHBondContact O-CG 3.33Å; N504-R508 PolarHBondContact O-N 3.44Å
505	A	86.8	Confident	79.7	Confident	6 Å²	6	90.1 Å²	90.1	5%	0.05	44%	0.436	C	S	.	.	H	α-helix	trans	-63.2	-45.1	175.5	0	0	0	0	0	110.9	F485 L489 F501 V502 R508 S509	F485-A505 HydrophobicContact CD2-CB 4.13Å; F485-A505 HydrophobicContact CE2-CB 4.37Å; L489-A505 HydrophobicContact CD2-CB 4.24Å; F501-A505 PolarHBondContact O-N 3.35Å; V502-A505 PolarHBondContact O-N 3.39Å; A505-R508 PolarHBondContact O-N 3.23Å; A505-S509 WeakPolarHBondContact O-CB 3.46Å; A505-S509 PolarHBondContact O-N 3.41Å; A505-S509 PolarHBondContact O-OG 3.38Å
506	F	90.8	Very high	82	Confident	96 Å²	96	83.9 Å²	83.9	42%	0.421	40%	0.398	S	S	.	.	H	α-helix	trans	-60.5	-52.6	176	-177.4	-99.8	0	0	0	111.7	F481 F485 V502 L503 R508 S509 V510	F481-F506 HydrophobicContact CE2-CD2 4.42Å; F481-F506 HydrophobicContact CE2-CE2 4.27Å; F481-F506 AromaticContact CZ-CD2 3.86Å; F481-F506 HydrophobicContact CZ-CD2 3.86Å; F481-F506 AromaticContact CZ-CE2 3.73Å; F481-F506 HydrophobicContact CZ-CE2 3.73Å; F485-F506 HydrophobicContact CD2-CB 4.23Å; F485-F506 HydrophobicContact CE2-CB 3.96Å; F485-F506 HydrophobicContact CE2-CD2 4.42Å; V502-F506 VanDerWaalsContact O-CB 3.29Å; V502-F506 WeakPolarHBondContact O-CB 3.11Å; V502-F506 PolarHBondContact O-N 2.94Å; L503-F506 PolarHBondContact O-N 3.4Å; F506-R508 VanDerWaalsContact C-N 3.33Å; F506-R508 PolarHBondContact O-N 2.95Å; F506-S509 WeakPolarHBondContact O-CB 3.5Å; F506-S509 PolarHBondContact O-N 2.6Å; F506-V510 HydrophobicContact CD1-CG2 3.99Å; F506-V510 HydrophobicContact CD2-CG2 4.44Å; F506-V510 HydrophobicContact CE1-CG2 3.63Å; F506-V510 HydrophobicContact CE2-CG2 4.12Å; F506-V510 HydrophobicContact CG-CG2 4.39Å; F506-V510 HydrophobicContact CZ-CG2 3.7Å; F506-V510 WeakPolarHBondContact O-CG2 3.46Å; F506-V510 PolarHBondContact O-N 3.02Å
507	V	90.9	Very high	84.4	Confident	77 Å²	77	82.4 Å²	82.4	47%	0.467	39%	0.388	S	S	.	.	H	α-helix	trans	-58.2	-42.7	-179.9	169.3	0	0	0	0	111.6	L503 S509 V510 L511	L503-V507 HydrophobicContact CD1-CG2 4.14Å; L503-V507 HydrophobicContact CG-CG2 4.29Å; L503-V507 WeakPolarHBondContact O-CB 3.45Å; L503-V507 WeakPolarHBondContact O-CG2 3.44Å; L503-V507 PolarHBondContact O-N 3.36Å; V507-S509 VanDerWaalsContact C-N 3.35Å; V507-S509 PolarHBondContact O-N 3.35Å; V507-V510 PolarHBondContact O-N 2.88Å; V507-L511 VanDerWaalsContact O-CB 3.27Å; V507-L511 WeakPolarHBondContact O-CB 3.19Å; V507-L511 PolarHBondContact O-N 2.91Å
508	R	89.2	Confident	86.7	Confident	178 Å²	178	76.4 Å²	76.4	67%	0.672	37%	0.371	S	S	*	.	H	α-helix	trans	-65.3	-38.6	176.3	-75.3	-179.9	175.4	-175.7	-1.6	112.7	N504 A505 F506 L511 T512	N504-R508 WeakPolarHBondContact O-CB 3.42Å; N504-R508 WeakPolarHBondContact O-CG 3.33Å; N504-R508 PolarHBondContact O-N 3.44Å; A505-R508 PolarHBondContact O-N 3.23Å; F506-R508 VanDerWaalsContact C-N 3.33Å; F506-R508 PolarHBondContact O-N 2.95Å; R508-L511 PolarHBondContact O-N 3.38Å; R508-T512 WeakPolarHBondContact O-CB 3.45Å; R508-T512 PolarHBondContact O-N 3Å; R508-T512 PolarHBondContact O-OG1 3.49Å
509	S	92.3	Very high	88.7	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.007	35%	0.349	C	S	.	.	H	α-helix	trans	-67.4	-45.4	178.1	-52.8	0	0	0	0	110.6	Q484 F485 A505 F506 V507 T512 V513	Q484-S509 VanDerWaalsContact C-OG 3.29Å; Q484-S509 WeakPolarHBondContact CB-OG 3.11Å; F485-S509 WeakPolarHBondContact CA-OG 3.15Å; F485-S509 PolarHBondContact N-OG 3.44Å; A505-S509 WeakPolarHBondContact O-CB 3.46Å; A505-S509 PolarHBondContact O-N 3.41Å; A505-S509 PolarHBondContact O-OG 3.38Å; F506-S509 WeakPolarHBondContact O-CB 3.5Å; F506-S509 PolarHBondContact O-N 2.6Å; V507-S509 VanDerWaalsContact C-N 3.35Å; V507-S509 PolarHBondContact O-N 3.35Å; S509-T512 WeakPolarHBondContact O-CB 3.37Å; S509-T512 PolarHBondContact O-N 3.27Å; S509-V513 PolarHBondContact O-N 2.95Å; S509-V513 VanDerWaalsContact O-N 3.1Å
510	V	94.7	Very high	90.5	Very high	60 Å²	60	60.2 Å²	60.2	36%	0.364	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-46.1	172.8	173.3	0	0	0	0	111	F481 F506 V507 T512 V513 F514	F481-V510 HydrophobicContact CE2-CG2 3.88Å; F506-V510 HydrophobicContact CD1-CG2 3.99Å; F506-V510 HydrophobicContact CD2-CG2 4.44Å; F506-V510 HydrophobicContact CE1-CG2 3.63Å; F506-V510 HydrophobicContact CE2-CG2 4.12Å; F506-V510 HydrophobicContact CG-CG2 4.39Å; F506-V510 HydrophobicContact CZ-CG2 3.7Å; F506-V510 WeakPolarHBondContact O-CG2 3.46Å; F506-V510 PolarHBondContact O-N 3.02Å; V507-V510 PolarHBondContact O-N 2.88Å; V510-T512 VanDerWaalsContact C-N 3.28Å; V510-T512 PolarHBondContact O-N 3.37Å; V510-V513 PolarHBondContact O-N 3.15Å; V510-F514 WeakPolarHBondContact O-CB 3.49Å; V510-F514 PolarHBondContact O-N 3Å
511	L	94.3	Very high	91.9	Very high	107 Å²	107	61.4 Å²	61.4	56%	0.56	32%	0.315	S	S	*	.	H	α-helix	trans	-61.9	-36.4	179	-176.9	64.1	0	0	0	112.1	V507 R508 F514 L515	V507-L511 VanDerWaalsContact O-CB 3.27Å; V507-L511 WeakPolarHBondContact O-CB 3.19Å; V507-L511 PolarHBondContact O-N 2.91Å; R508-L511 PolarHBondContact O-N 3.38Å; L511-F514 HydrophobicContact CD1-CD1 4.43Å; L511-L515 WeakPolarHBondContact O-CB 3.48Å; L511-L515 PolarHBondContact O-N 3.42Å
512	T	93.9	Very high	93.3	Very high	16 Å²	16	61.9 Å²	61.9	10%	0.098	33%	0.328	C	S	.	.	H	α-helix	trans	-65.4	-47.7	176.9	-56.5	0	0	0	0	110.8	F449 A460 V480 Q484 R508 S509 V510 L515 A516	F449-T512 HydrophobicContact CE1-CG2 3.78Å; F449-T512 HydrophobicContact CZ-CG2 4.31Å; A460-T512 HydrophobicContact CB-CG2 3.79Å; A460-T512 VanDerWaalsContact CB-O 3.24Å; A460-T512 WeakPolarHBondContact CB-O 3.05Å; V480-T512 HydrophobicContact CG1-CG2 4.02Å; Q484-T512 HydrophobicContact CG-CG2 4.4Å; R508-T512 WeakPolarHBondContact O-CB 3.45Å; R508-T512 PolarHBondContact O-N 3Å; R508-T512 PolarHBondContact O-OG1 3.49Å; S509-T512 WeakPolarHBondContact O-CB 3.37Å; S509-T512 PolarHBondContact O-N 3.27Å; V510-T512 VanDerWaalsContact C-N 3.28Å; V510-T512 PolarHBondContact O-N 3.37Å; T512-L515 PolarHBondContact O-N 3.23Å; T512-A516 PolarHBondContact O-N 2.91Å
513	V	95.4	Very high	94	Very high	28 Å²	28	62.5 Å²	62.5	17%	0.17	33%	0.33	C	S	.	.	H	α-helix	trans	-64.4	-44.6	175.5	173.2	0	0	0	0	111	I477 F481 S509 V510 L515 A516 C517	I477-V513 HydrophobicContact CG2-CB 4.49Å; I477-V513 HydrophobicContact CG2-CG1 3.61Å; I477-V513 HydrophobicContact CG2-CG2 4.06Å; F481-V513 HydrophobicContact CB-CG2 3.93Å; F481-V513 HydrophobicContact CD2-CG2 4.13Å; S509-V513 PolarHBondContact O-N 2.95Å; S509-V513 VanDerWaalsContact O-N 3.1Å; V510-V513 PolarHBondContact O-N 3.15Å; V513-L515 VanDerWaalsContact C-N 3.31Å; V513-L515 PolarHBondContact O-N 3.16Å; V513-A516 WeakPolarHBondContact O-CB 3.26Å; V513-A516 PolarHBondContact O-N 3.06Å; V513-A516 VanDerWaalsContact O-N 3.15Å; V513-C517 PolarHBondContact O-N 3.36Å; V513-C517 PolarHBondContact O-SG 2.98Å; V513-C517 VanDerWaalsContact O-SG 3.35Å
514	F	96.8	Very high	94.6	Very high	128 Å²	128	58.5 Å²	58.5	56%	0.561	31%	0.31	S	S	*	.	H	α-helix	trans	-57.7	-43.9	178.1	-179.4	-102.1	0	0	0	111.3	V510 L511 A516 C517 C518	V510-F514 WeakPolarHBondContact O-CB 3.49Å; V510-F514 PolarHBondContact O-N 3Å; L511-F514 HydrophobicContact CD1-CD1 4.43Å; F514-A516 PolarHBondContact O-N 3.46Å; F514-C517 CarbonylContact O-C 3.47Å; F514-C517 WeakPolarHBondContact O-CB 3.38Å; F514-C517 PolarHBondContact O-N 3.29Å; F514-C518 WeakPolarHBondContact CE1-SG 3.33Å; F514-C518 VanDerWaalsContact CZ-SG 3.51Å; F514-C518 WeakPolarHBondContact O-CB 3.26Å; F514-C518 PolarHBondContact O-N 3.39Å; F514-C518 PolarHBondContact O-SG 3.19Å
515	L	97.5	Very high	95.1	Very high	53 Å²	53	58 Å²	58	28%	0.277	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-42.9	176.2	-179.7	60.4	0	0	0	112.3	W457 A460 L511 T512 V513 C517 C518 V519	W457-L515 HydrophobicContact CB-CD2 3.75Å; W457-L515 VanDerWaalsContact O-CD2 3.24Å; W457-L515 WeakPolarHBondContact O-CD2 3.24Å; A460-L515 HydrophobicContact CB-CB 4.34Å; A460-L515 HydrophobicContact CB-CD2 4.27Å; A460-L515 HydrophobicContact CB-CG 4.38Å; L511-L515 WeakPolarHBondContact O-CB 3.48Å; L511-L515 PolarHBondContact O-N 3.42Å; T512-L515 PolarHBondContact O-N 3.23Å; V513-L515 VanDerWaalsContact C-N 3.31Å; V513-L515 PolarHBondContact O-N 3.16Å; L515-C517 VanDerWaalsContact C-N 3.32Å; L515-C517 PolarHBondContact O-N 3.41Å; L515-C518 PolarHBondContact O-N 2.94Å; L515-V519 HydrophobicContact CD1-CG2 4.4Å; L515-V519 WeakPolarHBondContact O-CG2 3.31Å; L515-V519 PolarHBondContact O-N 3.23Å
516	A	97.7	Very high	95.6	Very high	2 Å²	2	62.4 Å²	62.4	2%	0.017	33%	0.332	C	S	.	.	H	α-helix	trans	-60.4	-44	175.1	0	0	0	0	0	111.3	A460 G464 T512 V513 F514 V519 F520	A460-A516 HydrophobicContact CB-CB 4.22Å; A460-A516 WeakPolarHBondContact O-CA 3.28Å; A460-A516 WeakPolarHBondContact O-CB 3.21Å; G464-A516 VanDerWaalsContact CA-O 3.32Å; G464-A516 WeakPolarHBondContact CA-O 3.23Å; T512-A516 PolarHBondContact O-N 2.91Å; V513-A516 WeakPolarHBondContact O-CB 3.26Å; V513-A516 PolarHBondContact O-N 3.06Å; V513-A516 VanDerWaalsContact O-N 3.15Å; F514-A516 PolarHBondContact O-N 3.46Å; A516-V519 PolarHBondContact O-N 3.43Å; A516-F520 WeakPolarHBondContact O-CB 3.37Å; A516-F520 PolarHBondContact O-N 3.39Å
517	C	97.7	Very high	95.8	Very high	47 Å²	47	58.1 Å²	58.1	32%	0.318	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-42	174.4	-65.7	0	0	0	0	112.2	V513 F514 L515 F520 L521	V513-C517 PolarHBondContact O-N 3.36Å; V513-C517 PolarHBondContact O-SG 2.98Å; V513-C517 VanDerWaalsContact O-SG 3.35Å; F514-C517 CarbonylContact O-C 3.47Å; F514-C517 WeakPolarHBondContact O-CB 3.38Å; F514-C517 PolarHBondContact O-N 3.29Å; L515-C517 VanDerWaalsContact C-N 3.32Å; L515-C517 PolarHBondContact O-N 3.41Å; C517-F520 PolarHBondContact O-N 2.99Å; C517-L521 VanDerWaalsContact O-CB 3.28Å; C517-L521 WeakPolarHBondContact O-CB 3.47Å; C517-L521 VanDerWaalsContact O-CG 3.24Å; C517-L521 WeakPolarHBondContact O-CG 3.16Å; C517-L521 PolarHBondContact O-N 2.82Å
518	C	98.3	Very high	96.1	Very high	47 Å²	47	59.5 Å²	59.5	32%	0.318	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-43.6	177.3	-74.1	0	0	0	0	112.1	F514 L515 L521 A522	F514-C518 WeakPolarHBondContact CE1-SG 3.33Å; F514-C518 VanDerWaalsContact CZ-SG 3.51Å; F514-C518 WeakPolarHBondContact O-CB 3.26Å; F514-C518 PolarHBondContact O-N 3.39Å; F514-C518 PolarHBondContact O-SG 3.19Å; L515-C518 PolarHBondContact O-N 2.94Å; C518-L521 PolarHBondContact O-N 3.12Å; C518-A522 WeakPolarHBondContact O-CB 3.33Å; C518-A522 PolarHBondContact O-N 2.83Å
519	V	98.1	Very high	96.5	Very high	37 Å²	37	57.2 Å²	57.2	22%	0.224	31%	0.311	C	S	.	.	H	α-helix	trans	-65.4	-45.4	177.6	173.4	0	0	0	0	110.8	A461 L515 A516 L521 A522 L523	A461-V519 HydrophobicContact CB-CG2 4.12Å; L515-V519 HydrophobicContact CD1-CG2 4.4Å; L515-V519 WeakPolarHBondContact O-CG2 3.31Å; L515-V519 PolarHBondContact O-N 3.23Å; A516-V519 PolarHBondContact O-N 3.43Å; V519-L521 PolarHBondContact O-N 2.64Å; V519-A522 PolarHBondContact O-N 3.39Å; V519-L523 HydrophobicContact CG1-CD1 4.11Å; V519-L523 WeakPolarHBondContact O-CG 3.39Å; V519-L523 PolarHBondContact O-N 2.77Å
520	F	97.3	Very high	96.5	Very high	40 Å²	40	61 Å²	61	18%	0.175	34%	0.337	C	S	.	.	H	α-helix	trans	-57.1	-50.1	174.3	166.5	-107	0	0	0	111.7	I467 H468 L471 A516 C517 A522 L523 T524	I467-F520 HydrophobicContact CB-CD2 4.13Å; I467-F520 HydrophobicContact CG2-CD2 3.6Å; I467-F520 HydrophobicContact CG2-CE2 3.88Å; I467-F520 HydrophobicContact CG2-CG 4.06Å; H468-F520 HydrophobicContact CB-CD2 3.99Å; L471-F520 HydrophobicContact CD1-CE2 4.5Å; L471-F520 HydrophobicContact CD1-CZ 4.41Å; A516-F520 WeakPolarHBondContact O-CB 3.37Å; A516-F520 PolarHBondContact O-N 3.39Å; C517-F520 PolarHBondContact O-N 2.99Å; F520-A522 PolarHBondContact O-N 3.43Å; F520-L523 PolarHBondContact O-N 2.89Å; F520-T524 WeakPolarHBondContact CE2-OG1 3.35Å; F520-T524 VanDerWaalsContact O-CB 3.22Å; F520-T524 WeakPolarHBondContact O-CB 3.33Å; F520-T524 PolarHBondContact O-N 3.22Å; F520-T524 PolarHBondContact O-OG1 2.99Å
521	L	97.4	Very high	96.5	Very high	96 Å²	96	60 Å²	60	50%	0.503	33%	0.327	S	S	.	.	H	α-helix	trans	-65	-38	179.9	-74.5	169.3	0	0	0	111.9	C517 C518 V519 T524 T525	C517-L521 VanDerWaalsContact O-CB 3.28Å; C517-L521 WeakPolarHBondContact O-CB 3.47Å; C517-L521 VanDerWaalsContact O-CG 3.24Å; C517-L521 WeakPolarHBondContact O-CG 3.16Å; C517-L521 PolarHBondContact O-N 2.82Å; C518-L521 PolarHBondContact O-N 3.12Å; V519-L521 PolarHBondContact O-N 2.64Å; L521-T524 PolarHBondContact O-N 2.71Å; L521-T525 WeakPolarHBondContact O-CB 3.37Å; L521-T525 PolarHBondContact O-N 3.49Å; L521-T525 PolarHBondContact O-OG1 3.43Å
522	A	98	Very high	96.5	Very high	60 Å²	60	56.1 Å²	56.1	50%	0.496	31%	0.312	S	S	.	.	H	α-helix	trans	-65.1	-47.4	178.4	0	0	0	0	0	111.6	C518 V519 F520 T525 L526	C518-A522 WeakPolarHBondContact O-CB 3.33Å; C518-A522 PolarHBondContact O-N 2.83Å; V519-A522 PolarHBondContact O-N 3.39Å; F520-A522 PolarHBondContact O-N 3.43Å; A522-T525 PolarHBondContact O-N 3.15Å; A522-L526 WeakPolarHBondContact O-CB 3.33Å; A522-L526 PolarHBondContact O-N 3.15Å
523	L	97	Very high	96.5	Very high	47 Å²	47	61.8 Å²	61.8	25%	0.246	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-41.3	176.8	-68.2	174	0	0	0	111.9	A465 H468 V519 F520 L526 C527	A465-L523 HydrophobicContact CB-CD1 4.21Å; H468-L523 HydrophobicContact CB-CB 4.14Å; H468-L523 HydrophobicContact CB-CD1 3.91Å; V519-L523 HydrophobicContact CG1-CD1 4.11Å; V519-L523 WeakPolarHBondContact O-CG 3.39Å; V519-L523 PolarHBondContact O-N 2.77Å; F520-L523 PolarHBondContact O-N 2.89Å; L523-L526 PolarHBondContact O-N 3.43Å; L523-C527 PolarHBondContact O-N 3.34Å; L523-C527 PolarHBondContact O-SG 2.97Å
524	T	96.3	Very high	96.4	Very high	19 Å²	19	62.4 Å²	62.4	12%	0.117	35%	0.346	C	S	.	.	H	α-helix	trans	-65.2	-44	177.3	-58.1	0	0	0	0	111.1	H468 F520 L521 C527 Y528 Y535 L540	H468-T524 PolarHBondContact ND1-N 3Å; H468-T524 PolarHBondContact ND1-OG1 3.49Å; F520-T524 WeakPolarHBondContact CE2-OG1 3.35Å; F520-T524 VanDerWaalsContact O-CB 3.22Å; F520-T524 WeakPolarHBondContact O-CB 3.33Å; F520-T524 PolarHBondContact O-N 3.22Å; F520-T524 PolarHBondContact O-OG1 2.99Å; L521-T524 PolarHBondContact O-N 2.71Å; T524-C527 PolarHBondContact O-N 2.96Å; T524-Y528 WeakPolarHBondContact O-CB 3.41Å; T524-Y528 PolarHBondContact O-N 3.1Å; T524-Y535 HydrophobicContact CG2-CE1 3.79Å; T524-Y535 WeakPolarHBondContact O-CE1 3.47Å; T524-L540 HydrophobicContact CG2-CD1 3.8Å
525	T	97.4	Very high	96.3	Very high	73 Å²	73	56.4 Å²	56.4	45%	0.448	32%	0.319	S	S	.	.	H	α-helix	trans	-63.8	-42.2	176.3	-57.7	0	0	0	0	111.1	L521 A522 C527 Y528 I529	L521-T525 WeakPolarHBondContact O-CB 3.37Å; L521-T525 PolarHBondContact O-N 3.49Å; L521-T525 PolarHBondContact O-OG1 3.43Å; A522-T525 PolarHBondContact O-N 3.15Å; T525-C527 PolarHBondContact O-N 3.44Å; T525-Y528 PolarHBondContact O-N 2.98Å; T525-I529 HydrophobicContact CG2-CD1 3.96Å; T525-I529 HydrophobicContact CG2-CG1 4.43Å; T525-I529 VanDerWaalsContact O-CG1 3.28Å; T525-I529 WeakPolarHBondContact O-CG1 3.48Å; T525-I529 PolarHBondContact O-N 3.33Å
526	L	96.4	Very high	96.1	Very high	98 Å²	98	57 Å²	57	51%	0.513	32%	0.322	S	S	.	.	H	α-helix	trans	-59.1	-48.1	175.4	-179.4	65.3	0	0	0	111.3	A522 L523 Y528 I529 C530	A522-L526 WeakPolarHBondContact O-CB 3.33Å; A522-L526 PolarHBondContact O-N 3.15Å; L523-L526 PolarHBondContact O-N 3.43Å; L526-Y528 VanDerWaalsContact C-N 3.33Å; L526-Y528 PolarHBondContact O-N 2.9Å; L526-I529 PolarHBondContact O-N 3.49Å; L526-C530 PolarHBondContact O-N 3.43Å; L526-C530 PolarHBondContact O-SG 3.34Å; L526-C530 VanDerWaalsContact O-SG 3.35Å
527	C	96.2	Very high	95.9	Very high	6 Å²	6	60.6 Å²	60.6	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-65.3	-36.5	177.4	-68.1	0	0	0	0	112.4	P373 L523 T524 T525 C530 Y531 Y535	P373-C527 HydrophobicContact CG-CB 4.22Å; L523-C527 PolarHBondContact O-N 3.34Å; L523-C527 PolarHBondContact O-SG 2.97Å; T524-C527 PolarHBondContact O-N 2.96Å; T525-C527 PolarHBondContact O-N 3.44Å; C527-C530 PolarHBondContact O-N 3.1Å; C527-Y531 WeakPolarHBondContact O-CD2 3.48Å; C527-Y531 PolarHBondContact O-N 3.48Å; C527-Y535 HydrophobicContact CB-CD1 3.77Å; C527-Y535 HydrophobicContact CB-CE1 3.54Å; C527-Y535 HydrophobicContact CB-CE2 4.34Å; C527-Y535 HydrophobicContact CB-CG 4.26Å
528	Y	96.4	Very high	95.6	Very high	107 Å²	107	62 Å²	62	42%	0.42	34%	0.343	S	S	.	.	H	α-helix	trans	-66.2	-40.4	175.5	180	-99.6	0	0	0	112.2	T524 T525 L526 C530 Y531 G532	T524-Y528 WeakPolarHBondContact O-CB 3.41Å; T524-Y528 PolarHBondContact O-N 3.1Å; T525-Y528 PolarHBondContact O-N 2.98Å; L526-Y528 VanDerWaalsContact C-N 3.33Å; L526-Y528 PolarHBondContact O-N 2.9Å; Y528-C530 PolarHBondContact O-N 3.21Å; Y528-Y531 PolarHBondContact O-N 2.92Å; Y528-G532 WeakPolarHBondContact CD2-O 3.4Å; Y528-G532 VanDerWaalsContact O-CA 3.25Å; Y528-G532 WeakPolarHBondContact O-CA 3.38Å; Y528-G532 PolarHBondContact O-N 3.44Å
529	I	96.7	Very high	95.3	Very high	130 Å²	130	60.3 Å²	60.3	67%	0.667	33%	0.333	S	S	*	.	H	α-helix	trans	-60.7	-37.4	174.3	-69.8	164.8	0	0	0	110.7	T525 L526	T525-I529 HydrophobicContact CG2-CD1 3.96Å; T525-I529 HydrophobicContact CG2-CG1 4.43Å; T525-I529 VanDerWaalsContact O-CG1 3.28Å; T525-I529 WeakPolarHBondContact O-CG1 3.48Å; T525-I529 PolarHBondContact O-N 3.33Å; L526-I529 PolarHBondContact O-N 3.49Å
530	C	93.5	Very high	94.9	Very high	80 Å²	80	59.8 Å²	59.8	54%	0.541	33%	0.328	S	S	.	.	H	α-helix	trans	-76.6	-34.3	180	-64.8	0	0	0	0	114.2	L526 C527 Y528	L526-C530 PolarHBondContact O-N 3.43Å; L526-C530 PolarHBondContact O-SG 3.34Å; L526-C530 VanDerWaalsContact O-SG 3.35Å; C527-C530 PolarHBondContact O-N 3.1Å; Y528-C530 PolarHBondContact O-N 3.21Å
531	Y	94.5	Very high	94.5	Very high	39 Å²	39	62.1 Å²	62.1	15%	0.153	34%	0.343	C	S	.	.	H	α-helix	trans	-129.9	-2.9	-166.8	-59.6	-69.6	0	0	0	115.6	P363 F364 P373 W377 C527 Y528	P363-Y531 HydrophobicContact CG-CD1 4.36Å; P363-Y531 HydrophobicContact CG-CE1 3.96Å; F364-Y531 HydrophobicContact CD2-CG 4.41Å; F364-Y531 HydrophobicContact CE2-CD2 4.49Å; F364-Y531 HydrophobicContact CE2-CG 4.09Å; P373-Y531 HydrophobicContact CB-CD2 3.64Å; P373-Y531 HydrophobicContact CB-CE2 3.19Å; P373-Y531 HydrophobicContact CG-CD2 3.46Å; P373-Y531 VanDerWaalsContact CG-CD2 3.46Å; P373-Y531 HydrophobicContact CG-CE2 3.61Å; P373-Y531 HydrophobicContact CG-CG 4.32Å; W377-Y531 AromaticContact NE1-CZ 3.94Å; W377-Y531 PolarHBondContact NE1-OH 3.11Å; C527-Y531 WeakPolarHBondContact O-CD2 3.48Å; C527-Y531 PolarHBondContact O-N 3.48Å; Y528-Y531 PolarHBondContact O-N 2.92Å
532	G	93.8	Very high	94.1	Very high	25 Å²	25	60.9 Å²	60.9	26%	0.258	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	-147.6	175.3	0	0	0	0	0	114.5	Y528 A534 Y535	Y528-G532 WeakPolarHBondContact CD2-O 3.4Å; Y528-G532 VanDerWaalsContact O-CA 3.25Å; Y528-G532 WeakPolarHBondContact O-CA 3.38Å; Y528-G532 PolarHBondContact O-N 3.44Å; G532-A534 PolarHBondContact O-N 2.86Å; G532-Y535 PolarHBondContact O-N 3.14Å
533	E	94.3	Very high	93.6	Very high	136 Å²	136	61.1 Å²	61.1	64%	0.636	32%	0.322	S	S	*	.	H	α-helix	trans	-61	-28.9	-176.1	-64.5	-173.6	173.7	0	0	113.5	Y535 L536 N537	E533-Y535 VanDerWaalsContact C-N 3.27Å; E533-Y535 PolarHBondContact O-N 2.95Å; E533-L536 PolarHBondContact O-N 3.23Å; E533-L536 VanDerWaalsContact O-N 3.14Å; E533-N537 WeakPolarHBondContact O-CB 3.41Å; E533-N537 PolarHBondContact O-N 3.28Å; E533-N537 PolarHBondContact O-ND2 3.48Å
534	A	93.2	Very high	92.9	Very high	40 Å²	40	62.6 Å²	62.6	33%	0.331	33%	0.333	S	S	.	.	H	α-helix	trans	-57	-41.5	178.8	0	0	0	0	0	111.8	F364 G532 E538	F364-A534 HydrophobicContact CB-CB 4.1Å; F364-A534 HydrophobicContact CD2-CB 4.11Å; F364-A534 HydrophobicContact CG-CB 4.13Å; G532-A534 PolarHBondContact O-N 2.86Å; A534-E538 VanDerWaalsContact O-CB 3.3Å; A534-E538 WeakPolarHBondContact O-CB 3.33Å; A534-E538 WeakPolarHBondContact O-CG 3.47Å; A534-E538 PolarHBondContact O-N 3.17Å
535	Y	94.7	Very high	92.2	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.008	36%	0.355	C	S	.	.	H	α-helix	trans	-64.8	-46.7	175.8	166.1	-123.6	0	0	0	112.3	F364 P373 H468 T524 C527 G532 E533 N537 A539 L540	F364-Y535 HydrophobicContact CE2-CD2 4.39Å; F364-Y535 HydrophobicContact CE2-CG 4.48Å; F364-Y535 AromaticContact CZ-CD2 3.78Å; F364-Y535 HydrophobicContact CZ-CD2 3.78Å; F364-Y535 HydrophobicContact CZ-CG 4.26Å; P373-Y535 HydrophobicContact CG-CD2 4.03Å; P373-Y535 HydrophobicContact CG-CE2 4.5Å; P373-Y535 HydrophobicContact CG-CG 4.47Å; H468-Y535 PolarHBondContact CE1-OH 2.87Å; H468-Y535 PolarHBondContact ND1-OH 3.41Å; T524-Y535 HydrophobicContact CG2-CE1 3.79Å; T524-Y535 WeakPolarHBondContact O-CE1 3.47Å; C527-Y535 HydrophobicContact CB-CD1 3.77Å; C527-Y535 HydrophobicContact CB-CE1 3.54Å; C527-Y535 HydrophobicContact CB-CE2 4.34Å; C527-Y535 HydrophobicContact CB-CG 4.26Å; G532-Y535 PolarHBondContact O-N 3.14Å; E533-Y535 VanDerWaalsContact C-N 3.27Å; E533-Y535 PolarHBondContact O-N 2.95Å; Y535-N537 PolarHBondContact O-N 3.05Å; Y535-A539 HydrophobicContact CD2-CB 3.56Å; Y535-A539 HydrophobicContact CE2-CB 3.58Å; Y535-A539 VanDerWaalsContact O-CB 3.31Å; Y535-A539 WeakPolarHBondContact O-CB 3.17Å; Y535-A539 PolarHBondContact O-N 2.91Å; Y535-L540 HydrophobicContact CE1-CD1 4.35Å
536	L	93.2	Very high	91.6	Very high	65 Å²	65	63.5 Å²	63.5	34%	0.34	34%	0.344	S	S	.	.	I	π-helix	trans	-64.4	-42.9	-177.7	-174.8	63.8	0	0	0	111.2	E533 L540 L541	E533-L536 PolarHBondContact O-N 3.23Å; E533-L536 VanDerWaalsContact O-N 3.14Å; L536-L540 HydrophobicContact CD1-CB 4.27Å; L536-L540 HydrophobicContact CD1-CD1 3.79Å; L536-L540 WeakPolarHBondContact O-CB 3.4Å; L536-L540 PolarHBondContact O-N 3.2Å; L536-L541 HydrophobicContact CD1-CG 4.48Å; L536-L541 HydrophobicContact CD2-CD1 4.3Å; L536-L541 HydrophobicContact CG-CD1 3.93Å; L536-L541 HydrophobicContact CG-CG 4.17Å; L536-L541 WeakPolarHBondContact O-CG 3.36Å; L536-L541 PolarHBondContact O-N 3.09Å
537	N	93.6	Very high	90.8	Very high	78 Å²	78	61 Å²	61	42%	0.417	33%	0.333	S	S	.	.	I	π-helix	trans	-69.1	-49.6	-178.9	-69.5	-21.2	0	0	0	111.5	E533 Y535 Y542	E533-N537 WeakPolarHBondContact O-CB 3.41Å; E533-N537 PolarHBondContact O-N 3.28Å; E533-N537 PolarHBondContact O-ND2 3.48Å; Y535-N537 PolarHBondContact O-N 3.05Å; N537-Y542 VanDerWaalsContact O-CB 3.3Å; N537-Y542 WeakPolarHBondContact O-CB 3.42Å; N537-Y542 PolarHBondContact O-N 3.46Å
538	E	92	Very high	90.1	Very high	76 Å²	76	61.9 Å²	61.9	36%	0.355	34%	0.337	S	S	.	.	I	π-helix	trans	-82.8	-41.5	-172.6	-66.4	-64.7	161.3	0	0	114	F364 A534 Y542	F364-E538 HydrophobicContact CD1-CB 3.78Å; F364-E538 HydrophobicContact CD1-CG 4.14Å; F364-E538 HydrophobicContact CE1-CB 3.96Å; A534-E538 VanDerWaalsContact O-CB 3.3Å; A534-E538 WeakPolarHBondContact O-CB 3.33Å; A534-E538 WeakPolarHBondContact O-CG 3.47Å; A534-E538 PolarHBondContact O-N 3.17Å; E538-Y542 WeakPolarHBondContact O-CB 3.28Å
539	A	90.4	Very high	89.1	Confident	12 Å²	12	60.1 Å²	60.1	10%	0.099	33%	0.334	C	S	.	.	I	π-helix	trans	-93.9	-17.7	-172.9	0	0	0	0	0	114.1	F364 Y535 H543	F364-A539 HydrophobicContact CE1-CB 4.36Å; Y535-A539 HydrophobicContact CD2-CB 3.56Å; Y535-A539 HydrophobicContact CE2-CB 3.58Å; Y535-A539 VanDerWaalsContact O-CB 3.31Å; Y535-A539 WeakPolarHBondContact O-CB 3.17Å; Y535-A539 PolarHBondContact O-N 2.91Å; A539-H543 PolarHBondContact O-CD2 2.89Å
540	L	90.8	Very high	88.1	Confident	26 Å²	26	59.6 Å²	59.6	14%	0.136	32%	0.324	C	S	.	.	I	π-helix	trans	-120.9	-66.5	-177.9	-64.4	175.7	0	0	0	112.3	T524 Y535 L536 Y542 H543	T524-L540 HydrophobicContact CG2-CD1 3.8Å; Y535-L540 HydrophobicContact CE1-CD1 4.35Å; L536-L540 HydrophobicContact CD1-CB 4.27Å; L536-L540 HydrophobicContact CD1-CD1 3.79Å; L536-L540 WeakPolarHBondContact O-CB 3.4Å; L536-L540 PolarHBondContact O-N 3.2Å; L540-Y542 VanDerWaalsContact C-N 3.32Å; L540-Y542 PolarHBondContact O-N 3.15Å; L540-H543 PolarHBondContact O-N 3Å
541	L	89.7	Confident	87.4	Confident	90 Å²	90	60.1 Å²	60.1	47%	0.471	32%	0.318	S	S	.	.	I	π-helix	trans	-65.4	-34.8	-172.3	-67.9	176.3	0	0	0	112.8	L536 H543 V544 G545	L536-L541 HydrophobicContact CD1-CG 4.48Å; L536-L541 HydrophobicContact CD2-CD1 4.3Å; L536-L541 HydrophobicContact CG-CD1 3.93Å; L536-L541 HydrophobicContact CG-CG 4.17Å; L536-L541 WeakPolarHBondContact O-CG 3.36Å; L536-L541 PolarHBondContact O-N 3.09Å; L541-H543 PolarHBondContact O-N 3.31Å; L541-H543 VanDerWaalsContact O-N 3.16Å; L541-V544 PolarHBondContact O-N 2.93Å; L541-G545 PolarHBondContact O-N 2.96Å
542	Y	88.7	Confident	87.2	Confident	70 Å²	70	58.5 Å²	58.5	28%	0.275	31%	0.312	S	S	.	.	H	α-helix	trans	-49.9	-41.4	174.4	-179.5	-97.1	0	0	0	112.2	R370 N537 E538 L540 V544 G545 R546	R370-Y542 VanDerWaalsContact CD-CE1 3.47Å; R370-Y542 HydrophobicContact CG-CD1 4.24Å; R370-Y542 VanDerWaalsContact NE-CE1 3.33Å; R370-Y542 PolarHBondContact NH1-OH 3.43Å; R370-Y542 PolarHBondContact NH2-OH 3.47Å; N537-Y542 VanDerWaalsContact O-CB 3.3Å; N537-Y542 WeakPolarHBondContact O-CB 3.42Å; N537-Y542 PolarHBondContact O-N 3.46Å; E538-Y542 WeakPolarHBondContact O-CB 3.28Å; L540-Y542 VanDerWaalsContact C-N 3.32Å; L540-Y542 PolarHBondContact O-N 3.15Å; Y542-V544 VanDerWaalsContact C-N 3.32Å; Y542-V544 PolarHBondContact O-N 2.88Å; Y542-G545 PolarHBondContact O-N 3.42Å; Y542-R546 HydrophobicContact CE1-CB 4.34Å; Y542-R546 HydrophobicContact CE1-CG 4.03Å; Y542-R546 WeakPolarHBondContact O-CB 3.28Å; Y542-R546 PolarHBondContact O-N 3.28Å
543	H	87.7	Confident	87.2	Confident	65 Å²	65	57.7 Å²	57.7	30%	0.301	30%	0.301	S	S	.	.	H	α-helix	trans	-73.3	-20.2	-176.8	-68.7	-71.2	0	0	0	114.4	A539 L540 L541	A539-H543 PolarHBondContact O-CD2 2.89Å; L540-H543 PolarHBondContact O-N 3Å; L541-H543 PolarHBondContact O-N 3.31Å; L541-H543 VanDerWaalsContact O-N 3.16Å
544	V	82	Confident	87.2	Confident	77 Å²	77	51.6 Å²	51.6	47%	0.467	27%	0.274	S	S	.	.	H	α-helix	trans	-74.6	-47.8	176	-178.4	0	0	0	0	110	L541 Y542 K615	L541-V544 PolarHBondContact O-N 2.93Å; Y542-V544 VanDerWaalsContact C-N 3.32Å; Y542-V544 PolarHBondContact O-N 2.88Å; V544-K615 PolarHBondContact O-NZ 3.45Å
545	G	80.1	Confident	87	Confident	57 Å²	57	50.9 Å²	50.9	59%	0.588	27%	0.268	S	S	*	.	H	α-helix	trans	-80.3	-15.7	-179	0	0	0	0	0	114.7	L541 Y542 T547	L541-G545 PolarHBondContact O-N 2.96Å; Y542-G545 PolarHBondContact O-N 3.42Å; G545-T547 PolarHBondContact O-N 3.41Å
546	R	84.9	Confident	86.8	Confident	55 Å²	55	53.2 Å²	53.2	21%	0.208	28%	0.277	C	S	.	.			trans	-51.9	126.9	-175.1	-169.6	175.5	178.7	168	-9.3	112.4	Y542 D548 K615 V616	Y542-R546 HydrophobicContact CE1-CB 4.34Å; Y542-R546 HydrophobicContact CE1-CG 4.03Å; Y542-R546 WeakPolarHBondContact O-CB 3.28Å; Y542-R546 PolarHBondContact O-N 3.28Å; R546-D548 WeakPolarHBondContact CG-OD1 3.19Å; R546-D548 IonicContact CZ-OD1 2.61Å; R546-D548 IonicContact CZ-OD2 2.69Å; R546-D548 VanDerWaalsContact NE-CG 3.27Å; R546-D548 IonicContact NE-OD1 3.51Å; R546-D548 PolarHBondContact NE-OD1 3.47Å; R546-D548 IonicContact NE-OD2 3.15Å; R546-D548 PolarHBondContact NE-OD2 2.96Å; R546-D548 IonicContact NH2-OD1 3.55Å; R546-D548 IonicContact NH2-OD2 3.68Å; R546-D548 PolarHBondContact NH2-OD2 2.98Å; R546-K615 VanDerWaalsContact O-CE 3.3Å; R546-K615 WeakPolarHBondContact O-CE 3.47Å; R546-K615 PolarHBondContact O-NZ 3.31Å; R546-K615 VanDerWaalsContact O-NZ 3.12Å; R546-V616 HydrophobicContact CG-CG2 4.44Å
547	T	79.7	Confident	86.7	Confident	46 Å²	46	50.2 Å²	50.2	28%	0.282	26%	0.261	S	S	.	.			trans	-128.6	114.1	167	55.9	0	0	0	0	107.3	G545 L560	G545-T547 PolarHBondContact O-N 3.41Å; T547-L560 HydrophobicContact CG2-CD1 4.18Å
548	D	81.7	Confident	86.6	Confident	23 Å²	23	48 Å²	48	12%	0.123	25%	0.248	C	C	.	.			trans	-96.2	110.7	-180	-75.7	-4	0	0	0	108.3	R546 N552 V616	R546-D548 WeakPolarHBondContact CG-OD1 3.19Å; R546-D548 IonicContact CZ-OD1 2.61Å; R546-D548 IonicContact CZ-OD2 2.69Å; R546-D548 VanDerWaalsContact NE-CG 3.27Å; R546-D548 IonicContact NE-OD1 3.51Å; R546-D548 PolarHBondContact NE-OD1 3.47Å; R546-D548 IonicContact NE-OD2 3.15Å; R546-D548 PolarHBondContact NE-OD2 2.96Å; R546-D548 IonicContact NH2-OD1 3.55Å; R546-D548 IonicContact NH2-OD2 3.68Å; R546-D548 PolarHBondContact NH2-OD2 2.98Å; D548-N552 HydrophobicContact CB-CB 4.01Å; D548-N552 VanDerWaalsContact O-CB 3.3Å; D548-N552 WeakPolarHBondContact O-CB 3.28Å; D548-N552 PolarHBondContact O-ND2 3.24Å; D548-V616 HydrophobicContact CB-CG1 4.24Å; D548-V616 HydrophobicContact CB-CG2 4.29Å; D548-V616 VanDerWaalsContact OD2-CG1 3.29Å; D548-V616 WeakPolarHBondContact OD2-CG1 3.39Å
549	I	76.1	Confident	86.4	Confident	70 Å²	70	46.4 Å²	46.4	36%	0.359	24%	0.244	S	C	.	.	S	Bend	trans	-83	-23.7	176.7	56	161.9	0	0	0	112.4	Y561	I549-Y561 HydrophobicContact CB-CD2 4.26Å; I549-Y561 HydrophobicContact CG2-CD2 4.04Å
550	R	75.4	Confident	86.2	Confident	120 Å²	120	46.2 Å²	46.2	45%	0.453	24%	0.241	S	C	.	.	S	Bend	trans	-118.2	153.7	175.2	-62.3	-175.5	-174.4	-160.1	4.8	108.7	N552 E665	R550-N552 VanDerWaalsContact C-N 3.3Å; R550-N552 PolarHBondContact O-N 3.15Å; R550-E665 IonicContact NH1-OE2 3.72Å; R550-E665 PolarHBondContact NH1-OE2 3.24Å
551	H	77.8	Confident	86	Confident	91 Å²	91	49.6 Å²	49.6	42%	0.421	25%	0.253	S	S	.	.	S	Bend	trans	60.6	31.4	178.1	-53.1	95.1	0	0	0	115.3	E665	H551-E665 IonicContact CE1-OE1 2.86Å; H551-E665 IonicContact CE1-OE2 3.66Å
552	N	90.8	Very high	85.8	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	26%	0.259	C	S	.	.			trans	-122.4	110.8	-176.1	-171.6	3.5	0	0	0	111.8	D548 R550 S554 F557 K615 V616 C617 W657	D548-N552 HydrophobicContact CB-CB 4.01Å; D548-N552 VanDerWaalsContact O-CB 3.3Å; D548-N552 WeakPolarHBondContact O-CB 3.28Å; D548-N552 PolarHBondContact O-ND2 3.24Å; R550-N552 VanDerWaalsContact C-N 3.3Å; R550-N552 PolarHBondContact O-N 3.15Å; N552-S554 PolarHBondContact O-N 3.22Å; N552-S554 WeakPolarHBondContact OD1-CB 3.33Å; N552-S554 PolarHBondContact OD1-N 3.28Å; N552-F557 HydrophobicContact CB-CB 4.02Å; N552-K615 PolarHBondContact ND2-O 3.48Å; N552-V616 WeakPolarHBondContact OD1-CA 3.36Å; N552-C617 PolarHBondContact OD1-N 3.35Å; N552-C617 PolarHBondContact OD1-O 3.33Å; N552-W657 WeakPolarHBondContact O-CZ2 3.34Å
553	F	94	Very high	85.6	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.039	25%	0.253	C	S	.	.			trans	-67.6	-15.3	175.7	-75.1	-97.1	0	0	0	112.9	C617 F622 Q654 W657 S679 F682	F553-C617 HydrophobicContact CB-CB 4.1Å; F553-C617 WeakPolarHBondContact CD2-O 3.28Å; F553-C617 PolarHBondContact N-O 3.3Å; F553-F622 HydrophobicContact CD1-CZ 4.41Å; F553-F622 HydrophobicContact CD2-CZ 4.3Å; F553-F622 HydrophobicContact CE2-CZ 4.42Å; F553-F622 HydrophobicContact CG-CZ 4.3Å; F553-Q654 HydrophobicContact CE1-CB 4.24Å; F553-Q654 HydrophobicContact CE1-CG 4.17Å; F553-W657 HydrophobicContact CD1-CB 4.21Å; F553-W657 AromaticContact CD1-CD2 3.55Å; F553-W657 HydrophobicContact CD1-CD2 3.55Å; F553-W657 AromaticContact CD1-CE2 3.93Å; F553-W657 AromaticContact CD1-CE3 3.9Å; F553-W657 HydrophobicContact CD1-CE3 3.9Å; F553-W657 AromaticContact CD1-CG 3.67Å; F553-W657 HydrophobicContact CD1-CG 3.67Å; F553-W657 HydrophobicContact CD2-CE3 4.37Å; F553-W657 HydrophobicContact CD2-CH2 4.28Å; F553-W657 HydrophobicContact CD2-CZ2 4.41Å; F553-W657 HydrophobicContact CD2-CZ3 4.25Å; F553-W657 HydrophobicContact CE1-CB 3.91Å; F553-W657 AromaticContact CE1-CD2 3.44Å; F553-W657 HydrophobicContact CE1-CD2 3.44Å; F553-W657 VanDerWaalsContact CE1-CD2 3.44Å; F553-W657 AromaticContact CE1-CE3 3.36Å; F553-W657 HydrophobicContact CE1-CE3 3.36Å; F553-W657 AromaticContact CE1-CG 3.68Å; F553-W657 HydrophobicContact CE1-CG 3.68Å; F553-W657 HydrophobicContact CE1-CZ3 4.11Å; F553-W657 HydrophobicContact CE2-CD2 4.43Å; F553-W657 AromaticContact CE2-CE3 3.89Å; F553-W657 HydrophobicContact CE2-CE3 3.89Å; F553-W657 HydrophobicContact CE2-CH2 4.2Å; F553-W657 AromaticContact CE2-CZ3 3.75Å; F553-W657 HydrophobicContact CE2-CZ3 3.75Å; F553-W657 HydrophobicContact CG-CD2 4.11Å; F553-W657 HydrophobicContact CG-CE3 4.38Å; F553-W657 HydrophobicContact CG-CZ2 4.36Å; F553-W657 AromaticContact CZ-CD2 3.92Å; F553-W657 HydrophobicContact CZ-CD2 3.92Å; F553-W657 AromaticContact CZ-CE3 3.35Å; F553-W657 HydrophobicContact CZ-CE3 3.35Å; F553-W657 HydrophobicContact CZ-CH2 4.48Å; F553-W657 AromaticContact CZ-CZ3 3.68Å; F553-W657 HydrophobicContact CZ-CZ3 3.68Å; F553-S679 WeakPolarHBondContact O-CB 3.32Å; F553-S679 PolarHBondContact O-OG 3.5Å; F553-F682 HydrophobicContact CB-CD1 3.95Å; F553-F682 HydrophobicContact CB-CE1 3.81Å; F553-F682 HydrophobicContact CB-CG 4.47Å; F553-F682 HydrophobicContact CB-CZ 4.19Å; F553-F682 HydrophobicContact CD1-CD1 4.4Å; F553-F682 AromaticContact CD1-CD2 3.86Å; F553-F682 HydrophobicContact CD1-CD2 3.86Å; F553-F682 AromaticContact CD1-CE2 3.96Å; F553-F682 HydrophobicContact CD1-CE2 3.96Å; F553-F682 HydrophobicContact CD1-CG 4.09Å; F553-F682 HydrophobicContact CD1-CZ 4.3Å; F553-F682 HydrophobicContact CE1-CD2 4.48Å; F553-F682 HydrophobicContact CG-CZ 4.45Å
554	S	93.7	Very high	84.5	Confident	8 Å²	8	47.7 Å²	47.7	6%	0.056	26%	0.259	C	S	.	.	S	Bend	trans	-71.9	130.6	-176.7	-172.5	0	0	0	0	112.2	N552 Y556 F557 N614 K615	N552-S554 PolarHBondContact O-N 3.22Å; N552-S554 WeakPolarHBondContact OD1-CB 3.33Å; N552-S554 PolarHBondContact OD1-N 3.28Å; S554-Y556 PolarHBondContact O-N 3.41Å; S554-Y556 VanDerWaalsContact OG-CD2 3.31Å; S554-Y556 WeakPolarHBondContact OG-CD2 3.39Å; S554-Y556 PolarHBondContact OG-N 2.93Å; S554-F557 VanDerWaalsContact O-CD1 3.22Å; S554-F557 WeakPolarHBondContact O-CD1 3.32Å; S554-F557 PolarHBondContact O-N 3.44Å; S554-F557 VanDerWaalsContact O-N 3.1Å; S554-N614 WeakPolarHBondContact CB-O 3.47Å; S554-N614 PolarHBondContact OG-O 2.8Å; S554-K615 VanDerWaalsContact CB-O 3.28Å; S554-K615 WeakPolarHBondContact CB-O 3.33Å; S554-K615 PolarHBondContact OG-O 2.85Å
555	A	90.7	Very high	83.8	Confident	24 Å²	24	50.9 Å²	50.9	20%	0.198	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-14	176.7	0	0	0	0	0	113.9	F557 P559 W676 V680	A555-F557 VanDerWaalsContact C-N 3.28Å; A555-F557 PolarHBondContact O-N 2.96Å; A555-P559 WeakPolarHBondContact O-CD 3.36Å; A555-W676 PolarHBondContact O-NE1 3.43Å; A555-W676 VanDerWaalsContact O-NE1 3.13Å; A555-V680 HydrophobicContact CB-CG2 4.11Å
556	Y	90.1	Very high	83.1	Confident	51 Å²	51	57 Å²	57	20%	0.2	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-21.7	174.8	-70.2	-75.9	0	0	0	113.6	S554 F558 P559 L560 L575 A579 K615	S554-Y556 PolarHBondContact O-N 3.41Å; S554-Y556 VanDerWaalsContact OG-CD2 3.31Å; S554-Y556 WeakPolarHBondContact OG-CD2 3.39Å; S554-Y556 PolarHBondContact OG-N 2.93Å; Y556-F558 VanDerWaalsContact C-N 3.29Å; Y556-F558 PolarHBondContact O-N 3.11Å; Y556-P559 WeakPolarHBondContact O-CD 3.34Å; Y556-L560 WeakPolarHBondContact O-CB 3.46Å; Y556-L560 WeakPolarHBondContact O-CD1 3.5Å; Y556-L560 VanDerWaalsContact O-CG 3.23Å; Y556-L560 WeakPolarHBondContact O-CG 3.38Å; Y556-L560 PolarHBondContact O-N 3.46Å; Y556-L560 VanDerWaalsContact O-N 3.17Å; Y556-L575 HydrophobicContact CD1-CD1 4.09Å; Y556-L575 HydrophobicContact CD1-CG 4.31Å; Y556-L575 HydrophobicContact CE1-CD1 4Å; Y556-A579 HydrophobicContact CD2-CB 4.4Å; Y556-A579 HydrophobicContact CE1-CB 4.05Å; Y556-A579 HydrophobicContact CE2-CB 3.9Å; Y556-K615 HydrophobicContact CD2-CB 4.31Å; Y556-K615 HydrophobicContact CG-CB 4.35Å
557	F	90.9	Very high	82.1	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.009	32%	0.317	C	S	.	.	H	α-helix	trans	-58	-41.5	-174.6	91.2	-98.8	0	0	0	112.1	N552 S554 A555 Y561 Y672 L675 W676	N552-F557 HydrophobicContact CB-CB 4.02Å; S554-F557 VanDerWaalsContact O-CD1 3.22Å; S554-F557 WeakPolarHBondContact O-CD1 3.32Å; S554-F557 PolarHBondContact O-N 3.44Å; S554-F557 VanDerWaalsContact O-N 3.1Å; A555-F557 VanDerWaalsContact C-N 3.28Å; A555-F557 PolarHBondContact O-N 2.96Å; F557-Y561 VanDerWaalsContact O-CB 3.24Å; F557-Y561 WeakPolarHBondContact O-CB 3.48Å; F557-Y561 PolarHBondContact O-N 2.85Å; F557-Y672 HydrophobicContact CE2-CD1 4.2Å; F557-L675 HydrophobicContact CE1-CD2 4.44Å; F557-L675 HydrophobicContact CE1-CG 4.12Å; F557-L675 HydrophobicContact CE2-CD2 4.36Å; F557-L675 HydrophobicContact CZ-CB 4.14Å; F557-L675 HydrophobicContact CZ-CD2 3.9Å; F557-L675 HydrophobicContact CZ-CG 3.84Å; F557-W676 HydrophobicContact CE1-CB 4.22Å; F557-W676 HydrophobicContact CZ-CB 4.11Å
558	F	90.9	Very high	81.8	Confident	33 Å²	33	63 Å²	63	15%	0.145	31%	0.314	C	S	.	.	H	α-helix	trans	-77.4	-46.9	-171.7	-176.4	-120.9	0	0	0	113.1	Y556 L560 Y561 L562 L673 W676	Y556-F558 VanDerWaalsContact C-N 3.29Å; Y556-F558 PolarHBondContact O-N 3.11Å; F558-L560 VanDerWaalsContact C-N 3.29Å; F558-L560 PolarHBondContact O-N 3.26Å; F558-Y561 HydrophobicContact CD2-CD1 4.25Å; F558-Y561 HydrophobicContact CE2-CD1 4.41Å; F558-Y561 WeakPolarHBondContact O-CB 3.33Å; F558-Y561 PolarHBondContact O-N 2.9Å; F558-Y561 VanDerWaalsContact O-N 3.11Å; F558-L562 HydrophobicContact CD1-CD1 4.16Å; F558-L562 HydrophobicContact CD2-CG 4.39Å; F558-L562 HydrophobicContact CE1-CD1 3.73Å; F558-L562 HydrophobicContact CE1-CG 4.44Å; F558-L562 HydrophobicContact CE2-CD1 4.24Å; F558-L562 HydrophobicContact CE2-CD2 4.07Å; F558-L562 HydrophobicContact CE2-CG 4.09Å; F558-L562 HydrophobicContact CZ-CD1 3.78Å; F558-L562 HydrophobicContact CZ-CD2 4.15Å; F558-L562 HydrophobicContact CZ-CG 4.13Å; F558-L562 WeakPolarHBondContact O-CG 3.42Å; F558-L562 PolarHBondContact O-N 3.3Å; F558-L673 HydrophobicContact CE1-CD1 4.37Å; F558-W676 HydrophobicContact CB-CB 3.82Å; F558-W676 HydrophobicContact CB-CG 3.69Å; F558-W676 HydrophobicContact CD1-CB 3.84Å; F558-W676 AromaticContact CD1-CD1 3.94Å; F558-W676 AromaticContact CD1-CD2 3.94Å; F558-W676 HydrophobicContact CD1-CD2 3.94Å; F558-W676 AromaticContact CD1-CG 3.6Å; F558-W676 HydrophobicContact CD1-CG 3.6Å; F558-W676 HydrophobicContact CG-CB 3.9Å; F558-W676 AromaticContact CG-CG 3.93Å; F558-W676 HydrophobicContact CG-CG 3.93Å
559	P	88.8	Confident	81.6	Confident	41 Å²	41	66.9 Å²	66.9	27%	0.266	33%	0.334	S	S	.	.	H	α-helix	trans	-57.5	-40.6	170	-27	36	0	0	0	113	A555 Y556 Y561 L562 L563 L575	A555-P559 WeakPolarHBondContact O-CD 3.36Å; Y556-P559 WeakPolarHBondContact O-CD 3.34Å; P559-Y561 VanDerWaalsContact C-N 3.27Å; P559-Y561 PolarHBondContact O-N 3.39Å; P559-L562 PolarHBondContact O-N 2.94Å; P559-L563 WeakPolarHBondContact O-CB 3.26Å; P559-L563 WeakPolarHBondContact O-CD1 3.25Å; P559-L563 WeakPolarHBondContact O-CG 3.43Å; P559-L563 PolarHBondContact O-N 2.9Å; P559-L575 HydrophobicContact CB-CD2 3.69Å
560	L	86.2	Confident	82	Confident	9 Å²	9	69.8 Å²	69.8	5%	0.047	35%	0.35	C	S	.	.	H	α-helix	trans	-68.6	-26.7	177.1	-68.6	173	0	0	0	113	T547 Y556 F558 K572 L575	T547-L560 HydrophobicContact CG2-CD1 4.18Å; Y556-L560 WeakPolarHBondContact O-CB 3.46Å; Y556-L560 WeakPolarHBondContact O-CD1 3.5Å; Y556-L560 VanDerWaalsContact O-CG 3.23Å; Y556-L560 WeakPolarHBondContact O-CG 3.38Å; Y556-L560 PolarHBondContact O-N 3.46Å; Y556-L560 VanDerWaalsContact O-N 3.17Å; F558-L560 VanDerWaalsContact C-N 3.29Å; F558-L560 PolarHBondContact O-N 3.26Å; L560-K572 HydrophobicContact CD2-CG 3.82Å; L560-L575 HydrophobicContact CD2-CB 4.39Å; L560-L575 HydrophobicContact CD2-CD2 4Å; L560-L575 HydrophobicContact CD2-CG 4.26Å; L560-L575 HydrophobicContact CG-CD2 4.27Å
561	Y	86	Confident	82.4	Confident	97 Å²	97	69.1 Å²	69.1	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-74.3	-41.1	173.2	172.3	-104.3	0	0	0	112.1	I549 F557 F558 P559 Y672	I549-Y561 HydrophobicContact CB-CD2 4.26Å; I549-Y561 HydrophobicContact CG2-CD2 4.04Å; F557-Y561 VanDerWaalsContact O-CB 3.24Å; F557-Y561 WeakPolarHBondContact O-CB 3.48Å; F557-Y561 PolarHBondContact O-N 2.85Å; F558-Y561 HydrophobicContact CD2-CD1 4.25Å; F558-Y561 HydrophobicContact CE2-CD1 4.41Å; F558-Y561 WeakPolarHBondContact O-CB 3.33Å; F558-Y561 PolarHBondContact O-N 2.9Å; F558-Y561 VanDerWaalsContact O-N 3.11Å; P559-Y561 VanDerWaalsContact C-N 3.27Å; P559-Y561 PolarHBondContact O-N 3.39Å; Y561-Y672 HydrophobicContact CE1-CD2 4.43Å; Y561-Y672 HydrophobicContact CE1-CE2 4.42Å
562	L	86.6	Confident	82.7	Confident	113 Å²	113	66.1 Å²	66.1	59%	0.592	34%	0.34	S	S	*	.	H	α-helix	trans	-71	-33.9	178.4	-68.3	178	0	0	0	112.9	F558 P559 G564	F558-L562 HydrophobicContact CD1-CD1 4.16Å; F558-L562 HydrophobicContact CD2-CG 4.39Å; F558-L562 HydrophobicContact CE1-CD1 3.73Å; F558-L562 HydrophobicContact CE1-CG 4.44Å; F558-L562 HydrophobicContact CE2-CD1 4.24Å; F558-L562 HydrophobicContact CE2-CD2 4.07Å; F558-L562 HydrophobicContact CE2-CG 4.09Å; F558-L562 HydrophobicContact CZ-CD1 3.78Å; F558-L562 HydrophobicContact CZ-CD2 4.15Å; F558-L562 HydrophobicContact CZ-CG 4.13Å; F558-L562 WeakPolarHBondContact O-CG 3.42Å; F558-L562 PolarHBondContact O-N 3.3Å; P559-L562 PolarHBondContact O-N 2.94Å; L562-G564 VanDerWaalsContact C-N 3.3Å; L562-G564 PolarHBondContact O-N 3.45Å
563	L	82.7	Confident	82.4	Confident	31 Å²	31	68.5 Å²	68.5	16%	0.162	36%	0.355	C	S	.	.	S	Bend	trans	-74.9	87.1	173	-63.6	165.3	0	0	0	108.2	P559 A568 L571 K572 L575	P559-L563 WeakPolarHBondContact O-CB 3.26Å; P559-L563 WeakPolarHBondContact O-CD1 3.25Å; P559-L563 WeakPolarHBondContact O-CG 3.43Å; P559-L563 PolarHBondContact O-N 2.9Å; L563-A568 HydrophobicContact CB-CB 4.42Å; L563-A568 HydrophobicContact CD2-CB 3.69Å; L563-L571 HydrophobicContact CD1-CD2 3.77Å; L563-L571 HydrophobicContact CD2-CB 4.37Å; L563-L571 HydrophobicContact CD2-CD2 3.39Å; L563-L571 HydrophobicContact CD2-CG 4.48Å; L563-L571 HydrophobicContact CG-CD2 4.22Å; L563-K572 HydrophobicContact CB-CB 4.16Å; L563-K572 HydrophobicContact CD1-CB 4.46Å; L563-L575 HydrophobicContact CD1-CD2 4.04Å
564	G	65.4	Low	82	Confident	41 Å²	41	73 Å²	73	42%	0.423	38%	0.379	S	S	.	.			trans	-50.2	155.2	173.5	0	0	0	0	0	112.1	L562 E566	L562-G564 VanDerWaalsContact C-N 3.3Å; L562-G564 PolarHBondContact O-N 3.45Å; G564-E566 VanDerWaalsContact C-N 3.32Å; G564-E566 PolarHBondContact O-N 3.34Å
565	E	67.3	Low	81.6	Confident	144 Å²	144	74.7 Å²	74.7	67%	0.673	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-32.2	-170.7	-71.2	-168.6	157	0	0	114.1	K572	E565-K572 IonicContact OE1-NZ 3.38Å
566	E	66.5	Low	81.3	Confident	184 Å²	184	74.3 Å²	74.3	86%	0.86	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-54.9	-174.4	-65.2	-170.5	165.3	0	0	113.3	G564 A568	G564-E566 VanDerWaalsContact C-N 3.32Å; G564-E566 PolarHBondContact O-N 3.34Å; E566-A568 VanDerWaalsContact C-N 3.31Å; E566-A568 PolarHBondContact O-N 3.43Å
567	E	62.5	Low	81	Confident	201 Å²	201	78.4 Å²	78.4	94%	0.939	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-21.7	-166.8	-66.7	-170.7	163.8	0	0	114.3
568	A	73.1	Confident	80.7	Confident	27 Å²	27	81 Å²	81	22%	0.223	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.6	30.7	-175.1	0	0	0	0	0	113.9	L563 E566 L570 L571 K572	L563-A568 HydrophobicContact CB-CB 4.42Å; L563-A568 HydrophobicContact CD2-CB 3.69Å; E566-A568 VanDerWaalsContact C-N 3.31Å; E566-A568 PolarHBondContact O-N 3.43Å; A568-L570 VanDerWaalsContact C-N 3.26Å; A568-L570 PolarHBondContact O-N 3.06Å; A568-L570 VanDerWaalsContact O-N 3.17Å; A568-L571 HydrophobicContact CB-CB 4.32Å; A568-L571 PolarHBondContact O-N 3.07Å; A568-K572 PolarHBondContact O-N 3.4Å
569	L	79.3	Confident	80.3	Confident	104 Å²	104	79.5 Å²	79.5	55%	0.545	41%	0.411	S	S	.	.	H	α-helix	trans	-50.7	-43.3	-177.7	-177.4	63.3	0	0	0	113	L571 K572 T573	L569-L571 PolarHBondContact O-N 2.81Å; L569-K572 PolarHBondContact O-N 2.91Å; L569-T573 WeakPolarHBondContact O-CB 3.44Å; L569-T573 PolarHBondContact O-N 3.43Å; L569-T573 PolarHBondContact O-OG1 3.21Å
570	L	82.5	Confident	80.2	Confident	132 Å²	132	81 Å²	81	69%	0.691	41%	0.413	S	S	*	.	H	α-helix	trans	-60.9	-46.3	177.9	180	64.7	0	0	0	111.3	A568 T573 L574	A568-L570 VanDerWaalsContact C-N 3.26Å; A568-L570 PolarHBondContact O-N 3.06Å; A568-L570 VanDerWaalsContact O-N 3.17Å; L570-T573 PolarHBondContact O-N 3.2Å; L570-L574 HydrophobicContact CD1-CD1 4.24Å; L570-L574 HydrophobicContact CD1-CG 4.31Å; L570-L574 HydrophobicContact CG-CD1 4.06Å; L570-L574 WeakPolarHBondContact O-CB 3.28Å; L570-L574 VanDerWaalsContact O-CG 3.25Å; L570-L574 WeakPolarHBondContact O-CG 3.27Å; L570-L574 PolarHBondContact O-N 2.9Å
571	L	84.4	Confident	80.3	Confident	105 Å²	105	85 Å²	85	55%	0.55	44%	0.438	S	S	.	.	H	α-helix	trans	-67.9	-42.8	-179.1	-155.4	100.9	0	0	0	111.4	L563 A568 L569 T573 L574 L575	L563-L571 HydrophobicContact CD1-CD2 3.77Å; L563-L571 HydrophobicContact CD2-CB 4.37Å; L563-L571 HydrophobicContact CD2-CD2 3.39Å; L563-L571 HydrophobicContact CD2-CG 4.48Å; L563-L571 HydrophobicContact CG-CD2 4.22Å; A568-L571 HydrophobicContact CB-CB 4.32Å; A568-L571 PolarHBondContact O-N 3.07Å; L569-L571 PolarHBondContact O-N 2.81Å; L571-T573 VanDerWaalsContact C-N 3.3Å; L571-T573 PolarHBondContact O-N 3.33Å; L571-L574 PolarHBondContact O-N 2.85Å; L571-L575 VanDerWaalsContact O-CB 3.3Å; L571-L575 WeakPolarHBondContact O-CB 3.27Å; L571-L575 PolarHBondContact O-N 3.44Å
572	K	84.2	Confident	80.4	Confident	29 Å²	29	83.9 Å²	83.9	13%	0.126	44%	0.438	C	S	.	.	H	α-helix	trans	-57.7	-44.5	173.9	-175	-179.7	-178.7	176	0	111	L560 L563 E565 A568 L569 L575 S576	L560-K572 HydrophobicContact CD2-CG 3.82Å; L563-K572 HydrophobicContact CB-CB 4.16Å; L563-K572 HydrophobicContact CD1-CB 4.46Å; E565-K572 IonicContact OE1-NZ 3.38Å; A568-K572 PolarHBondContact O-N 3.4Å; L569-K572 PolarHBondContact O-N 2.91Å; K572-L575 PolarHBondContact O-N 2.96Å; K572-S576 WeakPolarHBondContact O-CB 3.46Å; K572-S576 PolarHBondContact O-N 2.93Å
573	T	84.2	Confident	80.6	Confident	53 Å²	53	78.8 Å²	78.8	33%	0.325	41%	0.411	S	S	.	.	H	α-helix	trans	-65.8	-48.6	179.3	-61	0	0	0	0	111.4	L569 L570 L571 L575 S576 Y577	L569-T573 WeakPolarHBondContact O-CB 3.44Å; L569-T573 PolarHBondContact O-N 3.43Å; L569-T573 PolarHBondContact O-OG1 3.21Å; L570-T573 PolarHBondContact O-N 3.2Å; L571-T573 VanDerWaalsContact C-N 3.3Å; L571-T573 PolarHBondContact O-N 3.33Å; T573-L575 VanDerWaalsContact C-N 3.33Å; T573-L575 PolarHBondContact O-N 3.16Å; T573-S576 PolarHBondContact O-N 3.12Å; T573-Y577 HydrophobicContact CG2-CD2 3.53Å; T573-Y577 HydrophobicContact CG2-CE2 3.27Å; T573-Y577 WeakPolarHBondContact O-CD2 3.4Å; T573-Y577 PolarHBondContact O-N 3.34Å
574	L	86.1	Confident	81	Confident	104 Å²	104	83.7 Å²	83.7	55%	0.545	43%	0.432	S	S	.	.	H	α-helix	trans	-60.7	-41.5	176.2	-72.5	174.1	0	0	0	112	L570 L571 Y577 S578	L570-L574 HydrophobicContact CD1-CD1 4.24Å; L570-L574 HydrophobicContact CD1-CG 4.31Å; L570-L574 HydrophobicContact CG-CD1 4.06Å; L570-L574 WeakPolarHBondContact O-CB 3.28Å; L570-L574 VanDerWaalsContact O-CG 3.25Å; L570-L574 WeakPolarHBondContact O-CG 3.27Å; L570-L574 PolarHBondContact O-N 2.9Å; L571-L574 PolarHBondContact O-N 2.85Å; L574-Y577 PolarHBondContact O-N 3.48Å; L574-S578 WeakPolarHBondContact O-CB 3.44Å; L574-S578 PolarHBondContact O-N 2.76Å; L574-S578 PolarHBondContact O-OG 3.26Å
575	L	85.7	Confident	82.4	Confident	44 Å²	44	87.4 Å²	87.4	23%	0.23	44%	0.439	C	S	.	.	H	α-helix	trans	-66.4	-41.7	176.7	-177.8	61.9	0	0	0	112.2	Y556 P559 L560 L563 L571 K572 T573 S578 A579	Y556-L575 HydrophobicContact CD1-CD1 4.09Å; Y556-L575 HydrophobicContact CD1-CG 4.31Å; Y556-L575 HydrophobicContact CE1-CD1 4Å; P559-L575 HydrophobicContact CB-CD2 3.69Å; L560-L575 HydrophobicContact CD2-CB 4.39Å; L560-L575 HydrophobicContact CD2-CD2 4Å; L560-L575 HydrophobicContact CD2-CG 4.26Å; L560-L575 HydrophobicContact CG-CD2 4.27Å; L563-L575 HydrophobicContact CD1-CD2 4.04Å; L571-L575 VanDerWaalsContact O-CB 3.3Å; L571-L575 WeakPolarHBondContact O-CB 3.27Å; L571-L575 PolarHBondContact O-N 3.44Å; K572-L575 PolarHBondContact O-N 2.96Å; T573-L575 VanDerWaalsContact C-N 3.33Å; T573-L575 PolarHBondContact O-N 3.16Å; L575-S578 PolarHBondContact O-N 3.42Å; L575-S578 PolarHBondContact O-OG 3.18Å; L575-A579 PolarHBondContact O-N 3.3Å
576	S	83.6	Confident	83.6	Confident	16 Å²	16	82.9 Å²	82.9	11%	0.112	42%	0.42	C	S	.	.	H	α-helix	trans	-62.8	-42.1	175.1	172.8	0	0	0	0	111.5	K572 T573 F580 K615	K572-S576 WeakPolarHBondContact O-CB 3.46Å; K572-S576 PolarHBondContact O-N 2.93Å; T573-S576 PolarHBondContact O-N 3.12Å; S576-F580 VanDerWaalsContact O-CD2 3.32Å; S576-F580 WeakPolarHBondContact O-CD2 3.44Å; S576-K615 PolarHBondContact OG-NZ 2.96Å
577	Y	84.4	Confident	85.1	Confident	137 Å²	137	74.9 Å²	74.9	54%	0.537	38%	0.382	S	S	.	.	H	α-helix	trans	-74.2	-32.4	178.7	-73.6	-56.6	0	0	0	113.5	T573 L574 A579 F580 V581	T573-Y577 HydrophobicContact CG2-CD2 3.53Å; T573-Y577 HydrophobicContact CG2-CE2 3.27Å; T573-Y577 WeakPolarHBondContact O-CD2 3.4Å; T573-Y577 PolarHBondContact O-N 3.34Å; L574-Y577 PolarHBondContact O-N 3.48Å; Y577-A579 VanDerWaalsContact C-N 3.27Å; Y577-A579 PolarHBondContact O-N 2.89Å; Y577-F580 PolarHBondContact O-N 3.32Å; Y577-F580 VanDerWaalsContact O-N 3.1Å; Y577-V581 PolarHBondContact O-N 2.84Å; Y577-V581 VanDerWaalsContact O-N 3.14Å
578	S	83.8	Confident	86.6	Confident	56 Å²	56	66.7 Å²	66.7	39%	0.392	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-33.8	179.2	70.3	0	0	0	0	112.4	L574 L575 F580 V581 L582	L574-S578 WeakPolarHBondContact O-CB 3.44Å; L574-S578 PolarHBondContact O-N 2.76Å; L574-S578 PolarHBondContact O-OG 3.26Å; L575-S578 PolarHBondContact O-N 3.42Å; L575-S578 PolarHBondContact O-OG 3.18Å; S578-F580 VanDerWaalsContact C-N 3.32Å; S578-F580 PolarHBondContact O-N 3.15Å; S578-V581 PolarHBondContact O-N 3Å; S578-L582 PolarHBondContact O-N 3.45Å
579	A	83.7	Confident	87.7	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.008	36%	0.358	C	S	.	.	H	α-helix	trans	-58	-43.6	172.5	0	0	0	0	0	111.9	Y556 L575 Y577 Q583 K615	Y556-A579 HydrophobicContact CD2-CB 4.4Å; Y556-A579 HydrophobicContact CE1-CB 4.05Å; Y556-A579 HydrophobicContact CE2-CB 3.9Å; L575-A579 PolarHBondContact O-N 3.3Å; Y577-A579 VanDerWaalsContact C-N 3.27Å; Y577-A579 PolarHBondContact O-N 2.89Å; A579-Q583 WeakPolarHBondContact O-CG 3.31Å; A579-Q583 PolarHBondContact O-N 3.22Å; A579-K615 HydrophobicContact CB-CB 4.27Å
580	F	85.7	Confident	88.5	Confident	73 Å²	73	63.5 Å²	63.5	32%	0.32	34%	0.336	S	S	.	.	H	α-helix	trans	-68.9	-35.1	178.2	-72.9	-70	0	0	0	113.3	S576 Y577 S578 Q583 F584 K615	S576-F580 VanDerWaalsContact O-CD2 3.32Å; S576-F580 WeakPolarHBondContact O-CD2 3.44Å; Y577-F580 PolarHBondContact O-N 3.32Å; Y577-F580 VanDerWaalsContact O-N 3.1Å; S578-F580 VanDerWaalsContact C-N 3.32Å; S578-F580 PolarHBondContact O-N 3.15Å; F580-Q583 PolarHBondContact O-N 3.39Å; F580-F584 WeakPolarHBondContact O-CB 3.25Å; F580-F584 PolarHBondContact O-N 3.3Å; F580-K615 HydrophobicContact CE2-CD 4.15Å; F580-K615 HydrophobicContact CZ-CD 4.47Å
581	V	88.5	Confident	89.2	Confident	93 Å²	93	57.2 Å²	57.2	56%	0.564	30%	0.303	S	S	*	.	H	α-helix	trans	-62.6	-46.6	177.9	174.8	0	0	0	0	110.6	Y577 S578 Q583 F584 M585	Y577-V581 PolarHBondContact O-N 2.84Å; Y577-V581 VanDerWaalsContact O-N 3.14Å; S578-V581 PolarHBondContact O-N 3Å; V581-Q583 PolarHBondContact O-N 2.84Å; V581-F584 PolarHBondContact O-N 3.04Å; V581-M585 WeakPolarHBondContact O-CG 3.43Å; V581-M585 PolarHBondContact O-N 3.28Å
582	L	88.2	Confident	89.5	Confident	73 Å²	73	57.9 Å²	57.9	38%	0.382	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-44.8	177.8	179.4	59.8	0	0	0	111.6	S578 F584 M585 L586 F613	S578-L582 PolarHBondContact O-N 3.45Å; L582-F584 VanDerWaalsContact C-N 3.34Å; L582-F584 PolarHBondContact O-N 3.48Å; L582-M585 PolarHBondContact O-N 3.48Å; L582-L586 HydrophobicContact CD1-CD1 4.3Å; L582-L586 HydrophobicContact CD1-CG 4.38Å; L582-L586 HydrophobicContact CG-CD1 4.23Å; L582-L586 WeakPolarHBondContact O-CG 3.44Å; L582-L586 PolarHBondContact O-N 2.96Å; L582-F613 HydrophobicContact CD2-CD1 3.58Å; L582-F613 HydrophobicContact CD2-CE1 3.87Å; L582-F613 HydrophobicContact CD2-CG 4.43Å; L582-F613 HydrophobicContact CG-CD1 4.34Å
583	Q	91	Very high	89.8	Confident	6 Å²	6	60.7 Å²	60.7	3%	0.028	33%	0.325	C	S	.	.	H	α-helix	trans	-57.9	-46.7	175.3	-72.3	179.1	-41	0	0	111.8	A579 F580 V581 M585 L586 I587 F610 F613	A579-Q583 WeakPolarHBondContact O-CG 3.31Å; A579-Q583 PolarHBondContact O-N 3.22Å; F580-Q583 PolarHBondContact O-N 3.39Å; V581-Q583 PolarHBondContact O-N 2.84Å; Q583-M585 PolarHBondContact O-N 2.97Å; Q583-L586 PolarHBondContact O-N 3.24Å; Q583-I587 WeakPolarHBondContact O-CB 3.19Å; Q583-I587 WeakPolarHBondContact O-CD1 3.38Å; Q583-I587 WeakPolarHBondContact O-CG1 3.38Å; Q583-I587 PolarHBondContact O-N 2.86Å; Q583-F610 PolarHBondContact NE2-O 3.3Å; Q583-F613 HydrophobicContact CG-CB 3.83Å; Q583-F613 PolarHBondContact NE2-O 3.25Å
584	F	91.5	Very high	90.1	Very high	135 Å²	135	60 Å²	60	59%	0.592	32%	0.317	S	S	*	.	H	α-helix	trans	-60.9	-44.9	-179.7	-179	-97.8	0	0	0	112.1	F580 V581 L582 L586 I587 A588	F580-F584 WeakPolarHBondContact O-CB 3.25Å; F580-F584 PolarHBondContact O-N 3.3Å; V581-F584 PolarHBondContact O-N 3.04Å; L582-F584 VanDerWaalsContact C-N 3.34Å; L582-F584 PolarHBondContact O-N 3.48Å; F584-L586 PolarHBondContact O-N 2.89Å; F584-I587 PolarHBondContact O-N 2.97Å; F584-A588 WeakPolarHBondContact O-CB 3.34Å; F584-A588 PolarHBondContact O-N 3.31Å
585	M	93.4	Very high	90.3	Very high	119 Å²	119	55 Å²	55	59%	0.586	29%	0.291	S	S	*	.	H	α-helix	trans	-61.9	-42.9	177.7	-67.9	-61.7	-69.1	0	0	111.9	V581 L582 Q583 A588 A589	V581-M585 WeakPolarHBondContact O-CG 3.43Å; V581-M585 PolarHBondContact O-N 3.28Å; L582-M585 PolarHBondContact O-N 3.48Å; Q583-M585 PolarHBondContact O-N 2.97Å; M585-A588 PolarHBondContact O-N 3.47Å; M585-A589 WeakPolarHBondContact O-CB 3.24Å; M585-A589 PolarHBondContact O-N 3.32Å
586	L	94.1	Very high	90.2	Very high	49 Å²	49	55 Å²	55	26%	0.257	29%	0.29	S	S	.	.	H	α-helix	trans	-65.2	-46	176.8	-72.5	173.1	0	0	0	111.9	L582 Q583 F584 A588 A589 I590 F613	L582-L586 HydrophobicContact CD1-CD1 4.3Å; L582-L586 HydrophobicContact CD1-CG 4.38Å; L582-L586 HydrophobicContact CG-CD1 4.23Å; L582-L586 WeakPolarHBondContact O-CG 3.44Å; L582-L586 PolarHBondContact O-N 2.96Å; Q583-L586 PolarHBondContact O-N 3.24Å; F584-L586 PolarHBondContact O-N 2.89Å; L586-A588 VanDerWaalsContact C-N 3.31Å; L586-A588 PolarHBondContact O-N 2.88Å; L586-A589 PolarHBondContact O-N 2.67Å; L586-I590 WeakPolarHBondContact O-CB 3.35Å; L586-I590 WeakPolarHBondContact O-CD1 3.17Å; L586-I590 WeakPolarHBondContact O-CG1 3.37Å; L586-I590 PolarHBondContact O-N 2.65Å; L586-F613 HydrophobicContact CD1-CD2 3.65Å; L586-F613 HydrophobicContact CD1-CE2 3.68Å; L586-F613 HydrophobicContact CD1-CG 4.16Å; L586-F613 HydrophobicContact CD1-CZ 4.2Å
587	I	96.9	Very high	90.1	Very high	15 Å²	15	56.7 Å²	56.7	8%	0.077	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-44.6	177.8	-68.3	163.8	0	0	0	110.4	I475 P478 Q583 F584 A591 T606 F610	I475-I587 HydrophobicContact CB-CD1 3.97Å; I475-I587 HydrophobicContact CG2-CD1 3.73Å; I475-I587 WeakPolarHBondContact O-CG2 3.31Å; P478-I587 HydrophobicContact CG-CG2 4.15Å; Q583-I587 WeakPolarHBondContact O-CB 3.19Å; Q583-I587 WeakPolarHBondContact O-CD1 3.38Å; Q583-I587 WeakPolarHBondContact O-CG1 3.38Å; Q583-I587 PolarHBondContact O-N 2.86Å; F584-I587 PolarHBondContact O-N 2.97Å; I587-A591 VanDerWaalsContact O-CB 3.3Å; I587-A591 WeakPolarHBondContact O-CB 3.45Å; I587-A591 PolarHBondContact O-N 2.91Å; I587-T606 HydrophobicContact CB-CG2 4.46Å; I587-T606 HydrophobicContact CG1-CG2 4Å; I587-T606 HydrophobicContact CG2-CG2 4.02Å; I587-F610 HydrophobicContact CD1-CD2 4.49Å
588	A	94.9	Very high	90.3	Very high	29 Å²	29	50.2 Å²	50.2	24%	0.24	27%	0.272	C	S	.	.	H	α-helix	trans	-64.1	-44.8	177	0	0	0	0	0	112	F584 M585 L586 A591 I592	F584-A588 WeakPolarHBondContact O-CB 3.34Å; F584-A588 PolarHBondContact O-N 3.31Å; M585-A588 PolarHBondContact O-N 3.47Å; L586-A588 VanDerWaalsContact C-N 3.31Å; L586-A588 PolarHBondContact O-N 2.88Å; A588-A591 PolarHBondContact O-N 3.37Å; A588-I592 VanDerWaalsContact O-CG1 3.28Å; A588-I592 WeakPolarHBondContact O-CG1 3.36Å; A588-I592 PolarHBondContact O-N 3.31Å
589	A	95.4	Very high	90.7	Very high	50 Å²	50	47.6 Å²	47.6	41%	0.413	25%	0.254	S	S	.	.	H	α-helix	trans	-62.1	-46.6	177.6	0	0	0	0	0	112.1	M585 L586 A591 I592 V593	M585-A589 WeakPolarHBondContact O-CB 3.24Å; M585-A589 PolarHBondContact O-N 3.32Å; L586-A589 PolarHBondContact O-N 2.67Å; A589-A591 VanDerWaalsContact C-N 3.31Å; A589-A591 PolarHBondContact O-N 3.45Å; A589-I592 PolarHBondContact O-N 2.96Å; A589-V593 WeakPolarHBondContact O-CG2 3.41Å; A589-V593 PolarHBondContact O-N 3.49Å
590	I	96.7	Very high	91.2	Very high	14 Å²	14	48.4 Å²	48.4	7%	0.072	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-40.8	177.6	-67.4	160.4	0	0	0	110.8	L586 V593 Y594 L605 T606 S609	L586-I590 WeakPolarHBondContact O-CB 3.35Å; L586-I590 WeakPolarHBondContact O-CD1 3.17Å; L586-I590 WeakPolarHBondContact O-CG1 3.37Å; L586-I590 PolarHBondContact O-N 2.65Å; I590-V593 PolarHBondContact O-N 3.41Å; I590-Y594 HydrophobicContact CG2-CD2 4.14Å; I590-Y594 PolarHBondContact O-N 3.05Å; I590-L605 HydrophobicContact CD1-CD2 4.25Å; I590-L605 HydrophobicContact CD1-CG 3.86Å; I590-L605 HydrophobicContact CG1-CD2 3.94Å; I590-L605 HydrophobicContact CG1-CG 4.11Å; I590-L605 HydrophobicContact CG2-CB 4.15Å; I590-L605 HydrophobicContact CG2-CD2 4.08Å; I590-L605 HydrophobicContact CG2-CG 4.22Å; I590-T606 WeakPolarHBondContact CG2-OG1 3.33Å; I590-S609 WeakPolarHBondContact CD1-OG 3.27Å
591	A	95.9	Very high	91.6	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.008	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-42.6	176.1	0	0	0	0	0	112.2	P478 I587 A588 A589 A595	P478-A591 HydrophobicContact CB-CB 4.13Å; I587-A591 VanDerWaalsContact O-CB 3.3Å; I587-A591 WeakPolarHBondContact O-CB 3.45Å; I587-A591 PolarHBondContact O-N 2.91Å; A588-A591 PolarHBondContact O-N 3.37Å; A589-A591 VanDerWaalsContact C-N 3.31Å; A589-A591 PolarHBondContact O-N 3.45Å; A591-A595 WeakPolarHBondContact O-CB 3.5Å; A591-A595 PolarHBondContact O-N 3.38Å
592	I	91.9	Very high	92	Very high	119 Å²	119	40.5 Å²	40.5	61%	0.61	22%	0.215	S	C	*	.	H	α-helix	trans	-65.2	-40.7	178.4	-68.7	164.1	0	0	0	111.2	A588 A589	A588-I592 VanDerWaalsContact O-CG1 3.28Å; A588-I592 WeakPolarHBondContact O-CG1 3.36Å; A588-I592 PolarHBondContact O-N 3.31Å; A589-I592 PolarHBondContact O-N 2.96Å
593	V	89.3	Confident	92.5	Very high	88 Å²	88	37 Å²	37	53%	0.533	20%	0.197	S	C	.	.	H	α-helix	trans	-79.1	-46.9	-174.4	175.9	0	0	0	0	112.5	A589 I590	A589-V593 WeakPolarHBondContact O-CG2 3.41Å; A589-V593 PolarHBondContact O-N 3.49Å; I590-V593 PolarHBondContact O-N 3.41Å
594	Y	90.9	Very high	92.8	Very high	37 Å²	37	36.8 Å²	36.8	15%	0.145	20%	0.196	C	C	.	.	H	α-helix	trans	-106.7	-22.9	-166.8	-65.2	-76.9	0	0	0	114.6	I590 E596 N597 D598 F601 L605 Y697	I590-Y594 HydrophobicContact CG2-CD2 4.14Å; I590-Y594 PolarHBondContact O-N 3.05Å; Y594-E596 PolarHBondContact O-N 2.81Å; Y594-E596 VanDerWaalsContact O-N 3.1Å; Y594-N597 PolarHBondContact O-N 2.98Å; Y594-D598 CarbonylContact O-C 3.57Å; Y594-D598 PolarHBondContact O-N 3.1Å; Y594-F601 AromaticContact CD1-CD1 3.68Å; Y594-F601 HydrophobicContact CD1-CD1 3.68Å; Y594-F601 HydrophobicContact CD1-CE1 4Å; Y594-F601 AromaticContact CE1-CD1 3.85Å; Y594-F601 HydrophobicContact CE1-CD1 3.85Å; Y594-F601 AromaticContact CE1-CE1 3.69Å; Y594-F601 HydrophobicContact CE1-CE1 3.69Å; Y594-F601 HydrophobicContact CE2-CE1 4.37Å; Y594-F601 HydrophobicContact CG-CD1 4.12Å; Y594-F601 HydrophobicContact CG-CE1 4.47Å; Y594-F601 AromaticContact CZ-CE1 3.89Å; Y594-L605 HydrophobicContact CD2-CD2 4.08Å; Y594-L605 HydrophobicContact CE2-CD2 3.71Å; Y594-Y697 HydrophobicContact CD1-CD1 4.46Å; Y594-Y697 AromaticContact CD1-CE1 3.98Å; Y594-Y697 HydrophobicContact CD1-CE1 3.98Å; Y594-Y697 AromaticContact CE1-CD1 3.78Å; Y594-Y697 HydrophobicContact CE1-CD1 3.78Å; Y594-Y697 AromaticContact CE1-CE1 3.68Å; Y594-Y697 HydrophobicContact CE1-CE1 3.68Å
595	A	90.1	Very high	93.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.8	-170.8	0	0	0	0	0	113.2	S479 C482 H483 A591 L599	S479-A595 WeakPolarHBondContact O-CB 3.42Å; C482-A595 HydrophobicContact CB-CB 3.95Å; H483-A595 HydrophobicContact CB-CB 4.28Å; H483-A595 WeakPolarHBondContact CB-O 3.25Å; H483-A595 PolarHBondContact ND1-O 3.4Å; A591-A595 WeakPolarHBondContact O-CB 3.5Å; A591-A595 PolarHBondContact O-N 3.38Å; A595-L599 HydrophobicContact CB-CD1 4.21Å
596	E	85.3	Confident	93.3	Very high	45 Å²	45	25 Å²	25	21%	0.21	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-51.3	176.2	-171.2	178.9	169.3	0	0	112.3	L486 K487 K490 Y594	L486-E596 HydrophobicContact CB-CB 4.27Å; L486-E596 HydrophobicContact CB-CG 4Å; L486-E596 HydrophobicContact CD1-CB 3.88Å; L486-E596 HydrophobicContact CD1-CG 4.44Å; K487-E596 WeakPolarHBondContact CE-O 3.31Å; K490-E596 WeakPolarHBondContact CE-OE1 3.28Å; K490-E596 IonicContact NZ-OE1 2.85Å; K490-E596 PolarHBondContact NZ-OE1 3.38Å; Y594-E596 PolarHBondContact O-N 2.81Å; Y594-E596 VanDerWaalsContact O-N 3.1Å
597	N	80.9	Confident	93.4	Very high	50 Å²	50	22.7 Å²	22.7	27%	0.267	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-44	-164.9	-63.3	-27	0	0	0	112.2	Y594 N792	Y594-N597 PolarHBondContact O-N 2.98Å; N597-N792 PolarHBondContact ND2-O 3.36Å
598	D	88	Confident	93.5	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.011	13%	0.127	C	C	.	.			trans	-142.1	93.7	-176.2	-161.7	-49	0	0	0	110	Y594 E600 F601 C602 R635 Y697	Y594-D598 CarbonylContact O-C 3.57Å; Y594-D598 PolarHBondContact O-N 3.1Å; D598-E600 VanDerWaalsContact C-N 3.26Å; D598-E600 PolarHBondContact O-N 3.03Å; D598-E600 WeakPolarHBondContact OD1-CB 3.37Å; D598-E600 PolarHBondContact OD1-N 3.11Å; D598-F601 HydrophobicContact CB-CB 4.17Å; D598-F601 WeakPolarHBondContact OD1-CB 3.44Å; D598-F601 PolarHBondContact OD1-N 3.29Å; D598-C602 VanDerWaalsContact O-CB 3.29Å; D598-C602 WeakPolarHBondContact O-CB 3.42Å; D598-C602 PolarHBondContact O-N 3.27Å; D598-R635 IonicContact OD2-CZ 3.62Å; D598-R635 IonicContact OD2-NE 3.51Å; D598-R635 PolarHBondContact OD2-NE 3.22Å; D598-R635 IonicContact OD2-NH2 2.97Å; D598-R635 PolarHBondContact OD2-NH2 2.89Å; D598-Y697 HydrophobicContact CB-CE2 4.2Å; D598-Y697 WeakPolarHBondContact CB-OH 3.36Å
599	L	93.2	Very high	93.5	Very high	1 Å²	1	21 Å²	21	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-71.1	-29.7	-177.7	-171.1	62.6	0	0	0	110.7	L446 F449 V450 H483 A595 C602 W603	L446-L599 HydrophobicContact CD1-CB 4.23Å; L446-L599 HydrophobicContact CD1-CD2 3.96Å; L446-L599 HydrophobicContact CD1-CG 3.8Å; F449-L599 HydrophobicContact CB-CD2 3.87Å; V450-L599 HydrophobicContact CG2-CB 4.06Å; V450-L599 HydrophobicContact CG2-CD2 4.17Å; H483-L599 HydrophobicContact CB-CD1 4.08Å; H483-L599 HydrophobicContact CB-CD2 4.42Å; A595-L599 HydrophobicContact CB-CD1 4.21Å; L599-C602 HydrophobicContact CD1-CB 4.45Å; L599-C602 WeakPolarHBondContact O-CB 3.45Å; L599-C602 PolarHBondContact O-N 2.9Å; L599-W603 WeakPolarHBondContact O-CB 3.32Å; L599-W603 VanDerWaalsContact O-CD1 3.23Å; L599-W603 PolarHBondContact O-N 3.43Å
600	E	93.6	Very high	93.5	Very high	17 Å²	17	19.9 Å²	19.9	8%	0.079	10%	0.102	C	C	.	.	H	α-helix	trans	-64.1	-49.5	177.6	-56.9	92.6	130.7	0	0	111.3	L407 L446 V450 D598 W603 F604 V631 V632	L407-E600 HydrophobicContact CD2-CG 4.31Å; L446-E600 HydrophobicContact CD1-CG 4.32Å; L446-E600 HydrophobicContact CD2-CB 4.27Å; L446-E600 HydrophobicContact CD2-CG 4.04Å; L446-E600 HydrophobicContact CG-CG 4.3Å; V450-E600 VanDerWaalsContact CG1-OE1 3.24Å; V450-E600 WeakPolarHBondContact CG1-OE1 3.32Å; V450-E600 HydrophobicContact CG2-CG 4.19Å; D598-E600 VanDerWaalsContact C-N 3.26Å; D598-E600 PolarHBondContact O-N 3.03Å; D598-E600 WeakPolarHBondContact OD1-CB 3.37Å; D598-E600 PolarHBondContact OD1-N 3.11Å; E600-W603 PolarHBondContact O-N 2.9Å; E600-F604 PolarHBondContact O-N 3.39Å; E600-V631 HydrophobicContact CB-CG1 3.86Å; E600-V631 HydrophobicContact CG-CG1 3.94Å; E600-V632 HydrophobicContact CB-CG1 4.43Å
601	F	94.6	Very high	93.4	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66.4	-38.8	173.5	-173.4	-106.4	0	0	0	112.1	Y594 D598 W603 F604 L605 V632 L636 Y697	Y594-F601 AromaticContact CD1-CD1 3.68Å; Y594-F601 HydrophobicContact CD1-CD1 3.68Å; Y594-F601 HydrophobicContact CD1-CE1 4Å; Y594-F601 AromaticContact CE1-CD1 3.85Å; Y594-F601 HydrophobicContact CE1-CD1 3.85Å; Y594-F601 AromaticContact CE1-CE1 3.69Å; Y594-F601 HydrophobicContact CE1-CE1 3.69Å; Y594-F601 HydrophobicContact CE2-CE1 4.37Å; Y594-F601 HydrophobicContact CG-CD1 4.12Å; Y594-F601 HydrophobicContact CG-CE1 4.47Å; Y594-F601 AromaticContact CZ-CE1 3.89Å; D598-F601 HydrophobicContact CB-CB 4.17Å; D598-F601 WeakPolarHBondContact OD1-CB 3.44Å; D598-F601 PolarHBondContact OD1-N 3.29Å; F601-W603 VanDerWaalsContact C-N 3.34Å; F601-W603 PolarHBondContact O-N 3.4Å; F601-F604 HydrophobicContact CD2-CD1 4.06Å; F601-F604 AromaticContact CE2-CD1 3.98Å; F601-F604 HydrophobicContact CE2-CD1 3.98Å; F601-F604 HydrophobicContact CE2-CE1 4.34Å; F601-F604 PolarHBondContact O-N 2.91Å; F601-L605 HydrophobicContact CE1-CD2 4.1Å; F601-L605 HydrophobicContact CZ-CD2 4.5Å; F601-L605 WeakPolarHBondContact O-CB 3.24Å; F601-L605 PolarHBondContact O-N 3.1Å; F601-V632 HydrophobicContact CB-CG1 4.27Å; F601-V632 HydrophobicContact CD2-CB 4.27Å; F601-V632 HydrophobicContact CD2-CG1 4.29Å; F601-L636 HydrophobicContact CE2-CD2 4.09Å; F601-Y697 HydrophobicContact CB-CD2 4.04Å; F601-Y697 HydrophobicContact CB-CE2 3.68Å; F601-Y697 HydrophobicContact CD1-CD1 4.32Å; F601-Y697 AromaticContact CD1-CD2 3.44Å; F601-Y697 HydrophobicContact CD1-CD2 3.44Å; F601-Y697 VanDerWaalsContact CD1-CD2 3.44Å; F601-Y697 HydrophobicContact CD1-CE1 4.46Å; F601-Y697 AromaticContact CD1-CE2 3.61Å; F601-Y697 HydrophobicContact CD1-CE2 3.61Å; F601-Y697 AromaticContact CD1-CG 3.82Å; F601-Y697 HydrophobicContact CD1-CG 3.82Å; F601-Y697 AromaticContact CD2-CD2 3.63Å; F601-Y697 HydrophobicContact CD2-CD2 3.63Å; F601-Y697 HydrophobicContact CD2-CE2 4.18Å; F601-Y697 HydrophobicContact CD2-CG 4.4Å; F601-Y697 HydrophobicContact CE1-CD1 4.17Å; F601-Y697 AromaticContact CE1-CD2 3.7Å; F601-Y697 HydrophobicContact CE1-CD2 3.7Å; F601-Y697 HydrophobicContact CE1-CE2 4.28Å; F601-Y697 AromaticContact CE1-CG 3.62Å; F601-Y697 HydrophobicContact CE1-CG 3.62Å; F601-Y697 AromaticContact CE2-CD2 3.87Å; F601-Y697 HydrophobicContact CE2-CD2 3.87Å; F601-Y697 HydrophobicContact CE2-CG 4.23Å; F601-Y697 AromaticContact CG-CD2 3.4Å; F601-Y697 HydrophobicContact CG-CD2 3.4Å; F601-Y697 AromaticContact CG-CE2 3.54Å; F601-Y697 HydrophobicContact CG-CE2 3.54Å; F601-Y697 HydrophobicContact CG-CG 4.21Å; F601-Y697 AromaticContact CZ-CD2 3.91Å; F601-Y697 HydrophobicContact CZ-CD2 3.91Å; F601-Y697 AromaticContact CZ-CG 3.84Å; F601-Y697 HydrophobicContact CZ-CG 3.84Å
602	C	96.6	Very high	93.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-55.9	-47.4	173.7	-174.7	0	0	0	0	111.5	D598 L599 L605 T606	D598-C602 VanDerWaalsContact O-CB 3.29Å; D598-C602 WeakPolarHBondContact O-CB 3.42Å; D598-C602 PolarHBondContact O-N 3.27Å; L599-C602 HydrophobicContact CD1-CB 4.45Å; L599-C602 WeakPolarHBondContact O-CB 3.45Å; L599-C602 PolarHBondContact O-N 2.9Å; C602-L605 PolarHBondContact O-N 3.27Å; C602-T606 WeakPolarHBondContact O-CB 3.45Å; C602-T606 PolarHBondContact O-N 3.16Å; C602-T606 PolarHBondContact O-OG1 3.22Å
603	W	97.9	Very high	93.5	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-68.9	-40.2	179.5	-78.9	30.6	0	0	0	112.3	T442 A445 L446 F449 L463 Y476 S479 V480 L599 E600 F601 T607 F628	T442-W603 VanDerWaalsContact O-CZ3 3.28Å; T442-W603 WeakPolarHBondContact O-CZ3 3.5Å; A445-W603 HydrophobicContact CB-CH2 4.02Å; A445-W603 HydrophobicContact CB-CZ3 4.43Å; L446-W603 HydrophobicContact CB-CD2 4.44Å; L446-W603 HydrophobicContact CB-CE3 3.84Å; L446-W603 HydrophobicContact CB-CH2 4.18Å; L446-W603 HydrophobicContact CB-CZ3 3.71Å; L446-W603 HydrophobicContact CD1-CD2 3.87Å; L446-W603 HydrophobicContact CD1-CE3 4.12Å; L446-W603 HydrophobicContact CD1-CG 4.16Å; L446-W603 HydrophobicContact CD2-CE3 4.28Å; L446-W603 HydrophobicContact CG-CE3 4.3Å; F449-W603 HydrophobicContact CD2-CH2 4.26Å; F449-W603 HydrophobicContact CD2-CZ2 4.09Å; F449-W603 HydrophobicContact CE2-CH2 4.42Å; F449-W603 HydrophobicContact CE2-CZ2 4.35Å; L463-W603 HydrophobicContact CD1-CH2 4.41Å; Y476-W603 HydrophobicContact CD1-CB 4.18Å; Y476-W603 AromaticContact CD1-CD1 3.95Å; Y476-W603 AromaticContact CD1-CD2 3.58Å; Y476-W603 HydrophobicContact CD1-CD2 3.58Å; Y476-W603 AromaticContact CD1-CE2 3.92Å; Y476-W603 AromaticContact CD1-CE3 3.96Å; Y476-W603 HydrophobicContact CD1-CE3 3.96Å; Y476-W603 AromaticContact CD1-CG 3.66Å; Y476-W603 HydrophobicContact CD1-CG 3.66Å; Y476-W603 HydrophobicContact CD2-CD2 4.27Å; Y476-W603 AromaticContact CD2-CE3 3.91Å; Y476-W603 HydrophobicContact CD2-CE3 3.91Å; Y476-W603 HydrophobicContact CD2-CH2 4.13Å; Y476-W603 HydrophobicContact CD2-CZ2 4.46Å; Y476-W603 AromaticContact CD2-CZ3 3.82Å; Y476-W603 HydrophobicContact CD2-CZ3 3.82Å; Y476-W603 HydrophobicContact CE1-CB 3.95Å; Y476-W603 AromaticContact CE1-CD2 3.96Å; Y476-W603 HydrophobicContact CE1-CD2 3.96Å; Y476-W603 HydrophobicContact CE1-CE3 4.06Å; Y476-W603 AromaticContact CE1-CG 3.92Å; Y476-W603 HydrophobicContact CE1-CG 3.92Å; Y476-W603 AromaticContact CE2-CE3 4Å; Y476-W603 HydrophobicContact CE2-CE3 4Å; Y476-W603 HydrophobicContact CE2-CZ3 4.13Å; Y476-W603 AromaticContact CG-CD2 3.77Å; Y476-W603 HydrophobicContact CG-CD2 3.77Å; Y476-W603 AromaticContact CG-CE2 3.8Å; Y476-W603 AromaticContact CG-CE3 3.9Å; Y476-W603 HydrophobicContact CG-CE3 3.9Å; Y476-W603 HydrophobicContact CG-CG 4.33Å; Y476-W603 HydrophobicContact CG-CH2 4.17Å; Y476-W603 HydrophobicContact CG-CZ2 4.04Å; Y476-W603 HydrophobicContact CG-CZ3 4.08Å; S479-W603 PolarHBondContact OG-NE1 3Å; V480-W603 HydrophobicContact CG2-CZ2 3.73Å; L599-W603 WeakPolarHBondContact O-CB 3.32Å; L599-W603 VanDerWaalsContact O-CD1 3.23Å; L599-W603 PolarHBondContact O-N 3.43Å; E600-W603 PolarHBondContact O-N 2.9Å; F601-W603 VanDerWaalsContact C-N 3.34Å; F601-W603 PolarHBondContact O-N 3.4Å; W603-T607 WeakPolarHBondContact O-CB 3.16Å; W603-T607 PolarHBondContact O-N 2.76Å; W603-T607 PolarHBondContact O-OG1 3.33Å; W603-F628 HydrophobicContact CB-CD1 4.49Å; W603-F628 HydrophobicContact CB-CE1 4.07Å; W603-F628 HydrophobicContact CB-CZ 4.19Å; W603-F628 AromaticContact CE3-CE1 3.96Å; W603-F628 HydrophobicContact CE3-CE1 3.96Å; W603-F628 AromaticContact CE3-CZ 3.96Å; W603-F628 HydrophobicContact CE3-CZ 3.96Å
604	F	97.6	Very high	93.6	Very high	2 Å²	2	11.6 Å²	11.6	1%	0.009	6%	0.055	C	C	.	.	H	α-helix	trans	-56.1	-54.2	172.5	169.5	-111	0	0	0	111.2	E600 F601 T607 Y608 Y625 F628 L629 V632 L693	E600-F604 PolarHBondContact O-N 3.39Å; F601-F604 HydrophobicContact CD2-CD1 4.06Å; F601-F604 AromaticContact CE2-CD1 3.98Å; F601-F604 HydrophobicContact CE2-CD1 3.98Å; F601-F604 HydrophobicContact CE2-CE1 4.34Å; F601-F604 PolarHBondContact O-N 2.91Å; F604-T607 PolarHBondContact O-N 3.38Å; F604-Y608 HydrophobicContact CE2-CD2 4.01Å; F604-Y608 AromaticContact CZ-CD2 3.81Å; F604-Y608 HydrophobicContact CZ-CD2 3.81Å; F604-Y608 HydrophobicContact CZ-CE2 4.42Å; F604-Y608 WeakPolarHBondContact O-CB 3.24Å; F604-Y608 PolarHBondContact O-N 3.11Å; F604-Y625 WeakPolarHBondContact CD2-O 3.18Å; F604-F628 HydrophobicContact CB-CB 3.73Å; F604-F628 HydrophobicContact CB-CG 4.32Å; F604-F628 HydrophobicContact CD2-CB 3.89Å; F604-F628 HydrophobicContact CG-CB 4.25Å; F604-L629 HydrophobicContact CE2-CD1 4.34Å; F604-L629 HydrophobicContact CZ-CD1 4.26Å; F604-V632 HydrophobicContact CB-CG1 3.87Å; F604-V632 HydrophobicContact CB-CG2 4.34Å; F604-V632 HydrophobicContact CD1-CG2 3.95Å; F604-V632 HydrophobicContact CD2-CG2 4.27Å; F604-V632 HydrophobicContact CE1-CG2 4.32Å; F604-V632 HydrophobicContact CG-CG1 4.34Å; F604-V632 HydrophobicContact CG-CG2 3.91Å; F604-L693 HydrophobicContact CE1-CD1 3.82Å; F604-L693 HydrophobicContact CZ-CD1 3.71Å
605	L	97.3	Very high	93.6	Very high	6 Å²	6	10.1 Å²	10.1	3%	0.031	5%	0.05	C	C	.	.	H	α-helix	trans	-66.2	-42.5	-176.8	-172.8	60.8	0	0	0	111.6	I590 Y594 F601 C602 T607 Y608 S609 M690 V694	I590-L605 HydrophobicContact CD1-CD2 4.25Å; I590-L605 HydrophobicContact CD1-CG 3.86Å; I590-L605 HydrophobicContact CG1-CD2 3.94Å; I590-L605 HydrophobicContact CG1-CG 4.11Å; I590-L605 HydrophobicContact CG2-CB 4.15Å; I590-L605 HydrophobicContact CG2-CD2 4.08Å; I590-L605 HydrophobicContact CG2-CG 4.22Å; Y594-L605 HydrophobicContact CD2-CD2 4.08Å; Y594-L605 HydrophobicContact CE2-CD2 3.71Å; F601-L605 HydrophobicContact CE1-CD2 4.1Å; F601-L605 HydrophobicContact CZ-CD2 4.5Å; F601-L605 WeakPolarHBondContact O-CB 3.24Å; F601-L605 PolarHBondContact O-N 3.1Å; C602-L605 PolarHBondContact O-N 3.27Å; L605-T607 VanDerWaalsContact C-N 3.29Å; L605-T607 PolarHBondContact O-N 3.44Å; L605-Y608 PolarHBondContact O-N 3.24Å; L605-S609 WeakPolarHBondContact O-CB 3.48Å; L605-S609 PolarHBondContact O-N 3.41Å; L605-S609 PolarHBondContact O-OG 2.88Å; L605-S609 VanDerWaalsContact O-OG 3.04Å; L605-M690 HydrophobicContact CD1-CG 3.5Å; L605-M690 VanDerWaalsContact CD1-CG 3.5Å; L605-M690 HydrophobicContact CD1-SD 4.04Å; L605-V694 HydrophobicContact CD1-CG2 3.77Å; L605-V694 HydrophobicContact CD2-CG2 3.75Å; L605-V694 HydrophobicContact CG-CG2 4.44Å
606	T	97.9	Very high	93.6	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-55.3	-45.4	174.2	-61.9	0	0	0	0	111.1	I475 Y476 I587 I590 C602 F610	I475-T606 HydrophobicContact CB-CG2 4.1Å; I475-T606 HydrophobicContact CD1-CG2 4.08Å; I475-T606 HydrophobicContact CG1-CG2 3.95Å; Y476-T606 HydrophobicContact CD1-CG2 4.42Å; I587-T606 HydrophobicContact CB-CG2 4.46Å; I587-T606 HydrophobicContact CG1-CG2 4Å; I587-T606 HydrophobicContact CG2-CG2 4.02Å; I590-T606 WeakPolarHBondContact CG2-OG1 3.33Å; C602-T606 WeakPolarHBondContact O-CB 3.45Å; C602-T606 PolarHBondContact O-N 3.16Å; C602-T606 PolarHBondContact O-OG1 3.22Å; T606-F610 VanDerWaalsContact O-CB 3.24Å; T606-F610 WeakPolarHBondContact O-CB 3.44Å; T606-F610 PolarHBondContact O-N 3.45Å
607	T	97.7	Very high	93.9	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-70.3	-42.1	179.5	-48.7	0	0	0	0	111.5	Y472 Y476 W603 F604 L605 F610 V611 W624	Y472-T607 HydrophobicContact CE2-CG2 4.37Å; Y476-T607 WeakPolarHBondContact CE1-OG1 3.35Å; Y476-T607 PolarHBondContact OH-OG1 2.89Å; W603-T607 WeakPolarHBondContact O-CB 3.16Å; W603-T607 PolarHBondContact O-N 2.76Å; W603-T607 PolarHBondContact O-OG1 3.33Å; F604-T607 PolarHBondContact O-N 3.38Å; L605-T607 VanDerWaalsContact C-N 3.29Å; L605-T607 PolarHBondContact O-N 3.44Å; T607-F610 PolarHBondContact O-N 3.34Å; T607-V611 WeakPolarHBondContact O-CG2 3.41Å; T607-V611 PolarHBondContact O-N 2.88Å; T607-W624 HydrophobicContact CG2-CB 3.51Å
608	Y	97.1	Very high	94.3	Very high	6 Å²	6	7 Å²	7	2%	0.024	4%	0.035	C	C	.	.	H	α-helix	trans	-61.2	-47.3	178	-158.7	-68.3	0	0	0	111	F604 L605 V611 T612 Y625 N686 I689 M690 L693	F604-Y608 HydrophobicContact CE2-CD2 4.01Å; F604-Y608 AromaticContact CZ-CD2 3.81Å; F604-Y608 HydrophobicContact CZ-CD2 3.81Å; F604-Y608 HydrophobicContact CZ-CE2 4.42Å; F604-Y608 WeakPolarHBondContact O-CB 3.24Å; F604-Y608 PolarHBondContact O-N 3.11Å; L605-Y608 PolarHBondContact O-N 3.24Å; Y608-V611 PolarHBondContact O-N 3.44Å; Y608-T612 WeakPolarHBondContact CD1-OG1 3.43Å; Y608-T612 WeakPolarHBondContact CE1-OG1 3.36Å; Y608-T612 VanDerWaalsContact O-CB 3.31Å; Y608-T612 WeakPolarHBondContact O-CB 3.45Å; Y608-T612 PolarHBondContact O-N 2.94Å; Y608-T612 PolarHBondContact O-OG1 3.49Å; Y608-Y625 HydrophobicContact CD2-CD1 4.36Å; Y608-Y625 AromaticContact CD2-CD2 3.62Å; Y608-Y625 HydrophobicContact CD2-CD2 3.62Å; Y608-Y625 HydrophobicContact CD2-CE2 4.06Å; Y608-Y625 AromaticContact CD2-CG 3.81Å; Y608-Y625 HydrophobicContact CD2-CG 3.81Å; Y608-Y625 AromaticContact CE2-CD2 3.81Å; Y608-Y625 HydrophobicContact CE2-CD2 3.81Å; Y608-Y625 AromaticContact CE2-CE2 3.77Å; Y608-Y625 HydrophobicContact CE2-CE2 3.77Å; Y608-Y625 HydrophobicContact CE2-CG 4.37Å; Y608-Y625 HydrophobicContact CG-CG 4.38Å; Y608-N686 HydrophobicContact CE1-CB 4.05Å; Y608-N686 WeakPolarHBondContact CE1-O 3.3Å; Y608-N686 PolarHBondContact OH-OD1 3.2Å; Y608-I689 HydrophobicContact CE2-CG2 4.43Å; Y608-I689 WeakPolarHBondContact OH-CG2 3.15Å; Y608-M690 HydrophobicContact CD1-CB 3.89Å; Y608-M690 HydrophobicContact CD1-CG 3.97Å; Y608-M690 HydrophobicContact CD1-SD 4.08Å; Y608-M690 HydrophobicContact CE1-CB 3.9Å; Y608-M690 HydrophobicContact CE1-CG 4.48Å; Y608-L693 HydrophobicContact CE2-CD1 4.45Å
609	S	96	Very high	94.2	Very high	3 Å²	3	8.9 Å²	8.9	2%	0.021	5%	0.049	C	C	.	.	H	α-helix	trans	-63.2	-44.6	174.8	-58.6	0	0	0	0	111.4	I590 L605 V611 T612 F613 M690	I590-S609 WeakPolarHBondContact CD1-OG 3.27Å; L605-S609 WeakPolarHBondContact O-CB 3.48Å; L605-S609 PolarHBondContact O-N 3.41Å; L605-S609 PolarHBondContact O-OG 2.88Å; L605-S609 VanDerWaalsContact O-OG 3.04Å; S609-V611 VanDerWaalsContact C-N 3.35Å; S609-V611 PolarHBondContact O-N 2.9Å; S609-T612 PolarHBondContact O-N 3.16Å; S609-F613 WeakPolarHBondContact O-CD2 3.4Å; S609-F613 PolarHBondContact O-N 3.44Å; S609-M690 PolarHBondContact OG-SD 3.34Å
610	F	95.7	Very high	93.9	Very high	26 Å²	26	9.7 Å²	9.7	11%	0.114	5%	0.052	C	C	.	.	H	α-helix	trans	-55.6	-49.8	177.7	176.4	-109.5	0	0	0	111.5	Y472 I475 Q583 I587 T606 T607 N614 W624	Y472-F610 HydrophobicContact CD2-CE1 4.48Å; I475-F610 HydrophobicContact CD1-CB 3.82Å; I475-F610 HydrophobicContact CD1-CD1 4.05Å; I475-F610 HydrophobicContact CD1-CG 3.9Å; I475-F610 HydrophobicContact CG2-CD2 3.84Å; I475-F610 HydrophobicContact CG2-CE2 4.08Å; I475-F610 HydrophobicContact CG2-CG 4.21Å; Q583-F610 PolarHBondContact NE2-O 3.3Å; I587-F610 HydrophobicContact CD1-CD2 4.49Å; T606-F610 VanDerWaalsContact O-CB 3.24Å; T606-F610 WeakPolarHBondContact O-CB 3.44Å; T606-F610 PolarHBondContact O-N 3.45Å; T607-F610 PolarHBondContact O-N 3.34Å; F610-N614 WeakPolarHBondContact CZ-ND2 3.12Å; F610-N614 WeakPolarHBondContact O-CB 3.41Å; F610-N614 PolarHBondContact O-N 2.94Å; F610-N614 VanDerWaalsContact O-N 3.15Å; F610-W624 HydrophobicContact CD1-CE3 4.44Å; F610-W624 HydrophobicContact CD1-CZ3 4.18Å; F610-W624 HydrophobicContact CE1-CE3 4.41Å; F610-W624 AromaticContact CE1-CZ3 3.75Å; F610-W624 HydrophobicContact CE1-CZ3 3.75Å
611	V	94.8	Very high	93.8	Very high	2 Å²	2	9.9 Å²	9.9	1%	0.012	5%	0.053	C	C	.	.	H	α-helix	trans	-67.4	-42.3	-179.8	177.1	0	0	0	0	112	T607 Y608 S609 F613 N614 F622 W624 Y625	T607-V611 WeakPolarHBondContact O-CG2 3.41Å; T607-V611 PolarHBondContact O-N 2.88Å; Y608-V611 PolarHBondContact O-N 3.44Å; S609-V611 VanDerWaalsContact C-N 3.35Å; S609-V611 PolarHBondContact O-N 2.9Å; V611-F613 PolarHBondContact O-N 3.02Å; V611-N614 PolarHBondContact O-N 3.45Å; V611-F622 HydrophobicContact CG1-CD1 4.16Å; V611-F622 HydrophobicContact CG1-CE1 4.32Å; V611-W624 HydrophobicContact CG2-CE3 3.69Å; V611-W624 HydrophobicContact CG2-CZ3 4.21Å; V611-Y625 HydrophobicContact CB-CD1 4.13Å; V611-Y625 HydrophobicContact CB-CE1 4.17Å; V611-Y625 HydrophobicContact CG1-CD1 4.36Å; V611-Y625 HydrophobicContact CG1-CE1 3.94Å; V611-Y625 HydrophobicContact CG2-CD1 4.12Å
612	T	94.9	Very high	93.7	Very high	7 Å²	7	10 Å²	10	4%	0.043	5%	0.053	C	C	.	.	H	α-helix	trans	-64.9	-37.3	-176.9	-59.8	0	0	0	0	112.9	Y608 S609 H683 N686 V687	Y608-T612 WeakPolarHBondContact CD1-OG1 3.43Å; Y608-T612 WeakPolarHBondContact CE1-OG1 3.36Å; Y608-T612 VanDerWaalsContact O-CB 3.31Å; Y608-T612 WeakPolarHBondContact O-CB 3.45Å; Y608-T612 PolarHBondContact O-N 2.94Å; Y608-T612 PolarHBondContact O-OG1 3.49Å; S609-T612 PolarHBondContact O-N 3.16Å; T612-H683 PolarHBondContact O-CE1 2.91Å; T612-H683 PolarHBondContact O-ND1 3.26Å; T612-N686 HydrophobicContact CG2-CB 3.67Å; T612-V687 HydrophobicContact CG2-CG2 3.87Å
613	F	93.7	Very high	93.5	Very high	26 Å²	26	10.3 Å²	10.3	11%	0.114	6%	0.055	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	7.9	-177.4	-68.3	-82.7	0	0	0	113.6	L582 Q583 L586 S609 V611 H683 V687 M690	L582-F613 HydrophobicContact CD2-CD1 3.58Å; L582-F613 HydrophobicContact CD2-CE1 3.87Å; L582-F613 HydrophobicContact CD2-CG 4.43Å; L582-F613 HydrophobicContact CG-CD1 4.34Å; Q583-F613 HydrophobicContact CG-CB 3.83Å; Q583-F613 PolarHBondContact NE2-O 3.25Å; L586-F613 HydrophobicContact CD1-CD2 3.65Å; L586-F613 HydrophobicContact CD1-CE2 3.68Å; L586-F613 HydrophobicContact CD1-CG 4.16Å; L586-F613 HydrophobicContact CD1-CZ 4.2Å; S609-F613 WeakPolarHBondContact O-CD2 3.4Å; S609-F613 PolarHBondContact O-N 3.44Å; V611-F613 PolarHBondContact O-N 3.02Å; F613-H683 AromaticContact CD1-CE1 3.54Å; F613-H683 AromaticContact CE1-CE1 3.44Å; F613-H683 VanDerWaalsContact CE1-CE1 3.44Å; F613-H683 WeakPolarHBondContact CE1-CE1 3.39Å; F613-H683 AromaticContact CE1-NE2 3.61Å; F613-V687 HydrophobicContact CE2-CG2 4.3Å; F613-V687 HydrophobicContact CZ-CG2 3.79Å; F613-M690 HydrophobicContact CE2-CE 4.15Å
614	N	92.2	Very high	93.3	Very high	14 Å²	14	10.5 Å²	10.5	8%	0.075	6%	0.056	C	C	.	.			trans	-72.7	140.7	177.9	-155.9	-34.8	0	0	0	111.5	S554 F610 V611 V616	S554-N614 WeakPolarHBondContact CB-O 3.47Å; S554-N614 PolarHBondContact OG-O 2.8Å; F610-N614 WeakPolarHBondContact CZ-ND2 3.12Å; F610-N614 WeakPolarHBondContact O-CB 3.41Å; F610-N614 PolarHBondContact O-N 2.94Å; F610-N614 VanDerWaalsContact O-N 3.15Å; V611-N614 PolarHBondContact O-N 3.45Å; N614-V616 VanDerWaalsContact CB-O 3.28Å; N614-V616 WeakPolarHBondContact CB-O 3.17Å; N614-V616 PolarHBondContact O-N 2.89Å; N614-V616 PolarHBondContact OD1-N 3.41Å; N614-V616 PolarHBondContact OD1-O 3.2Å
615	K	91.1	Very high	93.1	Very high	6 Å²	6	10.6 Å²	10.6	3%	0.026	6%	0.056	C	C	.	.	S	Bend	trans	-65	-24.5	170.8	63.5	165.4	-177.6	172	0	113.1	V544 R546 N552 S554 Y556 S576 A579 F580	V544-K615 PolarHBondContact O-NZ 3.45Å; R546-K615 VanDerWaalsContact O-CE 3.3Å; R546-K615 WeakPolarHBondContact O-CE 3.47Å; R546-K615 PolarHBondContact O-NZ 3.31Å; R546-K615 VanDerWaalsContact O-NZ 3.12Å; N552-K615 PolarHBondContact ND2-O 3.48Å; S554-K615 VanDerWaalsContact CB-O 3.28Å; S554-K615 WeakPolarHBondContact CB-O 3.33Å; S554-K615 PolarHBondContact OG-O 2.85Å; Y556-K615 HydrophobicContact CD2-CB 4.31Å; Y556-K615 HydrophobicContact CG-CB 4.35Å; S576-K615 PolarHBondContact OG-NZ 2.96Å; A579-K615 HydrophobicContact CB-CB 4.27Å; F580-K615 HydrophobicContact CE2-CD 4.15Å; F580-K615 HydrophobicContact CZ-CD 4.47Å
616	V	90.2	Very high	92.9	Very high	7 Å²	7	11.2 Å²	11.2	4%	0.042	6%	0.059	C	C	.	.	S	Bend	trans	-120.1	119.7	172.6	176	0	0	0	0	108	R546 D548 N552 N614 T618 Y621	R546-V616 HydrophobicContact CG-CG2 4.44Å; D548-V616 HydrophobicContact CB-CG1 4.24Å; D548-V616 HydrophobicContact CB-CG2 4.29Å; D548-V616 VanDerWaalsContact OD2-CG1 3.29Å; D548-V616 WeakPolarHBondContact OD2-CG1 3.39Å; N552-V616 WeakPolarHBondContact OD1-CA 3.36Å; N614-V616 VanDerWaalsContact CB-O 3.28Å; N614-V616 WeakPolarHBondContact CB-O 3.17Å; N614-V616 PolarHBondContact O-N 2.89Å; N614-V616 PolarHBondContact OD1-N 3.41Å; N614-V616 PolarHBondContact OD1-O 3.2Å; V616-T618 HydrophobicContact CG1-CG2 4.37Å; V616-Y621 WeakPolarHBondContact O-CE2 3.48Å
617	C	91.6	Very high	92.7	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.007	6%	0.062	C	C	.	.			trans	-134.1	112.8	179.4	-174	0	0	0	0	109.3	N552 F553	N552-C617 PolarHBondContact OD1-N 3.35Å; N552-C617 PolarHBondContact OD1-O 3.33Å; F553-C617 HydrophobicContact CB-CB 4.1Å; F553-C617 WeakPolarHBondContact CD2-O 3.28Å; F553-C617 PolarHBondContact N-O 3.3Å
618	T	89.2	Confident	92.5	Very high	20 Å²	20	11.8 Å²	11.8	12%	0.123	6%	0.062	C	C	.	.			trans	-111.6	161.2	177.7	69.1	0	0	0	0	109.6	V616 Q620 Y621	V616-T618 HydrophobicContact CG1-CG2 4.37Å; T618-Q620 PolarHBondContact O-N 3.3Å; T618-Y621 WeakPolarHBondContact O-CB 3.4Å; T618-Y621 PolarHBondContact O-N 3.45Å; T618-Y621 VanDerWaalsContact OG1-CD1 3.24Å; T618-Y621 WeakPolarHBondContact OG1-CD1 3.25Å; T618-Y621 WeakPolarHBondContact OG1-CE1 3.22Å
619	S	86.5	Confident	92.2	Very high	42 Å²	42	13.5 Å²	13.5	29%	0.294	7%	0.072	S	C	.	.	G	3₁₀ helix	trans	-61	-26.2	178.2	53.9	0	0	0	0	113.5	Y621 F622	S619-Y621 PolarHBondContact O-N 2.84Å; S619-F622 WeakPolarHBondContact O-CB 3.31Å; S619-F622 WeakPolarHBondContact O-CD2 3.37Å; S619-F622 WeakPolarHBondContact O-CG 3.43Å; S619-F622 PolarHBondContact O-N 2.87Å
620	Q	86.4	Confident	92	Very high	18 Å²	18	13.3 Å²	13.3	8%	0.084	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-61.8	-31.9	176.7	-59.6	-176	-4.5	0	0	111.5	D344 D346 N433 T618 F622 V623	D344-Q620 PolarHBondContact OD2-NE2 2.89Å; D346-Q620 PolarHBondContact OD2-NE2 3.42Å; N433-Q620 VanDerWaalsContact ND2-CD 3.32Å; N433-Q620 PolarHBondContact ND2-NE2 3.23Å; T618-Q620 PolarHBondContact O-N 3.3Å; Q620-F622 PolarHBondContact O-N 3.46Å; Q620-V623 WeakPolarHBondContact O-CB 3.39Å; Q620-V623 PolarHBondContact O-N 3.48Å
621	Y	91.7	Very high	91.7	Very high	22 Å²	22	12.5 Å²	12.5	9%	0.086	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-70.1	-19.3	-176.3	-64.9	4.5	0	0	0	112.4	V616 T618 S619 V623 W624	V616-Y621 WeakPolarHBondContact O-CE2 3.48Å; T618-Y621 WeakPolarHBondContact O-CB 3.4Å; T618-Y621 PolarHBondContact O-N 3.45Å; T618-Y621 VanDerWaalsContact OG1-CD1 3.24Å; T618-Y621 WeakPolarHBondContact OG1-CD1 3.25Å; T618-Y621 WeakPolarHBondContact OG1-CE1 3.22Å; S619-Y621 PolarHBondContact O-N 2.84Å; Y621-V623 PolarHBondContact O-N 3.25Å; Y621-W624 HydrophobicContact CD1-CD2 4.46Å; Y621-W624 AromaticContact CD1-CE2 3.94Å; Y621-W624 HydrophobicContact CD1-CE3 4.34Å; Y621-W624 AromaticContact CD1-CH2 3.15Å; Y621-W624 HydrophobicContact CD1-CH2 3.15Å; Y621-W624 AromaticContact CD1-CZ2 3.27Å; Y621-W624 HydrophobicContact CD1-CZ2 3.27Å; Y621-W624 AromaticContact CD1-CZ3 3.7Å; Y621-W624 HydrophobicContact CD1-CZ3 3.7Å; Y621-W624 HydrophobicContact CD2-CE3 4.46Å; Y621-W624 AromaticContact CD2-CH2 3.78Å; Y621-W624 HydrophobicContact CD2-CH2 3.78Å; Y621-W624 AromaticContact CD2-CZ3 3.63Å; Y621-W624 HydrophobicContact CD2-CZ3 3.63Å; Y621-W624 AromaticContact CE1-CH2 3.26Å; Y621-W624 HydrophobicContact CE1-CH2 3.26Å; Y621-W624 AromaticContact CE1-CZ2 3.54Å; Y621-W624 HydrophobicContact CE1-CZ2 3.54Å; Y621-W624 HydrophobicContact CE1-CZ3 4.13Å; Y621-W624 AromaticContact CE2-CH2 3.84Å; Y621-W624 HydrophobicContact CE2-CH2 3.84Å; Y621-W624 HydrophobicContact CE2-CZ3 4.02Å; Y621-W624 HydrophobicContact CG-CD2 4.44Å; Y621-W624 AromaticContact CG-CE3 3.99Å; Y621-W624 HydrophobicContact CG-CE3 3.99Å; Y621-W624 AromaticContact CG-CH2 3.44Å; Y621-W624 HydrophobicContact CG-CH2 3.44Å; Y621-W624 VanDerWaalsContact CG-CH2 3.44Å; Y621-W624 AromaticContact CG-CZ2 3.92Å; Y621-W624 HydrophobicContact CG-CZ2 3.92Å; Y621-W624 AromaticContact CG-CZ3 3.44Å; Y621-W624 HydrophobicContact CG-CZ3 3.44Å; Y621-W624 VanDerWaalsContact CG-CZ3 3.44Å; Y621-W624 AromaticContact CZ-CH2 3.6Å; Y621-W624 WeakPolarHBondContact O-CB 3.35Å; Y621-W624 PolarHBondContact O-N 3.14Å; Y621-W624 VanDerWaalsContact O-N 3.15Å
622	F	92.9	Very high	91.5	Very high	1 Å²	1	12.4 Å²	12.4	0%	0.004	7%	0.067	C	C	.	.	H	α-helix	trans	-65.2	-31.5	178.5	-55.5	-19.9	0	0	0	111.8	F553 V611 S619 Q620 W624 Y625 L626 W650 Q654 F682	F553-F622 HydrophobicContact CD1-CZ 4.41Å; F553-F622 HydrophobicContact CD2-CZ 4.3Å; F553-F622 HydrophobicContact CE2-CZ 4.42Å; F553-F622 HydrophobicContact CG-CZ 4.3Å; V611-F622 HydrophobicContact CG1-CD1 4.16Å; V611-F622 HydrophobicContact CG1-CE1 4.32Å; S619-F622 WeakPolarHBondContact O-CB 3.31Å; S619-F622 WeakPolarHBondContact O-CD2 3.37Å; S619-F622 WeakPolarHBondContact O-CG 3.43Å; S619-F622 PolarHBondContact O-N 2.87Å; Q620-F622 PolarHBondContact O-N 3.46Å; F622-W624 PolarHBondContact O-N 2.95Å; F622-Y625 HydrophobicContact CB-CE1 4.19Å; F622-Y625 AromaticContact CD1-CE1 3.86Å; F622-Y625 HydrophobicContact CD1-CE1 3.86Å; F622-Y625 AromaticContact CD1-CZ 3.97Å; F622-Y625 WeakPolarHBondContact CD1-OH 3.38Å; F622-Y625 HydrophobicContact CG-CE1 4.41Å; F622-Y625 PolarHBondContact O-N 2.98Å; F622-L626 HydrophobicContact CB-CD1 4.09Å; F622-L626 VanDerWaalsContact O-CB 3.26Å; F622-L626 WeakPolarHBondContact O-CB 3.4Å; F622-L626 WeakPolarHBondContact O-CG 3.41Å; F622-L626 PolarHBondContact O-N 2.89Å; F622-W650 HydrophobicContact CB-CZ2 4.11Å; F622-W650 HydrophobicContact CD2-CH2 4.16Å; F622-W650 AromaticContact CD2-CZ2 3.86Å; F622-W650 HydrophobicContact CD2-CZ2 3.86Å; F622-W650 HydrophobicContact CG-CZ2 4.02Å; F622-Q654 HydrophobicContact CE2-CG 3.79Å; F622-Q654 HydrophobicContact CZ-CG 4.39Å; F622-F682 HydrophobicContact CE1-CE2 4.07Å; F622-F682 AromaticContact CE1-CZ 3.56Å; F622-F682 HydrophobicContact CE1-CZ 3.56Å; F622-F682 HydrophobicContact CE2-CE2 4.41Å; F622-F682 AromaticContact CZ-CE2 3.61Å; F622-F682 HydrophobicContact CZ-CE2 3.61Å; F622-F682 AromaticContact CZ-CZ 3.52Å; F622-F682 HydrophobicContact CZ-CZ 3.52Å
623	V	90.9	Very high	91.1	Very high	7 Å²	7	13.2 Å²	13.2	4%	0.042	7%	0.073	C	C	.	.	H	α-helix	trans	-57.4	-33.3	175.8	176.8	0	0	0	0	111.3	T425 I428 T439 Q620 Y621 Y625 L626 T627	T425-V623 HydrophobicContact CG2-CG1 4.31Å; I428-V623 HydrophobicContact CD1-CG2 3.41Å; I428-V623 VanDerWaalsContact CD1-CG2 3.41Å; T439-V623 HydrophobicContact CG2-CG1 3.83Å; Q620-V623 WeakPolarHBondContact O-CB 3.39Å; Q620-V623 PolarHBondContact O-N 3.48Å; Y621-V623 PolarHBondContact O-N 3.25Å; V623-Y625 PolarHBondContact O-N 3.35Å; V623-L626 PolarHBondContact O-N 2.88Å; V623-T627 WeakPolarHBondContact O-CB 3.47Å; V623-T627 PolarHBondContact O-N 3.04Å; V623-T627 PolarHBondContact O-OG1 3.32Å
624	W	93.9	Very high	90.4	Very high	5 Å²	5	13.5 Å²	13.5	2%	0.019	8%	0.083	C	C	.	.	H	α-helix	trans	-62.9	-46.6	-176.2	-55.1	-18.2	0	0	0	112.6	E435 K470 Y472 T607 F610 V611 Y621 F622 F628	E435-W624 PolarHBondContact OE2-NE1 3.45Å; K470-W624 HydrophobicContact CD-CZ2 4.03Å; Y472-W624 HydrophobicContact CD1-CD2 4.13Å; Y472-W624 AromaticContact CD1-CE2 3.93Å; Y472-W624 HydrophobicContact CD1-CE3 4.36Å; Y472-W624 HydrophobicContact CD1-CH2 4.19Å; Y472-W624 AromaticContact CD1-CZ2 3.96Å; Y472-W624 HydrophobicContact CD1-CZ2 3.96Å; Y472-W624 HydrophobicContact CD1-CZ3 4.4Å; Y472-W624 HydrophobicContact CD2-CD2 4.38Å; Y472-W624 HydrophobicContact CD2-CE3 4.08Å; Y472-W624 HydrophobicContact CD2-CZ3 4.4Å; Y472-W624 AromaticContact CE1-CD2 3.93Å; Y472-W624 HydrophobicContact CE1-CD2 3.93Å; Y472-W624 AromaticContact CE1-CE2 3.85Å; Y472-W624 HydrophobicContact CE1-CG 4.09Å; Y472-W624 HydrophobicContact CE1-CZ2 4.33Å; Y472-W624 AromaticContact CE1-NE1 3.95Å; Y472-W624 HydrophobicContact CE2-CB 4.32Å; Y472-W624 HydrophobicContact CE2-CD2 4.21Å; Y472-W624 HydrophobicContact CE2-CE3 4.28Å; Y472-W624 HydrophobicContact CE2-CG 4.27Å; Y472-W624 HydrophobicContact CG-CD2 4.36Å; Y472-W624 HydrophobicContact CG-CE3 4.15Å; Y472-W624 HydrophobicContact CG-CH2 4.24Å; Y472-W624 HydrophobicContact CG-CZ2 4.46Å; Y472-W624 HydrophobicContact CG-CZ3 4.11Å; Y472-W624 AromaticContact CZ-CD2 4Å; Y472-W624 AromaticContact CZ-CG 3.85Å; T607-W624 HydrophobicContact CG2-CB 3.51Å; F610-W624 HydrophobicContact CD1-CE3 4.44Å; F610-W624 HydrophobicContact CD1-CZ3 4.18Å; F610-W624 HydrophobicContact CE1-CE3 4.41Å; F610-W624 AromaticContact CE1-CZ3 3.75Å; F610-W624 HydrophobicContact CE1-CZ3 3.75Å; V611-W624 HydrophobicContact CG2-CE3 3.69Å; V611-W624 HydrophobicContact CG2-CZ3 4.21Å; Y621-W624 HydrophobicContact CD1-CD2 4.46Å; Y621-W624 AromaticContact CD1-CE2 3.94Å; Y621-W624 HydrophobicContact CD1-CE3 4.34Å; Y621-W624 AromaticContact CD1-CH2 3.15Å; Y621-W624 HydrophobicContact CD1-CH2 3.15Å; Y621-W624 AromaticContact CD1-CZ2 3.27Å; Y621-W624 HydrophobicContact CD1-CZ2 3.27Å; Y621-W624 AromaticContact CD1-CZ3 3.7Å; Y621-W624 HydrophobicContact CD1-CZ3 3.7Å; Y621-W624 HydrophobicContact CD2-CE3 4.46Å; Y621-W624 AromaticContact CD2-CH2 3.78Å; Y621-W624 HydrophobicContact CD2-CH2 3.78Å; Y621-W624 AromaticContact CD2-CZ3 3.63Å; Y621-W624 HydrophobicContact CD2-CZ3 3.63Å; Y621-W624 AromaticContact CE1-CH2 3.26Å; Y621-W624 HydrophobicContact CE1-CH2 3.26Å; Y621-W624 AromaticContact CE1-CZ2 3.54Å; Y621-W624 HydrophobicContact CE1-CZ2 3.54Å; Y621-W624 HydrophobicContact CE1-CZ3 4.13Å; Y621-W624 AromaticContact CE2-CH2 3.84Å; Y621-W624 HydrophobicContact CE2-CH2 3.84Å; Y621-W624 HydrophobicContact CE2-CZ3 4.02Å; Y621-W624 HydrophobicContact CG-CD2 4.44Å; Y621-W624 AromaticContact CG-CE3 3.99Å; Y621-W624 HydrophobicContact CG-CE3 3.99Å; Y621-W624 AromaticContact CG-CH2 3.44Å; Y621-W624 HydrophobicContact CG-CH2 3.44Å; Y621-W624 VanDerWaalsContact CG-CH2 3.44Å; Y621-W624 AromaticContact CG-CZ2 3.92Å; Y621-W624 HydrophobicContact CG-CZ2 3.92Å; Y621-W624 AromaticContact CG-CZ3 3.44Å; Y621-W624 HydrophobicContact CG-CZ3 3.44Å; Y621-W624 VanDerWaalsContact CG-CZ3 3.44Å; Y621-W624 AromaticContact CZ-CH2 3.6Å; Y621-W624 WeakPolarHBondContact O-CB 3.35Å; Y621-W624 PolarHBondContact O-N 3.14Å; Y621-W624 VanDerWaalsContact O-N 3.15Å; F622-W624 PolarHBondContact O-N 2.95Å; W624-F628 WeakPolarHBondContact O-CD2 3.43Å; W624-F628 VanDerWaalsContact O-CE2 3.25Å; W624-F628 WeakPolarHBondContact O-CE2 3.49Å
625	Y	94.5	Very high	89.8	Confident	4 Å²	4	13.4 Å²	13.4	2%	0.016	8%	0.082	C	C	.	.	H	α-helix	trans	-85.7	-31	177	63	-105.6	0	0	0	112.5	F604 Y608 V611 F622 V623 T627 F628 L629 W650	F604-Y625 WeakPolarHBondContact CD2-O 3.18Å; Y608-Y625 HydrophobicContact CD2-CD1 4.36Å; Y608-Y625 AromaticContact CD2-CD2 3.62Å; Y608-Y625 HydrophobicContact CD2-CD2 3.62Å; Y608-Y625 HydrophobicContact CD2-CE2 4.06Å; Y608-Y625 AromaticContact CD2-CG 3.81Å; Y608-Y625 HydrophobicContact CD2-CG 3.81Å; Y608-Y625 AromaticContact CE2-CD2 3.81Å; Y608-Y625 HydrophobicContact CE2-CD2 3.81Å; Y608-Y625 AromaticContact CE2-CE2 3.77Å; Y608-Y625 HydrophobicContact CE2-CE2 3.77Å; Y608-Y625 HydrophobicContact CE2-CG 4.37Å; Y608-Y625 HydrophobicContact CG-CG 4.38Å; V611-Y625 HydrophobicContact CB-CD1 4.13Å; V611-Y625 HydrophobicContact CB-CE1 4.17Å; V611-Y625 HydrophobicContact CG1-CD1 4.36Å; V611-Y625 HydrophobicContact CG1-CE1 3.94Å; V611-Y625 HydrophobicContact CG2-CD1 4.12Å; F622-Y625 HydrophobicContact CB-CE1 4.19Å; F622-Y625 AromaticContact CD1-CE1 3.86Å; F622-Y625 HydrophobicContact CD1-CE1 3.86Å; F622-Y625 AromaticContact CD1-CZ 3.97Å; F622-Y625 WeakPolarHBondContact CD1-OH 3.38Å; F622-Y625 HydrophobicContact CG-CE1 4.41Å; F622-Y625 PolarHBondContact O-N 2.98Å; V623-Y625 PolarHBondContact O-N 3.35Å; Y625-T627 PolarHBondContact O-N 3.03Å; Y625-F628 PolarHBondContact O-N 3.4Å; Y625-F628 VanDerWaalsContact O-N 3.15Å; Y625-L629 PolarHBondContact O-N 3.45Å; Y625-W650 WeakPolarHBondContact OH-CZ2 3.48Å; Y625-W650 PolarHBondContact OH-NE1 2.99Å
626	L	92.7	Very high	89.6	Confident	18 Å²	18	14.1 Å²	14.1	9%	0.094	9%	0.086	C	C	.	.	H	α-helix	trans	-61.6	-31.4	176.8	-74.3	172.7	0	0	0	111.9	F424 F622 V623 F628 L629 P630 W650	F424-L626 HydrophobicContact CB-CD1 4.4Å; F622-L626 HydrophobicContact CB-CD1 4.09Å; F622-L626 VanDerWaalsContact O-CB 3.26Å; F622-L626 WeakPolarHBondContact O-CB 3.4Å; F622-L626 WeakPolarHBondContact O-CG 3.41Å; F622-L626 PolarHBondContact O-N 2.89Å; V623-L626 PolarHBondContact O-N 2.88Å; L626-F628 VanDerWaalsContact C-N 3.27Å; L626-F628 PolarHBondContact O-N 3.3Å; L626-L629 HydrophobicContact CD2-CD2 4.29Å; L626-L629 VanDerWaalsContact O-CB 3.27Å; L626-L629 WeakPolarHBondContact O-CB 3.42Å; L626-L629 PolarHBondContact O-N 3.05Å; L626-L629 VanDerWaalsContact O-N 3.12Å; L626-P630 VanDerWaalsContact O-CD 3.27Å; L626-P630 WeakPolarHBondContact O-CD 3.37Å; L626-W650 HydrophobicContact CD1-CH2 4.16Å; L626-W650 HydrophobicContact CD1-CZ2 4.34Å
627	T	92.3	Very high	89.2	Confident	11 Å²	11	16.9 Å²	16.9	7%	0.067	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-30.1	177.3	-61.3	0	0	0	0	113.3	T400 T439 L443 V623 Y625 P630	T400-T627 HydrophobicContact CG2-CG2 3.56Å; T439-T627 HydrophobicContact CG2-CG2 4.33Å; T439-T627 WeakPolarHBondContact CG2-OG1 3.38Å; L443-T627 HydrophobicContact CD1-CG2 3.59Å; L443-T627 HydrophobicContact CD2-CG2 4.19Å; L443-T627 HydrophobicContact CG-CG2 3.84Å; V623-T627 WeakPolarHBondContact O-CB 3.47Å; V623-T627 PolarHBondContact O-N 3.04Å; V623-T627 PolarHBondContact O-OG1 3.32Å; Y625-T627 PolarHBondContact O-N 3.03Å; T627-P630 WeakPolarHBondContact O-CD 3.42Å
628	F	94.2	Very high	88.7	Confident	1 Å²	1	19.1 Å²	19.1	0%	0.004	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-18.6	175.8	-60.1	-76.8	0	0	0	112.6	L443 L446 Y476 W603 F604 W624 Y625 L626 V631 V632	L443-F628 HydrophobicContact CD2-CD1 3.66Å; L443-F628 HydrophobicContact CD2-CE1 3.62Å; L446-F628 HydrophobicContact CD2-CD1 3.92Å; L446-F628 HydrophobicContact CD2-CE1 3.72Å; Y476-F628 WeakPolarHBondContact OH-CE2 3.43Å; W603-F628 HydrophobicContact CB-CD1 4.49Å; W603-F628 HydrophobicContact CB-CE1 4.07Å; W603-F628 HydrophobicContact CB-CZ 4.19Å; W603-F628 AromaticContact CE3-CE1 3.96Å; W603-F628 HydrophobicContact CE3-CE1 3.96Å; W603-F628 AromaticContact CE3-CZ 3.96Å; W603-F628 HydrophobicContact CE3-CZ 3.96Å; F604-F628 HydrophobicContact CB-CB 3.73Å; F604-F628 HydrophobicContact CB-CG 4.32Å; F604-F628 HydrophobicContact CD2-CB 3.89Å; F604-F628 HydrophobicContact CG-CB 4.25Å; W624-F628 WeakPolarHBondContact O-CD2 3.43Å; W624-F628 VanDerWaalsContact O-CE2 3.25Å; W624-F628 WeakPolarHBondContact O-CE2 3.49Å; Y625-F628 PolarHBondContact O-N 3.4Å; Y625-F628 VanDerWaalsContact O-N 3.15Å; L626-F628 VanDerWaalsContact C-N 3.27Å; L626-F628 PolarHBondContact O-N 3.3Å; F628-V631 WeakPolarHBondContact O-CA 3.32Å; F628-V631 VanDerWaalsContact O-CB 3.31Å; F628-V631 WeakPolarHBondContact O-CB 3.3Å; F628-V631 PolarHBondContact O-N 3.39Å; F628-V632 WeakPolarHBondContact O-CG2 3.21Å; F628-V632 PolarHBondContact O-N 2.89Å
629	L	91.8	Very high	88.4	Confident	42 Å²	42	22 Å²	22	22%	0.22	14%	0.138	C	C	.	.	H	α-helix	trans	-55.4	-43.3	-176.3	-169.8	67.2	0	0	0	113.7	L418 F604 Y625 L626 V631 V632 S633	L418-L629 HydrophobicContact CD1-CD2 4.4Å; L418-L629 HydrophobicContact CD2-CB 4.47Å; L418-L629 HydrophobicContact CD2-CD2 4.14Å; L418-L629 HydrophobicContact CD2-CG 3.97Å; F604-L629 HydrophobicContact CE2-CD1 4.34Å; F604-L629 HydrophobicContact CZ-CD1 4.26Å; Y625-L629 PolarHBondContact O-N 3.45Å; L626-L629 HydrophobicContact CD2-CD2 4.29Å; L626-L629 VanDerWaalsContact O-CB 3.27Å; L626-L629 WeakPolarHBondContact O-CB 3.42Å; L626-L629 PolarHBondContact O-N 3.05Å; L626-L629 VanDerWaalsContact O-N 3.12Å; L629-V631 VanDerWaalsContact C-N 3.26Å; L629-V631 PolarHBondContact O-N 3.41Å; L629-V632 HydrophobicContact CD1-CG2 4.45Å; L629-V632 PolarHBondContact O-N 2.65Å; L629-S633 WeakPolarHBondContact O-CB 3.27Å; L629-S633 PolarHBondContact O-N 2.86Å; L629-S633 PolarHBondContact O-OG 3.41Å
630	P	90.3	Very high	88.3	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59	-36.1	173.1	-19.9	29.9	0	0	0	113.6	C404 I415 L418 A419 L626 T627 S633	C404-P630 HydrophobicContact CB-CB 4.2Å; I415-P630 HydrophobicContact CG2-CB 3.83Å; L418-P630 HydrophobicContact CB-CB 4.28Å; L418-P630 HydrophobicContact CB-CG 3.98Å; L418-P630 HydrophobicContact CD2-CB 4.38Å; L418-P630 HydrophobicContact CD2-CG 4.19Å; L418-P630 HydrophobicContact CG-CG 3.95Å; A419-P630 HydrophobicContact CB-CB 4.38Å; A419-P630 HydrophobicContact CB-CG 3.89Å; L626-P630 VanDerWaalsContact O-CD 3.27Å; L626-P630 WeakPolarHBondContact O-CD 3.37Å; T627-P630 WeakPolarHBondContact O-CD 3.42Å; P630-S633 PolarHBondContact O-OG 3.4Å
631	V	90.5	Very high	88.5	Confident	8 Å²	8	27.5 Å²	27.5	5%	0.048	17%	0.174	C	C	.	.	H	α-helix	trans	-70.4	-48.7	179.4	-178.8	0	0	0	0	110.9	C404 L407 E600 F628 L629	C404-V631 HydrophobicContact CB-CG2 4.09Å; L407-V631 HydrophobicContact CB-CB 4.44Å; L407-V631 HydrophobicContact CB-CG1 3.65Å; L407-V631 HydrophobicContact CB-CG2 3.91Å; L407-V631 HydrophobicContact CD1-CG2 4.23Å; E600-V631 HydrophobicContact CB-CG1 3.86Å; E600-V631 HydrophobicContact CG-CG1 3.94Å; F628-V631 WeakPolarHBondContact O-CA 3.32Å; F628-V631 VanDerWaalsContact O-CB 3.31Å; F628-V631 WeakPolarHBondContact O-CB 3.3Å; F628-V631 PolarHBondContact O-N 3.39Å; L629-V631 VanDerWaalsContact C-N 3.26Å; L629-V631 PolarHBondContact O-N 3.41Å
632	V	90.4	Very high	88.4	Confident	1 Å²	1	29.5 Å²	29.5	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-84.6	-15.4	-174.3	-58.6	0	0	0	0	113.9	E600 F601 F604 F628 L629 G634 R635 L636	E600-V632 HydrophobicContact CB-CG1 4.43Å; F601-V632 HydrophobicContact CB-CG1 4.27Å; F601-V632 HydrophobicContact CD2-CB 4.27Å; F601-V632 HydrophobicContact CD2-CG1 4.29Å; F604-V632 HydrophobicContact CB-CG1 3.87Å; F604-V632 HydrophobicContact CB-CG2 4.34Å; F604-V632 HydrophobicContact CD1-CG2 3.95Å; F604-V632 HydrophobicContact CD2-CG2 4.27Å; F604-V632 HydrophobicContact CE1-CG2 4.32Å; F604-V632 HydrophobicContact CG-CG1 4.34Å; F604-V632 HydrophobicContact CG-CG2 3.91Å; F628-V632 WeakPolarHBondContact O-CG2 3.21Å; F628-V632 PolarHBondContact O-N 2.89Å; L629-V632 HydrophobicContact CD1-CG2 4.45Å; L629-V632 PolarHBondContact O-N 2.65Å; V632-G634 PolarHBondContact O-N 3.48Å; V632-R635 WeakPolarHBondContact O-CA 3.42Å; V632-R635 VanDerWaalsContact O-CB 3.31Å; V632-R635 WeakPolarHBondContact O-CB 3.35Å; V632-R635 PolarHBondContact O-N 2.86Å; V632-L636 HydrophobicContact CG2-CD1 4.48Å
633	S	87.1	Confident	88.2	Confident	24 Å²	24	31.2 Å²	31.2	17%	0.168	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-59.1	-21.8	-176.2	54.1	0	0	0	0	114.4	R410 L629 P630 R635	R410-S633 PolarHBondContact NH2-OG 3.23Å; L629-S633 WeakPolarHBondContact O-CB 3.27Å; L629-S633 PolarHBondContact O-N 2.86Å; L629-S633 PolarHBondContact O-OG 3.41Å; P630-S633 PolarHBondContact O-OG 3.4Å; S633-R635 VanDerWaalsContact C-N 3.28Å
634	G	78.3	Confident	88.2	Confident	31 Å²	31	35.5 Å²	35.5	32%	0.32	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-76.7	-11.7	173.1	0	0	0	0	0	114.5	V632	V632-G634 PolarHBondContact O-N 3.48Å
635	R	80.6	Confident	88.2	Confident	12 Å²	12	41.8 Å²	41.8	5%	0.045	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-97	-9.6	177.5	-58.5	-58.4	-152.6	178.2	8.6	113.4	D598 V632 S633 Y697 N698 D794	D598-R635 IonicContact OD2-CZ 3.62Å; D598-R635 IonicContact OD2-NE 3.51Å; D598-R635 PolarHBondContact OD2-NE 3.22Å; D598-R635 IonicContact OD2-NH2 2.97Å; D598-R635 PolarHBondContact OD2-NH2 2.89Å; V632-R635 WeakPolarHBondContact O-CA 3.42Å; V632-R635 VanDerWaalsContact O-CB 3.31Å; V632-R635 WeakPolarHBondContact O-CB 3.35Å; V632-R635 PolarHBondContact O-N 2.86Å; S633-R635 VanDerWaalsContact C-N 3.28Å; R635-Y697 HydrophobicContact CB-CD2 4.05Å; R635-Y697 HydrophobicContact CB-CE2 4.19Å; R635-N698 PolarHBondContact O-N 3.33Å; R635-D794 IonicContact CZ-OD1 3.54Å; R635-D794 IonicContact CZ-OD2 2.73Å; R635-D794 VanDerWaalsContact NH1-CG 3.25Å; R635-D794 IonicContact NH1-OD1 2.81Å; R635-D794 PolarHBondContact NH1-OD1 2.8Å; R635-D794 IonicContact NH1-OD2 2.59Å; R635-D794 PolarHBondContact NH1-OD2 3.49Å; R635-D794 IonicContact NH2-OD1 3.95Å; R635-D794 IonicContact NH2-OD2 2.82Å; R635-D794 PolarHBondContact NH2-OD2 3.18Å
636	L	86.3	Confident	88.2	Confident	22 Å²	22	42.6 Å²	42.6	12%	0.115	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-96.9	111.8	-175.8	-61.3	174.2	0	0	0	108.7	F601 V632 L638 L693	F601-L636 HydrophobicContact CE2-CD2 4.09Å; V632-L636 HydrophobicContact CG2-CD1 4.48Å; L636-L638 HydrophobicContact CB-CD1 4.04Å; L636-L638 HydrophobicContact CB-CG 4.12Å; L636-L638 HydrophobicContact CD1-CD1 4.27Å; L636-L638 PolarHBondContact O-N 2.87Å; L636-L693 HydrophobicContact CD1-CD2 3.6Å; L636-L693 HydrophobicContact CD2-CB 4.47Å; L636-L693 HydrophobicContact CD2-CD2 4.11Å; L636-L693 HydrophobicContact CG-CD2 4.47Å
637	S	81	Confident	88.1	Confident	65 Å²	65	45 Å²	45	46%	0.455	27%	0.267	S	S	.	.			trans	-77	52.8	175.9	59.5	0	0	0	0	112.1	A696 N698	S637-A696 PolarHBondContact N-O 2.82Å; S637-A696 PolarHBondContact OG-O 3.15Å; S637-N698 PolarHBondContact OG-ND2 3.29Å
638	L	82.3	Confident	88.3	Confident	48 Å²	48	49.7 Å²	49.7	25%	0.251	29%	0.292	S	S	.	.			trans	-94	130	-178	-67.2	172.1	0	0	0	111.3	L636 M642 M646 T692 L693 A696	L636-L638 HydrophobicContact CB-CD1 4.04Å; L636-L638 HydrophobicContact CB-CG 4.12Å; L636-L638 HydrophobicContact CD1-CD1 4.27Å; L636-L638 PolarHBondContact O-N 2.87Å; L638-M642 HydrophobicContact CD2-CG 4.07Å; L638-M646 HydrophobicContact CD1-SD 4.18Å; L638-M646 HydrophobicContact CD2-SD 4.1Å; L638-T692 HydrophobicContact CD2-CG2 4.49Å; L638-L693 HydrophobicContact CD1-CD2 4.01Å; L638-A696 HydrophobicContact CD2-CB 3.45Å; L638-A696 VanDerWaalsContact CD2-CB 3.45Å; L638-A696 HydrophobicContact CG-CB 3.8Å
639	S	82.7	Confident	88.4	Confident	80 Å²	80	53.1 Å²	53.1	56%	0.559	31%	0.309	S	S	*	.			trans	-61.4	143.9	163.9	172.7	0	0	0	0	110.3	S641 M642 A643	S639-S641 PolarHBondContact O-N 2.95Å; S639-M642 WeakPolarHBondContact O-CA 3.35Å; S639-M642 WeakPolarHBondContact O-CB 3.08Å; S639-M642 PolarHBondContact O-N 2.7Å; S639-A643 PolarHBondContact O-N 3.15Å
640	T	84.3	Confident	88.6	Confident	107 Å²	107	52.3 Å²	52.3	66%	0.656	30%	0.303	S	S	*	.	H	α-helix	trans	-54.2	-38.1	177.3	-48.2	0	0	0	0	112.1	M642 A643 I644	T640-M642 PolarHBondContact O-N 2.96Å; T640-A643 PolarHBondContact O-N 3.48Å; T640-I644 HydrophobicContact CG2-CD1 4.09Å; T640-I644 VanDerWaalsContact O-CG1 3.29Å; T640-I644 WeakPolarHBondContact O-CG1 3.32Å; T640-I644 PolarHBondContact O-N 2.98Å
641	S	89	Confident	88.8	Confident	69 Å²	69	56.1 Å²	56.1	48%	0.483	32%	0.323	S	S	.	.	H	α-helix	trans	-64	-40.4	176	180	0	0	0	0	112.2	S639 R645	S639-S641 PolarHBondContact O-N 2.95Å; S641-R645 WeakPolarHBondContact O-CB 3.46Å; S641-R645 PolarHBondContact O-N 2.99Å
642	M	89.5	Confident	89.1	Confident	63 Å²	63	61.9 Å²	61.9	31%	0.31	35%	0.348	S	S	.	.	H	α-helix	trans	-67.5	-44.8	177.8	-171.5	64.6	176	0	0	110.8	L638 S639 T640 I644 R645 M646 T692	L638-M642 HydrophobicContact CD2-CG 4.07Å; S639-M642 WeakPolarHBondContact O-CA 3.35Å; S639-M642 WeakPolarHBondContact O-CB 3.08Å; S639-M642 PolarHBondContact O-N 2.7Å; T640-M642 PolarHBondContact O-N 2.96Å; M642-I644 PolarHBondContact O-N 2.95Å; M642-R645 PolarHBondContact O-N 2.99Å; M642-M646 HydrophobicContact CE-CG 4.34Å; M642-M646 HydrophobicContact CE-SD 4.22Å; M642-M646 HydrophobicContact CG-CG 4.49Å; M642-M646 HydrophobicContact CG-SD 4.04Å; M642-M646 VanDerWaalsContact O-CG 3.29Å; M642-M646 WeakPolarHBondContact O-CG 3.42Å; M642-M646 PolarHBondContact O-N 2.95Å; M642-T692 HydrophobicContact CE-CG2 3.56Å
643	A	88.7	Confident	89.4	Confident	37 Å²	37	61.8 Å²	61.8	31%	0.306	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-47.7	176.8	0	0	0	0	0	111.7	S639 T640 R645 M646 S647	S639-A643 PolarHBondContact O-N 3.15Å; T640-A643 PolarHBondContact O-N 3.48Å; A643-R645 VanDerWaalsContact C-N 3.35Å; A643-R645 PolarHBondContact O-N 3.32Å; A643-M646 PolarHBondContact O-N 3.46Å; A643-S647 PolarHBondContact O-N 3.41Å; A643-S647 PolarHBondContact O-OG 3.15Å; A643-S647 VanDerWaalsContact O-OG 3.11Å
644	I	91.8	Very high	89.7	Confident	97 Å²	97	61 Å²	61	50%	0.497	34%	0.341	S	S	.	.	H	α-helix	trans	-59.4	-45.9	176.1	-68.8	166.5	0	0	0	110.8	T640 M642 M646 S647 L648	T640-I644 HydrophobicContact CG2-CD1 4.09Å; T640-I644 VanDerWaalsContact O-CG1 3.29Å; T640-I644 WeakPolarHBondContact O-CG1 3.32Å; T640-I644 PolarHBondContact O-N 2.98Å; M642-I644 PolarHBondContact O-N 2.95Å; I644-M646 VanDerWaalsContact C-N 3.35Å; I644-M646 PolarHBondContact O-N 3.27Å; I644-S647 PolarHBondContact O-N 3.34Å; I644-L648 HydrophobicContact CG2-CD1 3.98Å; I644-L648 HydrophobicContact CG2-CG 4.34Å; I644-L648 WeakPolarHBondContact O-CG 3.47Å; I644-L648 PolarHBondContact O-N 3.49Å
645	R	94	Very high	90.4	Very high	138 Å²	138	62.4 Å²	62.4	52%	0.521	35%	0.349	S	S	.	.	H	α-helix	trans	-60.9	-43.9	179.2	-167.6	-174.2	-47.8	178.4	6.7	111.8	S641 M642 A643 L648 I649	S641-R645 WeakPolarHBondContact O-CB 3.46Å; S641-R645 PolarHBondContact O-N 2.99Å; M642-R645 PolarHBondContact O-N 2.99Å; A643-R645 VanDerWaalsContact C-N 3.35Å; A643-R645 PolarHBondContact O-N 3.32Å; R645-L648 PolarHBondContact O-N 3.12Å; R645-I649 HydrophobicContact CG-CD1 3.95Å; R645-I649 WeakPolarHBondContact O-CB 3.29Å; R645-I649 VanDerWaalsContact O-CG1 3.27Å; R645-I649 WeakPolarHBondContact O-CG1 3.28Å; R645-I649 PolarHBondContact O-N 3.04Å
646	M	93.8	Very high	91.1	Very high	20 Å²	20	63.4 Å²	63.4	10%	0.099	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-42.7	176.1	-70	171.7	68.7	0	0	111.5	L638 M642 A643 I644 I649 W650 I689 T692 L693	L638-M646 HydrophobicContact CD1-SD 4.18Å; L638-M646 HydrophobicContact CD2-SD 4.1Å; M642-M646 HydrophobicContact CE-CG 4.34Å; M642-M646 HydrophobicContact CE-SD 4.22Å; M642-M646 HydrophobicContact CG-CG 4.49Å; M642-M646 HydrophobicContact CG-SD 4.04Å; M642-M646 VanDerWaalsContact O-CG 3.29Å; M642-M646 WeakPolarHBondContact O-CG 3.42Å; M642-M646 PolarHBondContact O-N 2.95Å; A643-M646 PolarHBondContact O-N 3.46Å; I644-M646 VanDerWaalsContact C-N 3.35Å; I644-M646 PolarHBondContact O-N 3.27Å; M646-I649 PolarHBondContact O-N 3.15Å; M646-W650 VanDerWaalsContact O-CB 3.3Å; M646-W650 WeakPolarHBondContact O-CB 3.43Å; M646-W650 PolarHBondContact O-N 2.75Å; M646-I689 HydrophobicContact CE-CB 4.4Å; M646-I689 HydrophobicContact CE-CG2 3.8Å; M646-T692 HydrophobicContact CE-CG2 3.87Å; M646-T692 HydrophobicContact SD-CG2 3.72Å; M646-L693 HydrophobicContact CE-CD2 3.78Å; M646-L693 HydrophobicContact CE-CG 3.82Å
647	S	91.7	Very high	91.5	Very high	69 Å²	69	62.7 Å²	62.7	48%	0.483	35%	0.35	S	S	.	.	H	α-helix	trans	-62.1	-42.2	175.1	-60.9	0	0	0	0	112.3	A643 I644 W650 L651	A643-S647 PolarHBondContact O-N 3.41Å; A643-S647 PolarHBondContact O-OG 3.15Å; A643-S647 VanDerWaalsContact O-OG 3.11Å; I644-S647 PolarHBondContact O-N 3.34Å; S647-W650 PolarHBondContact O-N 2.91Å; S647-L651 WeakPolarHBondContact O-CB 3.27Å; S647-L651 VanDerWaalsContact O-CG 3.26Å; S647-L651 WeakPolarHBondContact O-CG 3.37Å; S647-L651 PolarHBondContact O-N 3.46Å
648	L	96.1	Very high	92.1	Very high	110 Å²	110	64.1 Å²	64.1	58%	0.576	35%	0.352	S	S	*	.	H	α-helix	trans	-66.4	-42.5	177.1	-70.5	174.7	0	0	0	112.3	I644 R645 W650 L651 F652	I644-L648 HydrophobicContact CG2-CD1 3.98Å; I644-L648 HydrophobicContact CG2-CG 4.34Å; I644-L648 WeakPolarHBondContact O-CG 3.47Å; I644-L648 PolarHBondContact O-N 3.49Å; R645-L648 PolarHBondContact O-N 3.12Å; L648-W650 VanDerWaalsContact C-N 3.35Å; L648-L651 PolarHBondContact O-N 2.73Å; L648-F652 WeakPolarHBondContact O-CB 3.29Å; L648-F652 PolarHBondContact O-N 3.25Å
649	I	97.2	Very high	92.6	Very high	73 Å²	73	66.2 Å²	66.2	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-65.1	-41.6	176.5	-71	168.8	0	0	0	110.5	R645 M646 F652 A653 V685	R645-I649 HydrophobicContact CG-CD1 3.95Å; R645-I649 WeakPolarHBondContact O-CB 3.29Å; R645-I649 VanDerWaalsContact O-CG1 3.27Å; R645-I649 WeakPolarHBondContact O-CG1 3.28Å; R645-I649 PolarHBondContact O-N 3.04Å; M646-I649 PolarHBondContact O-N 3.15Å; I649-F652 PolarHBondContact O-N 3.47Å; I649-A653 PolarHBondContact O-N 3.5Å; I649-A653 VanDerWaalsContact O-N 3.11Å; I649-V685 HydrophobicContact CG2-CB 4.43Å; I649-V685 HydrophobicContact CG2-CG1 3.61Å; I649-V685 HydrophobicContact CG2-CG2 4.01Å
650	W	95.7	Very high	93.1	Very high	25 Å²	25	62.4 Å²	62.4	10%	0.095	34%	0.337	C	S	.	.	H	α-helix	trans	-57.4	-57.2	173.7	-173.4	85.1	0	0	0	109.4	F424 F622 Y625 L626 M646 S647 L648 F652 A653 Q654 I689	F424-W650 HydrophobicContact CD1-CH2 4.46Å; F424-W650 HydrophobicContact CD2-CH2 4.1Å; F424-W650 HydrophobicContact CD2-CZ3 4.1Å; F424-W650 HydrophobicContact CE1-CH2 4.13Å; F424-W650 AromaticContact CE2-CH2 3.76Å; F424-W650 HydrophobicContact CE2-CH2 3.76Å; F424-W650 AromaticContact CE2-CZ3 3.49Å; F424-W650 HydrophobicContact CE2-CZ3 3.49Å; F424-W650 VanDerWaalsContact CE2-CZ3 3.49Å; F424-W650 HydrophobicContact CG-CH2 4.44Å; F424-W650 AromaticContact CZ-CH2 3.77Å; F424-W650 HydrophobicContact CZ-CH2 3.77Å; F424-W650 AromaticContact CZ-CZ3 3.74Å; F424-W650 HydrophobicContact CZ-CZ3 3.74Å; F622-W650 HydrophobicContact CB-CZ2 4.11Å; F622-W650 HydrophobicContact CD2-CH2 4.16Å; F622-W650 AromaticContact CD2-CZ2 3.86Å; F622-W650 HydrophobicContact CD2-CZ2 3.86Å; F622-W650 HydrophobicContact CG-CZ2 4.02Å; Y625-W650 WeakPolarHBondContact OH-CZ2 3.48Å; Y625-W650 PolarHBondContact OH-NE1 2.99Å; L626-W650 HydrophobicContact CD1-CH2 4.16Å; L626-W650 HydrophobicContact CD1-CZ2 4.34Å; M646-W650 VanDerWaalsContact O-CB 3.3Å; M646-W650 WeakPolarHBondContact O-CB 3.43Å; M646-W650 PolarHBondContact O-N 2.75Å; S647-W650 PolarHBondContact O-N 2.91Å; L648-W650 VanDerWaalsContact C-N 3.35Å; W650-F652 VanDerWaalsContact C-N 3.32Å; W650-F652 PolarHBondContact O-N 2.83Å; W650-A653 WeakPolarHBondContact O-CA 3.29Å; W650-A653 VanDerWaalsContact O-CB 3.25Å; W650-A653 WeakPolarHBondContact O-CB 3.49Å; W650-A653 PolarHBondContact O-N 3.03Å; W650-Q654 VanDerWaalsContact CD2-NE2 3.27Å; W650-Q654 PolarHBondContact O-N 3.07Å; W650-Q654 PolarHBondContact O-NE2 3.28Å; W650-Q654 PolarHBondContact O-OE1 3.42Å; W650-I689 HydrophobicContact CB-CD1 3.67Å; W650-I689 HydrophobicContact CG-CD1 4.22Å
651	L	94.7	Very high	93.4	Very high	79 Å²	79	58.1 Å²	58.1	41%	0.414	31%	0.312	S	S	.	.	H	α-helix	trans	-54.9	-43	179.1	-73.6	171.8	0	0	0	113.3	F424 S647 L648 A653 Q654 A655	F424-L651 HydrophobicContact CE2-CD2 3.94Å; F424-L651 HydrophobicContact CZ-CD2 4.41Å; S647-L651 WeakPolarHBondContact O-CB 3.27Å; S647-L651 VanDerWaalsContact O-CG 3.26Å; S647-L651 WeakPolarHBondContact O-CG 3.37Å; S647-L651 PolarHBondContact O-N 3.46Å; L648-L651 PolarHBondContact O-N 2.73Å; L651-A653 VanDerWaalsContact C-N 3.26Å; L651-A653 PolarHBondContact O-N 2.82Å; L651-Q654 PolarHBondContact O-N 3.03Å; L651-Q654 PolarHBondContact O-OE1 3.21Å; L651-A655 WeakPolarHBondContact O-CB 3.42Å; L651-A655 PolarHBondContact O-N 3.46Å
652	F	96	Very high	93.4	Very high	129 Å²	129	59.3 Å²	59.3	57%	0.566	31%	0.307	S	S	*	.	H	α-helix	trans	-57.4	-42.5	176.1	171.8	-100.8	0	0	0	111	L648 I649 W650 Q654 A655 Q656	L648-F652 WeakPolarHBondContact O-CB 3.29Å; L648-F652 PolarHBondContact O-N 3.25Å; I649-F652 PolarHBondContact O-N 3.47Å; W650-F652 VanDerWaalsContact C-N 3.32Å; W650-F652 PolarHBondContact O-N 2.83Å; F652-Q654 VanDerWaalsContact C-N 3.31Å; F652-Q654 PolarHBondContact O-N 3.49Å; F652-A655 PolarHBondContact O-N 2.93Å; F652-Q656 HydrophobicContact CE1-CG 4.28Å; F652-Q656 HydrophobicContact CE2-CB 4.41Å; F652-Q656 HydrophobicContact CZ-CB 4.28Å; F652-Q656 HydrophobicContact CZ-CG 4.47Å; F652-Q656 WeakPolarHBondContact O-CB 3.47Å; F652-Q656 WeakPolarHBondContact O-CG 3.38Å; F652-Q656 PolarHBondContact O-N 2.97Å
653	A	96.1	Very high	93.5	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.4	-32	-178.7	0	0	0	0	0	113.5	I649 W650 L651 Q656 F682 V685	I649-A653 PolarHBondContact O-N 3.5Å; I649-A653 VanDerWaalsContact O-N 3.11Å; W650-A653 WeakPolarHBondContact O-CA 3.29Å; W650-A653 VanDerWaalsContact O-CB 3.25Å; W650-A653 WeakPolarHBondContact O-CB 3.49Å; W650-A653 PolarHBondContact O-N 3.03Å; L651-A653 VanDerWaalsContact C-N 3.26Å; L651-A653 PolarHBondContact O-N 2.82Å; A653-Q656 WeakPolarHBondContact O-CG 3.22Å; A653-Q656 PolarHBondContact O-NE2 3.02Å; A653-F682 HydrophobicContact CB-CD2 4.27Å; A653-V685 HydrophobicContact CB-CB 3.94Å; A653-V685 HydrophobicContact CB-CG1 3.79Å; A653-V685 HydrophobicContact CB-CG2 4.11Å
654	Q	94	Very high	93.4	Very high	7 Å²	7	57 Å²	57	3%	0.033	29%	0.29	C	S	.	.	H	α-helix	trans	-80.7	-41.9	170.8	-59	84.8	23.8	0	0	112.1	F553 F622 W650 L651 F652 Q656 W657 L658 F682	F553-Q654 HydrophobicContact CE1-CB 4.24Å; F553-Q654 HydrophobicContact CE1-CG 4.17Å; F622-Q654 HydrophobicContact CE2-CG 3.79Å; F622-Q654 HydrophobicContact CZ-CG 4.39Å; W650-Q654 VanDerWaalsContact CD2-NE2 3.27Å; W650-Q654 PolarHBondContact O-N 3.07Å; W650-Q654 PolarHBondContact O-NE2 3.28Å; W650-Q654 PolarHBondContact O-OE1 3.42Å; L651-Q654 PolarHBondContact O-N 3.03Å; L651-Q654 PolarHBondContact O-OE1 3.21Å; F652-Q654 VanDerWaalsContact C-N 3.31Å; F652-Q654 PolarHBondContact O-N 3.49Å; Q654-Q656 VanDerWaalsContact C-N 3.35Å; Q654-Q656 PolarHBondContact O-N 3.38Å; Q654-W657 WeakPolarHBondContact O-CB 3.47Å; Q654-W657 PolarHBondContact O-N 3.01Å; Q654-W657 VanDerWaalsContact O-N 3.07Å; Q654-L658 VanDerWaalsContact O-CG 3.3Å; Q654-L658 WeakPolarHBondContact O-CG 3.25Å; Q654-L658 PolarHBondContact O-N 2.94Å; Q654-F682 HydrophobicContact CG-CD2 4.45Å; Q654-F682 HydrophobicContact CG-CE2 4.19Å
655	A	93.5	Very high	93	Very high	60 Å²	60	55.9 Å²	55.9	50%	0.496	28%	0.283	S	S	.	.	H	α-helix	trans	-59.1	-45.3	-178	0	0	0	0	0	112.2	L651 F652 W657 L658	L651-A655 WeakPolarHBondContact O-CB 3.42Å; L651-A655 PolarHBondContact O-N 3.46Å; F652-A655 PolarHBondContact O-N 2.93Å; A655-W657 VanDerWaalsContact C-N 3.25Å; A655-W657 PolarHBondContact O-N 2.81Å; A655-L658 PolarHBondContact O-N 3.46Å
656	Q	94.7	Very high	92.5	Very high	33 Å²	33	54.4 Å²	54.4	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-63.8	-30.8	176.7	65.8	81.1	3.8	0	0	112.7	F652 A653 Q654 P660 A678	F652-Q656 HydrophobicContact CE1-CG 4.28Å; F652-Q656 HydrophobicContact CE2-CB 4.41Å; F652-Q656 HydrophobicContact CZ-CB 4.28Å; F652-Q656 HydrophobicContact CZ-CG 4.47Å; F652-Q656 WeakPolarHBondContact O-CB 3.47Å; F652-Q656 WeakPolarHBondContact O-CG 3.38Å; F652-Q656 PolarHBondContact O-N 2.97Å; A653-Q656 WeakPolarHBondContact O-CG 3.22Å; A653-Q656 PolarHBondContact O-NE2 3.02Å; Q654-Q656 VanDerWaalsContact C-N 3.35Å; Q654-Q656 PolarHBondContact O-N 3.38Å; Q656-P660 WeakPolarHBondContact O-CD 3.38Å; Q656-A678 PolarHBondContact NE2-O 2.73Å; Q656-A678 VanDerWaalsContact OE1-CA 3.31Å
657	W	95.5	Very high	92.1	Very high	8 Å²	8	58.1 Å²	58.1	3%	0.03	30%	0.297	C	S	.	.	H	α-helix	trans	-77.5	-35.7	179.3	-174.3	96.8	0	0	0	112	N552 F553 Q654 A655 L659 P660 A661 L675 A678 S679	N552-W657 WeakPolarHBondContact O-CZ2 3.34Å; F553-W657 HydrophobicContact CD1-CB 4.21Å; F553-W657 AromaticContact CD1-CD2 3.55Å; F553-W657 HydrophobicContact CD1-CD2 3.55Å; F553-W657 AromaticContact CD1-CE2 3.93Å; F553-W657 AromaticContact CD1-CE3 3.9Å; F553-W657 HydrophobicContact CD1-CE3 3.9Å; F553-W657 AromaticContact CD1-CG 3.67Å; F553-W657 HydrophobicContact CD1-CG 3.67Å; F553-W657 HydrophobicContact CD2-CE3 4.37Å; F553-W657 HydrophobicContact CD2-CH2 4.28Å; F553-W657 HydrophobicContact CD2-CZ2 4.41Å; F553-W657 HydrophobicContact CD2-CZ3 4.25Å; F553-W657 HydrophobicContact CE1-CB 3.91Å; F553-W657 AromaticContact CE1-CD2 3.44Å; F553-W657 HydrophobicContact CE1-CD2 3.44Å; F553-W657 VanDerWaalsContact CE1-CD2 3.44Å; F553-W657 AromaticContact CE1-CE3 3.36Å; F553-W657 HydrophobicContact CE1-CE3 3.36Å; F553-W657 AromaticContact CE1-CG 3.68Å; F553-W657 HydrophobicContact CE1-CG 3.68Å; F553-W657 HydrophobicContact CE1-CZ3 4.11Å; F553-W657 HydrophobicContact CE2-CD2 4.43Å; F553-W657 AromaticContact CE2-CE3 3.89Å; F553-W657 HydrophobicContact CE2-CE3 3.89Å; F553-W657 HydrophobicContact CE2-CH2 4.2Å; F553-W657 AromaticContact CE2-CZ3 3.75Å; F553-W657 HydrophobicContact CE2-CZ3 3.75Å; F553-W657 HydrophobicContact CG-CD2 4.11Å; F553-W657 HydrophobicContact CG-CE3 4.38Å; F553-W657 HydrophobicContact CG-CZ2 4.36Å; F553-W657 AromaticContact CZ-CD2 3.92Å; F553-W657 HydrophobicContact CZ-CD2 3.92Å; F553-W657 AromaticContact CZ-CE3 3.35Å; F553-W657 HydrophobicContact CZ-CE3 3.35Å; F553-W657 HydrophobicContact CZ-CH2 4.48Å; F553-W657 AromaticContact CZ-CZ3 3.68Å; F553-W657 HydrophobicContact CZ-CZ3 3.68Å; Q654-W657 WeakPolarHBondContact O-CB 3.47Å; Q654-W657 PolarHBondContact O-N 3.01Å; Q654-W657 VanDerWaalsContact O-N 3.07Å; A655-W657 VanDerWaalsContact C-N 3.25Å; A655-W657 PolarHBondContact O-N 2.81Å; W657-L659 VanDerWaalsContact C-N 3.28Å; W657-L659 PolarHBondContact O-N 3Å; W657-P660 VanDerWaalsContact O-CD 3.28Å; W657-P660 WeakPolarHBondContact O-CD 3.38Å; W657-P660 WeakPolarHBondContact O-CG 3.44Å; W657-A661 HydrophobicContact CD2-CB 4.47Å; W657-A661 HydrophobicContact CE3-CB 3.81Å; W657-A661 HydrophobicContact CH2-CB 3.79Å; W657-A661 HydrophobicContact CZ2-CB 4.44Å; W657-A661 HydrophobicContact CZ3-CB 3.44Å; W657-A661 VanDerWaalsContact CZ3-CB 3.44Å; W657-A661 WeakPolarHBondContact O-CB 3.31Å; W657-A661 PolarHBondContact O-N 3.45Å; W657-L675 HydrophobicContact CD2-CD1 4.01Å; W657-L675 HydrophobicContact CG-CD1 4.34Å; W657-L675 HydrophobicContact CH2-CD1 4.45Å; W657-L675 HydrophobicContact CZ2-CD1 3.76Å; W657-L675 HydrophobicContact CZ2-CG 4.42Å; W657-A678 HydrophobicContact CB-CB 4.25Å; W657-A678 HydrophobicContact CG-CB 4.31Å; W657-S679 PolarHBondContact NE1-OG 2.99Å
658	L	92.5	Very high	91.8	Very high	95 Å²	95	57.7 Å²	57.7	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-64.8	-29.8	-179.4	-74	169.2	0	0	0	112.9	Q654 A655 A661 Y662	Q654-L658 VanDerWaalsContact O-CG 3.3Å; Q654-L658 WeakPolarHBondContact O-CG 3.25Å; Q654-L658 PolarHBondContact O-N 2.94Å; A655-L658 PolarHBondContact O-N 3.46Å; L658-A661 PolarHBondContact O-N 3.28Å; L658-Y662 VanDerWaalsContact O-CB 3.24Å; L658-Y662 WeakPolarHBondContact O-CB 3.49Å; L658-Y662 PolarHBondContact O-N 3.42Å
659	L	92.5	Very high	91.5	Very high	92 Å²	92	57.9 Å²	57.9	48%	0.482	30%	0.3	S	S	.	.	H	α-helix	trans	-63.6	-58.8	179.2	178.4	62.5	0	0	0	113.3	W657 A661 Y662 L663 W674	W657-L659 VanDerWaalsContact C-N 3.28Å; W657-L659 PolarHBondContact O-N 3Å; L659-A661 VanDerWaalsContact C-N 3.25Å; L659-A661 PolarHBondContact O-N 3.2Å; L659-Y662 PolarHBondContact O-N 2.87Å; L659-L663 HydrophobicContact CD1-CD1 4.48Å; L659-L663 HydrophobicContact CG-CD1 4.5Å; L659-L663 WeakPolarHBondContact O-CG 3.45Å; L659-L663 PolarHBondContact O-N 2.97Å; L659-W674 HydrophobicContact CD2-CH2 3.79Å; L659-W674 HydrophobicContact CD2-CZ2 3.92Å; L659-W674 HydrophobicContact CG-CH2 4.06Å; L659-W674 HydrophobicContact CG-CZ2 4.33Å
660	P	93.7	Very high	91.1	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.7	-31.3	175.2	24.3	-32.3	0	0	0	112.2	Q656 W657 L663 L664 V671 W674 L675 A678	Q656-P660 WeakPolarHBondContact O-CD 3.38Å; W657-P660 VanDerWaalsContact O-CD 3.28Å; W657-P660 WeakPolarHBondContact O-CD 3.38Å; W657-P660 WeakPolarHBondContact O-CG 3.44Å; P660-L663 PolarHBondContact O-N 3.25Å; P660-L664 WeakPolarHBondContact O-CB 3.44Å; P660-L664 PolarHBondContact O-N 3.36Å; P660-V671 HydrophobicContact CB-CG2 4.05Å; P660-V671 WeakPolarHBondContact O-CG2 3.38Å; P660-W674 HydrophobicContact CB-CB 4.47Å; P660-W674 HydrophobicContact CB-CD2 3.79Å; P660-W674 HydrophobicContact CB-CE3 4.01Å; P660-W674 HydrophobicContact CB-CG 4.02Å; P660-W674 HydrophobicContact CG-CD2 4.25Å; P660-W674 HydrophobicContact CG-CG 4.34Å; P660-L675 HydrophobicContact CB-CB 4.27Å; P660-L675 HydrophobicContact CB-CD1 4.26Å; P660-L675 HydrophobicContact CG-CD1 4Å; P660-A678 HydrophobicContact CG-CB 4.27Å
661	A	91	Very high	90.9	Very high	16 Å²	16	60.9 Å²	60.9	13%	0.132	32%	0.32	C	S	.	.	H	α-helix	trans	-63.8	-42.6	174.9	0	0	0	0	0	112	W657 L658 L659 L664 E665 L675	W657-A661 HydrophobicContact CD2-CB 4.47Å; W657-A661 HydrophobicContact CE3-CB 3.81Å; W657-A661 HydrophobicContact CH2-CB 3.79Å; W657-A661 HydrophobicContact CZ2-CB 4.44Å; W657-A661 HydrophobicContact CZ3-CB 3.44Å; W657-A661 VanDerWaalsContact CZ3-CB 3.44Å; W657-A661 WeakPolarHBondContact O-CB 3.31Å; W657-A661 PolarHBondContact O-N 3.45Å; L658-A661 PolarHBondContact O-N 3.28Å; L659-A661 VanDerWaalsContact C-N 3.25Å; L659-A661 PolarHBondContact O-N 3.2Å; A661-L664 PolarHBondContact O-N 3.45Å; A661-E665 WeakPolarHBondContact O-CB 3.29Å; A661-E665 PolarHBondContact O-N 3.41Å; A661-L675 HydrophobicContact CB-CD1 3.94Å
662	Y	88.7	Confident	90.8	Very high	95 Å²	95	58.7 Å²	58.7	37%	0.373	31%	0.306	S	S	.	.	H	α-helix	trans	-63.6	-45.1	174.9	170.9	-94.6	0	0	0	111.8	L658 L659 L664 E665 F666 H667	L658-Y662 VanDerWaalsContact O-CB 3.24Å; L658-Y662 WeakPolarHBondContact O-CB 3.49Å; L658-Y662 PolarHBondContact O-N 3.42Å; L659-Y662 PolarHBondContact O-N 2.87Å; Y662-L664 VanDerWaalsContact C-N 3.3Å; Y662-L664 PolarHBondContact O-N 3.43Å; Y662-E665 PolarHBondContact O-N 3.15Å; Y662-F666 HydrophobicContact CD2-CB 4.19Å; Y662-F666 AromaticContact CD2-CD2 3.24Å; Y662-F666 HydrophobicContact CD2-CD2 3.24Å; Y662-F666 AromaticContact CD2-CE2 3.81Å; Y662-F666 HydrophobicContact CD2-CE2 3.81Å; Y662-F666 AromaticContact CD2-CG 3.92Å; Y662-F666 HydrophobicContact CD2-CG 3.92Å; Y662-F666 HydrophobicContact CE2-CB 3.87Å; Y662-F666 AromaticContact CE2-CD2 3.56Å; Y662-F666 HydrophobicContact CE2-CD2 3.56Å; Y662-F666 HydrophobicContact CE2-CE2 4.22Å; Y662-F666 AromaticContact CE2-CG 3.75Å; Y662-F666 HydrophobicContact CE2-CG 3.75Å; Y662-F666 HydrophobicContact CG-CD2 4.11Å; Y662-F666 WeakPolarHBondContact O-CB 3.37Å; Y662-F666 PolarHBondContact O-N 3.44Å; Y662-H667 AromaticContact CE1-CD2 3.37Å; Y662-H667 WeakPolarHBondContact CE1-CD2 3.24Å; Y662-H667 AromaticContact CE1-NE2 3.18Å; Y662-H667 WeakPolarHBondContact CE1-NE2 3.43Å; Y662-H667 AromaticContact CZ-CD2 3.89Å; Y662-H667 AromaticContact CZ-NE2 3.47Å; Y662-H667 PolarHBondContact OH-NE2 2.75Å; Y662-H667 VanDerWaalsContact OH-NE2 3.12Å
663	L	90.9	Very high	90.7	Very high	35 Å²	35	57.6 Å²	57.6	18%	0.183	31%	0.306	C	S	.	.	H	α-helix	trans	-62.1	-37	176.7	-68.7	176.2	0	0	0	112.3	L659 P660 H667 G668 F669 V671 W674	L659-L663 HydrophobicContact CD1-CD1 4.48Å; L659-L663 HydrophobicContact CG-CD1 4.5Å; L659-L663 WeakPolarHBondContact O-CG 3.45Å; L659-L663 PolarHBondContact O-N 2.97Å; P660-L663 PolarHBondContact O-N 3.25Å; L663-H667 CarbonylContact O-C 3.51Å; L663-H667 WeakPolarHBondContact O-CB 3.41Å; L663-H667 PolarHBondContact O-N 2.83Å; L663-G668 PolarHBondContact O-N 3.31Å; L663-G668 VanDerWaalsContact O-N 3.14Å; L663-F669 HydrophobicContact CB-CD2 4.09Å; L663-F669 HydrophobicContact CD2-CD2 3.93Å; L663-F669 HydrophobicContact CD2-CE2 4.14Å; L663-F669 PolarHBondContact O-N 2.99Å; L663-V671 HydrophobicContact CB-CG2 4.27Å; L663-W674 HydrophobicContact CD1-CH2 4.12Å; L663-W674 HydrophobicContact CD1-CZ3 3.61Å
664	L	88.1	Confident	90.6	Very high	17 Å²	17	63.1 Å²	63.1	9%	0.089	33%	0.327	C	S	.	.	H	α-helix	trans	-69.9	-48.7	175.8	-178.8	64.8	0	0	0	111.8	P660 A661 Y662 G668 F669 V671 Y672 L675	P660-L664 WeakPolarHBondContact O-CB 3.44Å; P660-L664 PolarHBondContact O-N 3.36Å; A661-L664 PolarHBondContact O-N 3.45Å; Y662-L664 VanDerWaalsContact C-N 3.3Å; Y662-L664 PolarHBondContact O-N 3.43Å; L664-G668 VanDerWaalsContact O-CA 3.28Å; L664-G668 WeakPolarHBondContact O-CA 2.96Å; L664-G668 PolarHBondContact O-N 3.48Å; L664-F669 VanDerWaalsContact CD1-O 3.22Å; L664-F669 WeakPolarHBondContact CD1-O 3.28Å; L664-V671 HydrophobicContact CB-CG2 3.87Å; L664-Y672 HydrophobicContact CD1-CE1 4.08Å; L664-Y672 HydrophobicContact CD1-CE2 4.11Å; L664-Y672 HydrophobicContact CD2-CD1 4.01Å; L664-Y672 HydrophobicContact CD2-CE1 3.67Å; L664-L675 HydrophobicContact CD2-CD2 3.72Å
665	E	83	Confident	90.6	Very high	73 Å²	73	63 Å²	63	34%	0.341	33%	0.326	S	S	.	.	H	α-helix	trans	-80.6	-43.4	-170.6	-171.1	66	-170.4	0	0	113.1	R550 H551 A661 Y662	R550-E665 IonicContact NH1-OE2 3.72Å; R550-E665 PolarHBondContact NH1-OE2 3.24Å; H551-E665 IonicContact CE1-OE1 2.86Å; H551-E665 IonicContact CE1-OE2 3.66Å; A661-E665 WeakPolarHBondContact O-CB 3.29Å; A661-E665 PolarHBondContact O-N 3.41Å; Y662-E665 PolarHBondContact O-N 3.15Å
666	F	83.2	Confident	90.7	Very high	106 Å²	106	63.7 Å²	63.7	47%	0.465	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-31.6	-175	-68.5	-84.1	0	0	0	113.4	V340 T343 Y662	V340-F666 HydrophobicContact CG1-CZ 4.4Å; T343-F666 HydrophobicContact CG2-CZ 3.96Å; Y662-F666 HydrophobicContact CD2-CB 4.19Å; Y662-F666 AromaticContact CD2-CD2 3.24Å; Y662-F666 HydrophobicContact CD2-CD2 3.24Å; Y662-F666 AromaticContact CD2-CE2 3.81Å; Y662-F666 HydrophobicContact CD2-CE2 3.81Å; Y662-F666 AromaticContact CD2-CG 3.92Å; Y662-F666 HydrophobicContact CD2-CG 3.92Å; Y662-F666 HydrophobicContact CE2-CB 3.87Å; Y662-F666 AromaticContact CE2-CD2 3.56Å; Y662-F666 HydrophobicContact CE2-CD2 3.56Å; Y662-F666 HydrophobicContact CE2-CE2 4.22Å; Y662-F666 AromaticContact CE2-CG 3.75Å; Y662-F666 HydrophobicContact CE2-CG 3.75Å; Y662-F666 HydrophobicContact CG-CD2 4.11Å; Y662-F666 WeakPolarHBondContact O-CB 3.37Å; Y662-F666 PolarHBondContact O-N 3.44Å
667	H	86.1	Confident	90.8	Very high	98 Å²	98	66.2 Å²	66.2	45%	0.454	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-9.1	180	-65.5	-73.4	0	0	0	113.8	Y662 L663 F669	Y662-H667 AromaticContact CE1-CD2 3.37Å; Y662-H667 WeakPolarHBondContact CE1-CD2 3.24Å; Y662-H667 AromaticContact CE1-NE2 3.18Å; Y662-H667 WeakPolarHBondContact CE1-NE2 3.43Å; Y662-H667 AromaticContact CZ-CD2 3.89Å; Y662-H667 AromaticContact CZ-NE2 3.47Å; Y662-H667 PolarHBondContact OH-NE2 2.75Å; Y662-H667 VanDerWaalsContact OH-NE2 3.12Å; L663-H667 CarbonylContact O-C 3.51Å; L663-H667 WeakPolarHBondContact O-CB 3.41Å; L663-H667 PolarHBondContact O-N 2.83Å; H667-F669 HydrophobicContact CB-CD2 3.5Å; H667-F669 VanDerWaalsContact CB-CD2 3.5Å; H667-F669 HydrophobicContact CB-CE2 3.48Å; H667-F669 VanDerWaalsContact CB-CE2 3.48Å; H667-F669 HydrophobicContact CB-CG 4.24Å; H667-F669 HydrophobicContact CB-CZ 4.19Å; H667-F669 AromaticContact CG-CE2 4Å; H667-F669 PolarHBondContact O-N 3.35Å
668	G	83.9	Confident	90.9	Very high	61 Å²	61	65.9 Å²	65.9	63%	0.629	33%	0.329	S	S	*	.			trans	68.2	17.3	178.7	0	0	0	0	0	114.2	L663 L664	L663-G668 PolarHBondContact O-N 3.31Å; L663-G668 VanDerWaalsContact O-N 3.14Å; L664-G668 VanDerWaalsContact O-CA 3.28Å; L664-G668 WeakPolarHBondContact O-CA 2.96Å; L664-G668 PolarHBondContact O-N 3.48Å
669	F	90	Very high	91	Very high	113 Å²	113	61.4 Å²	61.4	50%	0.496	31%	0.305	S	S	.	.			trans	-72.5	136.3	179.9	-66.6	-49.6	0	0	0	111.2	L663 L664 H667 V671	L663-F669 HydrophobicContact CB-CD2 4.09Å; L663-F669 HydrophobicContact CD2-CD2 3.93Å; L663-F669 HydrophobicContact CD2-CE2 4.14Å; L663-F669 PolarHBondContact O-N 2.99Å; L664-F669 VanDerWaalsContact CD1-O 3.22Å; L664-F669 WeakPolarHBondContact CD1-O 3.28Å; H667-F669 HydrophobicContact CB-CD2 3.5Å; H667-F669 VanDerWaalsContact CB-CD2 3.5Å; H667-F669 HydrophobicContact CB-CE2 3.48Å; H667-F669 VanDerWaalsContact CB-CE2 3.48Å; H667-F669 HydrophobicContact CB-CG 4.24Å; H667-F669 HydrophobicContact CB-CZ 4.19Å; H667-F669 AromaticContact CG-CE2 4Å; H667-F669 PolarHBondContact O-N 3.35Å; F669-V671 VanDerWaalsContact C-N 3.3Å; F669-V671 HydrophobicContact CB-CG1 4.02Å; F669-V671 PolarHBondContact O-N 2.81Å
670	N	89.2	Confident	91.2	Very high	137 Å²	137	59.5 Å²	59.5	73%	0.733	30%	0.297	S	S	*	.			trans	-74.6	81.1	175.7	-176.1	0.5	0	0	0	111.1	Y672	N670-Y672 WeakPolarHBondContact OD1-CD2 3.16Å
671	V	92.4	Very high	91.4	Very high	25 Å²	25	63.1 Å²	63.1	15%	0.152	32%	0.316	C	S	.	.			trans	-113.2	25	-178.9	-63.1	0	0	0	0	112.9	P660 L663 L664 F669 L673 W674 L675	P660-V671 HydrophobicContact CB-CG2 4.05Å; P660-V671 WeakPolarHBondContact O-CG2 3.38Å; L663-V671 HydrophobicContact CB-CG2 4.27Å; L664-V671 HydrophobicContact CB-CG2 3.87Å; F669-V671 VanDerWaalsContact C-N 3.3Å; F669-V671 HydrophobicContact CB-CG1 4.02Å; F669-V671 PolarHBondContact O-N 2.81Å; V671-L673 VanDerWaalsContact C-N 3.31Å; V671-L673 PolarHBondContact O-N 3Å; V671-W674 HydrophobicContact CB-CB 4.43Å; V671-W674 HydrophobicContact CB-CE3 4.3Å; V671-W674 HydrophobicContact CG1-CE3 4.19Å; V671-W674 PolarHBondContact O-N 2.68Å; V671-W674 VanDerWaalsContact O-N 3.11Å; V671-L675 PolarHBondContact O-N 3.21Å
672	Y	91.5	Very high	91.7	Very high	33 Å²	33	62.6 Å²	62.6	13%	0.129	31%	0.311	C	S	.	.	H	α-helix	trans	-56.1	-40.4	-176	-71.8	-70.7	0	0	0	113.8	F557 Y561 L664 N670 L675 W676	F557-Y672 HydrophobicContact CE2-CD1 4.2Å; Y561-Y672 HydrophobicContact CE1-CD2 4.43Å; Y561-Y672 HydrophobicContact CE1-CE2 4.42Å; L664-Y672 HydrophobicContact CD1-CE1 4.08Å; L664-Y672 HydrophobicContact CD1-CE2 4.11Å; L664-Y672 HydrophobicContact CD2-CD1 4.01Å; L664-Y672 HydrophobicContact CD2-CE1 3.67Å; N670-Y672 WeakPolarHBondContact OD1-CD2 3.16Å; Y672-L675 PolarHBondContact O-N 3.22Å; Y672-W676 WeakPolarHBondContact O-CB 3.34Å; Y672-W676 PolarHBondContact O-N 2.99Å
673	L	93.5	Very high	92.1	Very high	105 Å²	105	60.6 Å²	60.6	55%	0.55	31%	0.305	S	S	.	.	H	α-helix	trans	-65.7	-42.2	178.3	-178.4	63.8	0	0	0	111.7	F558 V671 W676 L677	F558-L673 HydrophobicContact CE1-CD1 4.37Å; V671-L673 VanDerWaalsContact C-N 3.31Å; V671-L673 PolarHBondContact O-N 3Å; L673-W676 HydrophobicContact CD1-CE3 4.05Å; L673-W676 PolarHBondContact O-N 3.17Å; L673-L677 WeakPolarHBondContact O-CG 3.32Å; L673-L677 PolarHBondContact O-N 2.86Å
674	W	95.2	Very high	92.4	Very high	117 Å²	117	62.1 Å²	62.1	44%	0.443	32%	0.319	S	S	.	.	H	α-helix	trans	-65.1	-44.3	175.8	-179.1	12.7	0	0	0	110.8	L659 P660 L663 V671 W676 L677 A678	L659-W674 HydrophobicContact CD2-CH2 3.79Å; L659-W674 HydrophobicContact CD2-CZ2 3.92Å; L659-W674 HydrophobicContact CG-CH2 4.06Å; L659-W674 HydrophobicContact CG-CZ2 4.33Å; P660-W674 HydrophobicContact CB-CB 4.47Å; P660-W674 HydrophobicContact CB-CD2 3.79Å; P660-W674 HydrophobicContact CB-CE3 4.01Å; P660-W674 HydrophobicContact CB-CG 4.02Å; P660-W674 HydrophobicContact CG-CD2 4.25Å; P660-W674 HydrophobicContact CG-CG 4.34Å; L663-W674 HydrophobicContact CD1-CH2 4.12Å; L663-W674 HydrophobicContact CD1-CZ3 3.61Å; V671-W674 HydrophobicContact CB-CB 4.43Å; V671-W674 HydrophobicContact CB-CE3 4.3Å; V671-W674 HydrophobicContact CG1-CE3 4.19Å; V671-W674 PolarHBondContact O-N 2.68Å; V671-W674 VanDerWaalsContact O-N 3.11Å; W674-W676 VanDerWaalsContact C-N 3.29Å; W674-W676 PolarHBondContact O-N 2.83Å; W674-L677 PolarHBondContact O-N 3.42Å; W674-A678 WeakPolarHBondContact O-CB 3.43Å; W674-A678 PolarHBondContact O-N 3.36Å
675	L	94.3	Very high	92.8	Very high	4 Å²	4	62.4 Å²	62.4	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-60.3	-38.8	175.2	-173.6	62.4	0	0	0	112	F557 W657 P660 A661 L664 V671 Y672 A678 S679	F557-L675 HydrophobicContact CE1-CD2 4.44Å; F557-L675 HydrophobicContact CE1-CG 4.12Å; F557-L675 HydrophobicContact CE2-CD2 4.36Å; F557-L675 HydrophobicContact CZ-CB 4.14Å; F557-L675 HydrophobicContact CZ-CD2 3.9Å; F557-L675 HydrophobicContact CZ-CG 3.84Å; W657-L675 HydrophobicContact CD2-CD1 4.01Å; W657-L675 HydrophobicContact CG-CD1 4.34Å; W657-L675 HydrophobicContact CH2-CD1 4.45Å; W657-L675 HydrophobicContact CZ2-CD1 3.76Å; W657-L675 HydrophobicContact CZ2-CG 4.42Å; P660-L675 HydrophobicContact CB-CB 4.27Å; P660-L675 HydrophobicContact CB-CD1 4.26Å; P660-L675 HydrophobicContact CG-CD1 4Å; A661-L675 HydrophobicContact CB-CD1 3.94Å; L664-L675 HydrophobicContact CD2-CD2 3.72Å; V671-L675 PolarHBondContact O-N 3.21Å; Y672-L675 PolarHBondContact O-N 3.22Å; L675-A678 WeakPolarHBondContact O-CB 3.41Å; L675-A678 PolarHBondContact O-N 2.93Å; L675-S679 PolarHBondContact O-N 3.44Å; L675-S679 PolarHBondContact O-OG 3.02Å
676	W	95.4	Very high	93.5	Very high	75 Å²	75	59 Å²	59	28%	0.284	31%	0.305	S	S	.	.	H	α-helix	trans	-67.3	-45.1	175.8	177.3	70.4	0	0	0	112.5	A555 F557 F558 Y672 L673 W674 A678 S679 V680	A555-W676 PolarHBondContact O-NE1 3.43Å; A555-W676 VanDerWaalsContact O-NE1 3.13Å; F557-W676 HydrophobicContact CE1-CB 4.22Å; F557-W676 HydrophobicContact CZ-CB 4.11Å; F558-W676 HydrophobicContact CB-CB 3.82Å; F558-W676 HydrophobicContact CB-CG 3.69Å; F558-W676 HydrophobicContact CD1-CB 3.84Å; F558-W676 AromaticContact CD1-CD1 3.94Å; F558-W676 AromaticContact CD1-CD2 3.94Å; F558-W676 HydrophobicContact CD1-CD2 3.94Å; F558-W676 AromaticContact CD1-CG 3.6Å; F558-W676 HydrophobicContact CD1-CG 3.6Å; F558-W676 HydrophobicContact CG-CB 3.9Å; F558-W676 AromaticContact CG-CG 3.93Å; F558-W676 HydrophobicContact CG-CG 3.93Å; Y672-W676 WeakPolarHBondContact O-CB 3.34Å; Y672-W676 PolarHBondContact O-N 2.99Å; L673-W676 HydrophobicContact CD1-CE3 4.05Å; L673-W676 PolarHBondContact O-N 3.17Å; W674-W676 VanDerWaalsContact C-N 3.29Å; W674-W676 PolarHBondContact O-N 2.83Å; W676-A678 VanDerWaalsContact C-N 3.26Å; W676-A678 PolarHBondContact O-N 3.01Å; W676-S679 WeakPolarHBondContact O-CA 3.33Å; W676-S679 WeakPolarHBondContact O-CB 3.25Å; W676-S679 PolarHBondContact O-N 2.89Å; W676-V680 HydrophobicContact CD2-CG2 4.31Å; W676-V680 HydrophobicContact CH2-CG2 4.4Å; W676-V680 HydrophobicContact CZ2-CG2 4Å; W676-V680 WeakPolarHBondContact O-CG2 3.25Å; W676-V680 PolarHBondContact O-N 3.03Å
677	L	96.8	Very high	94.2	Very high	86 Å²	86	55.8 Å²	55.8	45%	0.45	29%	0.294	S	S	.	.	H	α-helix	trans	-59	-40.1	173.4	-71.3	171.6	0	0	0	111.3	L673 W674 S679 V680 I681	L673-L677 WeakPolarHBondContact O-CG 3.32Å; L673-L677 PolarHBondContact O-N 2.86Å; W674-L677 PolarHBondContact O-N 3.42Å; L677-S679 VanDerWaalsContact C-N 3.35Å; L677-S679 PolarHBondContact O-N 3.32Å; L677-V680 PolarHBondContact O-N 3.47Å; L677-I681 WeakPolarHBondContact O-CG1 3.21Å; L677-I681 PolarHBondContact O-N 3.48Å
678	A	96.5	Very high	94.6	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.008	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-42.4	172.5	0	0	0	0	0	112.2	Q656 W657 P660 W674 L675 W676 V680 I681 F682	Q656-A678 PolarHBondContact NE2-O 2.73Å; Q656-A678 VanDerWaalsContact OE1-CA 3.31Å; W657-A678 HydrophobicContact CB-CB 4.25Å; W657-A678 HydrophobicContact CG-CB 4.31Å; P660-A678 HydrophobicContact CG-CB 4.27Å; W674-A678 WeakPolarHBondContact O-CB 3.43Å; W674-A678 PolarHBondContact O-N 3.36Å; L675-A678 WeakPolarHBondContact O-CB 3.41Å; L675-A678 PolarHBondContact O-N 2.93Å; W676-A678 VanDerWaalsContact C-N 3.26Å; W676-A678 PolarHBondContact O-N 3.01Å; A678-V680 VanDerWaalsContact C-N 3.34Å; A678-I681 PolarHBondContact O-N 2.68Å; A678-F682 WeakPolarHBondContact O-CB 3.46Å; A678-F682 PolarHBondContact O-N 2.92Å
679	S	96.2	Very high	95.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-36.6	174.9	-66.4	0	0	0	0	112.5	F553 W657 L675 W676 L677 F682 H683	F553-S679 WeakPolarHBondContact O-CB 3.32Å; F553-S679 PolarHBondContact O-OG 3.5Å; W657-S679 PolarHBondContact NE1-OG 2.99Å; L675-S679 PolarHBondContact O-N 3.44Å; L675-S679 PolarHBondContact O-OG 3.02Å; W676-S679 WeakPolarHBondContact O-CA 3.33Å; W676-S679 WeakPolarHBondContact O-CB 3.25Å; W676-S679 PolarHBondContact O-N 2.89Å; L677-S679 VanDerWaalsContact C-N 3.35Å; L677-S679 PolarHBondContact O-N 3.32Å; S679-F682 PolarHBondContact O-N 2.82Å; S679-H683 WeakPolarHBondContact O-CB 3.33Å; S679-H683 PolarHBondContact O-N 3.34Å
680	V	96.8	Very high	95.6	Very high	52 Å²	52	47.8 Å²	47.8	32%	0.315	25%	0.251	S	S	.	.	H	α-helix	trans	-64.3	-47.1	174.3	173.7	0	0	0	0	110.7	A555 W676 L677 A678 F682 H683 S684	A555-V680 HydrophobicContact CB-CG2 4.11Å; W676-V680 HydrophobicContact CD2-CG2 4.31Å; W676-V680 HydrophobicContact CH2-CG2 4.4Å; W676-V680 HydrophobicContact CZ2-CG2 4Å; W676-V680 WeakPolarHBondContact O-CG2 3.25Å; W676-V680 PolarHBondContact O-N 3.03Å; L677-V680 PolarHBondContact O-N 3.47Å; A678-V680 VanDerWaalsContact C-N 3.34Å; V680-F682 VanDerWaalsContact C-N 3.32Å; V680-F682 PolarHBondContact O-N 3.36Å; V680-H683 PolarHBondContact O-N 2.91Å; V680-S684 PolarHBondContact O-N 2.88Å; V680-S684 PolarHBondContact O-OG 2.85Å
681	I	97.2	Very high	95.8	Very high	77 Å²	77	44.4 Å²	44.4	40%	0.395	24%	0.237	S	C	.	.	H	α-helix	trans	-58.7	-45.8	175.3	-66.9	167.5	0	0	0	110.4	L677 A678 H683 S684 V685	L677-I681 WeakPolarHBondContact O-CG1 3.21Å; L677-I681 PolarHBondContact O-N 3.48Å; A678-I681 PolarHBondContact O-N 2.68Å; I681-H683 VanDerWaalsContact C-N 3.34Å; I681-H683 PolarHBondContact O-N 3.19Å; I681-S684 PolarHBondContact O-N 3.33Å; I681-V685 HydrophobicContact CG2-CG2 4.36Å; I681-V685 WeakPolarHBondContact O-CB 3.26Å; I681-V685 WeakPolarHBondContact O-CG2 3.48Å; I681-V685 PolarHBondContact O-N 2.8Å
682	F	96.8	Very high	95.9	Very high	4 Å²	4	45 Å²	45	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-57	-46.4	176.1	169.4	-91.8	0	0	0	112	F553 F622 A653 Q654 A678 S679 V680 N686	F553-F682 HydrophobicContact CB-CD1 3.95Å; F553-F682 HydrophobicContact CB-CE1 3.81Å; F553-F682 HydrophobicContact CB-CG 4.47Å; F553-F682 HydrophobicContact CB-CZ 4.19Å; F553-F682 HydrophobicContact CD1-CD1 4.4Å; F553-F682 AromaticContact CD1-CD2 3.86Å; F553-F682 HydrophobicContact CD1-CD2 3.86Å; F553-F682 AromaticContact CD1-CE2 3.96Å; F553-F682 HydrophobicContact CD1-CE2 3.96Å; F553-F682 HydrophobicContact CD1-CG 4.09Å; F553-F682 HydrophobicContact CD1-CZ 4.3Å; F553-F682 HydrophobicContact CE1-CD2 4.48Å; F553-F682 HydrophobicContact CG-CZ 4.45Å; F622-F682 HydrophobicContact CE1-CE2 4.07Å; F622-F682 AromaticContact CE1-CZ 3.56Å; F622-F682 HydrophobicContact CE1-CZ 3.56Å; F622-F682 HydrophobicContact CE2-CE2 4.41Å; F622-F682 AromaticContact CZ-CE2 3.61Å; F622-F682 HydrophobicContact CZ-CE2 3.61Å; F622-F682 AromaticContact CZ-CZ 3.52Å; F622-F682 HydrophobicContact CZ-CZ 3.52Å; A653-F682 HydrophobicContact CB-CD2 4.27Å; Q654-F682 HydrophobicContact CG-CD2 4.45Å; Q654-F682 HydrophobicContact CG-CE2 4.19Å; A678-F682 WeakPolarHBondContact O-CB 3.46Å; A678-F682 PolarHBondContact O-N 2.92Å; S679-F682 PolarHBondContact O-N 2.82Å; V680-F682 VanDerWaalsContact C-N 3.32Å; V680-F682 PolarHBondContact O-N 3.36Å; F682-N686 WeakPolarHBondContact CD2-ND2 3.44Å; F682-N686 WeakPolarHBondContact CE1-ND2 3.22Å; F682-N686 WeakPolarHBondContact CE2-ND2 3.29Å; F682-N686 WeakPolarHBondContact CZ-ND2 3.2Å; F682-N686 PolarHBondContact O-N 3.33Å; F682-N686 PolarHBondContact O-ND2 3.18Å
683	H	96.3	Very high	96	Very high	53 Å²	53	43.9 Å²	43.9	25%	0.245	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-48.6	177.7	-177	78.3	0	0	0	111.7	T612 F613 S679 V680 I681 V685 N686 V687	T612-H683 PolarHBondContact O-CE1 2.91Å; T612-H683 PolarHBondContact O-ND1 3.26Å; F613-H683 AromaticContact CD1-CE1 3.54Å; F613-H683 AromaticContact CE1-CE1 3.44Å; F613-H683 VanDerWaalsContact CE1-CE1 3.44Å; F613-H683 WeakPolarHBondContact CE1-CE1 3.39Å; F613-H683 AromaticContact CE1-NE2 3.61Å; S679-H683 WeakPolarHBondContact O-CB 3.33Å; S679-H683 PolarHBondContact O-N 3.34Å; V680-H683 PolarHBondContact O-N 2.91Å; I681-H683 VanDerWaalsContact C-N 3.34Å; I681-H683 PolarHBondContact O-N 3.19Å; H683-V685 VanDerWaalsContact C-N 3.34Å; H683-V685 PolarHBondContact O-N 3.35Å; H683-N686 PolarHBondContact O-N 2.81Å; H683-V687 WeakPolarHBondContact O-CG2 3.37Å; H683-V687 PolarHBondContact O-N 2.95Å
684	S	97.6	Very high	95.9	Very high	68 Å²	68	41.2 Å²	41.2	48%	0.476	23%	0.225	S	C	.	.	H	α-helix	trans	-59.9	-41.6	178.6	-61.8	0	0	0	0	112.8	V680 I681 V687 S688	V680-S684 PolarHBondContact O-N 2.88Å; V680-S684 PolarHBondContact O-OG 2.85Å; I681-S684 PolarHBondContact O-N 3.33Å; S684-V687 PolarHBondContact O-N 2.95Å; S684-S688 WeakPolarHBondContact O-CB 3.25Å; S684-S688 PolarHBondContact O-N 2.85Å
685	V	98	Very high	95.5	Very high	22 Å²	22	41.4 Å²	41.4	13%	0.133	24%	0.238	C	C	.	.	H	α-helix	trans	-62	-47.2	175.3	163.3	0	0	0	0	111.1	I649 A653 I681 H683 V687 S688 I689	I649-V685 HydrophobicContact CG2-CB 4.43Å; I649-V685 HydrophobicContact CG2-CG1 3.61Å; I649-V685 HydrophobicContact CG2-CG2 4.01Å; A653-V685 HydrophobicContact CB-CB 3.94Å; A653-V685 HydrophobicContact CB-CG1 3.79Å; A653-V685 HydrophobicContact CB-CG2 4.11Å; I681-V685 HydrophobicContact CG2-CG2 4.36Å; I681-V685 WeakPolarHBondContact O-CB 3.26Å; I681-V685 WeakPolarHBondContact O-CG2 3.48Å; I681-V685 PolarHBondContact O-N 2.8Å; H683-V685 VanDerWaalsContact C-N 3.34Å; H683-V685 PolarHBondContact O-N 3.35Å; V685-V687 PolarHBondContact O-N 2.85Å; V685-S688 PolarHBondContact O-N 3.09Å; V685-I689 HydrophobicContact CG1-CD1 3.7Å; V685-I689 HydrophobicContact CG1-CG1 4.41Å; V685-I689 WeakPolarHBondContact O-CG1 3.42Å; V685-I689 PolarHBondContact O-N 3.1Å
686	N	96.7	Very high	95.1	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-62.3	-42.3	179.2	-83.3	-74.1	0	0	0	112.1	Y608 T612 F682 H683 I689 M690	Y608-N686 HydrophobicContact CE1-CB 4.05Å; Y608-N686 WeakPolarHBondContact CE1-O 3.3Å; Y608-N686 PolarHBondContact OH-OD1 3.2Å; T612-N686 HydrophobicContact CG2-CB 3.67Å; F682-N686 WeakPolarHBondContact CD2-ND2 3.44Å; F682-N686 WeakPolarHBondContact CE1-ND2 3.22Å; F682-N686 WeakPolarHBondContact CE2-ND2 3.29Å; F682-N686 WeakPolarHBondContact CZ-ND2 3.2Å; F682-N686 PolarHBondContact O-N 3.33Å; F682-N686 PolarHBondContact O-ND2 3.18Å; H683-N686 PolarHBondContact O-N 2.81Å; N686-I689 PolarHBondContact O-N 3.03Å; N686-M690 VanDerWaalsContact O-CB 3.25Å; N686-M690 WeakPolarHBondContact O-CB 3.43Å; N686-M690 PolarHBondContact O-N 3.07Å
687	V	97.1	Very high	94.8	Very high	39 Å²	39	39.2 Å²	39.2	24%	0.236	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-43.8	175.2	173.6	0	0	0	0	111.1	T612 F613 H683 S684 V685 I689 M690 C691	T612-V687 HydrophobicContact CG2-CG2 3.87Å; F613-V687 HydrophobicContact CE2-CG2 4.3Å; F613-V687 HydrophobicContact CZ-CG2 3.79Å; H683-V687 WeakPolarHBondContact O-CG2 3.37Å; H683-V687 PolarHBondContact O-N 2.95Å; S684-V687 PolarHBondContact O-N 2.95Å; V685-V687 PolarHBondContact O-N 2.85Å; V687-I689 PolarHBondContact O-N 3.43Å; V687-M690 PolarHBondContact O-N 2.99Å; V687-C691 PolarHBondContact O-N 2.68Å; V687-C691 PolarHBondContact O-SG 2.85Å
688	S	96.5	Very high	93.9	Very high	73 Å²	73	37.4 Å²	37.4	51%	0.51	22%	0.223	S	C	.	.	H	α-helix	trans	-61.6	-44.8	177.6	179.5	0	0	0	0	112.5	S684 V685 C691 T692	S684-S688 WeakPolarHBondContact O-CB 3.25Å; S684-S688 PolarHBondContact O-N 2.85Å; V685-S688 PolarHBondContact O-N 3.09Å; S688-C691 PolarHBondContact O-N 3.03Å; S688-T692 WeakPolarHBondContact O-CB 3.29Å; S688-T692 PolarHBondContact O-N 3.23Å; S688-T692 PolarHBondContact O-OG1 3.4Å
689	I	97.4	Very high	93.2	Very high	13 Å²	13	38 Å²	38	7%	0.067	23%	0.226	C	C	.	.	H	α-helix	trans	-61.7	-48	175.4	-71.9	170.6	0	0	0	109.9	Y608 M646 W650 V685 N686 V687 C691 T692 L693	Y608-I689 HydrophobicContact CE2-CG2 4.43Å; Y608-I689 WeakPolarHBondContact OH-CG2 3.15Å; M646-I689 HydrophobicContact CE-CB 4.4Å; M646-I689 HydrophobicContact CE-CG2 3.8Å; W650-I689 HydrophobicContact CB-CD1 3.67Å; W650-I689 HydrophobicContact CG-CD1 4.22Å; V685-I689 HydrophobicContact CG1-CD1 3.7Å; V685-I689 HydrophobicContact CG1-CG1 4.41Å; V685-I689 WeakPolarHBondContact O-CG1 3.42Å; V685-I689 PolarHBondContact O-N 3.1Å; N686-I689 PolarHBondContact O-N 3.03Å; V687-I689 PolarHBondContact O-N 3.43Å; I689-C691 PolarHBondContact O-N 3.5Å; I689-T692 WeakPolarHBondContact O-CB 3.42Å; I689-T692 PolarHBondContact O-N 3.43Å; I689-T692 VanDerWaalsContact O-N 3.15Å; I689-L693 HydrophobicContact CG2-CD1 3.76Å; I689-L693 HydrophobicContact CG2-CG 4.28Å; I689-L693 VanDerWaalsContact O-CG 3.25Å; I689-L693 WeakPolarHBondContact O-CG 2.86Å; I689-L693 PolarHBondContact O-N 3.49Å
690	M	95.5	Very high	92.7	Very high	19 Å²	19	39.1 Å²	39.1	9%	0.094	23%	0.232	C	C	.	.	H	α-helix	trans	-57.4	-48.3	178.8	-171.6	-177.6	72.2	0	0	111.7	L605 Y608 S609 F613 N686 V687 T692 L693 V694	L605-M690 HydrophobicContact CD1-CG 3.5Å; L605-M690 VanDerWaalsContact CD1-CG 3.5Å; L605-M690 HydrophobicContact CD1-SD 4.04Å; Y608-M690 HydrophobicContact CD1-CB 3.89Å; Y608-M690 HydrophobicContact CD1-CG 3.97Å; Y608-M690 HydrophobicContact CD1-SD 4.08Å; Y608-M690 HydrophobicContact CE1-CB 3.9Å; Y608-M690 HydrophobicContact CE1-CG 4.48Å; S609-M690 PolarHBondContact OG-SD 3.34Å; F613-M690 HydrophobicContact CE2-CE 4.15Å; N686-M690 VanDerWaalsContact O-CB 3.25Å; N686-M690 WeakPolarHBondContact O-CB 3.43Å; N686-M690 PolarHBondContact O-N 3.07Å; V687-M690 PolarHBondContact O-N 2.99Å; M690-T692 VanDerWaalsContact C-N 3.33Å; M690-T692 PolarHBondContact O-N 2.91Å; M690-L693 PolarHBondContact O-N 3.14Å; M690-V694 WeakPolarHBondContact O-CG2 3.33Å; M690-V694 PolarHBondContact O-N 2.88Å
691	C	95.2	Very high	92.4	Very high	66 Å²	66	36.7 Å²	36.7	45%	0.446	22%	0.217	S	C	.	.	H	α-helix	trans	-60.8	-41.5	175.9	-69.1	0	0	0	0	112	V687 S688 I689 L693 V694 V695	V687-C691 PolarHBondContact O-N 2.68Å; V687-C691 PolarHBondContact O-SG 2.85Å; S688-C691 PolarHBondContact O-N 3.03Å; I689-C691 PolarHBondContact O-N 3.5Å; C691-L693 VanDerWaalsContact C-N 3.32Å; C691-L693 PolarHBondContact O-N 3.21Å; C691-V694 PolarHBondContact O-N 3.26Å; C691-V695 WeakPolarHBondContact O-CG2 2.98Å; C691-V695 PolarHBondContact O-N 3.02Å
692	T	93.1	Very high	92.1	Very high	37 Å²	37	33.2 Å²	33.2	23%	0.227	20%	0.199	C	C	.	.	H	α-helix	trans	-62.3	-40.6	176	-56	0	0	0	0	111.5	L638 M642 M646 S688 I689 M690 V695 A696	L638-T692 HydrophobicContact CD2-CG2 4.49Å; M642-T692 HydrophobicContact CE-CG2 3.56Å; M646-T692 HydrophobicContact CE-CG2 3.87Å; M646-T692 HydrophobicContact SD-CG2 3.72Å; S688-T692 WeakPolarHBondContact O-CB 3.29Å; S688-T692 PolarHBondContact O-N 3.23Å; S688-T692 PolarHBondContact O-OG1 3.4Å; I689-T692 WeakPolarHBondContact O-CB 3.42Å; I689-T692 PolarHBondContact O-N 3.43Å; I689-T692 VanDerWaalsContact O-N 3.15Å; M690-T692 VanDerWaalsContact C-N 3.33Å; M690-T692 PolarHBondContact O-N 2.91Å; T692-V695 PolarHBondContact O-N 3.19Å; T692-A696 VanDerWaalsContact O-CB 3.26Å; T692-A696 WeakPolarHBondContact O-CB 3.26Å; T692-A696 PolarHBondContact O-N 3.47Å
693	L	93.5	Very high	91.9	Very high	10 Å²	10	33 Å²	33	5%	0.052	20%	0.198	C	C	.	.	H	α-helix	trans	-67.2	-37.3	177.1	-67.1	169.4	0	0	0	112	F604 Y608 L636 L638 M646 I689 M690 C691 A696 Y697	F604-L693 HydrophobicContact CE1-CD1 3.82Å; F604-L693 HydrophobicContact CZ-CD1 3.71Å; Y608-L693 HydrophobicContact CE2-CD1 4.45Å; L636-L693 HydrophobicContact CD1-CD2 3.6Å; L636-L693 HydrophobicContact CD2-CB 4.47Å; L636-L693 HydrophobicContact CD2-CD2 4.11Å; L636-L693 HydrophobicContact CG-CD2 4.47Å; L638-L693 HydrophobicContact CD1-CD2 4.01Å; M646-L693 HydrophobicContact CE-CD2 3.78Å; M646-L693 HydrophobicContact CE-CG 3.82Å; I689-L693 HydrophobicContact CG2-CD1 3.76Å; I689-L693 HydrophobicContact CG2-CG 4.28Å; I689-L693 VanDerWaalsContact O-CG 3.25Å; I689-L693 WeakPolarHBondContact O-CG 2.86Å; I689-L693 PolarHBondContact O-N 3.49Å; M690-L693 PolarHBondContact O-N 3.14Å; C691-L693 VanDerWaalsContact C-N 3.32Å; C691-L693 PolarHBondContact O-N 3.21Å; L693-A696 PolarHBondContact O-N 2.92Å; L693-Y697 WeakPolarHBondContact O-CB 3.46Å; L693-Y697 PolarHBondContact O-N 3.44Å
694	V	91.1	Very high	91.7	Very high	49 Å²	49	30.5 Å²	30.5	30%	0.297	19%	0.186	S	C	.	.	H	α-helix	trans	-63.4	-41.8	173	167.7	0	0	0	0	111.4	L605 M690 C691	L605-V694 HydrophobicContact CD1-CG2 3.77Å; L605-V694 HydrophobicContact CD2-CG2 3.75Å; L605-V694 HydrophobicContact CG-CG2 4.44Å; M690-V694 WeakPolarHBondContact O-CG2 3.33Å; M690-V694 PolarHBondContact O-N 2.88Å; C691-V694 PolarHBondContact O-N 3.26Å
695	V	87.4	Confident	91.5	Very high	120 Å²	120	27.2 Å²	27.2	73%	0.727	16%	0.163	S	C	*	.	H	α-helix	trans	-71.4	-34.7	176.8	172.7	0	0	0	0	112.1	C691 T692 Y697	C691-V695 WeakPolarHBondContact O-CG2 2.98Å; C691-V695 PolarHBondContact O-N 3.02Å; T692-V695 PolarHBondContact O-N 3.19Å; V695-Y697 VanDerWaalsContact C-N 3.32Å
696	A	87.2	Confident	91.1	Very high	10 Å²	10	26.2 Å²	26.2	8%	0.083	16%	0.157	C	C	.	.	H	α-helix	trans	-80	-14.9	180	0	0	0	0	0	113.7	S637 L638 T692 L693 N698	S637-A696 PolarHBondContact N-O 2.82Å; S637-A696 PolarHBondContact OG-O 3.15Å; L638-A696 HydrophobicContact CD2-CB 3.45Å; L638-A696 VanDerWaalsContact CD2-CB 3.45Å; L638-A696 HydrophobicContact CG-CB 3.8Å; T692-A696 VanDerWaalsContact O-CB 3.26Å; T692-A696 WeakPolarHBondContact O-CB 3.26Å; T692-A696 PolarHBondContact O-N 3.47Å; L693-A696 PolarHBondContact O-N 2.92Å; A696-N698 PolarHBondContact O-N 2.85Å
697	Y	87.4	Confident	90.8	Very high	23 Å²	23	26.2 Å²	26.2	9%	0.09	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-65.9	121.4	177.1	169.3	-95.7	0	0	0	110	Y594 D598 F601 R635 L693 V695 L699	Y594-Y697 HydrophobicContact CD1-CD1 4.46Å; Y594-Y697 AromaticContact CD1-CE1 3.98Å; Y594-Y697 HydrophobicContact CD1-CE1 3.98Å; Y594-Y697 AromaticContact CE1-CD1 3.78Å; Y594-Y697 HydrophobicContact CE1-CD1 3.78Å; Y594-Y697 AromaticContact CE1-CE1 3.68Å; Y594-Y697 HydrophobicContact CE1-CE1 3.68Å; D598-Y697 HydrophobicContact CB-CE2 4.2Å; D598-Y697 WeakPolarHBondContact CB-OH 3.36Å; F601-Y697 HydrophobicContact CB-CD2 4.04Å; F601-Y697 HydrophobicContact CB-CE2 3.68Å; F601-Y697 HydrophobicContact CD1-CD1 4.32Å; F601-Y697 AromaticContact CD1-CD2 3.44Å; F601-Y697 HydrophobicContact CD1-CD2 3.44Å; F601-Y697 VanDerWaalsContact CD1-CD2 3.44Å; F601-Y697 HydrophobicContact CD1-CE1 4.46Å; F601-Y697 AromaticContact CD1-CE2 3.61Å; F601-Y697 HydrophobicContact CD1-CE2 3.61Å; F601-Y697 AromaticContact CD1-CG 3.82Å; F601-Y697 HydrophobicContact CD1-CG 3.82Å; F601-Y697 AromaticContact CD2-CD2 3.63Å; F601-Y697 HydrophobicContact CD2-CD2 3.63Å; F601-Y697 HydrophobicContact CD2-CE2 4.18Å; F601-Y697 HydrophobicContact CD2-CG 4.4Å; F601-Y697 HydrophobicContact CE1-CD1 4.17Å; F601-Y697 AromaticContact CE1-CD2 3.7Å; F601-Y697 HydrophobicContact CE1-CD2 3.7Å; F601-Y697 HydrophobicContact CE1-CE2 4.28Å; F601-Y697 AromaticContact CE1-CG 3.62Å; F601-Y697 HydrophobicContact CE1-CG 3.62Å; F601-Y697 AromaticContact CE2-CD2 3.87Å; F601-Y697 HydrophobicContact CE2-CD2 3.87Å; F601-Y697 HydrophobicContact CE2-CG 4.23Å; F601-Y697 AromaticContact CG-CD2 3.4Å; F601-Y697 HydrophobicContact CG-CD2 3.4Å; F601-Y697 AromaticContact CG-CE2 3.54Å; F601-Y697 HydrophobicContact CG-CE2 3.54Å; F601-Y697 HydrophobicContact CG-CG 4.21Å; F601-Y697 AromaticContact CZ-CD2 3.91Å; F601-Y697 HydrophobicContact CZ-CD2 3.91Å; F601-Y697 AromaticContact CZ-CG 3.84Å; F601-Y697 HydrophobicContact CZ-CG 3.84Å; R635-Y697 HydrophobicContact CB-CD2 4.05Å; R635-Y697 HydrophobicContact CB-CE2 4.19Å; L693-Y697 WeakPolarHBondContact O-CB 3.46Å; L693-Y697 PolarHBondContact O-N 3.44Å; V695-Y697 VanDerWaalsContact C-N 3.32Å; Y697-L699 HydrophobicContact CE1-CG 4.37Å; Y697-L699 WeakPolarHBondContact OH-CD2 3.15Å
698	N	78.6	Confident	90.4	Very high	49 Å²	49	25.8 Å²	25.8	26%	0.262	15%	0.154	S	C	.	.			trans	-135.3	148.7	177.7	-81.4	-44.6	0	0	0	111.2	R635 S637 A696 P822	R635-N698 PolarHBondContact O-N 3.33Å; S637-N698 PolarHBondContact OG-ND2 3.29Å; A696-N698 PolarHBondContact O-N 2.85Å; N698-P822 HydrophobicContact CB-CG 3.78Å
699	L	82	Confident	89.4	Confident	13 Å²	13	23.1 Å²	23.1	7%	0.068	14%	0.138	C	C	.	.			trans	-90	159.4	171.2	-69.2	158.4	0	0	0	109.8	Y697 N792 P822	Y697-L699 HydrophobicContact CE1-CG 4.37Å; Y697-L699 WeakPolarHBondContact OH-CD2 3.15Å; L699-N792 WeakPolarHBondContact CD1-O 3.33Å; L699-P822 WeakPolarHBondContact O-CD 3.36Å; L699-P822 WeakPolarHBondContact O-CG 3.33Å
700	M	86.1	Confident	88.3	Confident	24 Å²	24	22.5 Å²	22.5	12%	0.118	13%	0.134	C	C	.	.			trans	-113	134.6	-164.5	-169.8	73	65.6	0	0	112.1	Y702 D794 V795 P822 E824	M700-Y702 HydrophobicContact CB-CD2 4.17Å; M700-Y702 HydrophobicContact CB-CE2 3.53Å; M700-Y702 HydrophobicContact CG-CD1 4.33Å; M700-Y702 HydrophobicContact CG-CD2 3.96Å; M700-Y702 HydrophobicContact CG-CE1 3.96Å; M700-Y702 HydrophobicContact CG-CE2 3.56Å; M700-Y702 HydrophobicContact CG-CG 4.34Å; M700-D794 PolarHBondContact N-OD1 3.49Å; M700-D794 WeakPolarHBondContact O-CA 3.18Å; M700-V795 PolarHBondContact O-N 3.42Å; M700-V795 VanDerWaalsContact O-N 3.11Å; M700-P822 HydrophobicContact CE-CB 3.87Å; M700-P822 HydrophobicContact CE-CG 4.06Å; M700-P822 HydrophobicContact SD-CB 3.59Å; M700-P822 VanDerWaalsContact SD-CB 3.59Å; M700-P822 HydrophobicContact SD-CG 3.9Å; M700-E824 HydrophobicContact CG-CB 4.11Å; M700-E824 HydrophobicContact SD-CB 3.98Å
701	L	89.6	Confident	87.5	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.4	165.2	-179.9	63.6	0	0	0	109.4	I786 A790 V795 I797 L812 A816 I821 P822 V823 E824	L701-I786 HydrophobicContact CD1-CG2 3.73Å; L701-A790 HydrophobicContact CB-CB 4.23Å; L701-A790 HydrophobicContact CD1-CB 4.33Å; L701-V795 CarbonylContact C-O 3.52Å; L701-V795 WeakPolarHBondContact CA-O 3.09Å; L701-V795 HydrophobicContact CD1-CB 4.05Å; L701-V795 HydrophobicContact CD1-CG1 4.1Å; L701-I797 HydrophobicContact CD1-CD1 4.14Å; L701-I797 HydrophobicContact CD1-CG1 4.37Å; L701-L812 HydrophobicContact CD2-CG 4.23Å; L701-A816 HydrophobicContact CD2-CB 3.84Å; L701-I821 HydrophobicContact CB-CG2 4.11Å; L701-P822 PolarHBondContact N-O 3.33Å; L701-V823 HydrophobicContact CB-CG2 4.34Å; L701-V823 HydrophobicContact CD2-CG2 4.28Å; L701-V823 CarbonylContact O-C 3.58Å; L701-V823 VanDerWaalsContact O-CA 3.24Å; L701-V823 WeakPolarHBondContact O-CA 3.49Å; L701-E824 PolarHBondContact O-N 3.11Å
702	Y	91.6	Very high	87	Confident	4 Å²	4	25.8 Å²	25.8	2%	0.016	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	126.3	178.8	-64.8	-94.5	0	0	0	110.8	M700 A721 R724 C725 D794 V795 G796 I797 E824 I826	M700-Y702 HydrophobicContact CB-CD2 4.17Å; M700-Y702 HydrophobicContact CB-CE2 3.53Å; M700-Y702 HydrophobicContact CG-CD1 4.33Å; M700-Y702 HydrophobicContact CG-CD2 3.96Å; M700-Y702 HydrophobicContact CG-CE1 3.96Å; M700-Y702 HydrophobicContact CG-CE2 3.56Å; M700-Y702 HydrophobicContact CG-CG 4.34Å; Y702-A721 HydrophobicContact CD1-CB 3.69Å; Y702-A721 HydrophobicContact CE1-CB 3.91Å; Y702-A721 HydrophobicContact CG-CB 4.22Å; Y702-R724 PolarHBondContact OH-NH1 2.96Å; Y702-R724 VanDerWaalsContact OH-NH1 3.15Å; Y702-C725 WeakPolarHBondContact CD2-SG 3.28Å; Y702-D794 HydrophobicContact CE2-CB 4.34Å; Y702-V795 PolarHBondContact N-O 3.48Å; Y702-G796 CarbonylContact O-C 3.51Å; Y702-G796 WeakPolarHBondContact O-CA 3.29Å; Y702-I797 PolarHBondContact O-N 2.89Å; Y702-E824 CarbonylContact C-O 3.41Å; Y702-E824 WeakPolarHBondContact CA-O 3.46Å; Y702-E824 HydrophobicContact CD1-CB 3.82Å; Y702-E824 HydrophobicContact CD1-CG 4.23Å; Y702-E824 HydrophobicContact CE1-CB 4.01Å; Y702-E824 HydrophobicContact CE1-CG 4.3Å; Y702-E824 VanDerWaalsContact CE1-OE2 3.29Å; Y702-E824 WeakPolarHBondContact CE1-OE2 3.39Å; Y702-I826 HydrophobicContact CD1-CD1 4.27Å
703	L	91.7	Very high	86.7	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	110.1	166.4	-59.8	-176.1	0	0	0	108	I797 P803 L804 H809 L812 Y813 V823 E824 V825 I826	L703-I797 HydrophobicContact CD2-CB 4.04Å; L703-I797 HydrophobicContact CD2-CD1 3.84Å; L703-I797 HydrophobicContact CD2-CG1 4.37Å; L703-P803 HydrophobicContact CB-CB 3.88Å; L703-P803 HydrophobicContact CB-CG 4.16Å; L703-L804 HydrophobicContact CD1-CD2 4.35Å; L703-H809 HydrophobicContact CD1-CB 4.33Å; L703-L812 HydrophobicContact CD2-CD2 4.33Å; L703-Y813 HydrophobicContact CD1-CD2 4.27Å; L703-V823 HydrophobicContact CD1-CG1 4.18Å; L703-V823 HydrophobicContact CG-CG1 4.05Å; L703-E824 PolarHBondContact N-O 3.11Å; L703-V825 HydrophobicContact CB-CG1 4.39Å; L703-V825 HydrophobicContact CB-CG2 4.33Å; L703-V825 HydrophobicContact CD1-CG2 4.2Å; L703-I826 PolarHBondContact O-N 3.41Å
704	I	92.7	Very high	86.5	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	114.8	-167.7	-50.5	-178.6	0	0	0	110.1	L714 A721 I797 L798 V799 I826	I704-L714 HydrophobicContact CG2-CD1 4.09Å; I704-A721 HydrophobicContact CD1-CB 3.99Å; I704-I797 PolarHBondContact N-O 2.94Å; I704-L798 HydrophobicContact CB-CD2 3.89Å; I704-L798 HydrophobicContact CD1-CD2 4.02Å; I704-L798 HydrophobicContact CG1-CD2 4.42Å; I704-L798 HydrophobicContact CG2-CD2 4.11Å; I704-L798 WeakPolarHBondContact O-CA 3.29Å; I704-V799 PolarHBondContact O-N 2.92Å; I704-I826 HydrophobicContact CG1-CD1 4.28Å
705	G	92.2	Very high	86.5	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	123.3	171.1	0	0	0	0	0	112	G707 V799 G801 I826 N828	G705-G707 VanDerWaalsContact C-N 3.34Å; G705-V799 WeakPolarHBondContact CA-O 3.38Å; G705-G801 CarbonylContact C-O 3.57Å; G705-G801 WeakPolarHBondContact CA-O 3.44Å; G705-I826 PolarHBondContact N-O 3.25Å; G705-N828 WeakPolarHBondContact O-CB 3.32Å; G705-N828 PolarHBondContact O-ND2 3.36Å
706	L	90.4	Very high	86.5	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.15	C	C	.	.			trans	-79.1	-18.4	175.5	-64.3	-177.4	0	0	0	112.9	D713 L714 F730 L737 L746 L798 V799 V800 G801 N828	L706-D713 CarbonylContact O-C 3.51Å; L706-L714 HydrophobicContact CD2-CD1 3.8Å; L706-F730 HydrophobicContact CD1-CD2 3.94Å; L706-F730 HydrophobicContact CD1-CE2 3.52Å; L706-F730 HydrophobicContact CD1-CZ 4.49Å; L706-L737 HydrophobicContact CD1-CD2 4.12Å; L706-L746 HydrophobicContact CD1-CD1 3.96Å; L706-L746 HydrophobicContact CD1-CD2 4.5Å; L706-L746 HydrophobicContact CD2-CD2 4.16Å; L706-L798 HydrophobicContact CD1-CB 4.18Å; L706-L798 HydrophobicContact CD2-CB 4.09Å; L706-L798 HydrophobicContact CD2-CD1 4.42Å; L706-L798 HydrophobicContact CD2-CD2 4.09Å; L706-L798 HydrophobicContact CD2-CG 4.42Å; L706-L798 HydrophobicContact CG-CB 4.18Å; L706-V799 PolarHBondContact N-O 3.29Å; L706-V800 HydrophobicContact CD1-CG2 4.42Å; L706-G801 PolarHBondContact N-O 3.29Å; L706-N828 PolarHBondContact O-ND2 2.8Å
707	G	90.6	Very high	86.4	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.01	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	82.6	-153.1	-172	0	0	0	0	0	111.7	G705 G801 N828 A829	G705-G707 VanDerWaalsContact C-N 3.34Å; G707-G801 PolarHBondContact N-O 3.17Å; G707-G801 WeakPolarHBondContact O-CA 3.44Å; G707-G801 PolarHBondContact O-N 3.06Å; G707-N828 PolarHBondContact N-ND2 2.98Å; G707-N828 VanDerWaalsContact N-ND2 3.18Å; G707-A829 WeakPolarHBondContact CA-O 3.5Å
708	L	87.6	Confident	86.6	Confident	30 Å²	30	33.3 Å²	33.3	16%	0.157	17%	0.171	C	C	.	.	S	Bend	trans	-100.6	-46.9	-168.2	-58	171.1	0	0	0	112.5	D713 A829 A834 I943 W945	L708-D713 PolarHBondContact N-OD2 3.21Å; L708-A829 HydrophobicContact CD1-CB 4.25Å; L708-A829 HydrophobicContact CG-CB 4.23Å; L708-A834 HydrophobicContact CD1-CB 3.4Å; L708-A834 HydrophobicContact CD2-CB 4.39Å; L708-I943 HydrophobicContact CD1-CG2 4.49Å; L708-W945 PolarHBondContact O-NE1 3.23Å
709	G	76.1	Confident	87	Confident	17 Å²	17	32.8 Å²	32.8	18%	0.175	17%	0.168	C	C	.	.	S	Bend	trans	-93.3	14	-168.9	0	0	0	0	0	116.2	D713 P738	G709-D713 WeakPolarHBondContact CA-OD2 3.42Å; G709-D713 PolarHBondContact N-OD2 3.38Å; G709-P738 WeakPolarHBondContact O-CG 3.4Å
710	G	74.8	Confident	87.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	88	-145.6	177.6	0	0	0	0	0	114.2	D712 D713	G710-D712 VanDerWaalsContact C-N 3.27Å; G710-D712 PolarHBondContact O-N 3.39Å; G710-D713 PolarHBondContact O-N 3.01Å
711	P	79.1	Confident	87.1	Confident	19 Å²	19	36 Å²	36	12%	0.123	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-58.8	-32.5	-170.1	-20.8	28	0	0	0	114.9	D713 L714 Q745 L746	P711-D713 VanDerWaalsContact C-N 3.32Å; P711-D713 PolarHBondContact O-N 2.97Å; P711-L714 WeakPolarHBondContact O-CB 3.37Å; P711-L714 PolarHBondContact O-N 2.87Å; P711-Q745 HydrophobicContact CG-CB 3.68Å; P711-L746 HydrophobicContact CB-CD2 3.89Å; P711-L746 HydrophobicContact CG-CD2 3.75Å; P711-L746 HydrophobicContact CG-CG 4.04Å
712	D	83.2	Confident	87	Confident	135 Å²	135	36 Å²	36	72%	0.722	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-73.3	-24.3	-176.9	-68	-28.6	0	0	0	112.9	G710 L714	G710-D712 VanDerWaalsContact C-N 3.27Å; G710-D712 PolarHBondContact O-N 3.39Å; D712-L714 VanDerWaalsContact C-N 3.28Å
713	D	88.4	Confident	86.6	Confident	66 Å²	66	40.4 Å²	40.4	35%	0.353	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-85.2	-2.6	176.4	-82.5	9.7	0	0	0	112.7	L706 L708 G709 G710 P711 T715 N828	L706-D713 CarbonylContact O-C 3.51Å; L708-D713 PolarHBondContact N-OD2 3.21Å; G709-D713 WeakPolarHBondContact CA-OD2 3.42Å; G709-D713 PolarHBondContact N-OD2 3.38Å; G710-D713 PolarHBondContact O-N 3.01Å; P711-D713 VanDerWaalsContact C-N 3.32Å; P711-D713 PolarHBondContact O-N 2.97Å; D713-T715 PolarHBondContact O-N 3.46Å; D713-N828 PolarHBondContact O-ND2 3.02Å
714	L	88.9	Confident	86	Confident	20 Å²	20	44.1 Å²	44.1	11%	0.105	21%	0.214	C	C	.	.			trans	-63.9	124.2	179.1	-174.9	65.4	0	0	0	110	I704 L706 P711 D712 L719 F750	I704-L714 HydrophobicContact CG2-CD1 4.09Å; L706-L714 HydrophobicContact CD2-CD1 3.8Å; P711-L714 WeakPolarHBondContact O-CB 3.37Å; P711-L714 PolarHBondContact O-N 2.87Å; D712-L714 VanDerWaalsContact C-N 3.28Å; L714-L719 HydrophobicContact CD2-CB 3.73Å; L714-L719 HydrophobicContact CD2-CD1 3.87Å; L714-L719 HydrophobicContact CD2-CG 4.38Å; L714-L719 HydrophobicContact CG-CB 4.24Å; L714-F750 HydrophobicContact CD1-CZ 4.19Å; L714-F750 HydrophobicContact CD2-CE1 3.73Å; L714-F750 HydrophobicContact CD2-CE2 4.14Å; L714-F750 HydrophobicContact CD2-CZ 3.4Å; L714-F750 VanDerWaalsContact CD2-CZ 3.4Å; L714-F750 HydrophobicContact CG-CZ 4.46Å
715	T	91.5	Very high	85.7	Confident	42 Å²	42	44.1 Å²	44.1	26%	0.258	22%	0.215	S	C	.	.			trans	-60.9	146.1	174.5	69	0	0	0	0	110.7	D713 R717 G718 L719 I826 N828	D713-T715 PolarHBondContact O-N 3.46Å; T715-R717 PolarHBondContact O-N 2.94Å; T715-G718 WeakPolarHBondContact O-CA 3.13Å; T715-G718 PolarHBondContact O-N 2.8Å; T715-G718 PolarHBondContact OG1-N 3.41Å; T715-L719 PolarHBondContact O-N 3.45Å; T715-I826 WeakPolarHBondContact OG1-CG2 3.38Å; T715-N828 HydrophobicContact CG2-CB 4.42Å
716	L	87.4	Confident	85.2	Confident	117 Å²	117	46.8 Å²	46.8	61%	0.613	23%	0.233	S	C	*	.	H	α-helix	trans	-55.7	-28.8	173.8	-68.7	176.8	0	0	0	112.5	R720	L716-R720 WeakPolarHBondContact O-CD 3.29Å; L716-R720 VanDerWaalsContact O-CG 3.22Å; L716-R720 WeakPolarHBondContact O-CG 3.23Å; L716-R720 PolarHBondContact O-N 2.84Å
717	R	85.1	Confident	85	Confident	162 Å²	162	49.5 Å²	49.5	61%	0.611	25%	0.245	S	C	*	.	H	α-helix	trans	-69.1	-47.7	173.9	-168	-177.1	-68.4	-163.7	-1.3	110.7	T715 L719 R720 A721 I826	T715-R717 PolarHBondContact O-N 2.94Å; R717-L719 PolarHBondContact O-N 2.59Å; R717-R720 PolarHBondContact O-N 3.46Å; R717-A721 WeakPolarHBondContact O-CB 3.38Å; R717-A721 PolarHBondContact O-N 2.88Å; R717-I826 HydrophobicContact CB-CG2 4.27Å; R717-I826 HydrophobicContact CG-CD1 3.97Å; R717-I826 HydrophobicContact CG-CG1 4.28Å; R717-I826 HydrophobicContact CG-CG2 4.38Å
718	G	90.4	Very high	85	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-58.7	-44.5	175.7	0	0	0	0	0	112.4	T715 R720 A721 G722	T715-G718 WeakPolarHBondContact O-CA 3.13Å; T715-G718 PolarHBondContact O-N 2.8Å; T715-G718 PolarHBondContact OG1-N 3.41Å; G718-R720 PolarHBondContact O-N 2.76Å; G718-A721 PolarHBondContact O-N 2.91Å; G718-G722 PolarHBondContact O-N 3.32Å
719	L	88	Confident	85	Confident	39 Å²	39	48.5 Å²	48.5	20%	0.204	24%	0.239	C	C	.	.	H	α-helix	trans	-58.7	-49.6	175.2	-177.6	61.9	0	0	0	112.2	L714 T715 R717 G722 Q723 H749 F750	L714-L719 HydrophobicContact CD2-CB 3.73Å; L714-L719 HydrophobicContact CD2-CD1 3.87Å; L714-L719 HydrophobicContact CD2-CG 4.38Å; L714-L719 HydrophobicContact CG-CB 4.24Å; T715-L719 PolarHBondContact O-N 3.45Å; R717-L719 PolarHBondContact O-N 2.59Å; L719-G722 PolarHBondContact O-N 2.69Å; L719-Q723 HydrophobicContact CD1-CG 4.24Å; L719-Q723 VanDerWaalsContact O-CB 3.29Å; L719-Q723 WeakPolarHBondContact O-CB 3.47Å; L719-Q723 VanDerWaalsContact O-CG 3.23Å; L719-Q723 WeakPolarHBondContact O-CG 3.33Å; L719-Q723 PolarHBondContact O-N 3.48Å; L719-H749 HydrophobicContact CD1-CB 4.18Å; L719-H749 WeakPolarHBondContact CD1-O 3.45Å; L719-F750 HydrophobicContact CD1-CD1 4.07Å; L719-F750 HydrophobicContact CD1-CE1 4.22Å
720	R	83.7	Confident	85.5	Confident	95 Å²	95	47.7 Å²	47.7	36%	0.358	23%	0.231	S	C	.	.	H	α-helix	trans	-64.9	-40.5	180	-71.5	171	-166.3	156	4	112.3	L716 R717 G718 R724	L716-R720 WeakPolarHBondContact O-CD 3.29Å; L716-R720 VanDerWaalsContact O-CG 3.22Å; L716-R720 WeakPolarHBondContact O-CG 3.23Å; L716-R720 PolarHBondContact O-N 2.84Å; R717-R720 PolarHBondContact O-N 3.46Å; G718-R720 PolarHBondContact O-N 2.76Å; R720-R724 WeakPolarHBondContact O-CB 3Å; R720-R724 PolarHBondContact O-N 2.76Å; R720-R724 VanDerWaalsContact O-N 3.09Å
721	A	85.4	Confident	85.8	Confident	8 Å²	8	47.7 Å²	47.7	7%	0.066	23%	0.231	C	C	.	.	H	α-helix	trans	-64.2	-49.6	176.6	0	0	0	0	0	110.8	Y702 I704 R717 G718 Q723 R724 C725 I826	Y702-A721 HydrophobicContact CD1-CB 3.69Å; Y702-A721 HydrophobicContact CE1-CB 3.91Å; Y702-A721 HydrophobicContact CG-CB 4.22Å; I704-A721 HydrophobicContact CD1-CB 3.99Å; R717-A721 WeakPolarHBondContact O-CB 3.38Å; R717-A721 PolarHBondContact O-N 2.88Å; G718-A721 PolarHBondContact O-N 2.91Å; A721-Q723 VanDerWaalsContact C-N 3.35Å; A721-Q723 PolarHBondContact O-N 3.11Å; A721-R724 WeakPolarHBondContact O-CA 3.33Å; A721-R724 VanDerWaalsContact O-CB 3.25Å; A721-R724 WeakPolarHBondContact O-CB 3.11Å; A721-R724 PolarHBondContact O-N 3.11Å; A721-C725 PolarHBondContact O-N 2.78Å; A721-C725 PolarHBondContact O-SG 3.45Å; A721-I826 HydrophobicContact CB-CD1 3.29Å
722	G	88	Confident	85.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.6	-34.7	178.9	0	0	0	0	0	113.5	G718 L719 R724 C725 K752	G718-G722 PolarHBondContact O-N 3.32Å; L719-G722 PolarHBondContact O-N 2.69Å; G722-R724 PolarHBondContact O-N 3.21Å; G722-C725 PolarHBondContact O-N 2.95Å; G722-K752 PolarHBondContact O-NZ 3.01Å
723	Q	84.2	Confident	84.9	Confident	98 Å²	98	42.4 Å²	42.4	46%	0.458	20%	0.199	S	C	.	.	H	α-helix	trans	-63.5	-27.9	170.9	-77.2	178.1	-11.8	0	0	112.5	L719 A721 H749 F750 K752	L719-Q723 HydrophobicContact CD1-CG 4.24Å; L719-Q723 VanDerWaalsContact O-CB 3.29Å; L719-Q723 WeakPolarHBondContact O-CB 3.47Å; L719-Q723 VanDerWaalsContact O-CG 3.23Å; L719-Q723 WeakPolarHBondContact O-CG 3.33Å; L719-Q723 PolarHBondContact O-N 3.48Å; A721-Q723 VanDerWaalsContact C-N 3.35Å; A721-Q723 PolarHBondContact O-N 3.11Å; Q723-H749 PolarHBondContact NE2-O 2.82Å; Q723-F750 HydrophobicContact CG-CD1 4.37Å; Q723-K752 PolarHBondContact O-NZ 3.15Å
724	R	78.4	Confident	83.7	Confident	77 Å²	77	41.3 Å²	41.3	29%	0.291	20%	0.195	S	C	.	.	H	α-helix	trans	-77.9	-42	176.2	-171	-171.9	-167.1	167.3	10.9	112.8	Y702 R720 A721 G722 D794	Y702-R724 PolarHBondContact OH-NH1 2.96Å; Y702-R724 VanDerWaalsContact OH-NH1 3.15Å; R720-R724 WeakPolarHBondContact O-CB 3Å; R720-R724 PolarHBondContact O-N 2.76Å; R720-R724 VanDerWaalsContact O-N 3.09Å; A721-R724 WeakPolarHBondContact O-CA 3.33Å; A721-R724 VanDerWaalsContact O-CB 3.25Å; A721-R724 WeakPolarHBondContact O-CB 3.11Å; A721-R724 PolarHBondContact O-N 3.11Å; G722-R724 PolarHBondContact O-N 3.21Å; R724-D794 IonicContact NE-OD2 3.21Å
725	C	86.5	Confident	82.9	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.007	20%	0.198	C	C	.	.			trans	-56.4	137.7	-176.5	-60.5	0	0	0	0	112.2	Y702 A721 G722 K727 L728 K752 D794 G796	Y702-C725 WeakPolarHBondContact CD2-SG 3.28Å; A721-C725 PolarHBondContact O-N 2.78Å; A721-C725 PolarHBondContact O-SG 3.45Å; G722-C725 PolarHBondContact O-N 2.95Å; C725-K727 VanDerWaalsContact C-N 3.26Å; C725-K727 WeakPolarHBondContact CB-O 3.22Å; C725-K727 PolarHBondContact O-N 3.33Å; C725-L728 HydrophobicContact CB-CD2 4.05Å; C725-L728 HydrophobicContact CB-CG 4.49Å; C725-K752 PolarHBondContact O-NZ 3.2Å; C725-D794 CarbonylContact C-O 3.52Å; C725-D794 WeakPolarHBondContact CA-O 3.26Å; C725-D794 WeakPolarHBondContact CB-O 3.02Å; C725-G796 PolarHBondContact SG-N 2.87Å
726	S	81.8	Confident	82.1	Confident	55 Å²	55	40.4 Å²	40.4	39%	0.385	19%	0.19	S	C	.	.	S	Bend	trans	-66.1	-35	173.6	-65.5	0	0	0	0	111.4	E793 D794	S726-E793 WeakPolarHBondContact CB-OE2 3.38Å; S726-D794 PolarHBondContact N-O 2.78Å
727	K	86	Confident	81.5	Confident	58 Å²	58	35 Å²	35	25%	0.252	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	144.2	178	-70.4	174.3	179.5	159.9	0	111.3	C725 Y729 E789 E793 G796	C725-K727 VanDerWaalsContact C-N 3.26Å; C725-K727 WeakPolarHBondContact CB-O 3.22Å; C725-K727 PolarHBondContact O-N 3.33Å; K727-Y729 HydrophobicContact CB-CE2 4.35Å; K727-E789 WeakPolarHBondContact CD-OE2 3.24Å; K727-E789 IonicContact NZ-OE1 3.39Å; K727-E789 PolarHBondContact NZ-OE1 2.89Å; K727-E789 IonicContact NZ-OE2 3.18Å; K727-E789 PolarHBondContact NZ-OE2 2.9Å; K727-E793 WeakPolarHBondContact CD-OE1 3.41Å; K727-E793 WeakPolarHBondContact CE-OE1 3.47Å; K727-E793 IonicContact NZ-OE1 3.17Å; K727-E793 PolarHBondContact NZ-OE1 3Å; K727-G796 PolarHBondContact O-N 3.38Å
728	L	89.6	Confident	80.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.7	173.4	-75.7	178.4	0	0	0	108.9	C725 F750 K752 I754 L755 G796 L798	C725-L728 HydrophobicContact CB-CD2 4.05Å; C725-L728 HydrophobicContact CB-CG 4.49Å; L728-F750 HydrophobicContact CD1-CB 3.78Å; L728-F750 HydrophobicContact CD1-CD1 3.79Å; L728-F750 HydrophobicContact CD1-CD2 3.76Å; L728-F750 HydrophobicContact CD1-CE1 4.26Å; L728-F750 HydrophobicContact CD1-CE2 4.25Å; L728-F750 HydrophobicContact CD1-CG 3.5Å; L728-F750 HydrophobicContact CD1-CZ 4.47Å; L728-K752 HydrophobicContact CD1-CD 3.91Å; L728-K752 HydrophobicContact CD1-CG 4.14Å; L728-K752 HydrophobicContact CG-CD 4.15Å; L728-I754 HydrophobicContact CB-CG1 4.11Å; L728-I754 HydrophobicContact CD1-CG1 4.38Å; L728-L755 PolarHBondContact O-N 2.8Å; L728-G796 CarbonylContact C-O 3.52Å; L728-G796 WeakPolarHBondContact CA-O 3.24Å; L728-L798 HydrophobicContact CD1-CD1 4.47Å; L728-L798 HydrophobicContact CD2-CD2 4.15Å; L728-L798 HydrophobicContact CD2-CG 4.38Å
729	Y	87.8	Confident	79.4	Confident	9 Å²	9	34 Å²	34	4%	0.035	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	137	171.4	-72	-79.8	0	0	0	108.7	K727 L755 C757 Q785 I786 E789 V795 G796 I797 L798	K727-Y729 HydrophobicContact CB-CE2 4.35Å; Y729-L755 CarbonylContact C-O 3.55Å; Y729-L755 VanDerWaalsContact CA-O 3.26Å; Y729-L755 WeakPolarHBondContact CA-O 3.38Å; Y729-L755 HydrophobicContact CD1-CB 3.6Å; Y729-L755 HydrophobicContact CD1-CD1 4.2Å; Y729-L755 HydrophobicContact CE1-CB 3.78Å; Y729-L755 HydrophobicContact CE1-CD1 3.61Å; Y729-L755 HydrophobicContact CE1-CG 4.36Å; Y729-L755 HydrophobicContact CE2-CD1 4.48Å; Y729-L755 HydrophobicContact CG-CB 4.42Å; Y729-C757 WeakPolarHBondContact CD1-SG 3.5Å; Y729-Q785 PolarHBondContact OH-NE2 2.96Å; Y729-I786 HydrophobicContact CD1-CD1 4.49Å; Y729-I786 HydrophobicContact CD2-CD1 4.05Å; Y729-I786 HydrophobicContact CD2-CG1 3.83Å; Y729-I786 HydrophobicContact CE1-CG1 4.46Å; Y729-I786 HydrophobicContact CE2-CD1 4.41Å; Y729-I786 HydrophobicContact CE2-CG1 3.71Å; Y729-I786 HydrophobicContact CG-CD1 4.07Å; Y729-I786 HydrophobicContact CG-CG1 4.26Å; Y729-E789 PolarHBondContact OH-OE1 2.95Å; Y729-E789 PolarHBondContact OH-OE2 2.92Å; Y729-V795 HydrophobicContact CD2-CG1 3.65Å; Y729-V795 HydrophobicContact CE2-CG1 3.75Å; Y729-G796 PolarHBondContact N-O 3.23Å; Y729-I797 CarbonylContact O-C 3.56Å; Y729-I797 WeakPolarHBondContact O-CA 3.19Å; Y729-L798 PolarHBondContact O-N 3.03Å
730	F	87.1	Confident	78.3	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.9	174	175.6	-123.2	0	0	0	110.1	L706 M732 L737 M743 I754 L755 C757 L798 V800	L706-F730 HydrophobicContact CD1-CD2 3.94Å; L706-F730 HydrophobicContact CD1-CE2 3.52Å; L706-F730 HydrophobicContact CD1-CZ 4.49Å; F730-M732 HydrophobicContact CD1-CG 3.57Å; F730-M732 HydrophobicContact CD1-SD 4.32Å; F730-M732 HydrophobicContact CE1-CG 3.73Å; F730-M732 HydrophobicContact CG-CG 4.44Å; F730-L737 HydrophobicContact CE1-CD1 3.76Å; F730-L737 HydrophobicContact CE1-CG 4.41Å; F730-L737 HydrophobicContact CE2-CD1 4.08Å; F730-L737 HydrophobicContact CE2-CG 4.44Å; F730-L737 HydrophobicContact CZ-CD1 3.39Å; F730-L737 HydrophobicContact CZ-CD2 4.44Å; F730-L737 HydrophobicContact CZ-CG 3.72Å; F730-M743 HydrophobicContact CB-SD 3.98Å; F730-M743 HydrophobicContact CD1-CG 3.84Å; F730-M743 HydrophobicContact CD1-SD 3.74Å; F730-M743 HydrophobicContact CE1-CG 4.43Å; F730-M743 HydrophobicContact CG-SD 4.29Å; F730-I754 HydrophobicContact CB-CG2 3.37Å; F730-L755 PolarHBondContact N-O 3.18Å; F730-C757 PolarHBondContact O-N 3.33Å; F730-L798 HydrophobicContact CB-CB 4.38Å; F730-L798 HydrophobicContact CD2-CB 3.82Å; F730-L798 WeakPolarHBondContact CD2-O 3.5Å; F730-V800 HydrophobicContact CE2-CG2 3.76Å; F730-V800 HydrophobicContact CZ-CG2 3.9Å
731	E	81.2	Confident	77.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	121.9	179.3	-176.1	-77	125.5	0	0	109.7	Y733 T734 L798	E731-Y733 HydrophobicContact CG-CD1 3.94Å; E731-Y733 HydrophobicContact CG-CE1 3.43Å; E731-Y733 VanDerWaalsContact CG-CE1 3.43Å; E731-Y733 VanDerWaalsContact OE1-C 3.3Å; E731-Y733 WeakPolarHBondContact OE1-CA 3.34Å; E731-Y733 WeakPolarHBondContact OE1-CD1 3.38Å; E731-Y733 WeakPolarHBondContact OE1-CE1 3.11Å; E731-Y733 PolarHBondContact OE1-N 2.95Å; E731-T734 VanDerWaalsContact CD-OG1 3.3Å; E731-T734 HydrophobicContact CG-CG2 4.43Å; E731-T734 VanDerWaalsContact OE1-CG2 3.25Å; E731-T734 WeakPolarHBondContact OE1-CG2 3.16Å; E731-T734 PolarHBondContact OE1-N 2.96Å; E731-T734 PolarHBondContact OE1-OG1 2.79Å; E731-T734 WeakPolarHBondContact OE2-CB 3.41Å; E731-T734 WeakPolarHBondContact OE2-CG2 3.28Å; E731-T734 PolarHBondContact OE2-OG1 3.24Å; E731-L798 WeakPolarHBondContact CB-O 3.25Å; E731-L798 PolarHBondContact N-O 3.38Å
732	M	73.7	Confident	77	Confident	20 Å²	20	35.5 Å²	35.5	10%	0.099	20%	0.198	C	C	.	.			trans	-114	4	-169.2	-63.8	-167.2	-46.9	0	0	114.9	F730 Q741 P756 C757	F730-M732 HydrophobicContact CD1-CG 3.57Å; F730-M732 HydrophobicContact CD1-SD 4.32Å; F730-M732 HydrophobicContact CE1-CG 3.73Å; F730-M732 HydrophobicContact CG-CG 4.44Å; M732-Q741 PolarHBondContact O-NE2 2.77Å; M732-P756 HydrophobicContact CE-CB 3.39Å; M732-P756 HydrophobicContact CG-CB 4.46Å; M732-P756 HydrophobicContact SD-CB 3.5Å; M732-P756 WeakPolarHBondContact SD-CB 3.41Å; M732-C757 PolarHBondContact N-O 2.77Å; M732-C757 VanDerWaalsContact N-O 3.09Å
733	Y	70.8	Confident	76.5	Confident	23 Å²	23	37 Å²	37	9%	0.09	21%	0.206	C	C	.	.	S	Bend	trans	-114	-4.5	-171.6	64.4	-93.4	0	0	0	114.5	E731 R759 L762 T808 L883	E731-Y733 HydrophobicContact CG-CD1 3.94Å; E731-Y733 HydrophobicContact CG-CE1 3.43Å; E731-Y733 VanDerWaalsContact CG-CE1 3.43Å; E731-Y733 VanDerWaalsContact OE1-C 3.3Å; E731-Y733 WeakPolarHBondContact OE1-CA 3.34Å; E731-Y733 WeakPolarHBondContact OE1-CD1 3.38Å; E731-Y733 WeakPolarHBondContact OE1-CE1 3.11Å; E731-Y733 PolarHBondContact OE1-N 2.95Å; Y733-R759 HydrophobicContact CD1-CB 4.03Å; Y733-R759 HydrophobicContact CD2-CB 3.94Å; Y733-R759 HydrophobicContact CD2-CG 4.02Å; Y733-R759 HydrophobicContact CE2-CG 4.33Å; Y733-R759 HydrophobicContact CG-CB 3.67Å; Y733-R759 HydrophobicContact CG-CG 4.28Å; Y733-L762 HydrophobicContact CE1-CD1 3.65Å; Y733-T808 HydrophobicContact CE2-CG2 3.75Å; Y733-L883 VanDerWaalsContact O-CD1 3.23Å; Y733-L883 WeakPolarHBondContact O-CD1 3.35Å
734	T	62.8	Low	76.4	Confident	43 Å²	43	35.2 Å²	35.2	26%	0.264	21%	0.205	S	C	.	.	S	Bend	trans	-95.6	-24.1	174.2	71.1	0	0	0	0	112.1	E731 T808 L883	E731-T734 VanDerWaalsContact CD-OG1 3.3Å; E731-T734 HydrophobicContact CG-CG2 4.43Å; E731-T734 VanDerWaalsContact OE1-CG2 3.25Å; E731-T734 WeakPolarHBondContact OE1-CG2 3.16Å; E731-T734 PolarHBondContact OE1-N 2.96Å; E731-T734 PolarHBondContact OE1-OG1 2.79Å; E731-T734 WeakPolarHBondContact OE2-CB 3.41Å; E731-T734 WeakPolarHBondContact OE2-CG2 3.28Å; E731-T734 PolarHBondContact OE2-OG1 3.24Å; T734-T808 HydrophobicContact CG2-CG2 4.05Å; T734-L883 WeakPolarHBondContact O-CD2 3.5Å
735	S	72.2	Confident	76.5	Confident	23 Å²	23	35.5 Å²	35.5	16%	0.161	21%	0.209	C	C	.	.			trans	-166.3	179.6	-175.1	-159.6	0	0	0	0	113.1	Q741 L967	S735-Q741 PolarHBondContact O-NE2 2.96Å; S735-Q741 VanDerWaalsContact O-NE2 3.14Å; S735-L967 WeakPolarHBondContact OG-CD1 3.35Å
736	L	74.4	Confident	76.5	Confident	20 Å²	20	35.5 Å²	35.5	11%	0.105	21%	0.209	C	C	.	.			trans	-117.8	149.8	177	-73.6	174	0	0	0	110	Q741 F905 W945 P966 L967	L736-Q741 HydrophobicContact CD2-CG 3.72Å; L736-F905 HydrophobicContact CD1-CD1 3.9Å; L736-F905 HydrophobicContact CD1-CD2 4.24Å; L736-F905 HydrophobicContact CD1-CE1 3.44Å; L736-F905 VanDerWaalsContact CD1-CE1 3.44Å; L736-F905 HydrophobicContact CD1-CE2 3.8Å; L736-F905 HydrophobicContact CD1-CG 4.29Å; L736-F905 HydrophobicContact CD1-CZ 3.41Å; L736-F905 VanDerWaalsContact CD1-CZ 3.41Å; L736-F905 HydrophobicContact CD2-CE1 4.07Å; L736-F905 HydrophobicContact CD2-CZ 3.7Å; L736-F905 HydrophobicContact CG-CD1 4.41Å; L736-F905 HydrophobicContact CG-CE1 3.6Å; L736-F905 HydrophobicContact CG-CZ 3.7Å; L736-W945 HydrophobicContact CB-CH2 4.48Å; L736-W945 WeakPolarHBondContact O-CZ2 3.46Å; L736-P966 HydrophobicContact CD1-CB 4.36Å; L736-P966 HydrophobicContact CD1-CG 4.22Å; L736-L967 HydrophobicContact CB-CD1 3.86Å; L736-L967 HydrophobicContact CB-CD2 4.37Å; L736-L967 HydrophobicContact CB-CG 3.96Å; L736-L967 HydrophobicContact CD1-CD2 3.95Å; L736-L967 HydrophobicContact CD1-CG 4.05Å; L736-L967 HydrophobicContact CG-CD2 4.17Å; L736-L967 HydrophobicContact CG-CG 4.27Å
737	L	74.2	Confident	76.7	Confident	5 Å²	5	35.7 Å²	35.7	3%	0.026	20%	0.204	C	C	.	.			trans	-89.8	158	164.8	-68.5	170.6	0	0	0	110.4	L706 F730 D739 G740 L746 V800 W945	L706-L737 HydrophobicContact CD1-CD2 4.12Å; F730-L737 HydrophobicContact CE1-CD1 3.76Å; F730-L737 HydrophobicContact CE1-CG 4.41Å; F730-L737 HydrophobicContact CE2-CD1 4.08Å; F730-L737 HydrophobicContact CE2-CG 4.44Å; F730-L737 HydrophobicContact CZ-CD1 3.39Å; F730-L737 HydrophobicContact CZ-CD2 4.44Å; F730-L737 HydrophobicContact CZ-CG 3.72Å; L737-D739 PolarHBondContact O-N 3.11Å; L737-D739 VanDerWaalsContact O-N 3.11Å; L737-G740 PolarHBondContact O-N 3.21Å; L737-L746 HydrophobicContact CD1-CD1 3.63Å; L737-V800 HydrophobicContact CD2-CG2 4.12Å; L737-V800 HydrophobicContact CG-CG2 4.4Å; L737-W945 WeakPolarHBondContact O-CH2 3.46Å
738	P	67.3	Low	76.6	Confident	47 Å²	47	39 Å²	39	31%	0.305	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-38.9	175.4	-26.7	30.8	0	0	0	114.4	G709 G740 W945	G709-P738 WeakPolarHBondContact O-CG 3.4Å; P738-G740 VanDerWaalsContact C-N 3.3Å; P738-G740 PolarHBondContact O-N 3.32Å; P738-W945 VanDerWaalsContact CA-CH2 3.47Å; P738-W945 VanDerWaalsContact CA-CZ3 3.49Å; P738-W945 HydrophobicContact CB-CD2 4.04Å; P738-W945 HydrophobicContact CB-CE3 4.05Å; P738-W945 HydrophobicContact CB-CH2 4.48Å; P738-W945 HydrophobicContact CB-CZ2 4.44Å; P738-W945 HydrophobicContact CB-CZ3 4.3Å; P738-W945 HydrophobicContact CG-CD2 3.77Å; P738-W945 HydrophobicContact CG-CE3 4.28Å; P738-W945 HydrophobicContact CG-CG 4.08Å; P738-W945 HydrophobicContact CG-CZ2 4.01Å
739	D	65.3	Low	76.4	Confident	94 Å²	94	42.2 Å²	42.2	50%	0.503	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	23.1	-175.5	-58.6	-31.5	0	0	0	113.5	L737 Q741 D742	L737-D739 PolarHBondContact O-N 3.11Å; L737-D739 VanDerWaalsContact O-N 3.11Å; D739-Q741 PolarHBondContact O-N 3.12Å; D739-D742 HydrophobicContact CB-CB 4.23Å; D739-D742 PolarHBondContact O-N 2.88Å
740	G	65	Low	76.3	Confident	59 Å²	59	42.1 Å²	42.1	61%	0.608	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.5	27.5	173.1	0	0	0	0	0	114.8	L737 P738	L737-G740 PolarHBondContact O-N 3.21Å; P738-G740 VanDerWaalsContact C-N 3.3Å; P738-G740 PolarHBondContact O-N 3.32Å
741	Q	67.4	Low	75.7	Confident	35 Å²	35	45.3 Å²	45.3	16%	0.164	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	17.9	-172.4	-53.4	-173.7	-25.3	0	0	115.3	M732 S735 L736 D739 M743	M732-Q741 PolarHBondContact O-NE2 2.77Å; S735-Q741 PolarHBondContact O-NE2 2.96Å; S735-Q741 VanDerWaalsContact O-NE2 3.14Å; L736-Q741 HydrophobicContact CD2-CG 3.72Å; D739-Q741 PolarHBondContact O-N 3.12Å; Q741-M743 PolarHBondContact O-N 3.31Å; Q741-M743 VanDerWaalsContact O-N 3.11Å
742	D	74.1	Confident	75.6	Confident	78 Å²	78	47.8 Å²	47.8	42%	0.417	28%	0.282	S	S	.	.			trans	-62.9	113.6	162.9	-175.2	9	0	0	0	110	D739 S744	D739-D742 HydrophobicContact CB-CB 4.23Å; D739-D742 PolarHBondContact O-N 2.88Å; D742-S744 VanDerWaalsContact C-N 3.29Å; D742-S744 WeakPolarHBondContact OD1-CB 2.95Å; D742-S744 PolarHBondContact OD1-N 3.21Å; D742-S744 PolarHBondContact OD1-OG 3.49Å; D742-S744 PolarHBondContact OD2-OG 3.29Å
743	M	77	Confident	76	Confident	32 Å²	32	52.8 Å²	52.8	16%	0.158	31%	0.305	C	S	.	.			trans	-81.8	-8.6	179.7	-65	178.5	-70.4	0	0	112.3	F730 Q741 Q745 L746 E747 I754 P756	F730-M743 HydrophobicContact CB-SD 3.98Å; F730-M743 HydrophobicContact CD1-CG 3.84Å; F730-M743 HydrophobicContact CD1-SD 3.74Å; F730-M743 HydrophobicContact CE1-CG 4.43Å; F730-M743 HydrophobicContact CG-SD 4.29Å; Q741-M743 PolarHBondContact O-N 3.31Å; Q741-M743 VanDerWaalsContact O-N 3.11Å; M743-Q745 PolarHBondContact O-N 3.22Å; M743-Q745 VanDerWaalsContact O-N 3.12Å; M743-L746 CarbonylContact O-C 3.52Å; M743-L746 WeakPolarHBondContact O-CA 3.04Å; M743-L746 WeakPolarHBondContact O-CB 3.16Å; M743-L746 PolarHBondContact O-N 2.89Å; M743-E747 HydrophobicContact CB-CG 4.3Å; M743-E747 WeakPolarHBondContact O-CG 3.46Å; M743-E747 PolarHBondContact O-N 2.75Å; M743-I754 HydrophobicContact SD-CB 4.11Å; M743-I754 HydrophobicContact SD-CG2 3.73Å; M743-P756 HydrophobicContact CE-CB 4.06Å; M743-P756 HydrophobicContact CE-CG 4.16Å; M743-P756 HydrophobicContact SD-CB 4.46Å
744	S	81.7	Confident	76.7	Confident	61 Å²	61	51.8 Å²	51.8	43%	0.427	30%	0.301	S	S	.	.	H	α-helix	trans	-53.3	-40	-173.4	-59.5	0	0	0	0	113	D742 L748	D742-S744 VanDerWaalsContact C-N 3.29Å; D742-S744 WeakPolarHBondContact OD1-CB 2.95Å; D742-S744 PolarHBondContact OD1-N 3.21Å; D742-S744 PolarHBondContact OD1-OG 3.49Å; D742-S744 PolarHBondContact OD2-OG 3.29Å; S744-L748 WeakPolarHBondContact O-CB 3.46Å; S744-L748 PolarHBondContact O-N 2.81Å
745	Q	81.4	Confident	77.7	Confident	83 Å²	83	52.3 Å²	52.3	39%	0.388	30%	0.302	S	S	.	.	H	α-helix	trans	-69.2	-42.7	176.7	-66.9	-61.2	-31.3	0	0	112.2	P711 M743 L748 H749	P711-Q745 HydrophobicContact CG-CB 3.68Å; M743-Q745 PolarHBondContact O-N 3.22Å; M743-Q745 VanDerWaalsContact O-N 3.12Å; Q745-L748 WeakPolarHBondContact O-CB 3.35Å; Q745-L748 PolarHBondContact O-N 2.78Å; Q745-H749 PolarHBondContact O-N 3.32Å; Q745-H749 VanDerWaalsContact O-N 3.11Å; Q745-H749 PolarHBondContact O-ND1 3.33Å
746	L	84.7	Confident	78	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-63.2	-44.9	175	-69.5	173.3	0	0	0	110.8	L706 P711 L737 M743 L748 H749 F750 I754	L706-L746 HydrophobicContact CD1-CD1 3.96Å; L706-L746 HydrophobicContact CD1-CD2 4.5Å; L706-L746 HydrophobicContact CD2-CD2 4.16Å; P711-L746 HydrophobicContact CB-CD2 3.89Å; P711-L746 HydrophobicContact CG-CD2 3.75Å; P711-L746 HydrophobicContact CG-CG 4.04Å; L737-L746 HydrophobicContact CD1-CD1 3.63Å; M743-L746 CarbonylContact O-C 3.52Å; M743-L746 WeakPolarHBondContact O-CA 3.04Å; M743-L746 WeakPolarHBondContact O-CB 3.16Å; M743-L746 PolarHBondContact O-N 2.89Å; L746-L748 VanDerWaalsContact C-N 3.25Å; L746-L748 PolarHBondContact O-N 2.87Å; L746-H749 PolarHBondContact O-N 2.94Å; L746-H749 VanDerWaalsContact O-N 3.11Å; L746-F750 HydrophobicContact CB-CD2 4.34Å; L746-F750 HydrophobicContact CB-CE2 4.38Å; L746-F750 HydrophobicContact CD2-CE2 4.23Å; L746-F750 WeakPolarHBondContact O-CD2 3.47Å; L746-F750 PolarHBondContact O-N 2.98Å; L746-I754 HydrophobicContact CB-CD1 3.4Å
747	E	86.9	Confident	78.1	Confident	59 Å²	59	53.5 Å²	53.5	28%	0.276	31%	0.31	S	S	.	.	H	α-helix	trans	-58.3	-38.7	177	-69.9	-171.2	152.9	0	0	111.8	M743 G751 K752 E753 I754	M743-E747 HydrophobicContact CB-CG 4.3Å; M743-E747 WeakPolarHBondContact O-CG 3.46Å; M743-E747 PolarHBondContact O-N 2.75Å; E747-G751 VanDerWaalsContact O-CA 3.26Å; E747-G751 WeakPolarHBondContact O-CA 3.39Å; E747-G751 PolarHBondContact O-N 2.83Å; E747-K752 WeakPolarHBondContact CA-O 3.33Å; E747-K752 WeakPolarHBondContact CB-O 3.38Å; E747-K752 WeakPolarHBondContact CG-O 3.36Å; E747-K752 PolarHBondContact O-N 3.49Å; E747-E753 WeakPolarHBondContact OE1-CA 3.41Å; E747-I754 HydrophobicContact CG-CB 4.06Å; E747-I754 HydrophobicContact CG-CD1 3.8Å; E747-I754 HydrophobicContact CG-CG1 3.83Å; E747-I754 PolarHBondContact OE1-N 3.08Å
748	L	84.9	Confident	77.8	Confident	127 Å²	127	53.7 Å²	53.7	67%	0.665	31%	0.312	S	S	*	.	H	α-helix	trans	-63.5	-45.1	174.6	-177.9	64.6	0	0	0	112	S744 Q745 L746 G751	S744-L748 WeakPolarHBondContact O-CB 3.46Å; S744-L748 PolarHBondContact O-N 2.81Å; Q745-L748 WeakPolarHBondContact O-CB 3.35Å; Q745-L748 PolarHBondContact O-N 2.78Å; L746-L748 VanDerWaalsContact C-N 3.25Å; L746-L748 PolarHBondContact O-N 2.87Å; L748-G751 PolarHBondContact O-N 2.77Å
749	H	83.7	Confident	77.6	Confident	68 Å²	68	57 Å²	57	32%	0.315	32%	0.318	S	S	.	.	H	α-helix	trans	-67.8	-43.3	179.8	-75.1	84.3	0	0	0	112.4	L719 Q723 Q745 L746 G751	L719-H749 HydrophobicContact CD1-CB 4.18Å; L719-H749 WeakPolarHBondContact CD1-O 3.45Å; Q723-H749 PolarHBondContact NE2-O 2.82Å; Q745-H749 PolarHBondContact O-N 3.32Å; Q745-H749 VanDerWaalsContact O-N 3.11Å; Q745-H749 PolarHBondContact O-ND1 3.33Å; L746-H749 PolarHBondContact O-N 2.94Å; L746-H749 VanDerWaalsContact O-N 3.11Å; H749-G751 VanDerWaalsContact C-N 3.34Å
750	F	85.9	Confident	77.3	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.026	31%	0.307	C	S	.	.	H	α-helix	trans	-78.6	-18.8	177.1	-67.9	-65.8	0	0	0	113.4	L714 L719 Q723 L728 L746 K752 I754 L798	L714-F750 HydrophobicContact CD1-CZ 4.19Å; L714-F750 HydrophobicContact CD2-CE1 3.73Å; L714-F750 HydrophobicContact CD2-CE2 4.14Å; L714-F750 HydrophobicContact CD2-CZ 3.4Å; L714-F750 VanDerWaalsContact CD2-CZ 3.4Å; L714-F750 HydrophobicContact CG-CZ 4.46Å; L719-F750 HydrophobicContact CD1-CD1 4.07Å; L719-F750 HydrophobicContact CD1-CE1 4.22Å; Q723-F750 HydrophobicContact CG-CD1 4.37Å; L728-F750 HydrophobicContact CD1-CB 3.78Å; L728-F750 HydrophobicContact CD1-CD1 3.79Å; L728-F750 HydrophobicContact CD1-CD2 3.76Å; L728-F750 HydrophobicContact CD1-CE1 4.26Å; L728-F750 HydrophobicContact CD1-CE2 4.25Å; L728-F750 HydrophobicContact CD1-CG 3.5Å; L728-F750 HydrophobicContact CD1-CZ 4.47Å; L746-F750 HydrophobicContact CB-CD2 4.34Å; L746-F750 HydrophobicContact CB-CE2 4.38Å; L746-F750 HydrophobicContact CD2-CE2 4.23Å; L746-F750 WeakPolarHBondContact O-CD2 3.47Å; L746-F750 PolarHBondContact O-N 2.98Å; F750-K752 VanDerWaalsContact C-N 3.34Å; F750-K752 HydrophobicContact CB-CG 4.13Å; F750-I754 HydrophobicContact CD2-CD1 3.92Å; F750-I754 HydrophobicContact CE2-CD1 4.45Å; F750-L798 HydrophobicContact CD2-CD1 4.24Å; F750-L798 HydrophobicContact CE2-CD1 3.57Å; F750-L798 HydrophobicContact CE2-CD2 3.99Å; F750-L798 HydrophobicContact CE2-CG 4.45Å; F750-L798 HydrophobicContact CZ-CD1 4.17Å; F750-L798 HydrophobicContact CZ-CD2 3.69Å
751	G	75.8	Confident	76.7	Confident	67 Å²	67	55.4 Å²	55.4	69%	0.691	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	28.1	-178.3	0	0	0	0	0	113.9	E747 L748 H749	E747-G751 VanDerWaalsContact O-CA 3.26Å; E747-G751 WeakPolarHBondContact O-CA 3.39Å; E747-G751 PolarHBondContact O-N 2.83Å; L748-G751 PolarHBondContact O-N 2.77Å; H749-G751 VanDerWaalsContact C-N 3.34Å
752	K	79.5	Confident	75.9	Confident	52 Å²	52	54.2 Å²	54.2	23%	0.226	29%	0.288	C	S	.	.	S	Bend	trans	-156.9	161.5	-178.6	67.8	-170.5	65.4	167.5	0	112	G722 Q723 C725 L728 E747 F750	G722-K752 PolarHBondContact O-NZ 3.01Å; Q723-K752 PolarHBondContact O-NZ 3.15Å; C725-K752 PolarHBondContact O-NZ 3.2Å; L728-K752 HydrophobicContact CD1-CD 3.91Å; L728-K752 HydrophobicContact CD1-CG 4.14Å; L728-K752 HydrophobicContact CG-CD 4.15Å; E747-K752 WeakPolarHBondContact CA-O 3.33Å; E747-K752 WeakPolarHBondContact CB-O 3.38Å; E747-K752 WeakPolarHBondContact CG-O 3.36Å; E747-K752 PolarHBondContact O-N 3.49Å; F750-K752 VanDerWaalsContact C-N 3.34Å; F750-K752 HydrophobicContact CB-CG 4.13Å
753	E	80.9	Confident	74.9	Confident	125 Å²	125	55.3 Å²	55.3	58%	0.584	29%	0.291	S	S	*	.			trans	-64.7	141.9	174.5	-175.5	177.2	-173.8	0	0	111.2	E747	E747-E753 WeakPolarHBondContact OE1-CA 3.41Å
754	I	85.6	Confident	73.6	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.7	178.1	-63.9	167.9	0	0	0	108.9	L728 F730 M743 L746 E747 F750 L798	L728-I754 HydrophobicContact CB-CG1 4.11Å; L728-I754 HydrophobicContact CD1-CG1 4.38Å; F730-I754 HydrophobicContact CB-CG2 3.37Å; M743-I754 HydrophobicContact SD-CB 4.11Å; M743-I754 HydrophobicContact SD-CG2 3.73Å; L746-I754 HydrophobicContact CB-CD1 3.4Å; E747-I754 HydrophobicContact CG-CB 4.06Å; E747-I754 HydrophobicContact CG-CD1 3.8Å; E747-I754 HydrophobicContact CG-CG1 3.83Å; E747-I754 PolarHBondContact OE1-N 3.08Å; F750-I754 HydrophobicContact CD2-CD1 3.92Å; F750-I754 HydrophobicContact CE2-CD1 4.45Å; I754-L798 HydrophobicContact CD1-CD1 3.91Å; I754-L798 HydrophobicContact CG1-CD1 4.4Å; I754-L798 HydrophobicContact CG2-CD1 4.17Å
755	L	83.5	Confident	71.6	Confident	55 Å²	55	56.1 Å²	56.1	29%	0.288	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.8	-175.5	-60.7	176.4	0	0	0	110.2	L728 Y729 F730	L728-L755 PolarHBondContact O-N 2.8Å; Y729-L755 CarbonylContact C-O 3.55Å; Y729-L755 VanDerWaalsContact CA-O 3.26Å; Y729-L755 WeakPolarHBondContact CA-O 3.38Å; Y729-L755 HydrophobicContact CD1-CB 3.6Å; Y729-L755 HydrophobicContact CD1-CD1 4.2Å; Y729-L755 HydrophobicContact CE1-CB 3.78Å; Y729-L755 HydrophobicContact CE1-CD1 3.61Å; Y729-L755 HydrophobicContact CE1-CG 4.36Å; Y729-L755 HydrophobicContact CE2-CD1 4.48Å; Y729-L755 HydrophobicContact CG-CB 4.42Å; F730-L755 PolarHBondContact N-O 3.18Å
756	P	79.9	Confident	69.4	Low	64 Å²	64	58.4 Å²	58.4	42%	0.416	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	132.9	179.7	26.3	-31.1	0	0	0	111.9	M732 M743	M732-P756 HydrophobicContact CE-CB 3.39Å; M732-P756 HydrophobicContact CG-CB 4.46Å; M732-P756 HydrophobicContact SD-CB 3.5Å; M732-P756 WeakPolarHBondContact SD-CB 3.41Å; M743-P756 HydrophobicContact CE-CB 4.06Å; M743-P756 HydrophobicContact CE-CG 4.16Å; M743-P756 HydrophobicContact SD-CB 4.46Å
757	C	74.9	Confident	67	Low	3 Å²	3	60.8 Å²	60.8	2%	0.02	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	116.4	174.5	-73.2	0	0	0	0	110.7	Y729 F730 M732 L762 I782	Y729-C757 WeakPolarHBondContact CD1-SG 3.5Å; F730-C757 PolarHBondContact O-N 3.33Å; M732-C757 PolarHBondContact N-O 2.77Å; M732-C757 VanDerWaalsContact N-O 3.09Å; C757-L762 HydrophobicContact CB-CD1 3.88Å; C757-I782 HydrophobicContact CB-CD1 4.36Å
758	D	67.8	Low	64.3	Low	10 Å²	10	67.8 Å²	67.8	5%	0.053	38%	0.383	C	S	.	.			trans	-101.6	155	172.7	48.8	-19.4	0	0	0	112.3	E760 L761 L762 K886	D758-E760 PolarHBondContact O-N 2.95Å; D758-L761 WeakPolarHBondContact O-CB 3.38Å; D758-L761 PolarHBondContact O-N 2.88Å; D758-L761 VanDerWaalsContact O-N 3.1Å; D758-L761 WeakPolarHBondContact OD1-CB 3.44Å; D758-L761 WeakPolarHBondContact OD1-CD1 3.34Å; D758-L762 PolarHBondContact O-N 3.49Å; D758-L762 VanDerWaalsContact O-N 3.15Å; D758-K886 HydrophobicContact CB-CD 3.74Å; D758-K886 WeakPolarHBondContact OD2-CD 3.38Å; D758-K886 IonicContact OD2-NZ 3.81Å; D758-K886 PolarHBondContact OD2-NZ 2.84Å
759	R	63.9	Low	61.9	Low	117 Å²	117	66.4 Å²	66.4	44%	0.442	38%	0.379	S	S	.	.	H	α-helix	trans	-58.4	-43.3	-173.3	-167.5	176.9	-178.5	163.1	11.7	113.6	Y733 L761 L762 E763	Y733-R759 HydrophobicContact CD1-CB 4.03Å; Y733-R759 HydrophobicContact CD2-CB 3.94Å; Y733-R759 HydrophobicContact CD2-CG 4.02Å; Y733-R759 HydrophobicContact CE2-CG 4.33Å; Y733-R759 HydrophobicContact CG-CB 3.67Å; Y733-R759 HydrophobicContact CG-CG 4.28Å; R759-L761 PolarHBondContact O-N 3.5Å; R759-L762 PolarHBondContact O-N 3.49Å; R759-L762 VanDerWaalsContact O-N 3.13Å; R759-E763 HydrophobicContact CG-CG 4.14Å; R759-E763 IonicContact CZ-OE1 3.73Å; R759-E763 IonicContact CZ-OE2 2.69Å; R759-E763 VanDerWaalsContact NE-CD 3.27Å; R759-E763 IonicContact NE-OE1 2.64Å; R759-E763 PolarHBondContact NE-OE1 2.97Å; R759-E763 VanDerWaalsContact NE-OE1 3.15Å; R759-E763 IonicContact NE-OE2 3.52Å; R759-E763 PolarHBondContact NE-OE2 3.21Å; R759-E763 IonicContact NH2-OE1 2.85Å; R759-E763 PolarHBondContact NH2-OE1 3.1Å; R759-E763 IonicContact NH2-OE2 2.85Å; R759-E763 PolarHBondContact NH2-OE2 3.31Å; R759-E763 WeakPolarHBondContact O-CB 3.23Å; R759-E763 PolarHBondContact O-N 2.88Å
760	E	58.6	Low	59.2	Low	59 Å²	59	68.3 Å²	68.3	28%	0.276	40%	0.4	S	S	.	.	H	α-helix	trans	-59.8	-34	178.4	-78.6	-169.4	173.4	0	0	112.3	D758 S764 R888	D758-E760 PolarHBondContact O-N 2.95Å; E760-S764 WeakPolarHBondContact O-CA 3.22Å; E760-S764 WeakPolarHBondContact O-CB 3.47Å; E760-S764 PolarHBondContact O-N 3.33Å; E760-S764 PolarHBondContact O-OG 3.01Å; E760-R888 VanDerWaalsContact OE1-CD 3.25Å; E760-R888 WeakPolarHBondContact OE1-CD 3.49Å
761	L	53.4	Low	56.7	Low	59 Å²	59	73.8 Å²	73.8	31%	0.309	43%	0.43	S	S	.	.	H	α-helix	trans	-80.7	-24.1	-178	-113.4	154.8	0	0	0	111.2	D758 R759 F779 I782	D758-L761 WeakPolarHBondContact O-CB 3.38Å; D758-L761 PolarHBondContact O-N 2.88Å; D758-L761 VanDerWaalsContact O-N 3.1Å; D758-L761 WeakPolarHBondContact OD1-CB 3.44Å; D758-L761 WeakPolarHBondContact OD1-CD1 3.34Å; R759-L761 PolarHBondContact O-N 3.5Å; L761-F779 HydrophobicContact CD2-CE1 4.17Å; L761-F779 HydrophobicContact CD2-CZ 3.79Å; L761-F779 HydrophobicContact CG-CZ 4.41Å; L761-I782 HydrophobicContact CB-CD1 3.5Å; L761-I782 HydrophobicContact CB-CG1 3.88Å; L761-I782 HydrophobicContact CD1-CD1 4.4Å; L761-I782 HydrophobicContact CD2-CD1 3.68Å; L761-I782 HydrophobicContact CD2-CG1 3.51Å; L761-I782 HydrophobicContact CG-CD1 4.02Å; L761-I782 HydrophobicContact CG-CG1 4.26Å; L761-I782 WeakPolarHBondContact O-CB 3.31Å; L761-I782 WeakPolarHBondContact O-CG1 3.44Å; L761-I782 PolarHBondContact O-N 3.26Å
762	L	50.7	Low	55	Low	11 Å²	11	78.9 Å²	78.9	6%	0.058	44%	0.441	C	S	.	.	H	α-helix	trans	-85.5	-42.6	173.5	-114.8	134.5	0	0	0	113.6	Y733 C757 D758 R759 I782 E783	Y733-L762 HydrophobicContact CE1-CD1 3.65Å; C757-L762 HydrophobicContact CB-CD1 3.88Å; D758-L762 PolarHBondContact O-N 3.49Å; D758-L762 VanDerWaalsContact O-N 3.15Å; R759-L762 PolarHBondContact O-N 3.49Å; R759-L762 VanDerWaalsContact O-N 3.13Å; L762-I782 HydrophobicContact CD1-CG2 4.25Å; L762-I782 HydrophobicContact CG-CB 4.28Å; L762-I782 HydrophobicContact CG-CG2 4.15Å; L762-E783 HydrophobicContact CD2-CG 3.37Å; L762-E783 HydrophobicContact CG-CG 4.24Å
763	E	53.1	Low	53.1	Low	101 Å²	101	85.1 Å²	85.1	47%	0.472	47%	0.469	S	S	.	.	H	α-helix	trans	-103.8	-30.5	-170.2	-65.3	-179.7	-176.2	0	0	114.3	R759 G765	R759-E763 HydrophobicContact CG-CG 4.14Å; R759-E763 IonicContact CZ-OE1 3.73Å; R759-E763 IonicContact CZ-OE2 2.69Å; R759-E763 VanDerWaalsContact NE-CD 3.27Å; R759-E763 IonicContact NE-OE1 2.64Å; R759-E763 PolarHBondContact NE-OE1 2.97Å; R759-E763 VanDerWaalsContact NE-OE1 3.15Å; R759-E763 IonicContact NE-OE2 3.52Å; R759-E763 PolarHBondContact NE-OE2 3.21Å; R759-E763 IonicContact NH2-OE1 2.85Å; R759-E763 PolarHBondContact NH2-OE1 3.1Å; R759-E763 IonicContact NH2-OE2 2.85Å; R759-E763 PolarHBondContact NH2-OE2 3.31Å; R759-E763 WeakPolarHBondContact O-CB 3.23Å; R759-E763 PolarHBondContact O-N 2.88Å; E763-G765 PolarHBondContact O-N 2.93Å
764	S	48.2	Very low	50.8	Low	74 Å²	74	83.6 Å²	83.6	52%	0.517	49%	0.487	S	S	.	.			trans	-95.4	43.7	-165.5	-49.5	0	0	0	0	115.7	E760 C766	E760-S764 WeakPolarHBondContact O-CA 3.22Å; E760-S764 WeakPolarHBondContact O-CB 3.47Å; E760-S764 PolarHBondContact O-N 3.33Å; E760-S764 PolarHBondContact O-OG 3.01Å; S764-C766 PolarHBondContact O-N 3.48Å
765	G	41.5	Very low	48.3	Very low	35 Å²	35	94.2 Å²	94.2	36%	0.361	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	8.9	177.6	0	0	0	0	0	116.2	E763 G767	E763-G765 PolarHBondContact O-N 2.93Å; G765-G767 VanDerWaalsContact C-N 3.26Å; G765-G767 PolarHBondContact O-N 3.08Å
766	C	34.2	Very low	45.9	Very low	132 Å²	132	96 Å²	96	89%	0.892	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	1.8	-171.9	-72.4	0	0	0	0	115.8	S764 K768	S764-C766 PolarHBondContact O-N 3.48Å; C766-K768 PolarHBondContact O-N 2.67Å
767	G	33.8	Very low	43.8	Very low	51 Å²	51	104.1 Å²	104.1	53%	0.526	57%	0.566	S	S	.	*			trans	-91.8	91.7	179.4	0	0	0	0	0	113.1	G765 V769	G765-G767 VanDerWaalsContact C-N 3.26Å; G765-G767 PolarHBondContact O-N 3.08Å; G767-V769 PolarHBondContact O-N 3.35Å
768	K	30.1	Very low	42	Very low	206 Å²	206	108.9 Å²	108.9	90%	0.896	59%	0.591	S	S	*	*			trans	-58.4	91.4	153.1	-79.9	-178.2	177.5	174.8	0	107.8	C766 S770	C766-K768 PolarHBondContact O-N 2.67Å; K768-S770 VanDerWaalsContact C-N 3.29Å; K768-S770 PolarHBondContact O-N 2.73Å
769	V	35.6	Very low	40.7	Very low	97 Å²	97	115.3 Å²	115.3	59%	0.588	62%	0.619	S	S	*	*			trans	-81.4	84.8	173.1	-176.3	0	0	0	0	107.7	G767 N771	G767-V769 PolarHBondContact O-N 3.35Å; V769-N771 HydrophobicContact CG1-CB 4.39Å; V769-N771 VanDerWaalsContact CG1-CG 3.5Å; V769-N771 VanDerWaalsContact CG1-OD1 3.3Å; V769-N771 WeakPolarHBondContact CG1-OD1 3.07Å; V769-N771 PolarHBondContact O-N 3.29Å
770	S	27.2	Very low	39.7	Very low	108 Å²	108	114.5 Å²	114.5	76%	0.755	62%	0.619	S	S	*	*			trans	-69.3	84.6	159.5	48.6	0	0	0	0	108	K768	K768-S770 VanDerWaalsContact C-N 3.29Å; K768-S770 PolarHBondContact O-N 2.73Å
771	N	32.7	Very low	39.5	Very low	122 Å²	122	113.6 Å²	113.6	65%	0.652	62%	0.616	S	S	*	*			trans	-82.3	129	161.6	-78.5	-13.2	0	0	0	107.6	V769 F773	V769-N771 HydrophobicContact CG1-CB 4.39Å; V769-N771 VanDerWaalsContact CG1-CG 3.5Å; V769-N771 VanDerWaalsContact CG1-OD1 3.3Å; V769-N771 WeakPolarHBondContact CG1-OD1 3.07Å; V769-N771 PolarHBondContact O-N 3.29Å; N771-F773 CarbonylContact O-C 3.5Å; N771-F773 PolarHBondContact O-N 2.85Å
772	D	39.2	Very low	39.9	Very low	174 Å²	174	111.2 Å²	111.2	93%	0.93	60%	0.603	S	S	*	*	S	Bend	trans	-59.5	9.2	-179.4	-75.2	-32	0	0	0	115.5
773	F	40.2	Very low	40.8	Very low	183 Å²	183	111.5 Å²	111.5	80%	0.803	60%	0.604	S	S	*	*	S	Bend	trans	-109.2	105.8	167	-122.2	-103.1	0	0	0	106.4	N771 R775	N771-F773 CarbonylContact O-C 3.5Å; N771-F773 PolarHBondContact O-N 2.85Å; F773-R775 PolarHBondContact O-N 2.83Å
774	G	32.9	Very low	41.7	Very low	93 Å²	93	110.3 Å²	110.3	96%	0.959	60%	0.599	S	S	*	*	S	Bend	trans	-58.1	50.7	-172.1	0	0	0	0	0	117
775	R	32.3	Very low	43.1	Very low	224 Å²	224	110.4 Å²	110.4	85%	0.845	59%	0.591	S	S	*	*			trans	-128.8	70.1	178.6	-141.8	179.5	-164.1	177.6	5.2	106.2	F773 R777	F773-R775 PolarHBondContact O-N 2.83Å; R775-R777 VanDerWaalsContact C-N 3.33Å; R775-R777 PolarHBondContact O-N 3.46Å
776	S	33.5	Very low	45.1	Very low	92 Å²	92	108.9 Å²	108.9	64%	0.643	57%	0.574	S	S	*	*			trans	-55.9	98.1	169.8	-168	0	0	0	0	107.9	N778	S776-N778 PolarHBondContact O-N 2.89Å; S776-N778 VanDerWaalsContact O-N 3.13Å; S776-N778 PolarHBondContact OG-OD1 3.01Å
777	R	35.8	Very low	47.5	Very low	235 Å²	235	102.7 Å²	102.7	89%	0.887	53%	0.532	S	S	*	.			trans	-72	98	154.3	-86.3	-174.5	169	167.6	-3.2	103.5	R775 F779	R775-R777 VanDerWaalsContact C-N 3.33Å; R775-R777 PolarHBondContact O-N 3.46Å; R777-F779 PolarHBondContact O-N 2.74Å
778	N	38.1	Very low	49.8	Very low	104 Å²	104	104.1 Å²	104.1	56%	0.556	53%	0.526	S	S	*	.			trans	-52.1	107.2	170.9	-69.2	-9	0	0	0	106.6	S776 F780	S776-N778 PolarHBondContact O-N 2.89Å; S776-N778 VanDerWaalsContact O-N 3.13Å; S776-N778 PolarHBondContact OG-OD1 3.01Å; N778-F780 HydrophobicContact CB-CD2 4Å; N778-F780 HydrophobicContact CB-CE2 3.55Å; N778-F780 HydrophobicContact CB-CZ 3.92Å; N778-F780 WeakPolarHBondContact O-CD2 3.07Å; N778-F780 PolarHBondContact O-N 3.45Å; N778-F780 VanDerWaalsContact O-N 3.08Å
779	F	39	Very low	52.4	Low	145 Å²	145	95.6 Å²	95.6	64%	0.636	49%	0.489	S	S	*	.			trans	-79.8	88.3	171.8	-160	-90.9	0	0	0	104.4	L761 R777	L761-F779 HydrophobicContact CD2-CE1 4.17Å; L761-F779 HydrophobicContact CD2-CZ 3.79Å; L761-F779 HydrophobicContact CG-CZ 4.41Å; R777-F779 PolarHBondContact O-N 2.74Å
780	F	43.8	Very low	54.8	Low	100 Å²	100	91 Å²	91	44%	0.439	46%	0.461	S	S	.	.			trans	-63.8	139.3	170.2	-67.5	-82.8	0	0	0	107.5	N778 E784 Q785	N778-F780 HydrophobicContact CB-CD2 4Å; N778-F780 HydrophobicContact CB-CE2 3.55Å; N778-F780 HydrophobicContact CB-CZ 3.92Å; N778-F780 WeakPolarHBondContact O-CD2 3.07Å; N778-F780 PolarHBondContact O-N 3.45Å; N778-F780 VanDerWaalsContact O-N 3.08Å; F780-E784 HydrophobicContact CB-CB 4.11Å; F780-E784 HydrophobicContact CD1-CB 4.29Å; F780-Q785 HydrophobicContact CB-CB 4.4Å
781	L	54.5	Low	57.4	Low	39 Å²	39	89.7 Å²	89.7	20%	0.204	44%	0.442	C	S	.	.			trans	-51.5	146.9	164.4	-78.1	165.9	0	0	0	108.9	E783 E784 Q785	L781-E783 PolarHBondContact O-N 2.81Å; L781-E784 HydrophobicContact CB-CB 4.08Å; L781-E784 HydrophobicContact CB-CG 3.89Å; L781-E784 HydrophobicContact CD1-CG 4.38Å; L781-E784 PolarHBondContact N-OE2 3.41Å; L781-E784 CarbonylContact O-C 3.55Å; L781-E784 WeakPolarHBondContact O-CA 3.36Å; L781-E784 WeakPolarHBondContact O-CB 3.47Å; L781-E784 PolarHBondContact O-N 2.81Å; L781-Q785 PolarHBondContact O-N 3.33Å
782	I	61.6	Low	59.6	Low	9 Å²	9	88.7 Å²	88.7	5%	0.046	44%	0.436	C	S	.	.	H	α-helix	trans	-55.8	-39.2	174.5	-78.6	-167.9	0	0	0	110.4	C757 L761 L762 E784 Q785 I786	C757-I782 HydrophobicContact CB-CD1 4.36Å; L761-I782 HydrophobicContact CB-CD1 3.5Å; L761-I782 HydrophobicContact CB-CG1 3.88Å; L761-I782 HydrophobicContact CD1-CD1 4.4Å; L761-I782 HydrophobicContact CD2-CD1 3.68Å; L761-I782 HydrophobicContact CD2-CG1 3.51Å; L761-I782 HydrophobicContact CG-CD1 4.02Å; L761-I782 HydrophobicContact CG-CG1 4.26Å; L761-I782 WeakPolarHBondContact O-CB 3.31Å; L761-I782 WeakPolarHBondContact O-CG1 3.44Å; L761-I782 PolarHBondContact O-N 3.26Å; L762-I782 HydrophobicContact CD1-CG2 4.25Å; L762-I782 HydrophobicContact CG-CB 4.28Å; L762-I782 HydrophobicContact CG-CG2 4.15Å; I782-E784 VanDerWaalsContact C-N 3.34Å; I782-E784 PolarHBondContact O-N 2.75Å; I782-Q785 PolarHBondContact O-N 3.46Å; I782-I786 HydrophobicContact CG2-CD1 3.41Å; I782-I786 VanDerWaalsContact CG2-CD1 3.41Å; I782-I786 HydrophobicContact CG2-CG1 3.9Å; I782-I786 VanDerWaalsContact O-CB 3.29Å; I782-I786 WeakPolarHBondContact O-CB 3.47Å; I782-I786 WeakPolarHBondContact O-CG1 3.37Å; I782-I786 PolarHBondContact O-N 2.81Å
783	E	68.6	Low	61.7	Low	17 Å²	17	81.3 Å²	81.3	8%	0.079	40%	0.396	C	S	.	.	H	α-helix	trans	-57.8	-48.1	174.6	-65	-169.1	147.3	0	0	110.7	L762 L781 Q785 I786 I787 S811 L812 Q815	L762-E783 HydrophobicContact CD2-CG 3.37Å; L762-E783 HydrophobicContact CG-CG 4.24Å; L781-E783 PolarHBondContact O-N 2.81Å; E783-Q785 PolarHBondContact O-N 3.28Å; E783-I786 PolarHBondContact O-N 2.81Å; E783-I787 VanDerWaalsContact O-CB 3.31Å; E783-I787 WeakPolarHBondContact O-CB 3.2Å; E783-I787 WeakPolarHBondContact O-CG1 3.29Å; E783-I787 PolarHBondContact O-N 2.8Å; E783-S811 PolarHBondContact OE1-OG 3.16Å; E783-L812 HydrophobicContact CB-CD1 3.94Å; E783-L812 HydrophobicContact CG-CD1 4.09Å; E783-Q815 PolarHBondContact OE2-NE2 3.37Å; E783-Q815 PolarHBondContact OE2-OE1 3.37Å
784	E	73.5	Confident	63.9	Low	77 Å²	77	72.9 Å²	72.9	36%	0.36	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-41.7	175.9	-70.3	173.6	173.5	0	0	112.3	F780 L781 I782 I787 E788	F780-E784 HydrophobicContact CB-CB 4.11Å; F780-E784 HydrophobicContact CD1-CB 4.29Å; L781-E784 HydrophobicContact CB-CB 4.08Å; L781-E784 HydrophobicContact CB-CG 3.89Å; L781-E784 HydrophobicContact CD1-CG 4.38Å; L781-E784 PolarHBondContact N-OE2 3.41Å; L781-E784 CarbonylContact O-C 3.55Å; L781-E784 WeakPolarHBondContact O-CA 3.36Å; L781-E784 WeakPolarHBondContact O-CB 3.47Å; L781-E784 PolarHBondContact O-N 2.81Å; I782-E784 VanDerWaalsContact C-N 3.34Å; I782-E784 PolarHBondContact O-N 2.75Å; E784-I787 PolarHBondContact O-N 2.77Å; E784-E788 WeakPolarHBondContact O-CB 3.4Å; E784-E788 WeakPolarHBondContact O-CG 3.18Å; E784-E788 PolarHBondContact O-N 3.27Å
785	Q	77.8	Confident	66.7	Low	76 Å²	76	68.5 Å²	68.5	36%	0.355	31%	0.314	S	S	.	.	H	α-helix	trans	-62.9	-47.1	175.8	-179.1	-179.6	-17.5	0	0	110.7	Y729 F780 L781 I782 E783 I787 E788 E789	Y729-Q785 PolarHBondContact OH-NE2 2.96Å; F780-Q785 HydrophobicContact CB-CB 4.4Å; L781-Q785 PolarHBondContact O-N 3.33Å; I782-Q785 PolarHBondContact O-N 3.46Å; E783-Q785 PolarHBondContact O-N 3.28Å; Q785-I787 VanDerWaalsContact C-N 3.27Å; Q785-I787 PolarHBondContact O-N 3.43Å; Q785-E788 PolarHBondContact O-N 2.83Å; Q785-E789 HydrophobicContact CG-CG 4.27Å; Q785-E789 PolarHBondContact NE2-OE1 2.63Å; Q785-E789 VanDerWaalsContact O-CB 3.31Å; Q785-E789 WeakPolarHBondContact O-CB 3.47Å; Q785-E789 WeakPolarHBondContact O-CG 3.48Å; Q785-E789 PolarHBondContact O-N 3.12Å
786	I	83.2	Confident	69.5	Low	2 Å²	2	57.8 Å²	57.8	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-59.6	-42	176.8	-74.6	174.7	0	0	0	109.9	L701 Y729 I782 E783 E789 A790 V795 I797 L812	L701-I786 HydrophobicContact CD1-CG2 3.73Å; Y729-I786 HydrophobicContact CD1-CD1 4.49Å; Y729-I786 HydrophobicContact CD2-CD1 4.05Å; Y729-I786 HydrophobicContact CD2-CG1 3.83Å; Y729-I786 HydrophobicContact CE1-CG1 4.46Å; Y729-I786 HydrophobicContact CE2-CD1 4.41Å; Y729-I786 HydrophobicContact CE2-CG1 3.71Å; Y729-I786 HydrophobicContact CG-CD1 4.07Å; Y729-I786 HydrophobicContact CG-CG1 4.26Å; I782-I786 HydrophobicContact CG2-CD1 3.41Å; I782-I786 VanDerWaalsContact CG2-CD1 3.41Å; I782-I786 HydrophobicContact CG2-CG1 3.9Å; I782-I786 VanDerWaalsContact O-CB 3.29Å; I782-I786 WeakPolarHBondContact O-CB 3.47Å; I782-I786 WeakPolarHBondContact O-CG1 3.37Å; I782-I786 PolarHBondContact O-N 2.81Å; E783-I786 PolarHBondContact O-N 2.81Å; I786-E789 PolarHBondContact O-N 2.82Å; I786-A790 WeakPolarHBondContact O-CB 3.34Å; I786-A790 PolarHBondContact O-N 3.49Å; I786-V795 HydrophobicContact CG2-CG1 4.21Å; I786-I797 HydrophobicContact CD1-CD1 3.84Å; I786-I797 HydrophobicContact CD1-CG1 4.29Å; I786-I797 HydrophobicContact CG2-CD1 3.95Å; I786-L812 HydrophobicContact CG2-CD1 4.36Å; I786-L812 HydrophobicContact CG2-CD2 4.43Å
787	I	84	Confident	72.2	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-65.2	-46.6	177.5	-70.2	-72.1	0	0	0	110.5	E783 E784 Q785 E789 A790 K791 L812 Q815 A816 Y819 I821	E783-I787 VanDerWaalsContact O-CB 3.31Å; E783-I787 WeakPolarHBondContact O-CB 3.2Å; E783-I787 WeakPolarHBondContact O-CG1 3.29Å; E783-I787 PolarHBondContact O-N 2.8Å; E784-I787 PolarHBondContact O-N 2.77Å; Q785-I787 VanDerWaalsContact C-N 3.27Å; Q785-I787 PolarHBondContact O-N 3.43Å; I787-E789 VanDerWaalsContact C-N 3.32Å; I787-E789 PolarHBondContact O-N 3.47Å; I787-A790 PolarHBondContact O-N 3.29Å; I787-K791 WeakPolarHBondContact O-CG 3.42Å; I787-K791 PolarHBondContact O-N 3.26Å; I787-K791 VanDerWaalsContact O-N 3.12Å; I787-L812 HydrophobicContact CD1-CD1 3.99Å; I787-L812 HydrophobicContact CG1-CD1 3.97Å; I787-Q815 HydrophobicContact CD1-CB 4.21Å; I787-Q815 HydrophobicContact CG1-CB 4.48Å; I787-A816 VanDerWaalsContact CD1-CA 3.43Å; I787-A816 HydrophobicContact CD1-CB 3.64Å; I787-Y819 HydrophobicContact CG2-CD2 3.47Å; I787-Y819 VanDerWaalsContact CG2-CD2 3.47Å; I787-Y819 HydrophobicContact CG2-CE2 3.97Å; I787-Y819 HydrophobicContact CG2-CG 3.83Å; I787-I821 HydrophobicContact CB-CD1 4.45Å; I787-I821 HydrophobicContact CD1-CD1 4.16Å; I787-I821 HydrophobicContact CG2-CD1 3.83Å; I787-I821 VanDerWaalsContact O-CD1 3.28Å; I787-I821 WeakPolarHBondContact O-CD1 3.47Å
788	E	82.7	Confident	74.8	Confident	82 Å²	82	42.5 Å²	42.5	38%	0.383	20%	0.203	S	C	.	.	H	α-helix	trans	-63.1	-37.9	175.9	-76.6	-59.6	133.2	0	0	112.5	E784 Q785 K791 N792	E784-E788 WeakPolarHBondContact O-CB 3.4Å; E784-E788 WeakPolarHBondContact O-CG 3.18Å; E784-E788 PolarHBondContact O-N 3.27Å; Q785-E788 PolarHBondContact O-N 2.83Å; E788-K791 IonicContact OE1-NZ 2.68Å; E788-K791 PolarHBondContact OE1-NZ 2.72Å; E788-N792 PolarHBondContact O-ND2 2.98Å
789	E	84.3	Confident	77.2	Confident	26 Å²	26	37.8 Å²	37.8	12%	0.121	18%	0.177	C	C	.	.	H	α-helix	trans	-71.2	-41.1	175.2	-70.5	-178.1	177.3	0	0	111.4	K727 Y729 Q785 I786 I787 K791 N792 E793 V795	K727-E789 WeakPolarHBondContact CD-OE2 3.24Å; K727-E789 IonicContact NZ-OE1 3.39Å; K727-E789 PolarHBondContact NZ-OE1 2.89Å; K727-E789 IonicContact NZ-OE2 3.18Å; K727-E789 PolarHBondContact NZ-OE2 2.9Å; Y729-E789 PolarHBondContact OH-OE1 2.95Å; Y729-E789 PolarHBondContact OH-OE2 2.92Å; Q785-E789 HydrophobicContact CG-CG 4.27Å; Q785-E789 PolarHBondContact NE2-OE1 2.63Å; Q785-E789 VanDerWaalsContact O-CB 3.31Å; Q785-E789 WeakPolarHBondContact O-CB 3.47Å; Q785-E789 WeakPolarHBondContact O-CG 3.48Å; Q785-E789 PolarHBondContact O-N 3.12Å; I786-E789 PolarHBondContact O-N 2.82Å; I787-E789 VanDerWaalsContact C-N 3.32Å; I787-E789 PolarHBondContact O-N 3.47Å; E789-K791 PolarHBondContact O-N 3.02Å; E789-N792 CarbonylContact O-C 3.55Å; E789-N792 PolarHBondContact O-N 3.1Å; E789-E793 WeakPolarHBondContact O-CG 3.31Å; E789-E793 PolarHBondContact O-N 3.45Å; E789-V795 HydrophobicContact CB-CG2 3.95Å
790	A	85.7	Confident	79.5	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-66	-19.2	178	0	0	0	0	0	113.4	L701 I786 I787 N792 E793 V795 I821	L701-A790 HydrophobicContact CB-CB 4.23Å; L701-A790 HydrophobicContact CD1-CB 4.33Å; I786-A790 WeakPolarHBondContact O-CB 3.34Å; I786-A790 PolarHBondContact O-N 3.49Å; I787-A790 PolarHBondContact O-N 3.29Å; A790-N792 VanDerWaalsContact C-N 3.27Å; A790-E793 WeakPolarHBondContact CA-O 3.26Å; A790-V795 HydrophobicContact CB-CB 4.29Å; A790-V795 HydrophobicContact CB-CG2 4.2Å; A790-I821 HydrophobicContact CB-CD1 4.11Å; A790-I821 HydrophobicContact CB-CG2 4.01Å
791	K	81.6	Confident	81.7	Confident	81 Å²	81	27.2 Å²	27.2	35%	0.352	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-28	167.8	-69.6	171.7	-172.7	173.5	0	112.6	I787 E788 E789 I821	I787-K791 WeakPolarHBondContact O-CG 3.42Å; I787-K791 PolarHBondContact O-N 3.26Å; I787-K791 VanDerWaalsContact O-N 3.12Å; E788-K791 IonicContact OE1-NZ 2.68Å; E788-K791 PolarHBondContact OE1-NZ 2.72Å; E789-K791 PolarHBondContact O-N 3.02Å; K791-I821 HydrophobicContact CG-CD1 3.83Å; K791-I821 HydrophobicContact CG-CG1 4.28Å
792	N	79.7	Confident	83.4	Confident	100 Å²	100	26.8 Å²	26.8	54%	0.535	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-21.3	-168.1	-65.2	-64.2	0	0	0	114.2	N597 L699 E788 E789 A790	N597-N792 PolarHBondContact ND2-O 3.36Å; L699-N792 WeakPolarHBondContact CD1-O 3.33Å; E788-N792 PolarHBondContact O-ND2 2.98Å; E789-N792 CarbonylContact O-C 3.55Å; E789-N792 PolarHBondContact O-N 3.1Å; A790-N792 VanDerWaalsContact C-N 3.27Å
793	E	82.6	Confident	84.7	Confident	19 Å²	19	26.5 Å²	26.5	9%	0.089	13%	0.131	C	C	.	.	S	Bend	trans	-146.5	159.4	176	57.6	-166.5	157.2	0	0	112	K490 S726 K727 E789 A790 V795	K490-E793 IonicContact NZ-OE2 3.59Å; S726-E793 WeakPolarHBondContact CB-OE2 3.38Å; K727-E793 WeakPolarHBondContact CD-OE1 3.41Å; K727-E793 WeakPolarHBondContact CE-OE1 3.47Å; K727-E793 IonicContact NZ-OE1 3.17Å; K727-E793 PolarHBondContact NZ-OE1 3Å; E789-E793 WeakPolarHBondContact O-CG 3.31Å; E789-E793 PolarHBondContact O-N 3.45Å; A790-E793 WeakPolarHBondContact CA-O 3.26Å; E793-V795 HydrophobicContact CG-CG2 4.1Å; E793-V795 PolarHBondContact O-N 2.98Å
794	D	87.6	Confident	85.7	Confident	7 Å²	7	28.3 Å²	28.3	4%	0.037	14%	0.14	C	C	.	.			trans	-67	124.1	169.8	-75	-24.1	0	0	0	108.8	R635 M700 Y702 R724 C725 S726	R635-D794 IonicContact CZ-OD1 3.54Å; R635-D794 IonicContact CZ-OD2 2.73Å; R635-D794 VanDerWaalsContact NH1-CG 3.25Å; R635-D794 IonicContact NH1-OD1 2.81Å; R635-D794 PolarHBondContact NH1-OD1 2.8Å; R635-D794 IonicContact NH1-OD2 2.59Å; R635-D794 PolarHBondContact NH1-OD2 3.49Å; R635-D794 IonicContact NH2-OD1 3.95Å; R635-D794 IonicContact NH2-OD2 2.82Å; R635-D794 PolarHBondContact NH2-OD2 3.18Å; M700-D794 PolarHBondContact N-OD1 3.49Å; M700-D794 WeakPolarHBondContact O-CA 3.18Å; Y702-D794 HydrophobicContact CE2-CB 4.34Å; R724-D794 IonicContact NE-OD2 3.21Å; C725-D794 CarbonylContact C-O 3.52Å; C725-D794 WeakPolarHBondContact CA-O 3.26Å; C725-D794 WeakPolarHBondContact CB-O 3.02Å; S726-D794 PolarHBondContact N-O 2.78Å
795	V	90.1	Very high	86	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.5	-179.1	178.8	0	0	0	0	109	M700 L701 Y702 Y729 I786 E789 A790 E793	M700-V795 PolarHBondContact O-N 3.42Å; M700-V795 VanDerWaalsContact O-N 3.11Å; L701-V795 CarbonylContact C-O 3.52Å; L701-V795 WeakPolarHBondContact CA-O 3.09Å; L701-V795 HydrophobicContact CD1-CB 4.05Å; L701-V795 HydrophobicContact CD1-CG1 4.1Å; Y702-V795 PolarHBondContact N-O 3.48Å; Y729-V795 HydrophobicContact CD2-CG1 3.65Å; Y729-V795 HydrophobicContact CE2-CG1 3.75Å; I786-V795 HydrophobicContact CG2-CG1 4.21Å; E789-V795 HydrophobicContact CB-CG2 3.95Å; A790-V795 HydrophobicContact CB-CB 4.29Å; A790-V795 HydrophobicContact CB-CG2 4.2Å; E793-V795 HydrophobicContact CG-CG2 4.1Å; E793-V795 PolarHBondContact O-N 2.98Å
796	G	91.6	Very high	85.8	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	145.1	175.1	0	0	0	0	0	112	Y702 C725 K727 L728 Y729	Y702-G796 CarbonylContact O-C 3.51Å; Y702-G796 WeakPolarHBondContact O-CA 3.29Å; C725-G796 PolarHBondContact SG-N 2.87Å; K727-G796 PolarHBondContact O-N 3.38Å; L728-G796 CarbonylContact C-O 3.52Å; L728-G796 WeakPolarHBondContact CA-O 3.24Å; Y729-G796 PolarHBondContact N-O 3.23Å
797	I	90.7	Very high	85	Confident	6 Å²	6	30.5 Å²	30.5	3%	0.031	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	120.1	175.6	-56.5	174.2	0	0	0	107.4	L701 Y702 L703 I704 Y729 I786 V799 L812	L701-I797 HydrophobicContact CD1-CD1 4.14Å; L701-I797 HydrophobicContact CD1-CG1 4.37Å; Y702-I797 PolarHBondContact O-N 2.89Å; L703-I797 HydrophobicContact CD2-CB 4.04Å; L703-I797 HydrophobicContact CD2-CD1 3.84Å; L703-I797 HydrophobicContact CD2-CG1 4.37Å; I704-I797 PolarHBondContact N-O 2.94Å; Y729-I797 CarbonylContact O-C 3.56Å; Y729-I797 WeakPolarHBondContact O-CA 3.19Å; I786-I797 HydrophobicContact CD1-CD1 3.84Å; I786-I797 HydrophobicContact CD1-CG1 4.29Å; I786-I797 HydrophobicContact CG2-CD1 3.95Å; I797-V799 HydrophobicContact CG2-CG2 4.05Å; I797-L812 HydrophobicContact CD1-CD2 3.05Å; I797-L812 HydrophobicContact CD1-CG 4.4Å
798	L	90.5	Very high	84.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	119.3	179.2	-55.3	-178.7	0	0	0	107.6	I704 L706 L728 Y729 F730 E731 F750 I754	I704-L798 HydrophobicContact CB-CD2 3.89Å; I704-L798 HydrophobicContact CD1-CD2 4.02Å; I704-L798 HydrophobicContact CG1-CD2 4.42Å; I704-L798 HydrophobicContact CG2-CD2 4.11Å; I704-L798 WeakPolarHBondContact O-CA 3.29Å; L706-L798 HydrophobicContact CD1-CB 4.18Å; L706-L798 HydrophobicContact CD2-CB 4.09Å; L706-L798 HydrophobicContact CD2-CD1 4.42Å; L706-L798 HydrophobicContact CD2-CD2 4.09Å; L706-L798 HydrophobicContact CD2-CG 4.42Å; L706-L798 HydrophobicContact CG-CB 4.18Å; L728-L798 HydrophobicContact CD1-CD1 4.47Å; L728-L798 HydrophobicContact CD2-CD2 4.15Å; L728-L798 HydrophobicContact CD2-CG 4.38Å; Y729-L798 PolarHBondContact O-N 3.03Å; F730-L798 HydrophobicContact CB-CB 4.38Å; F730-L798 HydrophobicContact CD2-CB 3.82Å; F730-L798 WeakPolarHBondContact CD2-O 3.5Å; E731-L798 WeakPolarHBondContact CB-O 3.25Å; E731-L798 PolarHBondContact N-O 3.38Å; F750-L798 HydrophobicContact CD2-CD1 4.24Å; F750-L798 HydrophobicContact CE2-CD1 3.57Å; F750-L798 HydrophobicContact CE2-CD2 3.99Å; F750-L798 HydrophobicContact CE2-CG 4.45Å; F750-L798 HydrophobicContact CZ-CD1 4.17Å; F750-L798 HydrophobicContact CZ-CD2 3.69Å; I754-L798 HydrophobicContact CD1-CD1 3.91Å; I754-L798 HydrophobicContact CG1-CD1 4.4Å; I754-L798 HydrophobicContact CG2-CD1 4.17Å
799	V	88.9	Confident	84.1	Confident	4 Å²	4	28.7 Å²	28.7	2%	0.024	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.4	179.6	-173.6	0	0	0	0	107.9	I704 G705 L706 I797 G801 P803 H809	I704-V799 PolarHBondContact O-N 2.92Å; G705-V799 WeakPolarHBondContact CA-O 3.38Å; L706-V799 PolarHBondContact N-O 3.29Å; I797-V799 HydrophobicContact CG2-CG2 4.05Å; V799-G801 PolarHBondContact O-N 2.97Å; V799-P803 HydrophobicContact CB-CB 4.26Å; V799-P803 HydrophobicContact CB-CG 4.25Å; V799-P803 HydrophobicContact CG2-CB 4.1Å; V799-P803 HydrophobicContact CG2-CG 4.39Å; V799-H809 VanDerWaalsContact CG2-CD2 3.49Å; V799-H809 WeakPolarHBondContact CG2-CD2 3.48Å; V799-H809 WeakPolarHBondContact CG2-NE2 3.27Å
800	V	87.1	Confident	84	Confident	17 Å²	17	29.7 Å²	29.7	10%	0.103	18%	0.182	C	C	.	.	S	Bend	trans	-67.9	132.3	174.9	-177.2	0	0	0	0	109.2	L706 F730 L737	L706-V800 HydrophobicContact CD1-CG2 4.42Å; F730-V800 HydrophobicContact CE2-CG2 3.76Å; F730-V800 HydrophobicContact CZ-CG2 3.9Å; L737-V800 HydrophobicContact CD2-CG2 4.12Å; L737-V800 HydrophobicContact CG-CG2 4.4Å
801	G	89.5	Confident	83.8	Confident	6 Å²	6	32 Å²	32	6%	0.062	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	80.6	-132.5	-173.7	0	0	0	0	0	113.3	G705 L706 G707 V799 A829	G705-G801 CarbonylContact C-O 3.57Å; G705-G801 WeakPolarHBondContact CA-O 3.44Å; L706-G801 PolarHBondContact N-O 3.29Å; G707-G801 PolarHBondContact N-O 3.17Å; G707-G801 WeakPolarHBondContact O-CA 3.44Å; G707-G801 PolarHBondContact O-N 3.06Å; V799-G801 PolarHBondContact O-N 2.97Å; G801-A829 CarbonylContact C-O 3.46Å; G801-A829 WeakPolarHBondContact CA-O 3.45Å
802	D	90.5	Very high	83.8	Confident	30 Å²	30	28.2 Å²	28.2	16%	0.16	18%	0.182	C	C	.	.			trans	-105.1	128.3	175.5	-173	-61.7	0	0	0	110.1	L804 G805 H827	D802-L804 PolarHBondContact O-N 3.13Å; D802-L804 VanDerWaalsContact O-N 3.13Å; D802-L804 PolarHBondContact OD1-N 3.36Å; D802-G805 PolarHBondContact O-N 3.06Å; D802-H827 IonicContact OD1-ND1 3.2Å; D802-H827 PolarHBondContact OD1-ND1 3.33Å; D802-H827 WeakPolarHBondContact OD2-CB 3.43Å; D802-H827 IonicContact OD2-CG 3.6Å; D802-H827 IonicContact OD2-ND1 3.65Å; D802-H827 PolarHBondContact OD2-ND1 2.96Å
803	P	89.2	Confident	84.1	Confident	3 Å²	3	26.8 Å²	26.8	2%	0.019	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.6	-176.2	-25.3	34.1	0	0	0	115.6	L703 V799 V825	L703-P803 HydrophobicContact CB-CB 3.88Å; L703-P803 HydrophobicContact CB-CG 4.16Å; V799-P803 HydrophobicContact CB-CB 4.26Å; V799-P803 HydrophobicContact CB-CG 4.25Å; V799-P803 HydrophobicContact CG2-CB 4.1Å; V799-P803 HydrophobicContact CG2-CG 4.39Å; P803-V825 HydrophobicContact CB-CG1 4.44Å; P803-V825 HydrophobicContact CG-CG1 4.42Å
804	L	88.5	Confident	84.3	Confident	55 Å²	55	31.5 Å²	31.5	29%	0.288	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-2.6	-176.4	-61.1	-175.1	0	0	0	113.3	L703 D802 A806 T807 V825	L703-L804 HydrophobicContact CD1-CD2 4.35Å; D802-L804 PolarHBondContact O-N 3.13Å; D802-L804 VanDerWaalsContact O-N 3.13Å; D802-L804 PolarHBondContact OD1-N 3.36Å; L804-A806 VanDerWaalsContact C-N 3.32Å; L804-A806 PolarHBondContact O-N 3.46Å; L804-T807 PolarHBondContact O-N 3.4Å; L804-V825 HydrophobicContact CD1-CG1 4.09Å; L804-V825 HydrophobicContact CD1-CG2 4.18Å; L804-V825 HydrophobicContact CG-CG1 4.12Å
805	G	80.2	Confident	84.1	Confident	33 Å²	33	33.7 Å²	33.7	34%	0.34	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-36.4	-174.9	0	0	0	0	0	114.3	D802	D802-G805 PolarHBondContact O-N 3.06Å
806	A	72.7	Confident	83.9	Confident	67 Å²	67	33.7 Å²	33.7	55%	0.554	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.5	13.9	-177.7	0	0	0	0	0	113.8	L804 T808	L804-A806 VanDerWaalsContact C-N 3.32Å; L804-A806 PolarHBondContact O-N 3.46Å; A806-T808 PolarHBondContact O-N 3.49Å
807	T	68.2	Low	83.5	Confident	101 Å²	101	38.7 Å²	38.7	62%	0.62	23%	0.226	S	C	*	.	S	Bend	trans	60.9	-6.3	-177.3	69.7	0	0	0	0	117.4	L804 H809 C810	L804-T807 PolarHBondContact O-N 3.4Å; T807-H809 PolarHBondContact O-N 2.98Å; T807-H809 VanDerWaalsContact O-N 3.11Å; T807-C810 VanDerWaalsContact O-CB 3.27Å; T807-C810 WeakPolarHBondContact O-CB 3.46Å; T807-C810 PolarHBondContact O-N 3.46Å
808	T	68	Low	83.2	Confident	44 Å²	44	45.2 Å²	45.2	27%	0.27	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-37.7	-176.5	-51	0	0	0	0	113.4	Y733 T734 A806 S811	Y733-T808 HydrophobicContact CE2-CG2 3.75Å; T734-T808 HydrophobicContact CG2-CG2 4.05Å; A806-T808 PolarHBondContact O-N 3.49Å; T808-S811 PolarHBondContact O-OG 3.47Å
809	H	78.3	Confident	82.8	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.009	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	8.8	-179.1	-59.1	-61.4	0	0	0	114.4	L703 V799 T807 S811 L812 Y813	L703-H809 HydrophobicContact CD1-CB 4.33Å; V799-H809 VanDerWaalsContact CG2-CD2 3.49Å; V799-H809 WeakPolarHBondContact CG2-CD2 3.48Å; V799-H809 WeakPolarHBondContact CG2-NE2 3.27Å; T807-H809 PolarHBondContact O-N 2.98Å; T807-H809 VanDerWaalsContact O-N 3.11Å; H809-S811 VanDerWaalsContact C-N 3.28Å; H809-S811 PolarHBondContact O-N 3.46Å; H809-L812 PolarHBondContact O-N 2.96Å; H809-Y813 PolarHBondContact O-N 3.17Å
810	C	82.6	Confident	82.3	Confident	47 Å²	47	57.9 Å²	57.9	32%	0.318	31%	0.311	S	S	.	.	H	α-helix	trans	-65.1	-33.9	171.6	-69.5	0	0	0	0	111.4	T807 Y813 L814	T807-C810 VanDerWaalsContact O-CB 3.27Å; T807-C810 WeakPolarHBondContact O-CB 3.46Å; T807-C810 PolarHBondContact O-N 3.46Å; C810-Y813 PolarHBondContact O-N 3.22Å; C810-L814 WeakPolarHBondContact O-CB 3.39Å; C810-L814 VanDerWaalsContact O-CG 3.25Å; C810-L814 WeakPolarHBondContact O-CG 3.49Å; C810-L814 PolarHBondContact O-N 2.89Å
811	S	81.8	Confident	82.1	Confident	49 Å²	49	57.5 Å²	57.5	34%	0.343	31%	0.308	S	S	.	.	H	α-helix	trans	-56.1	-53.1	174.4	52.4	0	0	0	0	111	E783 T808 H809 Y813 L814 Q815	E783-S811 PolarHBondContact OE1-OG 3.16Å; T808-S811 PolarHBondContact O-OG 3.47Å; H809-S811 VanDerWaalsContact C-N 3.28Å; H809-S811 PolarHBondContact O-N 3.46Å; S811-Y813 PolarHBondContact O-N 3Å; S811-L814 PolarHBondContact O-N 2.97Å; S811-L814 VanDerWaalsContact O-N 3.16Å; S811-Q815 WeakPolarHBondContact O-CG 3.36Å; S811-Q815 PolarHBondContact O-N 2.93Å
812	L	81.6	Confident	81.8	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	31%	0.314	C	S	.	.	H	α-helix	trans	-65.6	-38.9	-178.5	-176.8	61.5	0	0	0	112.2	L701 L703 E783 I786 I787 I797 H809 L814 Q815 A816	L701-L812 HydrophobicContact CD2-CG 4.23Å; L703-L812 HydrophobicContact CD2-CD2 4.33Å; E783-L812 HydrophobicContact CB-CD1 3.94Å; E783-L812 HydrophobicContact CG-CD1 4.09Å; I786-L812 HydrophobicContact CG2-CD1 4.36Å; I786-L812 HydrophobicContact CG2-CD2 4.43Å; I787-L812 HydrophobicContact CD1-CD1 3.99Å; I787-L812 HydrophobicContact CG1-CD1 3.97Å; I797-L812 HydrophobicContact CD1-CD2 3.05Å; I797-L812 HydrophobicContact CD1-CG 4.4Å; H809-L812 PolarHBondContact O-N 2.96Å; L812-L814 VanDerWaalsContact C-N 3.32Å; L812-L814 PolarHBondContact O-N 3.04Å; L812-Q815 PolarHBondContact O-N 3.07Å; L812-A816 WeakPolarHBondContact O-CB 3.35Å; L812-A816 PolarHBondContact O-N 3.43Å
813	Y	86.5	Confident	81.7	Confident	71 Å²	71	57.9 Å²	57.9	28%	0.278	31%	0.311	S	S	.	.	H	α-helix	trans	-58.4	-45.8	172.8	-172.9	-76.6	0	0	0	111.3	L703 H809 C810 S811 A816 K817 V823 V825	L703-Y813 HydrophobicContact CD1-CD2 4.27Å; H809-Y813 PolarHBondContact O-N 3.17Å; C810-Y813 PolarHBondContact O-N 3.22Å; S811-Y813 PolarHBondContact O-N 3Å; Y813-A816 PolarHBondContact O-N 2.51Å; Y813-K817 HydrophobicContact CD1-CG 4.07Å; Y813-K817 HydrophobicContact CE1-CD 4.31Å; Y813-K817 HydrophobicContact CE1-CG 3.74Å; Y813-K817 WeakPolarHBondContact O-CG 3.27Å; Y813-K817 PolarHBondContact O-N 3.23Å; Y813-K817 VanDerWaalsContact O-N 3.1Å; Y813-K817 VanDerWaalsContact OH-CE 3.24Å; Y813-K817 WeakPolarHBondContact OH-CE 3.42Å; Y813-V823 HydrophobicContact CD2-CB 3.96Å; Y813-V823 HydrophobicContact CD2-CG1 3.56Å; Y813-V823 HydrophobicContact CD2-CG2 4.44Å; Y813-V823 HydrophobicContact CE2-CB 3.8Å; Y813-V823 HydrophobicContact CE2-CG1 3.76Å; Y813-V823 HydrophobicContact CG-CG1 4.49Å; Y813-V825 HydrophobicContact CD2-CG2 3.96Å; Y813-V825 HydrophobicContact CE2-CG2 3.8Å
814	L	86	Confident	81.7	Confident	118 Å²	118	60.8 Å²	60.8	62%	0.618	32%	0.324	S	S	*	.	H	α-helix	trans	-67.1	-43.5	179.8	-70.5	171.4	0	0	0	112	C810 S811 L812 A816 K817 E818	C810-L814 WeakPolarHBondContact O-CB 3.39Å; C810-L814 VanDerWaalsContact O-CG 3.25Å; C810-L814 WeakPolarHBondContact O-CG 3.49Å; C810-L814 PolarHBondContact O-N 2.89Å; S811-L814 PolarHBondContact O-N 2.97Å; S811-L814 VanDerWaalsContact O-N 3.16Å; L812-L814 VanDerWaalsContact C-N 3.32Å; L812-L814 PolarHBondContact O-N 3.04Å; L814-A816 PolarHBondContact O-N 3.43Å; L814-K817 WeakPolarHBondContact O-CB 3.46Å; L814-K817 PolarHBondContact O-N 3.23Å; L814-E818 PolarHBondContact O-N 3.4Å
815	Q	83.8	Confident	81.9	Confident	53 Å²	53	59.5 Å²	59.5	25%	0.248	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-45.9	174.9	-73.4	176.9	12.3	0	0	111.4	E783 I787 S811 L812 K817 E818 Y819	E783-Q815 PolarHBondContact OE2-NE2 3.37Å; E783-Q815 PolarHBondContact OE2-OE1 3.37Å; I787-Q815 HydrophobicContact CD1-CB 4.21Å; I787-Q815 HydrophobicContact CG1-CB 4.48Å; S811-Q815 WeakPolarHBondContact O-CG 3.36Å; S811-Q815 PolarHBondContact O-N 2.93Å; L812-Q815 PolarHBondContact O-N 3.07Å; Q815-K817 VanDerWaalsContact C-N 3.27Å; Q815-K817 PolarHBondContact O-N 3.46Å; Q815-E818 WeakPolarHBondContact O-CB 3.4Å; Q815-E818 PolarHBondContact O-N 3.02Å; Q815-E818 VanDerWaalsContact O-N 3.08Å; Q815-Y819 VanDerWaalsContact O-CD2 3.23Å; Q815-Y819 WeakPolarHBondContact O-CD2 3.5Å; Q815-Y819 PolarHBondContact O-N 3.12Å
816	A	85.6	Confident	82.5	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-58.6	-40.2	176.6	0	0	0	0	0	112.1	L701 I787 L812 Y813 L814 Y819 H820 I821 V823	L701-A816 HydrophobicContact CD2-CB 3.84Å; I787-A816 VanDerWaalsContact CD1-CA 3.43Å; I787-A816 HydrophobicContact CD1-CB 3.64Å; L812-A816 WeakPolarHBondContact O-CB 3.35Å; L812-A816 PolarHBondContact O-N 3.43Å; Y813-A816 PolarHBondContact O-N 2.51Å; L814-A816 PolarHBondContact O-N 3.43Å; A816-Y819 CarbonylContact O-C 3.56Å; A816-Y819 PolarHBondContact O-N 3.02Å; A816-H820 PolarHBondContact O-N 2.72Å; A816-I821 HydrophobicContact CB-CB 4.21Å; A816-I821 WeakPolarHBondContact O-CB 3.41Å; A816-I821 PolarHBondContact O-N 2.79Å; A816-V823 HydrophobicContact CB-CG2 3.29Å
817	K	84.4	Confident	83.4	Confident	104 Å²	104	60 Å²	60	45%	0.452	30%	0.301	S	S	.	.	H	α-helix	trans	-63.8	-40.1	173.9	-72.7	-68.6	-175.5	-177.7	0	113.1	Y813 L814 Q815 Y819 H820	Y813-K817 HydrophobicContact CD1-CG 4.07Å; Y813-K817 HydrophobicContact CE1-CD 4.31Å; Y813-K817 HydrophobicContact CE1-CG 3.74Å; Y813-K817 WeakPolarHBondContact O-CG 3.27Å; Y813-K817 PolarHBondContact O-N 3.23Å; Y813-K817 VanDerWaalsContact O-N 3.1Å; Y813-K817 VanDerWaalsContact OH-CE 3.24Å; Y813-K817 WeakPolarHBondContact OH-CE 3.42Å; L814-K817 WeakPolarHBondContact O-CB 3.46Å; L814-K817 PolarHBondContact O-N 3.23Å; Q815-K817 VanDerWaalsContact C-N 3.27Å; Q815-K817 PolarHBondContact O-N 3.46Å; K817-Y819 VanDerWaalsContact C-N 3.3Å; K817-Y819 PolarHBondContact O-N 2.79Å; K817-H820 PolarHBondContact O-N 3Å; K817-H820 VanDerWaalsContact O-N 3.08Å
818	E	83.8	Confident	84.6	Confident	144 Å²	144	56.9 Å²	56.9	67%	0.673	28%	0.28	S	S	*	.	H	α-helix	trans	-61.4	-39.7	176.1	-172	175.4	-175.4	0	0	111.5	L814 Q815 H820	L814-E818 PolarHBondContact O-N 3.4Å; Q815-E818 WeakPolarHBondContact O-CB 3.4Å; Q815-E818 PolarHBondContact O-N 3.02Å; Q815-E818 VanDerWaalsContact O-N 3.08Å; E818-H820 PolarHBondContact O-N 3.09Å
819	Y	81.5	Confident	85.8	Confident	117 Å²	117	56.6 Å²	56.6	46%	0.459	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	11.3	174.3	-70.5	-74.3	0	0	0	114.4	I787 Q815 A816 K817 I821	I787-Y819 HydrophobicContact CG2-CD2 3.47Å; I787-Y819 VanDerWaalsContact CG2-CD2 3.47Å; I787-Y819 HydrophobicContact CG2-CE2 3.97Å; I787-Y819 HydrophobicContact CG2-CG 3.83Å; Q815-Y819 VanDerWaalsContact O-CD2 3.23Å; Q815-Y819 WeakPolarHBondContact O-CD2 3.5Å; Q815-Y819 PolarHBondContact O-N 3.12Å; A816-Y819 CarbonylContact O-C 3.56Å; A816-Y819 PolarHBondContact O-N 3.02Å; K817-Y819 VanDerWaalsContact C-N 3.3Å; K817-Y819 PolarHBondContact O-N 2.79Å; Y819-I821 PolarHBondContact O-N 3.03Å; Y819-I821 VanDerWaalsContact O-N 3.15Å
820	H	77.8	Confident	86.4	Confident	153 Å²	153	57.4 Å²	57.4	71%	0.708	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	24.3	-177.9	-56.5	-52.5	0	0	0	115	A816 K817 E818	A816-H820 PolarHBondContact O-N 2.72Å; K817-H820 PolarHBondContact O-N 3Å; K817-H820 VanDerWaalsContact O-N 3.08Å; E818-H820 PolarHBondContact O-N 3.09Å
821	I	83.1	Confident	86.7	Confident	8 Å²	8	57 Å²	57	4%	0.041	28%	0.284	C	S	.	.			trans	-82.2	124	174.9	-55.4	175.7	0	0	0	107.9	L701 I787 A790 K791 A816 Y819 V823	L701-I821 HydrophobicContact CB-CG2 4.11Å; I787-I821 HydrophobicContact CB-CD1 4.45Å; I787-I821 HydrophobicContact CD1-CD1 4.16Å; I787-I821 HydrophobicContact CG2-CD1 3.83Å; I787-I821 VanDerWaalsContact O-CD1 3.28Å; I787-I821 WeakPolarHBondContact O-CD1 3.47Å; A790-I821 HydrophobicContact CB-CD1 4.11Å; A790-I821 HydrophobicContact CB-CG2 4.01Å; K791-I821 HydrophobicContact CG-CD1 3.83Å; K791-I821 HydrophobicContact CG-CG1 4.28Å; A816-I821 HydrophobicContact CB-CB 4.21Å; A816-I821 WeakPolarHBondContact O-CB 3.41Å; A816-I821 PolarHBondContact O-N 2.79Å; Y819-I821 PolarHBondContact O-N 3.03Å; Y819-I821 VanDerWaalsContact O-N 3.15Å; I821-V823 PolarHBondContact O-N 3.07Å
822	P	84.9	Confident	87.1	Confident	28 Å²	28	58 Å²	58	18%	0.182	29%	0.285	C	S	.	.			trans	-68	134.8	174.5	30.8	-35.4	0	0	0	109.7	N698 L699 M700 L701	N698-P822 HydrophobicContact CB-CG 3.78Å; L699-P822 WeakPolarHBondContact O-CD 3.36Å; L699-P822 WeakPolarHBondContact O-CG 3.33Å; M700-P822 HydrophobicContact CE-CB 3.87Å; M700-P822 HydrophobicContact CE-CG 4.06Å; M700-P822 HydrophobicContact SD-CB 3.59Å; M700-P822 VanDerWaalsContact SD-CB 3.59Å; M700-P822 HydrophobicContact SD-CG 3.9Å; L701-P822 PolarHBondContact N-O 3.33Å
823	V	88.3	Confident	87.6	Confident	17 Å²	17	60.8 Å²	60.8	10%	0.103	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.6	179.3	-172.7	0	0	0	0	109.3	L701 L703 Y813 A816 I821 V825	L701-V823 HydrophobicContact CB-CG2 4.34Å; L701-V823 HydrophobicContact CD2-CG2 4.28Å; L701-V823 CarbonylContact O-C 3.58Å; L701-V823 VanDerWaalsContact O-CA 3.24Å; L701-V823 WeakPolarHBondContact O-CA 3.49Å; L703-V823 HydrophobicContact CD1-CG1 4.18Å; L703-V823 HydrophobicContact CG-CG1 4.05Å; Y813-V823 HydrophobicContact CD2-CB 3.96Å; Y813-V823 HydrophobicContact CD2-CG1 3.56Å; Y813-V823 HydrophobicContact CD2-CG2 4.44Å; Y813-V823 HydrophobicContact CE2-CB 3.8Å; Y813-V823 HydrophobicContact CE2-CG1 3.76Å; Y813-V823 HydrophobicContact CG-CG1 4.49Å; A816-V823 HydrophobicContact CB-CG2 3.29Å; I821-V823 PolarHBondContact O-N 3.07Å; V823-V825 HydrophobicContact CG1-CG2 4.42Å
824	E	88.8	Confident	87.9	Confident	64 Å²	64	58.3 Å²	58.3	30%	0.299	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	122.9	171.4	-174.3	174.9	162.3	0	0	109.9	M700 L701 Y702 L703	M700-E824 HydrophobicContact CG-CB 4.11Å; M700-E824 HydrophobicContact SD-CB 3.98Å; L701-E824 PolarHBondContact O-N 3.11Å; Y702-E824 CarbonylContact C-O 3.41Å; Y702-E824 WeakPolarHBondContact CA-O 3.46Å; Y702-E824 HydrophobicContact CD1-CB 3.82Å; Y702-E824 HydrophobicContact CD1-CG 4.23Å; Y702-E824 HydrophobicContact CE1-CB 4.01Å; Y702-E824 HydrophobicContact CE1-CG 4.3Å; Y702-E824 VanDerWaalsContact CE1-OE2 3.29Å; Y702-E824 WeakPolarHBondContact CE1-OE2 3.39Å; L703-E824 PolarHBondContact N-O 3.11Å
825	V	92	Very high	88.3	Confident	27 Å²	27	52.7 Å²	52.7	16%	0.164	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	122.1	177.2	-172.9	0	0	0	0	109	L703 P803 L804 Y813 V823	L703-V825 HydrophobicContact CB-CG1 4.39Å; L703-V825 HydrophobicContact CB-CG2 4.33Å; L703-V825 HydrophobicContact CD1-CG2 4.2Å; P803-V825 HydrophobicContact CB-CG1 4.44Å; P803-V825 HydrophobicContact CG-CG1 4.42Å; L804-V825 HydrophobicContact CD1-CG1 4.09Å; L804-V825 HydrophobicContact CD1-CG2 4.18Å; L804-V825 HydrophobicContact CG-CG1 4.12Å; Y813-V825 HydrophobicContact CD2-CG2 3.96Å; Y813-V825 HydrophobicContact CE2-CG2 3.8Å; V823-V825 HydrophobicContact CG1-CG2 4.42Å
826	I	92.1	Very high	88.8	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	99.2	174.4	-59.4	176.1	0	0	0	107.3	Y702 L703 I704 G705 T715 R717 A721	Y702-I826 HydrophobicContact CD1-CD1 4.27Å; L703-I826 PolarHBondContact O-N 3.41Å; I704-I826 HydrophobicContact CG1-CD1 4.28Å; G705-I826 PolarHBondContact N-O 3.25Å; T715-I826 WeakPolarHBondContact OG1-CG2 3.38Å; R717-I826 HydrophobicContact CB-CG2 4.27Å; R717-I826 HydrophobicContact CG-CD1 3.97Å; R717-I826 HydrophobicContact CG-CG1 4.28Å; R717-I826 HydrophobicContact CG-CG2 4.38Å; A721-I826 HydrophobicContact CB-CD1 3.29Å
827	H	93.4	Very high	89.2	Confident	108 Å²	108	53.5 Å²	53.5	50%	0.5	29%	0.285	S	S	.	.			trans	-66.2	152.9	177.7	-63.6	-74.5	0	0	0	112.4	D802	D802-H827 IonicContact OD1-ND1 3.2Å; D802-H827 PolarHBondContact OD1-ND1 3.33Å; D802-H827 WeakPolarHBondContact OD2-CB 3.43Å; D802-H827 IonicContact OD2-CG 3.6Å; D802-H827 IonicContact OD2-ND1 3.65Å; D802-H827 PolarHBondContact OD2-ND1 2.96Å
828	N	93	Very high	89.7	Confident	35 Å²	35	48.6 Å²	48.6	19%	0.187	26%	0.263	C	S	.	.			trans	-151.9	177.5	174.5	-152.2	-18.6	0	0	0	110.3	G705 L706 G707 D713 T715	G705-N828 WeakPolarHBondContact O-CB 3.32Å; G705-N828 PolarHBondContact O-ND2 3.36Å; L706-N828 PolarHBondContact O-ND2 2.8Å; G707-N828 PolarHBondContact N-ND2 2.98Å; G707-N828 VanDerWaalsContact N-ND2 3.18Å; D713-N828 PolarHBondContact O-ND2 3.02Å; T715-N828 HydrophobicContact CG2-CB 4.42Å
829	A	91.9	Very high	90.2	Very high	38 Å²	38	42.3 Å²	42.3	31%	0.314	24%	0.238	S	C	.	.			trans	-63.4	141.3	177.5	0	0	0	0	0	111.5	G707 L708 G801	G707-A829 WeakPolarHBondContact CA-O 3.5Å; L708-A829 HydrophobicContact CD1-CB 4.25Å; L708-A829 HydrophobicContact CG-CB 4.23Å; G801-A829 CarbonylContact C-O 3.46Å; G801-A829 WeakPolarHBondContact CA-O 3.45Å
830	S	90.9	Very high	90.9	Very high	18 Å²	18	37 Å²	37	13%	0.126	22%	0.217	C	C	.	.			trans	-131.8	162	176.8	75.6	0	0	0	0	111	L832 S833 A834	S830-L832 PolarHBondContact O-N 2.84Å; S830-S833 PolarHBondContact O-N 2.8Å; S830-S833 PolarHBondContact O-OG 3.25Å; S830-A834 WeakPolarHBondContact O-CB 3.41Å; S830-A834 PolarHBondContact O-N 3.4Å
831	V	89.6	Confident	91.7	Very high	40 Å²	40	33.2 Å²	33.2	24%	0.242	20%	0.199	C	C	.	.	H	α-helix	trans	-53.7	-30.5	177.8	67.2	0	0	0	0	112.7	S833 A834 I835 L880 I943	V831-S833 PolarHBondContact O-N 3.08Å; V831-A834 PolarHBondContact O-N 3.19Å; V831-I835 WeakPolarHBondContact O-CB 3.46Å; V831-I835 PolarHBondContact O-N 2.69Å; V831-L880 HydrophobicContact CG1-CD2 3.73Å; V831-I943 HydrophobicContact CG2-CD1 4.12Å
832	L	90.7	Very high	92.2	Very high	69 Å²	69	36.5 Å²	36.5	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-61	-33	178.3	-62.1	177.7	0	0	0	113	S830 T848 L878	S830-L832 PolarHBondContact O-N 2.84Å; L832-T848 HydrophobicContact CD2-CG2 4.16Å; L832-L878 HydrophobicContact CD2-CD2 3.81Å
833	S	91.4	Very high	92.6	Very high	60 Å²	60	45.4 Å²	45.4	42%	0.42	25%	0.248	S	C	.	.	H	α-helix	trans	-97.1	-34.2	176.7	57.5	0	0	0	0	112.1	S830 V831 I835 L842	S830-S833 PolarHBondContact O-N 2.8Å; S830-S833 PolarHBondContact O-OG 3.25Å; V831-S833 PolarHBondContact O-N 3.08Å; S833-I835 VanDerWaalsContact C-N 3.29Å; S833-I835 PolarHBondContact O-N 2.83Å; S833-L842 WeakPolarHBondContact O-CD1 3.42Å
834	A	93.6	Very high	92.9	Very high	19 Å²	19	46.8 Å²	46.8	16%	0.157	26%	0.255	C	S	.	.	H	α-helix	trans	-72	-22.2	-176.1	0	0	0	0	0	113.6	L708 S830 V831 G836 C837 I943	L708-A834 HydrophobicContact CD1-CB 3.4Å; L708-A834 HydrophobicContact CD2-CB 4.39Å; S830-A834 WeakPolarHBondContact O-CB 3.41Å; S830-A834 PolarHBondContact O-N 3.4Å; V831-A834 PolarHBondContact O-N 3.19Å; A834-G836 PolarHBondContact O-N 3.45Å; A834-C837 WeakPolarHBondContact O-CB 3.27Å; A834-C837 PolarHBondContact O-N 3.31Å; A834-C837 PolarHBondContact O-SG 3.11Å; A834-I943 HydrophobicContact CB-CG2 3.71Å
835	I	94.7	Very high	93.2	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-55	-24.7	178.9	-167.8	65.6	0	0	0	113.1	V831 S833 C837 C838 L842 F845 L878 L940 I943 A971	V831-I835 WeakPolarHBondContact O-CB 3.46Å; V831-I835 PolarHBondContact O-N 2.69Å; S833-I835 VanDerWaalsContact C-N 3.29Å; S833-I835 PolarHBondContact O-N 2.83Å; I835-C837 PolarHBondContact O-N 2.8Å; I835-C838 PolarHBondContact O-N 2.95Å; I835-C838 VanDerWaalsContact O-N 3.17Å; I835-C838 PolarHBondContact O-SG 3.19Å; I835-L842 HydrophobicContact CG2-CD2 3.45Å; I835-L842 VanDerWaalsContact CG2-CD2 3.45Å; I835-F845 HydrophobicContact CG1-CE1 4.07Å; I835-F845 HydrophobicContact CG1-CZ 3.81Å; I835-F845 HydrophobicContact CG2-CE1 4.35Å; I835-F845 HydrophobicContact CG2-CE2 4.26Å; I835-F845 HydrophobicContact CG2-CZ 4.02Å; I835-L878 HydrophobicContact CB-CD1 4.47Å; I835-L878 HydrophobicContact CB-CD2 4.42Å; I835-L878 HydrophobicContact CD1-CD1 3.75Å; I835-L878 HydrophobicContact CG1-CD1 3.93Å; I835-L878 HydrophobicContact CG2-CD2 4.36Å; I835-L940 HydrophobicContact CD1-CD1 3.5Å; I835-L940 HydrophobicContact CD1-CD2 3.65Å; I835-L940 HydrophobicContact CD1-CG 4.18Å; I835-I943 HydrophobicContact CD1-CD1 4.24Å; I835-A971 HydrophobicContact CD1-CB 4.4Å
836	G	93.6	Very high	93.4	Very high	26 Å²	26	45.1 Å²	45.1	27%	0.268	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-58.3	-14.1	174.9	0	0	0	0	0	114.2	A834 C838 G839	A834-G836 PolarHBondContact O-N 3.45Å; G836-C838 PolarHBondContact O-N 3Å; G836-G839 PolarHBondContact O-N 3.12Å
837	C	94.1	Very high	93.5	Very high	44 Å²	44	51.2 Å²	51.2	30%	0.297	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-62.3	-20.7	174.6	71.1	0	0	0	0	114.1	A834 I835 G839 I950	A834-C837 WeakPolarHBondContact O-CB 3.27Å; A834-C837 PolarHBondContact O-N 3.31Å; A834-C837 PolarHBondContact O-SG 3.11Å; I835-C837 PolarHBondContact O-N 2.8Å; C837-G839 PolarHBondContact O-N 3.44Å; C837-I950 HydrophobicContact CB-CD1 4.43Å
838	C	94.2	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-75.5	-6.2	172	63.7	0	0	0	0	113.9	I835 G836 V938 L940 I950 W987	I835-C838 PolarHBondContact O-N 2.95Å; I835-C838 VanDerWaalsContact O-N 3.17Å; I835-C838 PolarHBondContact O-SG 3.19Å; G836-C838 PolarHBondContact O-N 3Å; C838-V938 HydrophobicContact CB-CB 4.5Å; C838-V938 HydrophobicContact CB-CG1 3.85Å; C838-L940 HydrophobicContact CB-CD2 3.85Å; C838-I950 HydrophobicContact CB-CG2 4.02Å; C838-W987 PolarHBondContact O-NE1 3.09Å
839	G	93.8	Very high	93.7	Very high	13 Å²	13	47.7 Å²	47.7	13%	0.134	27%	0.265	C	S	.	.	S	Bend	trans	92.4	-2.2	179.3	0	0	0	0	0	115.2	G836 C837	G836-G839 PolarHBondContact O-N 3.12Å; C837-G839 PolarHBondContact O-N 3.44Å
840	L	96.6	Very high	93.7	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.021	27%	0.274	C	S	.	.			trans	-75.2	137.7	168.6	-61.7	177.3	0	0	0	110.1	L842 F845 H876 A971 V973 T976 E980 L984	L840-L842 PolarHBondContact O-N 2.95Å; L840-F845 HydrophobicContact CB-CE2 3.62Å; L840-F845 HydrophobicContact CB-CZ 3.89Å; L840-F845 HydrophobicContact CD1-CE2 4.35Å; L840-F845 HydrophobicContact CD1-CZ 3.82Å; L840-H876 HydrophobicContact CD1-CB 4.23Å; L840-A971 HydrophobicContact CD1-CB 3.99Å; L840-V973 HydrophobicContact CD1-CG2 4.23Å; L840-V973 HydrophobicContact CD2-CG1 4.2Å; L840-V973 HydrophobicContact CD2-CG2 4.49Å; L840-T976 HydrophobicContact CD2-CG2 4.34Å; L840-E980 HydrophobicContact CD2-CB 4.37Å; L840-L984 HydrophobicContact CD2-CD1 3.91Å; L840-L984 HydrophobicContact CD2-CD2 4.08Å; L840-L984 HydrophobicContact CD2-CG 4.19Å; L840-L984 HydrophobicContact CG-CD2 4.3Å
841	Q	94.8	Very high	93.9	Very high	74 Å²	74	48.5 Å²	48.5	35%	0.346	27%	0.268	S	S	.	.			trans	-73.5	125.4	179.3	-64	176.7	-0.5	0	0	109.8	Y843 N844 F845 E980	Q841-Y843 PolarHBondContact O-N 3.25Å; Q841-Y843 VanDerWaalsContact O-N 3.1Å; Q841-N844 PolarHBondContact O-N 3.06Å; Q841-N844 PolarHBondContact OE1-ND2 3.4Å; Q841-F845 WeakPolarHBondContact O-CD2 3.3Å; Q841-E980 WeakPolarHBondContact CA-OE1 3.39Å; Q841-E980 WeakPolarHBondContact CB-OE1 3.43Å; Q841-E980 HydrophobicContact CG-CG 3.88Å; Q841-E980 VanDerWaalsContact CG-OE1 3.29Å; Q841-E980 WeakPolarHBondContact CG-OE1 3.25Å; Q841-E980 PolarHBondContact N-OE1 3.37Å
842	L	93.6	Very high	93.9	Very high	77 Å²	77	49 Å²	49	40%	0.403	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-56.8	-30.3	-179.3	-66.5	178	0	0	0	113.3	S833 I835 L840 N844 F845	S833-L842 WeakPolarHBondContact O-CD1 3.42Å; I835-L842 HydrophobicContact CG2-CD2 3.45Å; I835-L842 VanDerWaalsContact CG2-CD2 3.45Å; L840-L842 PolarHBondContact O-N 2.95Å; L842-N844 PolarHBondContact O-N 3.38Å; L842-F845 PolarHBondContact O-N 2.94Å
843	Y	93	Very high	93.7	Very high	215 Å²	215	46.5 Å²	46.5	84%	0.843	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-70.4	-17.3	178.7	-58.8	-76.2	0	0	0	113.8	Q841	Q841-Y843 PolarHBondContact O-N 3.25Å; Q841-Y843 VanDerWaalsContact O-N 3.1Å
844	N	94.6	Very high	93.6	Very high	47 Å²	47	45.7 Å²	45.7	25%	0.251	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-97.4	6.9	178.9	-64.1	-17.2	0	0	0	112.6	Q841 L842 F875 H876 E980	Q841-N844 PolarHBondContact O-N 3.06Å; Q841-N844 PolarHBondContact OE1-ND2 3.4Å; L842-N844 PolarHBondContact O-N 3.38Å; N844-F875 CarbonylContact O-C 3.6Å; N844-F875 VanDerWaalsContact O-CA 3.28Å; N844-F875 WeakPolarHBondContact O-CA 3.4Å; N844-F875 WeakPolarHBondContact O-CB 3.46Å; N844-H876 PolarHBondContact O-N 2.85Å; N844-E980 PolarHBondContact ND2-OE1 2.78Å
845	F	96.4	Very high	93	Very high	34 Å²	34	48.1 Å²	48.1	15%	0.149	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-82.9	133.3	172.4	-81.2	-99.6	0	0	0	111.5	I835 L840 Q841 L842 H876 L878 A971	I835-F845 HydrophobicContact CG1-CE1 4.07Å; I835-F845 HydrophobicContact CG1-CZ 3.81Å; I835-F845 HydrophobicContact CG2-CE1 4.35Å; I835-F845 HydrophobicContact CG2-CE2 4.26Å; I835-F845 HydrophobicContact CG2-CZ 4.02Å; L840-F845 HydrophobicContact CB-CE2 3.62Å; L840-F845 HydrophobicContact CB-CZ 3.89Å; L840-F845 HydrophobicContact CD1-CE2 4.35Å; L840-F845 HydrophobicContact CD1-CZ 3.82Å; Q841-F845 WeakPolarHBondContact O-CD2 3.3Å; L842-F845 PolarHBondContact O-N 2.94Å; F845-H876 WeakPolarHBondContact CA-O 3.42Å; F845-H876 HydrophobicContact CD1-CB 3.93Å; F845-H876 HydrophobicContact CD2-CB 4.26Å; F845-H876 HydrophobicContact CE1-CB 3.93Å; F845-H876 HydrophobicContact CE2-CB 4.28Å; F845-H876 HydrophobicContact CG-CB 4.12Å; F845-H876 HydrophobicContact CZ-CB 4.12Å; F845-L878 HydrophobicContact CD1-CB 3.92Å; F845-L878 HydrophobicContact CE1-CB 3.95Å; F845-A971 HydrophobicContact CE1-CB 4.27Å; F845-A971 HydrophobicContact CZ-CB 4.42Å
846	G	96	Very high	92.2	Very high	21 Å²	21	52.1 Å²	52.1	22%	0.216	29%	0.291	C	S	.	.			trans	-85.9	-154.6	172.7	0	0	0	0	0	111.9	T848 H876	G846-T848 PolarHBondContact O-N 2.82Å; G846-H876 PolarHBondContact N-O 3.37Å
847	K	94.6	Very high	91.5	Very high	132 Å²	132	59 Å²	59	57%	0.574	32%	0.316	S	S	*	.			trans	-65.5	125.3	178.6	-59.8	-165	-155	155.2	0	110.6	Q866 N870	K847-Q866 HydrophobicContact CB-CG 3.88Å; K847-Q866 HydrophobicContact CD-CG 4.35Å; K847-N870 PolarHBondContact N-ND2 3.36Å; K847-N870 PolarHBondContact N-OD1 2.89Å; K847-N870 PolarHBondContact O-ND2 3.17Å
848	T	94.8	Very high	90.9	Very high	62 Å²	62	64 Å²	64	38%	0.38	33%	0.33	S	S	.	.			trans	-60	141.3	169	-56.5	0	0	0	0	110.4	L832 G846 L878 L880	L832-T848 HydrophobicContact CD2-CG2 4.16Å; G846-T848 PolarHBondContact O-N 2.82Å; T848-L878 WeakPolarHBondContact CA-O 3.26Å; T848-L878 HydrophobicContact CG2-CB 4.23Å; T848-L878 HydrophobicContact CG2-CD2 4.25Å; T848-L878 HydrophobicContact CG2-CG 4.04Å; T848-L878 WeakPolarHBondContact CG2-O 3.39Å; T848-L880 HydrophobicContact CG2-CD1 3.88Å; T848-L880 HydrophobicContact CG2-CD2 4.43Å; T848-L880 HydrophobicContact CG2-CG 3.74Å
849	V	95.3	Very high	90.6	Very high	8 Å²	8	69.1 Å²	69.1	5%	0.048	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	154.7	178.6	-58	0	0	0	0	110.7	F863 Q866 I867 T877 L878 C879 L880	V849-F863 HydrophobicContact CB-CB 4.19Å; V849-Q866 HydrophobicContact CG1-CB 3.8Å; V849-Q866 HydrophobicContact CG1-CG 3.75Å; V849-I867 HydrophobicContact CG1-CG1 4.39Å; V849-I867 HydrophobicContact CG2-CD1 4.12Å; V849-I867 HydrophobicContact CG2-CG1 3.94Å; V849-T877 HydrophobicContact CG1-CG2 4.1Å; V849-T877 HydrophobicContact CG2-CG2 3.79Å; V849-L878 PolarHBondContact N-O 3.04Å; V849-C879 HydrophobicContact CG2-CB 4.09Å; V849-C879 VanDerWaalsContact CG2-SG 3.52Å; V849-C879 CarbonylContact O-C 3.41Å; V849-C879 WeakPolarHBondContact O-CA 3.48Å; V849-L880 PolarHBondContact O-N 3.45Å
850	S	91.9	Very high	90.3	Very high	73 Å²	73	69.3 Å²	69.3	51%	0.51	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.5	171.8	-59.1	0	0	0	0	110	L880	S850-L880 CarbonylContact C-O 3.37Å; S850-L880 VanDerWaalsContact CA-O 3.29Å; S850-L880 WeakPolarHBondContact CA-O 3.39Å
851	I	93.9	Very high	90	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	110.8	178.4	-58.7	179.7	0	0	0	108.5	F863 C879 L880 L881 D882 M906 A911 I914 L915	I851-F863 HydrophobicContact CB-CE2 4.46Å; I851-F863 HydrophobicContact CG1-CD2 4.07Å; I851-F863 HydrophobicContact CG1-CE2 4.13Å; I851-F863 HydrophobicContact CG2-CE2 4.03Å; I851-F863 HydrophobicContact CG2-CZ 4.02Å; I851-C879 HydrophobicContact CD1-CB 3.71Å; I851-C879 HydrophobicContact CG1-CB 4.14Å; I851-L880 PolarHBondContact N-O 2.81Å; I851-L881 HydrophobicContact CB-CD2 4.26Å; I851-L881 HydrophobicContact CD1-CD2 4.07Å; I851-L881 HydrophobicContact CG1-CD2 4.45Å; I851-D882 WeakPolarHBondContact O-CB 3.47Å; I851-D882 PolarHBondContact O-N 2.66Å; I851-M906 HydrophobicContact CB-SD 4.1Å; I851-M906 HydrophobicContact CG2-CE 4.06Å; I851-M906 HydrophobicContact CG2-SD 3.64Å; I851-M906 WeakPolarHBondContact O-CE 3.42Å; I851-A911 HydrophobicContact CD1-CB 4.11Å; I851-I914 HydrophobicContact CG2-CD1 4.21Å; I851-I914 HydrophobicContact CG2-CG2 4.13Å; I851-L915 HydrophobicContact CD1-CD1 4.1Å; I851-L915 HydrophobicContact CD1-CD2 4.3Å; I851-L915 HydrophobicContact CD1-CG 4.24Å
852	V	89.5	Confident	89.7	Confident	50 Å²	50	71.7 Å²	71.7	30%	0.303	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-83	144.1	-175.6	-168.8	0	0	0	0	111.1	W854 P860	V852-W854 PolarHBondContact O-N 2.7Å; V852-P860 HydrophobicContact CB-CG 4.28Å
853	F	88.4	Confident	89.7	Confident	17 Å²	17	68.8 Å²	68.8	8%	0.075	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-58.7	133.6	169.6	-83.5	-70.7	0	0	0	111.5	D882 K884 R904 M906	F853-D882 HydrophobicContact CD2-CB 3.98Å; F853-D882 WeakPolarHBondContact CD2-OD2 3.05Å; F853-D882 HydrophobicContact CE2-CB 4.49Å; F853-D882 WeakPolarHBondContact CE2-O 3.38Å; F853-D882 PolarHBondContact N-OD2 2.97Å; F853-K884 HydrophobicContact CD2-CD 4.41Å; F853-K884 HydrophobicContact CD2-CG 3.59Å; F853-K884 HydrophobicContact CE2-CG 3.83Å; F853-R904 HydrophobicContact CE1-CG 4.3Å; F853-R904 HydrophobicContact CE2-CG 4.37Å; F853-R904 HydrophobicContact CZ-CB 4.49Å; F853-R904 HydrophobicContact CZ-CG 3.75Å; F853-M906 HydrophobicContact CB-CE 4.39Å; F853-M906 HydrophobicContact CD1-CE 3.79Å; F853-M906 HydrophobicContact CD2-CE 4.3Å; F853-M906 HydrophobicContact CE1-CB 3.83Å; F853-M906 HydrophobicContact CE1-CE 4.14Å; F853-M906 HydrophobicContact CE1-CG 4.33Å; F853-M906 HydrophobicContact CE2-CB 3.91Å; F853-M906 HydrophobicContact CG-CE 3.9Å; F853-M906 VanDerWaalsContact CZ-CA 3.43Å; F853-M906 HydrophobicContact CZ-CB 3.5Å; F853-M906 HydrophobicContact CZ-CG 4.47Å
854	W	87.3	Confident	89.7	Confident	42 Å²	42	58.5 Å²	58.5	16%	0.159	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-80.7	135.7	169.6	-79	0.7	0	0	0	111.6	V852 K859 P860 I914 D917 I918	V852-W854 PolarHBondContact O-N 2.7Å; W854-K859 HydrophobicContact CB-CG 4.01Å; W854-K859 HydrophobicContact CD2-CB 3.95Å; W854-K859 HydrophobicContact CD2-CD 3.99Å; W854-K859 HydrophobicContact CD2-CG 3.88Å; W854-K859 HydrophobicContact CE3-CD 3.91Å; W854-K859 HydrophobicContact CE3-CG 4.32Å; W854-K859 HydrophobicContact CG-CB 3.96Å; W854-K859 HydrophobicContact CG-CD 4.31Å; W854-K859 HydrophobicContact CG-CG 3.75Å; W854-P860 PolarHBondContact NE1-O 3.15Å; W854-I914 HydrophobicContact CD2-CG1 4.42Å; W854-I914 HydrophobicContact CD2-CG2 4.35Å; W854-I914 HydrophobicContact CE3-CG1 4.48Å; W854-I914 HydrophobicContact CH2-CG2 4.04Å; W854-I914 WeakPolarHBondContact CH2-O 3.43Å; W854-I914 HydrophobicContact CZ2-CG2 3.66Å; W854-D917 HydrophobicContact CH2-CB 3.64Å; W854-D917 HydrophobicContact CZ3-CB 3.64Å; W854-I918 HydrophobicContact CH2-CD1 4.46Å; W854-I918 HydrophobicContact CH2-CG1 3.71Å; W854-I918 HydrophobicContact CZ2-CD1 3.79Å; W854-I918 HydrophobicContact CZ2-CG1 3.42Å; W854-I918 VanDerWaalsContact CZ2-CG1 3.42Å
855	T	82	Confident	89.7	Confident	71 Å²	71	59.9 Å²	59.9	44%	0.436	32%	0.323	S	S	.	.			trans	-104.8	179.3	166.2	69.8	0	0	0	0	110.1	E857 Y858 K859	T855-E857 VanDerWaalsContact C-N 3.28Å; T855-Y858 PolarHBondContact N-O 3.13Å; T855-Y858 WeakPolarHBondContact OG1-CB 3.25Å; T855-Y858 PolarHBondContact OG1-N 2.99Å; T855-K859 VanDerWaalsContact O-CE 3.26Å; T855-K859 WeakPolarHBondContact O-CE 3.48Å; T855-K859 WeakPolarHBondContact O-CG 3.4Å
856	A	78.9	Confident	89.6	Confident	84 Å²	84	60.2 Å²	60.2	69%	0.694	33%	0.325	S	S	*	.	S	Bend	trans	-64.5	-36.9	175.9	0	0	0	0	0	111.4
857	E	77.4	Confident	89.6	Confident	172 Å²	172	59.2 Å²	59.2	80%	0.804	31%	0.314	S	S	*	.	S	Bend	trans	-95.4	-25.5	-175	-55.6	73.1	-156.6	0	0	113.5	T855	T855-E857 VanDerWaalsContact C-N 3.28Å
858	Y	81.6	Confident	89.7	Confident	147 Å²	147	53.3 Å²	53.3	58%	0.576	29%	0.289	S	S	*	.			trans	-127.3	110.3	-172.3	-170.1	-115.8	0	0	0	112	T855 P860	T855-Y858 PolarHBondContact N-O 3.13Å; T855-Y858 WeakPolarHBondContact OG1-CB 3.25Å; T855-Y858 PolarHBondContact OG1-N 2.99Å; Y858-P860 HydrophobicContact CD1-CG 4.09Å; Y858-P860 HydrophobicContact CE1-CB 4.19Å; Y858-P860 HydrophobicContact CE1-CG 3.55Å
859	K	87.9	Confident	89.8	Confident	108 Å²	108	53.5 Å²	53.5	47%	0.47	29%	0.29	S	S	.	.			trans	-130.5	70.4	-179.3	-61.5	-170.6	179.2	-178.9	0	111.5	W854 T855	W854-K859 HydrophobicContact CB-CG 4.01Å; W854-K859 HydrophobicContact CD2-CB 3.95Å; W854-K859 HydrophobicContact CD2-CD 3.99Å; W854-K859 HydrophobicContact CD2-CG 3.88Å; W854-K859 HydrophobicContact CE3-CD 3.91Å; W854-K859 HydrophobicContact CE3-CG 4.32Å; W854-K859 HydrophobicContact CG-CB 3.96Å; W854-K859 HydrophobicContact CG-CD 4.31Å; W854-K859 HydrophobicContact CG-CG 3.75Å; T855-K859 VanDerWaalsContact O-CE 3.26Å; T855-K859 WeakPolarHBondContact O-CE 3.48Å; T855-K859 WeakPolarHBondContact O-CG 3.4Å
860	P	88.4	Confident	89.9	Confident	17 Å²	17	53.3 Å²	53.3	11%	0.11	29%	0.288	C	S	.	.			trans	-64.5	145.8	-179.9	28.6	-35.7	0	0	0	111.1	V852 W854 Y858 F863	V852-P860 HydrophobicContact CB-CG 4.28Å; W854-P860 PolarHBondContact NE1-O 3.15Å; Y858-P860 HydrophobicContact CD1-CG 4.09Å; Y858-P860 HydrophobicContact CE1-CB 4.19Å; Y858-P860 HydrophobicContact CE1-CG 3.55Å; P860-F863 WeakPolarHBondContact O-CE1 3.35Å
861	E	89.5	Confident	90.1	Very high	43 Å²	43	50.8 Å²	50.8	20%	0.201	27%	0.269	C	S	.	.			trans	-125.4	1.2	178.6	-56.7	-173.3	-174.6	0	0	113	F863 F864 I918 R921 R922	E861-F863 PolarHBondContact O-N 2.74Å; E861-F864 WeakPolarHBondContact O-CA 3.48Å; E861-F864 WeakPolarHBondContact O-CB 3.39Å; E861-F864 PolarHBondContact O-N 3.09Å; E861-I918 HydrophobicContact CB-CD1 4.13Å; E861-I918 HydrophobicContact CB-CG1 4.5Å; E861-I918 HydrophobicContact CB-CG2 4.43Å; E861-I918 HydrophobicContact CG-CD1 3.98Å; E861-I918 HydrophobicContact CG-CG1 3.92Å; E861-I918 HydrophobicContact CG-CG2 4.33Å; E861-I918 WeakPolarHBondContact OE2-CG2 3.31Å; E861-R921 IonicContact OE1-CZ 3.02Å; E861-R921 IonicContact OE1-NE 2.93Å; E861-R921 IonicContact OE1-NH1 3.98Å; E861-R921 PolarHBondContact OE1-NH1 3.19Å; E861-R921 IonicContact OE1-NH2 2.66Å; E861-R921 PolarHBondContact OE1-NH2 3.47Å; E861-R922 IonicContact OE2-NE 2.67Å; E861-R922 PolarHBondContact OE2-NE 2.87Å; E861-R922 IonicContact OE2-NH2 3.08Å
862	S	89.2	Confident	90.2	Very high	86 Å²	86	57.3 Å²	57.3	60%	0.601	30%	0.297	S	S	*	.	H	α-helix	trans	-60.6	-31.3	-172.5	53	0	0	0	0	113.7	F864 D865	S862-F864 PolarHBondContact O-N 2.97Å; S862-D865 PolarHBondContact O-N 2.64Å
863	F	92.7	Very high	90.5	Very high	15 Å²	15	59.7 Å²	59.7	7%	0.066	31%	0.309	C	S	.	.	H	α-helix	trans	-64.1	-28.4	174	57.5	-98.6	0	0	0	112.5	V849 I851 P860 E861 D865 Q866 I867 I914 L915 I918	V849-F863 HydrophobicContact CB-CB 4.19Å; I851-F863 HydrophobicContact CB-CE2 4.46Å; I851-F863 HydrophobicContact CG1-CD2 4.07Å; I851-F863 HydrophobicContact CG1-CE2 4.13Å; I851-F863 HydrophobicContact CG2-CE2 4.03Å; I851-F863 HydrophobicContact CG2-CZ 4.02Å; P860-F863 WeakPolarHBondContact O-CE1 3.35Å; E861-F863 PolarHBondContact O-N 2.74Å; F863-D865 VanDerWaalsContact C-N 3.33Å; F863-Q866 PolarHBondContact O-N 3.04Å; F863-I867 HydrophobicContact CD2-CD1 4.45Å; F863-I867 WeakPolarHBondContact O-CG1 3.14Å; F863-I867 PolarHBondContact O-N 3.14Å; F863-I867 VanDerWaalsContact O-N 3.13Å; F863-I914 HydrophobicContact CE2-CG2 4.35Å; F863-I914 HydrophobicContact CZ-CG2 3.92Å; F863-L915 HydrophobicContact CD2-CD2 4.4Å; F863-L915 HydrophobicContact CE2-CD2 3.95Å; F863-I918 HydrophobicContact CE2-CD1 3.87Å; F863-I918 HydrophobicContact CZ-CD1 3.87Å
864	F	94.4	Very high	90.8	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.6	-38.3	176.9	-167.7	-83.2	0	0	0	111.2	E861 S862 Q866 I867 E868 L915 I918 W919 T929 L931	E861-F864 WeakPolarHBondContact O-CA 3.48Å; E861-F864 WeakPolarHBondContact O-CB 3.39Å; E861-F864 PolarHBondContact O-N 3.09Å; S862-F864 PolarHBondContact O-N 2.97Å; F864-Q866 PolarHBondContact O-N 2.8Å; F864-I867 WeakPolarHBondContact O-CB 2.96Å; F864-I867 PolarHBondContact O-N 2.76Å; F864-E868 HydrophobicContact CD1-CG 3.77Å; F864-E868 HydrophobicContact CE1-CG 3.63Å; F864-E868 WeakPolarHBondContact O-CG 3.22Å; F864-E868 PolarHBondContact O-N 3.38Å; F864-L915 HydrophobicContact CD2-CD2 3.77Å; F864-L915 HydrophobicContact CE2-CD2 4.3Å; F864-I918 HydrophobicContact CB-CD1 4.04Å; F864-I918 HydrophobicContact CB-CG2 4.08Å; F864-I918 HydrophobicContact CD1-CG2 3.9Å; F864-I918 HydrophobicContact CD2-CB 3.74Å; F864-I918 HydrophobicContact CD2-CD1 3.88Å; F864-I918 HydrophobicContact CD2-CG1 4.41Å; F864-I918 HydrophobicContact CD2-CG2 3.47Å; F864-I918 VanDerWaalsContact CD2-CG2 3.47Å; F864-I918 HydrophobicContact CE1-CG2 4.18Å; F864-I918 HydrophobicContact CE2-CB 3.89Å; F864-I918 HydrophobicContact CE2-CG2 3.75Å; F864-I918 HydrophobicContact CG-CB 4.31Å; F864-I918 HydrophobicContact CG-CD1 4.28Å; F864-I918 HydrophobicContact CG-CG2 3.55Å; F864-I918 HydrophobicContact CZ-CG2 4.1Å; F864-W919 HydrophobicContact CE2-CB 4.48Å; F864-W919 HydrophobicContact CZ-CB 4.29Å; F864-T929 HydrophobicContact CE1-CG2 3.86Å; F864-T929 HydrophobicContact CZ-CG2 4.22Å; F864-L931 HydrophobicContact CD2-CD2 4.33Å; F864-L931 HydrophobicContact CE2-CD2 3.35Å; F864-L931 HydrophobicContact CZ-CB 4.05Å; F864-L931 HydrophobicContact CZ-CD2 3.57Å; F864-L931 HydrophobicContact CZ-CG 4.45Å
865	D	93.6	Very high	91.3	Very high	75 Å²	75	61.2 Å²	61.2	40%	0.401	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-35.2	176.5	-61.3	-39.6	0	0	0	111.6	S862 F863 E868 V869 R922	S862-D865 PolarHBondContact O-N 2.64Å; F863-D865 VanDerWaalsContact C-N 3.33Å; D865-E868 WeakPolarHBondContact O-CB 3.39Å; D865-E868 PolarHBondContact O-N 2.79Å; D865-V869 VanDerWaalsContact O-CG2 3.3Å; D865-V869 WeakPolarHBondContact O-CG2 3.46Å; D865-V869 PolarHBondContact O-N 2.86Å; D865-R922 IonicContact OD1-CZ 2.88Å; D865-R922 IonicContact OD1-NH1 3.5Å; D865-R922 PolarHBondContact OD1-NH1 3.03Å; D865-R922 IonicContact OD1-NH2 3.93Å; D865-R922 PolarHBondContact OD1-NH2 3.42Å; D865-R922 IonicContact OD2-NH2 3.63Å
866	Q	94.5	Very high	92.1	Very high	41 Å²	41	57.8 Å²	57.8	19%	0.192	30%	0.298	C	S	.	.	H	α-helix	trans	-74.5	-34.8	177.4	-170.7	56.8	73.2	0	0	112.4	K847 V849 F863 F864 E868 V869 N870	K847-Q866 HydrophobicContact CB-CG 3.88Å; K847-Q866 HydrophobicContact CD-CG 4.35Å; V849-Q866 HydrophobicContact CG1-CB 3.8Å; V849-Q866 HydrophobicContact CG1-CG 3.75Å; F863-Q866 PolarHBondContact O-N 3.04Å; F864-Q866 PolarHBondContact O-N 2.8Å; Q866-E868 VanDerWaalsContact C-N 3.34Å; Q866-V869 PolarHBondContact O-N 2.98Å; Q866-N870 PolarHBondContact NE2-OD1 3.27Å; Q866-N870 VanDerWaalsContact NE2-OD1 3.13Å; Q866-N870 VanDerWaalsContact O-CG 3.27Å; Q866-N870 PolarHBondContact O-N 2.72Å; Q866-N870 PolarHBondContact O-OD1 3.02Å
867	I	96.8	Very high	93	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.6	-45.8	170.3	-65.7	167.2	0	0	0	109.9	V849 F863 F864 V869 N870 L871 T877 L915 L931 I972	V849-I867 HydrophobicContact CG1-CG1 4.39Å; V849-I867 HydrophobicContact CG2-CD1 4.12Å; V849-I867 HydrophobicContact CG2-CG1 3.94Å; F863-I867 HydrophobicContact CD2-CD1 4.45Å; F863-I867 WeakPolarHBondContact O-CG1 3.14Å; F863-I867 PolarHBondContact O-N 3.14Å; F863-I867 VanDerWaalsContact O-N 3.13Å; F864-I867 WeakPolarHBondContact O-CB 2.96Å; F864-I867 PolarHBondContact O-N 2.76Å; I867-V869 PolarHBondContact O-N 3.13Å; I867-N870 PolarHBondContact O-N 2.85Å; I867-L871 HydrophobicContact CG2-CD1 4.08Å; I867-L871 HydrophobicContact CG2-CG 4.45Å; I867-L871 WeakPolarHBondContact O-CG 3.47Å; I867-L871 PolarHBondContact O-N 3.47Å; I867-T877 HydrophobicContact CG1-CG2 3.94Å; I867-L915 HydrophobicContact CD1-CD1 4.36Å; I867-L915 HydrophobicContact CD1-CD2 3.62Å; I867-L931 HydrophobicContact CG2-CD1 4.41Å; I867-I972 HydrophobicContact CG2-CB 4.42Å; I867-I972 HydrophobicContact CG2-CG1 4.26Å; I867-I972 HydrophobicContact CG2-CG2 4.16Å
868	E	96	Very high	94	Very high	9 Å²	9	45.8 Å²	45.8	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-43.6	176.8	-74.7	-79.5	135.8	0	0	112.3	F864 D865 Q866 L871 K872 V930 L931	F864-E868 HydrophobicContact CD1-CG 3.77Å; F864-E868 HydrophobicContact CE1-CG 3.63Å; F864-E868 WeakPolarHBondContact O-CG 3.22Å; F864-E868 PolarHBondContact O-N 3.38Å; D865-E868 WeakPolarHBondContact O-CB 3.39Å; D865-E868 PolarHBondContact O-N 2.79Å; Q866-E868 VanDerWaalsContact C-N 3.34Å; E868-L871 PolarHBondContact O-N 3.22Å; E868-K872 WeakPolarHBondContact O-CB 3.28Å; E868-K872 VanDerWaalsContact O-CG 3.25Å; E868-K872 WeakPolarHBondContact O-CG 3.23Å; E868-K872 PolarHBondContact O-N 3.13Å; E868-V930 VanDerWaalsContact CD-N 3.28Å; E868-V930 PolarHBondContact OE1-N 3.1Å; E868-V930 WeakPolarHBondContact OE2-CB 3.36Å; E868-V930 WeakPolarHBondContact OE2-CG2 3.31Å; E868-V930 PolarHBondContact OE2-N 3.08Å; E868-L931 WeakPolarHBondContact OE1-CB 3.08Å; E868-L931 PolarHBondContact OE1-N 2.77Å
869	V	96.2	Very high	94.7	Very high	65 Å²	65	38.8 Å²	38.8	39%	0.394	20%	0.2	S	C	.	.	H	α-helix	trans	-63.8	-40.7	176	169.2	0	0	0	0	111.4	D865 Q866 I867 N873	D865-V869 VanDerWaalsContact O-CG2 3.3Å; D865-V869 WeakPolarHBondContact O-CG2 3.46Å; D865-V869 PolarHBondContact O-N 2.86Å; Q866-V869 PolarHBondContact O-N 2.98Å; I867-V869 PolarHBondContact O-N 3.13Å; V869-N873 PolarHBondContact O-N 2.91Å; V869-N873 PolarHBondContact O-ND2 3.15Å
870	N	97.8	Very high	95	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-64	-48.9	177	-69.8	-11	0	0	0	110.6	K847 Q866 I867 K872 N873 G874 F875 T877	K847-N870 PolarHBondContact N-ND2 3.36Å; K847-N870 PolarHBondContact N-OD1 2.89Å; K847-N870 PolarHBondContact O-ND2 3.17Å; Q866-N870 PolarHBondContact NE2-OD1 3.27Å; Q866-N870 VanDerWaalsContact NE2-OD1 3.13Å; Q866-N870 VanDerWaalsContact O-CG 3.27Å; Q866-N870 PolarHBondContact O-N 2.72Å; Q866-N870 PolarHBondContact O-OD1 3.02Å; I867-N870 PolarHBondContact O-N 2.85Å; N870-K872 PolarHBondContact O-N 2.86Å; N870-N873 CarbonylContact O-C 3.6Å; N870-N873 PolarHBondContact O-N 2.71Å; N870-G874 PolarHBondContact O-N 2.87Å; N870-F875 CarbonylContact C-O 3.55Å; N870-F875 HydrophobicContact CB-CB 4.16Å; N870-F875 PolarHBondContact O-N 2.9Å; N870-T877 WeakPolarHBondContact CB-OG1 3.24Å; N870-T877 WeakPolarHBondContact ND2-CG2 3.36Å; N870-T877 PolarHBondContact ND2-OG1 2.91Å
871	L	97.2	Very high	95.2	Very high	20 Å²	20	35.9 Å²	35.9	11%	0.105	19%	0.188	C	C	.	.	H	α-helix	trans	-59.9	-41.8	178.4	-75.4	175.8	0	0	0	113	I867 E868 N873 G874 V930 L931 I972	I867-L871 HydrophobicContact CG2-CD1 4.08Å; I867-L871 HydrophobicContact CG2-CG 4.45Å; I867-L871 WeakPolarHBondContact O-CG 3.47Å; I867-L871 PolarHBondContact O-N 3.47Å; E868-L871 PolarHBondContact O-N 3.22Å; L871-N873 PolarHBondContact O-N 2.7Å; L871-G874 PolarHBondContact O-N 2.82Å; L871-V930 HydrophobicContact CB-CG1 3.85Å; L871-L931 HydrophobicContact CD1-CB 3.96Å; L871-L931 HydrophobicContact CD1-CD1 3.64Å; L871-L931 HydrophobicContact CD1-CG 4.44Å; L871-I972 HydrophobicContact CD1-CG2 4.13Å; L871-I972 HydrophobicContact CD2-CG2 4.05Å; L871-I972 HydrophobicContact CG-CG2 4.34Å
872	K	95.5	Very high	95.2	Very high	137 Å²	137	35.5 Å²	35.5	60%	0.596	19%	0.188	S	C	*	.	H	α-helix	trans	-58.7	-28.2	175.7	-78.7	173	-174	176.7	0	113.5	E868 N870 V930	E868-K872 WeakPolarHBondContact O-CB 3.28Å; E868-K872 VanDerWaalsContact O-CG 3.25Å; E868-K872 WeakPolarHBondContact O-CG 3.23Å; E868-K872 PolarHBondContact O-N 3.13Å; N870-K872 PolarHBondContact O-N 2.86Å; K872-V930 HydrophobicContact CD-CG2 4.13Å; K872-V930 HydrophobicContact CG-CB 4.32Å; K872-V930 HydrophobicContact CG-CG1 4.32Å; K872-V930 HydrophobicContact CG-CG2 3.62Å
873	N	95.9	Very high	94.9	Very high	101 Å²	101	32.9 Å²	32.9	54%	0.54	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	10.5	179.2	-65.3	-53.3	0	0	0	112.5	V869 N870 L871 F875	V869-N873 PolarHBondContact O-N 2.91Å; V869-N873 PolarHBondContact O-ND2 3.15Å; N870-N873 CarbonylContact O-C 3.6Å; N870-N873 PolarHBondContact O-N 2.71Å; L871-N873 PolarHBondContact O-N 2.7Å; N873-F875 VanDerWaalsContact C-N 3.27Å; N873-F875 HydrophobicContact CB-CD2 3.69Å; N873-F875 HydrophobicContact CB-CE2 3.74Å; N873-F875 PolarHBondContact O-N 2.99Å
874	G	94.7	Very high	94.1	Very high	8 Å²	8	35 Å²	35	8%	0.082	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	3.2	-179.1	0	0	0	0	0	115.1	N870 L871 E975	N870-G874 PolarHBondContact O-N 2.87Å; L871-G874 PolarHBondContact O-N 2.82Å; G874-E975 PolarHBondContact O-N 3.36Å
875	F	97.6	Very high	93	Very high	82 Å²	82	36.2 Å²	36.2	36%	0.36	18%	0.183	S	C	.	.			trans	-83.3	144	-175.7	-61.4	-47.6	0	0	0	113.7	N844 N870 N873	N844-F875 CarbonylContact O-C 3.6Å; N844-F875 VanDerWaalsContact O-CA 3.28Å; N844-F875 WeakPolarHBondContact O-CA 3.4Å; N844-F875 WeakPolarHBondContact O-CB 3.46Å; N870-F875 CarbonylContact C-O 3.55Å; N870-F875 HydrophobicContact CB-CB 4.16Å; N870-F875 PolarHBondContact O-N 2.9Å; N873-F875 VanDerWaalsContact C-N 3.27Å; N873-F875 HydrophobicContact CB-CD2 3.69Å; N873-F875 HydrophobicContact CB-CE2 3.74Å; N873-F875 PolarHBondContact O-N 2.99Å
876	H	98	Very high	91.7	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-69.5	156.5	164.6	-42.7	-53.7	0	0	0	110.6	L840 N844 F845 G846 I972 G974 E975 E980	L840-H876 HydrophobicContact CD1-CB 4.23Å; N844-H876 PolarHBondContact O-N 2.85Å; F845-H876 WeakPolarHBondContact CA-O 3.42Å; F845-H876 HydrophobicContact CD1-CB 3.93Å; F845-H876 HydrophobicContact CD2-CB 4.26Å; F845-H876 HydrophobicContact CE1-CB 3.93Å; F845-H876 HydrophobicContact CE2-CB 4.28Å; F845-H876 HydrophobicContact CG-CB 4.12Å; F845-H876 HydrophobicContact CZ-CB 4.12Å; G846-H876 PolarHBondContact N-O 3.37Å; H876-I972 CarbonylContact C-O 3.46Å; H876-I972 VanDerWaalsContact CA-O 3.23Å; H876-I972 WeakPolarHBondContact CA-O 3.34Å; H876-G974 PolarHBondContact ND1-N 3.17Å; H876-G974 VanDerWaalsContact ND1-N 3.15Å; H876-E975 PolarHBondContact CE1-O 2.86Å; H876-E980 IonicContact CD2-OE1 2.68Å; H876-E980 IonicContact CE1-OE2 2.98Å; H876-E980 IonicContact NE2-OE1 3.18Å; H876-E980 PolarHBondContact NE2-OE1 2.64Å; H876-E980 VanDerWaalsContact NE2-OE1 3.08Å; H876-E980 IonicContact NE2-OE2 3.29Å
877	T	98.3	Very high	90.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	121.3	176.7	-52.9	0	0	0	0	110.6	V849 I867 N870 A971 I972	V849-T877 HydrophobicContact CG1-CG2 4.1Å; V849-T877 HydrophobicContact CG2-CG2 3.79Å; I867-T877 HydrophobicContact CG1-CG2 3.94Å; N870-T877 WeakPolarHBondContact CB-OG1 3.24Å; N870-T877 WeakPolarHBondContact ND2-CG2 3.36Å; N870-T877 PolarHBondContact ND2-OG1 2.91Å; T877-A971 CarbonylContact O-C 3.47Å; T877-A971 VanDerWaalsContact O-CA 3.26Å; T877-A971 WeakPolarHBondContact O-CA 3.23Å; T877-I972 PolarHBondContact N-O 2.88Å; T877-I972 PolarHBondContact O-N 3.36Å
878	L	97.4	Very high	89	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.016	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.3	166	173.6	56.2	0	0	0	108.8	L832 I835 F845 T848 V849 L880	L832-L878 HydrophobicContact CD2-CD2 3.81Å; I835-L878 HydrophobicContact CB-CD1 4.47Å; I835-L878 HydrophobicContact CB-CD2 4.42Å; I835-L878 HydrophobicContact CD1-CD1 3.75Å; I835-L878 HydrophobicContact CG1-CD1 3.93Å; I835-L878 HydrophobicContact CG2-CD2 4.36Å; F845-L878 HydrophobicContact CD1-CB 3.92Å; F845-L878 HydrophobicContact CE1-CB 3.95Å; T848-L878 WeakPolarHBondContact CA-O 3.26Å; T848-L878 HydrophobicContact CG2-CB 4.23Å; T848-L878 HydrophobicContact CG2-CD2 4.25Å; T848-L878 HydrophobicContact CG2-CG 4.04Å; T848-L878 WeakPolarHBondContact CG2-O 3.39Å; V849-L878 PolarHBondContact N-O 3.04Å; L878-L880 HydrophobicContact CD1-CD2 4.41Å; L878-L880 HydrophobicContact CD2-CD2 4.25Å; L878-L880 HydrophobicContact CG-CD2 4.19Å
879	C	97.1	Very high	87.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	107.8	175	-58.6	0	0	0	0	109	V849 I851 L881 V970	V849-C879 HydrophobicContact CG2-CB 4.09Å; V849-C879 VanDerWaalsContact CG2-SG 3.52Å; V849-C879 CarbonylContact O-C 3.41Å; V849-C879 WeakPolarHBondContact O-CA 3.48Å; I851-C879 HydrophobicContact CD1-CB 3.71Å; I851-C879 HydrophobicContact CG1-CB 4.14Å; C879-L881 HydrophobicContact CB-CD2 4.46Å; C879-V970 WeakPolarHBondContact CA-O 3.26Å; C879-V970 HydrophobicContact CB-CB 4.11Å; C879-V970 VanDerWaalsContact CB-O 3.28Å; C879-V970 WeakPolarHBondContact CB-O 3.5Å; C879-V970 PolarHBondContact N-O 2.87Å; C879-V970 PolarHBondContact O-N 3.36Å
880	L	93.8	Very high	86.4	Confident	45 Å²	45	41.9 Å²	41.9	24%	0.236	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	132.9	167.1	-56.4	-179.2	0	0	0	108.3	V831 T848 V849 S850 I851 L878	V831-L880 HydrophobicContact CG1-CD2 3.73Å; T848-L880 HydrophobicContact CG2-CD1 3.88Å; T848-L880 HydrophobicContact CG2-CD2 4.43Å; T848-L880 HydrophobicContact CG2-CG 3.74Å; V849-L880 PolarHBondContact O-N 3.45Å; S850-L880 CarbonylContact C-O 3.37Å; S850-L880 VanDerWaalsContact CA-O 3.29Å; S850-L880 WeakPolarHBondContact CA-O 3.39Å; I851-L880 PolarHBondContact N-O 2.81Å; L878-L880 HydrophobicContact CD1-CD2 4.41Å; L878-L880 HydrophobicContact CD2-CD2 4.25Å; L878-L880 HydrophobicContact CG-CD2 4.19Å
881	L	93.8	Very high	85.1	Confident	19 Å²	19	46.5 Å²	46.5	10%	0.099	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	135.2	-175.7	-54.8	-172.4	0	0	0	109.7	I851 C879 M906 A911 H968 V970	I851-L881 HydrophobicContact CB-CD2 4.26Å; I851-L881 HydrophobicContact CD1-CD2 4.07Å; I851-L881 HydrophobicContact CG1-CD2 4.45Å; C879-L881 HydrophobicContact CB-CD2 4.46Å; L881-M906 HydrophobicContact CB-CB 4.01Å; L881-M906 HydrophobicContact CB-CG 4.27Å; L881-M906 HydrophobicContact CB-SD 4.36Å; L881-M906 VanDerWaalsContact CD1-O 3.32Å; L881-M906 WeakPolarHBondContact CD1-O 3.19Å; L881-M906 HydrophobicContact CD2-SD 4.23Å; L881-A911 HydrophobicContact CD1-CB 4.13Å; L881-A911 HydrophobicContact CD2-CB 3.46Å; L881-A911 VanDerWaalsContact CD2-CB 3.46Å; L881-A911 HydrophobicContact CG-CB 4.43Å; L881-H968 HydrophobicContact CD1-CB 3.82Å; L881-V970 HydrophobicContact CD1-CG2 4.24Å; L881-V970 HydrophobicContact CD2-CG2 4.3Å
882	D	88.2	Confident	84	Confident	36 Å²	36	46.5 Å²	46.5	19%	0.193	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-64.2	147.8	-177.5	-171.1	27.3	0	0	0	112	I851 F853 K884 M906	I851-D882 WeakPolarHBondContact O-CB 3.47Å; I851-D882 PolarHBondContact O-N 2.66Å; F853-D882 HydrophobicContact CD2-CB 3.98Å; F853-D882 WeakPolarHBondContact CD2-OD2 3.05Å; F853-D882 HydrophobicContact CE2-CB 4.49Å; F853-D882 WeakPolarHBondContact CE2-O 3.38Å; F853-D882 PolarHBondContact N-OD2 2.97Å; D882-K884 WeakPolarHBondContact OD2-CE 3.28Å; D882-M906 HydrophobicContact CB-CE 4.28Å; D882-M906 VanDerWaalsContact O-CB 3.28Å; D882-M906 WeakPolarHBondContact O-CB 3.47Å; D882-M906 PolarHBondContact O-N 2.76Å
883	L	83	Confident	82.6	Confident	31 Å²	31	44.7 Å²	44.7	16%	0.162	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.2	-178.9	60.8	95.2	0	0	0	109.6	Y733 T734 V885 F905 L967	Y733-L883 VanDerWaalsContact O-CD1 3.23Å; Y733-L883 WeakPolarHBondContact O-CD1 3.35Å; T734-L883 WeakPolarHBondContact O-CD2 3.5Å; L883-V885 HydrophobicContact CD1-CG2 3.8Å; L883-F905 HydrophobicContact CB-CD1 3.58Å; L883-F905 HydrophobicContact CB-CE1 3.97Å; L883-L967 HydrophobicContact CD2-CD2 4.31Å
884	K	76.9	Confident	81.4	Confident	60 Å²	60	46.4 Å²	46.4	26%	0.261	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	95.5	-173.5	-62	-59.5	-165	162.5	0	107.4	F853 D882 E887 P903 R904	F853-K884 HydrophobicContact CD2-CD 4.41Å; F853-K884 HydrophobicContact CD2-CG 3.59Å; F853-K884 HydrophobicContact CE2-CG 3.83Å; D882-K884 WeakPolarHBondContact OD2-CE 3.28Å; K884-E887 VanDerWaalsContact CD-CD 3.48Å; K884-E887 VanDerWaalsContact CD-OE1 3.31Å; K884-E887 WeakPolarHBondContact CD-OE1 3.43Å; K884-E887 VanDerWaalsContact CD-OE2 3.31Å; K884-E887 WeakPolarHBondContact CD-OE2 3.33Å; K884-E887 VanDerWaalsContact NZ-CD 3.25Å; K884-E887 IonicContact NZ-OE1 3.87Å; K884-E887 PolarHBondContact NZ-OE1 3.17Å; K884-E887 IonicContact NZ-OE2 3.9Å; K884-E887 PolarHBondContact NZ-OE2 2.83Å; K884-P903 CarbonylContact O-C 3.59Å; K884-P903 WeakPolarHBondContact O-CA 3.48Å; K884-R904 HydrophobicContact CB-CB 4.25Å; K884-R904 PolarHBondContact N-O 3.02Å; K884-R904 PolarHBondContact O-N 2.8Å
885	V	70	Confident	80.5	Confident	24 Å²	24	52.2 Å²	52.2	15%	0.145	25%	0.254	C	S	.	.			trans	-116.7	125.2	-179.3	-177.6	0	0	0	0	108.4	L883 E887 P903 F905	L883-V885 HydrophobicContact CD1-CG2 3.8Å; V885-E887 VanDerWaalsContact C-N 3.29Å; V885-E887 PolarHBondContact O-N 2.84Å; V885-P903 HydrophobicContact CG2-CB 4.37Å; V885-F905 HydrophobicContact CG2-CE1 3.67Å; V885-F905 HydrophobicContact CG2-CZ 3.66Å
886	K	66.9	Low	79	Confident	81 Å²	81	53.9 Å²	53.9	35%	0.352	27%	0.267	S	S	.	.	S	Bend	trans	57.3	35	177.6	-99.4	-173.3	167.4	-170.3	0	114.4	D758 Y900	D758-K886 HydrophobicContact CB-CD 3.74Å; D758-K886 WeakPolarHBondContact OD2-CD 3.38Å; D758-K886 IonicContact OD2-NZ 3.81Å; D758-K886 PolarHBondContact OD2-NZ 2.84Å; K886-Y900 HydrophobicContact CB-CD1 4.39Å; K886-Y900 HydrophobicContact CG-CD1 4.48Å; K886-Y900 HydrophobicContact CG-CG 4.42Å; K886-Y900 WeakPolarHBondContact O-CD1 3.43Å
887	E	67.4	Low	77.6	Confident	70 Å²	70	59.6 Å²	59.6	33%	0.327	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-86.6	144.4	172.2	-71.7	-170.1	-174	0	0	111.5	K884 V885 E901	K884-E887 VanDerWaalsContact CD-CD 3.48Å; K884-E887 VanDerWaalsContact CD-OE1 3.31Å; K884-E887 WeakPolarHBondContact CD-OE1 3.43Å; K884-E887 VanDerWaalsContact CD-OE2 3.31Å; K884-E887 WeakPolarHBondContact CD-OE2 3.33Å; K884-E887 VanDerWaalsContact NZ-CD 3.25Å; K884-E887 IonicContact NZ-OE1 3.87Å; K884-E887 PolarHBondContact NZ-OE1 3.17Å; K884-E887 IonicContact NZ-OE2 3.9Å; K884-E887 PolarHBondContact NZ-OE2 2.83Å; V885-E887 VanDerWaalsContact C-N 3.29Å; V885-E887 PolarHBondContact O-N 2.84Å; E887-E901 PolarHBondContact O-N 3.31Å
888	R	67.6	Low	76.2	Confident	32 Å²	32	67 Å²	67	12%	0.121	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-89.7	140.8	172.4	-66.8	169.2	63.8	178.7	-4.5	109.6	E760 N892 I893 D896 R897 Y900	E760-R888 VanDerWaalsContact OE1-CD 3.25Å; E760-R888 WeakPolarHBondContact OE1-CD 3.49Å; R888-N892 HydrophobicContact CB-CB 4.34Å; R888-N892 PolarHBondContact NH2-O 3.26Å; R888-I893 HydrophobicContact CB-CD1 4.34Å; R888-I893 HydrophobicContact CB-CG1 3.69Å; R888-I893 WeakPolarHBondContact O-CD1 3.49Å; R888-D896 IonicContact CZ-OD1 2.78Å; R888-D896 IonicContact NH1-OD1 2.89Å; R888-D896 PolarHBondContact NH1-OD1 3.34Å; R888-D896 VanDerWaalsContact NH1-OD1 3.17Å; R888-D896 IonicContact NH2-OD1 2.87Å; R888-D896 PolarHBondContact NH2-OD1 3.42Å; R888-R897 PolarHBondContact NE-O 2.85Å; R888-R897 VanDerWaalsContact NH2-C 3.28Å; R888-R897 PolarHBondContact NH2-O 3.03Å; R888-Y900 HydrophobicContact CG-CD1 3.68Å; R888-Y900 HydrophobicContact CG-CE1 3.7Å
889	S	68.3	Low	75	Confident	20 Å²	20	71.5 Å²	71.5	14%	0.14	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-60.5	152.2	171.7	79.5	0	0	0	0	111	E891 N892 I893 E901	S889-E891 PolarHBondContact O-N 3.15Å; S889-N892 CarbonylContact O-C 3Å; S889-N892 WeakPolarHBondContact O-CA 3.43Å; S889-N892 WeakPolarHBondContact O-CB 3.39Å; S889-N892 PolarHBondContact O-N 2.68Å; S889-N892 WeakPolarHBondContact OG-CB 3.46Å; S889-N892 VanDerWaalsContact OG-CG 3.24Å; S889-N892 PolarHBondContact OG-N 3.35Å; S889-N892 PolarHBondContact OG-ND2 2.97Å; S889-I893 WeakPolarHBondContact O-CG1 3.23Å; S889-I893 PolarHBondContact O-N 2.62Å; S889-E901 WeakPolarHBondContact CB-OE1 3.3Å
890	V	68.5	Low	73.7	Confident	107 Å²	107	75.6 Å²	75.6	65%	0.648	36%	0.36	S	S	*	.	H	α-helix	trans	-53.9	-39.2	177.1	179.2	0	0	0	0	111.3	I893 I894	V890-I893 PolarHBondContact O-N 2.89Å; V890-I894 HydrophobicContact CG1-CD1 3.84Å; V890-I894 HydrophobicContact CG1-CG1 4.48Å; V890-I894 WeakPolarHBondContact O-CD1 3.29Å; V890-I894 VanDerWaalsContact O-CG1 3.23Å; V890-I894 WeakPolarHBondContact O-CG1 3.34Å; V890-I894 PolarHBondContact O-N 2.8Å
891	E	70.9	Confident	72.8	Confident	101 Å²	101	78.7 Å²	78.7	47%	0.472	37%	0.373	S	S	.	.	H	α-helix	trans	-63.5	-43.1	174.9	-175	179.6	-167.9	0	0	112.3	S889 I894 R895	S889-E891 PolarHBondContact O-N 3.15Å; E891-I894 PolarHBondContact O-N 3.04Å; E891-R895 WeakPolarHBondContact O-CB 3.17Å; E891-R895 WeakPolarHBondContact O-CG 3.48Å; E891-R895 PolarHBondContact O-N 3.25Å; E891-R895 IonicContact OE1-CZ 2.87Å; E891-R895 IonicContact OE1-NE 2.72Å; E891-R895 IonicContact OE1-NH1 3.98Å; E891-R895 PolarHBondContact OE1-NH1 3Å; E891-R895 IonicContact OE1-NH2 2.67Å; E891-R895 PolarHBondContact OE1-NH2 2.79Å
892	N	74.5	Confident	71.9	Confident	19 Å²	19	83.1 Å²	83.1	10%	0.102	40%	0.403	C	S	.	.	H	α-helix	trans	-69.4	-33.2	177.7	-75.1	-24.8	0	0	0	112	R888 S889 D896 R897 I899	R888-N892 HydrophobicContact CB-CB 4.34Å; R888-N892 PolarHBondContact NH2-O 3.26Å; S889-N892 CarbonylContact O-C 3Å; S889-N892 WeakPolarHBondContact O-CA 3.43Å; S889-N892 WeakPolarHBondContact O-CB 3.39Å; S889-N892 PolarHBondContact O-N 2.68Å; S889-N892 WeakPolarHBondContact OG-CB 3.46Å; S889-N892 VanDerWaalsContact OG-CG 3.24Å; S889-N892 PolarHBondContact OG-N 3.35Å; S889-N892 PolarHBondContact OG-ND2 2.97Å; N892-D896 CarbonylContact O-C 3.57Å; N892-D896 WeakPolarHBondContact O-CA 3.21Å; N892-D896 PolarHBondContact O-N 3.2Å; N892-D896 VanDerWaalsContact O-N 3.16Å; N892-R897 HydrophobicContact CB-CB 4.27Å; N892-R897 PolarHBondContact O-N 3.15Å; N892-I899 PolarHBondContact ND2-O 3.4Å; N892-I899 VanDerWaalsContact ND2-O 3.07Å
893	I	65.5	Low	71.4	Confident	99 Å²	99	85.1 Å²	85.1	51%	0.508	42%	0.418	S	S	.	.	H	α-helix	trans	-64.1	-52.3	172.1	-65.9	169.5	0	0	0	109.7	R888 S889 V890 R895 D896	R888-I893 HydrophobicContact CB-CD1 4.34Å; R888-I893 HydrophobicContact CB-CG1 3.69Å; R888-I893 WeakPolarHBondContact O-CD1 3.49Å; S889-I893 WeakPolarHBondContact O-CG1 3.23Å; S889-I893 PolarHBondContact O-N 2.62Å; V890-I893 PolarHBondContact O-N 2.89Å; I893-R895 VanDerWaalsContact C-N 3.28Å; I893-R895 PolarHBondContact O-N 2.8Å; I893-D896 PolarHBondContact O-N 3.48Å; I893-D896 VanDerWaalsContact O-N 3.13Å
894	I	70.5	Confident	71.5	Confident	137 Å²	137	89.9 Å²	89.9	70%	0.703	43%	0.434	S	S	*	.	H	α-helix	trans	-60.1	-37.9	-179.3	-67.8	165.8	0	0	0	111.7	V890 E891 D896	V890-I894 HydrophobicContact CG1-CD1 3.84Å; V890-I894 HydrophobicContact CG1-CG1 4.48Å; V890-I894 WeakPolarHBondContact O-CD1 3.29Å; V890-I894 VanDerWaalsContact O-CG1 3.23Å; V890-I894 WeakPolarHBondContact O-CG1 3.34Å; V890-I894 PolarHBondContact O-N 2.8Å; E891-I894 PolarHBondContact O-N 3.04Å; I894-D896 VanDerWaalsContact C-N 3.31Å
895	R	75.5	Confident	72	Confident	130 Å²	130	88.3 Å²	88.3	49%	0.491	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	5.6	-178.9	-68	-175.2	176.6	158	10	114.7	E891 I893 R897	E891-R895 WeakPolarHBondContact O-CB 3.17Å; E891-R895 WeakPolarHBondContact O-CG 3.48Å; E891-R895 PolarHBondContact O-N 3.25Å; E891-R895 IonicContact OE1-CZ 2.87Å; E891-R895 IonicContact OE1-NE 2.72Å; E891-R895 IonicContact OE1-NH1 3.98Å; E891-R895 PolarHBondContact OE1-NH1 3Å; E891-R895 IonicContact OE1-NH2 2.67Å; E891-R895 PolarHBondContact OE1-NH2 2.79Å; I893-R895 VanDerWaalsContact C-N 3.28Å; I893-R895 PolarHBondContact O-N 2.8Å; R895-R897 HydrophobicContact CB-CG 4.03Å; R895-R897 PolarHBondContact O-N 3.25Å; R895-R897 VanDerWaalsContact O-N 3.17Å
896	D	67.8	Low	73.1	Confident	117 Å²	117	87.3 Å²	87.3	63%	0.626	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.2	38.9	-170.5	-158.3	24.8	0	0	0	116	R888 N892 I893 I894	R888-D896 IonicContact CZ-OD1 2.78Å; R888-D896 IonicContact NH1-OD1 2.89Å; R888-D896 PolarHBondContact NH1-OD1 3.34Å; R888-D896 VanDerWaalsContact NH1-OD1 3.17Å; R888-D896 IonicContact NH2-OD1 2.87Å; R888-D896 PolarHBondContact NH2-OD1 3.42Å; N892-D896 CarbonylContact O-C 3.57Å; N892-D896 WeakPolarHBondContact O-CA 3.21Å; N892-D896 PolarHBondContact O-N 3.2Å; N892-D896 VanDerWaalsContact O-N 3.16Å; I893-D896 PolarHBondContact O-N 3.48Å; I893-D896 VanDerWaalsContact O-N 3.13Å; I894-D896 VanDerWaalsContact C-N 3.31Å
897	R	68.7	Low	74.5	Confident	120 Å²	120	85.3 Å²	85.3	45%	0.453	41%	0.414	S	S	.	.			trans	-89.7	121.4	173.7	-62.8	179.2	-177.5	-179.4	-0.9	111.4	R888 N892 R895 I899	R888-R897 PolarHBondContact NE-O 2.85Å; R888-R897 VanDerWaalsContact NH2-C 3.28Å; R888-R897 PolarHBondContact NH2-O 3.03Å; N892-R897 HydrophobicContact CB-CB 4.27Å; N892-R897 PolarHBondContact O-N 3.15Å; R895-R897 HydrophobicContact CB-CG 4.03Å; R895-R897 PolarHBondContact O-N 3.25Å; R895-R897 VanDerWaalsContact O-N 3.17Å; R897-I899 HydrophobicContact CB-CD1 4.22Å; R897-I899 HydrophobicContact CB-CG1 4.31Å; R897-I899 PolarHBondContact O-N 3.48Å
898	K	67	Low	75.9	Confident	155 Å²	155	82.1 Å²	82.1	67%	0.674	40%	0.399	S	S	*	.			trans	-76	52.1	174.1	-61.4	-170.8	178.2	-170	0	112.8
899	I	73.5	Confident	77.2	Confident	99 Å²	99	81.7 Å²	81.7	51%	0.508	40%	0.399	S	S	.	.			trans	-108	115.4	175.9	-60.6	170.9	0	0	0	106.7	N892 R897	N892-I899 PolarHBondContact ND2-O 3.4Å; N892-I899 VanDerWaalsContact ND2-O 3.07Å; R897-I899 HydrophobicContact CB-CD1 4.22Å; R897-I899 HydrophobicContact CB-CG1 4.31Å; R897-I899 PolarHBondContact O-N 3.48Å
900	Y	69	Low	78.5	Confident	85 Å²	85	82.9 Å²	82.9	33%	0.333	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-93.8	143.6	-178.2	-56.7	-77.1	0	0	0	110.7	K886 R888	K886-Y900 HydrophobicContact CB-CD1 4.39Å; K886-Y900 HydrophobicContact CG-CD1 4.48Å; K886-Y900 HydrophobicContact CG-CG 4.42Å; K886-Y900 WeakPolarHBondContact O-CD1 3.43Å; R888-Y900 HydrophobicContact CG-CD1 3.68Å; R888-Y900 HydrophobicContact CG-CE1 3.7Å
901	E	74.4	Confident	79.8	Confident	110 Å²	110	77.8 Å²	77.8	51%	0.514	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-73.7	151.9	172.3	-66.3	-164.6	170.9	0	0	110.9	E887 S889	E887-E901 PolarHBondContact O-N 3.31Å; S889-E901 WeakPolarHBondContact CB-OE1 3.3Å
902	P	75.2	Confident	81	Confident	112 Å²	112	73 Å²	73	73%	0.727	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-59.7	144.6	173.5	26.1	-34.3	0	0	0	110.3	R904	P902-R904 PolarHBondContact O-N 2.81Å
903	P	78.5	Confident	82.1	Confident	79 Å²	79	77.6 Å²	77.6	51%	0.513	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-65.5	134.9	-175	28.2	-35.1	0	0	0	110.8	K884 V885 F905	K884-P903 CarbonylContact O-C 3.59Å; K884-P903 WeakPolarHBondContact O-CA 3.48Å; V885-P903 HydrophobicContact CG2-CB 4.37Å; P903-F905 HydrophobicContact CB-CE2 3.76Å; P903-F905 HydrophobicContact CB-CZ 3.93Å; P903-F905 HydrophobicContact CG-CE2 4.33Å
904	R	84.6	Confident	83.5	Confident	130 Å²	130	73.8 Å²	73.8	49%	0.491	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.8	-179.1	-167.9	-175.9	174.8	-172	-3.8	110	F853 K884 P902 E910	F853-R904 HydrophobicContact CE1-CG 4.3Å; F853-R904 HydrophobicContact CE2-CG 4.37Å; F853-R904 HydrophobicContact CZ-CB 4.49Å; F853-R904 HydrophobicContact CZ-CG 3.75Å; K884-R904 HydrophobicContact CB-CB 4.25Å; K884-R904 PolarHBondContact N-O 3.02Å; K884-R904 PolarHBondContact O-N 2.8Å; P902-R904 PolarHBondContact O-N 2.81Å; R904-E910 IonicContact NH2-OE1 3.02Å; R904-E910 PolarHBondContact NH2-OE1 3.47Å
905	F	88.4	Confident	84.7	Confident	28 Å²	28	67.2 Å²	67.2	12%	0.123	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	128.4	-178.4	-57.6	-85.7	0	0	0	108.5	L736 L883 V885 P903 L907 P966 L967	L736-F905 HydrophobicContact CD1-CD1 3.9Å; L736-F905 HydrophobicContact CD1-CD2 4.24Å; L736-F905 HydrophobicContact CD1-CE1 3.44Å; L736-F905 VanDerWaalsContact CD1-CE1 3.44Å; L736-F905 HydrophobicContact CD1-CE2 3.8Å; L736-F905 HydrophobicContact CD1-CG 4.29Å; L736-F905 HydrophobicContact CD1-CZ 3.41Å; L736-F905 VanDerWaalsContact CD1-CZ 3.41Å; L736-F905 HydrophobicContact CD2-CE1 4.07Å; L736-F905 HydrophobicContact CD2-CZ 3.7Å; L736-F905 HydrophobicContact CG-CD1 4.41Å; L736-F905 HydrophobicContact CG-CE1 3.6Å; L736-F905 HydrophobicContact CG-CZ 3.7Å; L883-F905 HydrophobicContact CB-CD1 3.58Å; L883-F905 HydrophobicContact CB-CE1 3.97Å; V885-F905 HydrophobicContact CG2-CE1 3.67Å; V885-F905 HydrophobicContact CG2-CZ 3.66Å; P903-F905 HydrophobicContact CB-CE2 3.76Å; P903-F905 HydrophobicContact CB-CZ 3.93Å; P903-F905 HydrophobicContact CG-CE2 4.33Å; F905-L907 PolarHBondContact O-N 2.92Å; F905-P966 HydrophobicContact CB-CB 3.44Å; F905-P966 VanDerWaalsContact CB-CB 3.44Å; F905-P966 HydrophobicContact CB-CG 3.87Å; F905-P966 HydrophobicContact CD1-CB 4.34Å; F905-P966 HydrophobicContact CD2-CB 4.05Å; F905-P966 HydrophobicContact CD2-CG 3.6Å; F905-P966 HydrophobicContact CE2-CG 4.38Å; F905-P966 HydrophobicContact CG-CB 3.68Å; F905-P966 HydrophobicContact CG-CG 3.79Å; F905-L967 HydrophobicContact CD1-CD2 3.65Å; F905-L967 HydrophobicContact CE1-CD2 4.15Å; F905-L967 HydrophobicContact CG-CD2 4.48Å
906	M	93.3	Very high	85.6	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.015	30%	0.296	C	S	.	.			trans	-70.4	124.4	-179.1	178.8	-177.9	-60.1	0	0	109.2	I851 F853 L881 D882 E910 A911 I914	I851-M906 HydrophobicContact CB-SD 4.1Å; I851-M906 HydrophobicContact CG2-CE 4.06Å; I851-M906 HydrophobicContact CG2-SD 3.64Å; I851-M906 WeakPolarHBondContact O-CE 3.42Å; F853-M906 HydrophobicContact CB-CE 4.39Å; F853-M906 HydrophobicContact CD1-CE 3.79Å; F853-M906 HydrophobicContact CD2-CE 4.3Å; F853-M906 HydrophobicContact CE1-CB 3.83Å; F853-M906 HydrophobicContact CE1-CE 4.14Å; F853-M906 HydrophobicContact CE1-CG 4.33Å; F853-M906 HydrophobicContact CE2-CB 3.91Å; F853-M906 HydrophobicContact CG-CE 3.9Å; F853-M906 VanDerWaalsContact CZ-CA 3.43Å; F853-M906 HydrophobicContact CZ-CB 3.5Å; F853-M906 HydrophobicContact CZ-CG 4.47Å; L881-M906 HydrophobicContact CB-CB 4.01Å; L881-M906 HydrophobicContact CB-CG 4.27Å; L881-M906 HydrophobicContact CB-SD 4.36Å; L881-M906 VanDerWaalsContact CD1-O 3.32Å; L881-M906 WeakPolarHBondContact CD1-O 3.19Å; L881-M906 HydrophobicContact CD2-SD 4.23Å; D882-M906 HydrophobicContact CB-CE 4.28Å; D882-M906 VanDerWaalsContact O-CB 3.28Å; D882-M906 WeakPolarHBondContact O-CB 3.47Å; D882-M906 PolarHBondContact O-N 2.76Å; M906-E910 HydrophobicContact CG-CB 4.1Å; M906-A911 HydrophobicContact CG-CB 4.19Å; M906-A911 HydrophobicContact SD-CB 3.72Å; M906-I914 HydrophobicContact CE-CD1 3.57Å; M906-I914 HydrophobicContact SD-CD1 4.05Å
907	L	95.5	Very high	86.8	Confident	39 Å²	39	60.4 Å²	60.4	20%	0.204	29%	0.285	C	S	.	.			trans	-84.6	153	176.2	-56.6	-177.8	0	0	0	110.5	F905 N909 E910 A911	F905-L907 PolarHBondContact O-N 2.92Å; L907-N909 VanDerWaalsContact CB-OD1 3.22Å; L907-N909 WeakPolarHBondContact CB-OD1 3.38Å; L907-N909 PolarHBondContact O-N 3.41Å; L907-N909 VanDerWaalsContact O-N 3.11Å; L907-E910 HydrophobicContact CB-CG 4.39Å; L907-E910 PolarHBondContact N-OE2 2.61Å; L907-E910 VanDerWaalsContact N-OE2 3.08Å; L907-E910 WeakPolarHBondContact O-CB 3.5Å; L907-E910 PolarHBondContact O-N 2.81Å; L907-A911 PolarHBondContact O-N 3.2Å
908	A	96	Very high	87.9	Confident	2 Å²	2	54.7 Å²	54.7	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-50.2	-37.1	177.1	0	0	0	0	0	114	A912 L963 H968 V970	A908-A912 WeakPolarHBondContact O-CB 3.48Å; A908-A912 PolarHBondContact O-N 3.4Å; A908-L963 HydrophobicContact CB-CD1 4.19Å; A908-H968 HydrophobicContact CB-CB 4.33Å; A908-H968 PolarHBondContact N-ND1 3.07Å; A908-V970 HydrophobicContact CB-CG2 3.72Å
909	N	96.4	Very high	89.2	Confident	23 Å²	23	48.8 Å²	48.8	12%	0.123	24%	0.237	C	C	.	.	H	α-helix	trans	-75.1	-30.5	177.8	65	-9.8	0	0	0	113.9	L907 R913 M958 V961	L907-N909 VanDerWaalsContact CB-OD1 3.22Å; L907-N909 WeakPolarHBondContact CB-OD1 3.38Å; L907-N909 PolarHBondContact O-N 3.41Å; L907-N909 VanDerWaalsContact O-N 3.11Å; N909-R913 WeakPolarHBondContact O-CG 3.48Å; N909-R913 PolarHBondContact O-N 3.45Å; N909-R913 VanDerWaalsContact O-N 3.07Å; N909-R913 PolarHBondContact O-NE 2.95Å; N909-M958 WeakPolarHBondContact CA-O 3.42Å; N909-M958 VanDerWaalsContact CB-O 3.25Å; N909-M958 WeakPolarHBondContact CB-O 3.44Å; N909-V961 VanDerWaalsContact CB-O 3.24Å; N909-V961 WeakPolarHBondContact CB-O 3.48Å; N909-V961 PolarHBondContact ND2-O 2.77Å; N909-V961 VanDerWaalsContact ND2-O 3.16Å
910	E	94.9	Very high	90	Very high	45 Å²	45	48 Å²	48	21%	0.21	23%	0.231	C	C	.	.	H	α-helix	trans	-68.3	-44.4	170.4	-67.6	-178	131	0	0	110.2	R904 M906 L907 A912 R913 I914	R904-E910 IonicContact NH2-OE1 3.02Å; R904-E910 PolarHBondContact NH2-OE1 3.47Å; M906-E910 HydrophobicContact CG-CB 4.1Å; L907-E910 HydrophobicContact CB-CG 4.39Å; L907-E910 PolarHBondContact N-OE2 2.61Å; L907-E910 VanDerWaalsContact N-OE2 3.08Å; L907-E910 WeakPolarHBondContact O-CB 3.5Å; L907-E910 PolarHBondContact O-N 2.81Å; E910-A912 PolarHBondContact O-N 3.21Å; E910-R913 WeakPolarHBondContact O-CB 3.35Å; E910-R913 PolarHBondContact O-N 3.38Å; E910-I914 WeakPolarHBondContact O-CG1 3.32Å; E910-I914 PolarHBondContact O-N 3.2Å
911	A	95.9	Very high	91.1	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-60.1	-45.5	174.9	0	0	0	0	0	111.9	I851 L881 M906 L907 R913 I914 L915 V970	I851-A911 HydrophobicContact CD1-CB 4.11Å; L881-A911 HydrophobicContact CD1-CB 4.13Å; L881-A911 HydrophobicContact CD2-CB 3.46Å; L881-A911 VanDerWaalsContact CD2-CB 3.46Å; L881-A911 HydrophobicContact CG-CB 4.43Å; M906-A911 HydrophobicContact CG-CB 4.19Å; M906-A911 HydrophobicContact SD-CB 3.72Å; L907-A911 PolarHBondContact O-N 3.2Å; A911-R913 VanDerWaalsContact C-N 3.31Å; A911-R913 PolarHBondContact O-N 2.93Å; A911-I914 PolarHBondContact O-N 3.13Å; A911-L915 WeakPolarHBondContact O-CG 3.28Å; A911-L915 PolarHBondContact O-N 3.26Å; A911-V970 HydrophobicContact CB-CG2 4.27Å
912	A	96.8	Very high	91.9	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-59.9	-40.4	174.9	0	0	0	0	0	112	A908 E910 L915 M916 L955 M958 C959	A908-A912 WeakPolarHBondContact O-CB 3.48Å; A908-A912 PolarHBondContact O-N 3.4Å; E910-A912 PolarHBondContact O-N 3.21Å; A912-L915 PolarHBondContact O-N 2.99Å; A912-M916 WeakPolarHBondContact O-CB 3.06Å; A912-M916 WeakPolarHBondContact O-CG 3.38Å; A912-M916 PolarHBondContact O-N 3.01Å; A912-L955 HydrophobicContact CB-CD1 4.07Å; A912-M958 HydrophobicContact CB-CB 3.95Å; A912-M958 HydrophobicContact CB-CG 3.86Å; A912-C959 VanDerWaalsContact C-SG 3.56Å
913	R	96	Very high	92.5	Very high	115 Å²	115	47.2 Å²	47.2	43%	0.434	21%	0.209	S	C	.	.	H	α-helix	trans	-63.1	-42.9	174.8	-79.4	-179.9	-76.3	-172.6	-0.7	112.5	N909 E910 A911 L915 M916 D917 C959	N909-R913 WeakPolarHBondContact O-CG 3.48Å; N909-R913 PolarHBondContact O-N 3.45Å; N909-R913 VanDerWaalsContact O-N 3.07Å; N909-R913 PolarHBondContact O-NE 2.95Å; E910-R913 WeakPolarHBondContact O-CB 3.35Å; E910-R913 PolarHBondContact O-N 3.38Å; A911-R913 VanDerWaalsContact C-N 3.31Å; A911-R913 PolarHBondContact O-N 2.93Å; R913-L915 VanDerWaalsContact C-N 3.33Å; R913-L915 PolarHBondContact O-N 2.84Å; R913-M916 PolarHBondContact O-N 2.82Å; R913-D917 WeakPolarHBondContact O-CB 3.49Å; R913-D917 PolarHBondContact O-N 3.47Å; R913-C959 HydrophobicContact CG-CB 3.75Å
914	I	95.3	Very high	93	Very high	18 Å²	18	50.9 Å²	50.9	9%	0.092	22%	0.216	C	C	.	.	H	α-helix	trans	-57.8	-47.8	174.6	-71.4	170.5	0	0	0	110.4	I851 W854 F863 M906 E910 A911 M916 D917 I918	I851-I914 HydrophobicContact CG2-CD1 4.21Å; I851-I914 HydrophobicContact CG2-CG2 4.13Å; W854-I914 HydrophobicContact CD2-CG1 4.42Å; W854-I914 HydrophobicContact CD2-CG2 4.35Å; W854-I914 HydrophobicContact CE3-CG1 4.48Å; W854-I914 HydrophobicContact CH2-CG2 4.04Å; W854-I914 WeakPolarHBondContact CH2-O 3.43Å; W854-I914 HydrophobicContact CZ2-CG2 3.66Å; F863-I914 HydrophobicContact CE2-CG2 4.35Å; F863-I914 HydrophobicContact CZ-CG2 3.92Å; M906-I914 HydrophobicContact CE-CD1 3.57Å; M906-I914 HydrophobicContact SD-CD1 4.05Å; E910-I914 WeakPolarHBondContact O-CG1 3.32Å; E910-I914 PolarHBondContact O-N 3.2Å; A911-I914 PolarHBondContact O-N 3.13Å; I914-M916 PolarHBondContact O-N 2.96Å; I914-D917 PolarHBondContact O-N 3.03Å; I914-I918 HydrophobicContact CG2-CD1 4.23Å; I914-I918 WeakPolarHBondContact O-CG1 3.42Å; I914-I918 PolarHBondContact O-N 3.11Å
915	L	95.8	Very high	93.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-41.2	177.9	-65.2	176.3	0	0	0	112.3	I851 F863 F864 I867 A911 A912 R913 I918 W919 L931 L955 I972	I851-L915 HydrophobicContact CD1-CD1 4.1Å; I851-L915 HydrophobicContact CD1-CD2 4.3Å; I851-L915 HydrophobicContact CD1-CG 4.24Å; F863-L915 HydrophobicContact CD2-CD2 4.4Å; F863-L915 HydrophobicContact CE2-CD2 3.95Å; F864-L915 HydrophobicContact CD2-CD2 3.77Å; F864-L915 HydrophobicContact CE2-CD2 4.3Å; I867-L915 HydrophobicContact CD1-CD1 4.36Å; I867-L915 HydrophobicContact CD1-CD2 3.62Å; A911-L915 WeakPolarHBondContact O-CG 3.28Å; A911-L915 PolarHBondContact O-N 3.26Å; A912-L915 PolarHBondContact O-N 2.99Å; R913-L915 VanDerWaalsContact C-N 3.33Å; R913-L915 PolarHBondContact O-N 2.84Å; L915-I918 PolarHBondContact O-N 3.31Å; L915-W919 WeakPolarHBondContact O-CB 3.24Å; L915-W919 PolarHBondContact O-N 2.91Å; L915-L931 HydrophobicContact CB-CD2 4.37Å; L915-L955 HydrophobicContact CB-CD1 4.29Å; L915-L955 HydrophobicContact CB-CD2 4.3Å; L915-L955 HydrophobicContact CD1-CD1 4.17Å; L915-I972 HydrophobicContact CD1-CD1 3.86Å; L915-I972 HydrophobicContact CD1-CG1 4.46Å
916	M	94.4	Very high	93	Very high	27 Å²	27	52.9 Å²	52.9	13%	0.133	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-40.3	176.1	-77.6	-63.2	-62.8	0	0	112.6	A912 R913 I914 W919 E920 L955 K956 C959	A912-M916 WeakPolarHBondContact O-CB 3.06Å; A912-M916 WeakPolarHBondContact O-CG 3.38Å; A912-M916 PolarHBondContact O-N 3.01Å; R913-M916 PolarHBondContact O-N 2.82Å; I914-M916 PolarHBondContact O-N 2.96Å; M916-W919 HydrophobicContact CE-CE3 3.98Å; M916-W919 HydrophobicContact CE-CZ3 4.06Å; M916-W919 WeakPolarHBondContact O-CB 3.22Å; M916-W919 PolarHBondContact O-N 3.3Å; M916-W919 HydrophobicContact SD-CE3 4.48Å; M916-E920 WeakPolarHBondContact O-CB 3.32Å; M916-E920 PolarHBondContact O-N 2.98Å; M916-L955 HydrophobicContact CG-CD2 4.25Å; M916-L955 HydrophobicContact CG-CG 4Å; M916-L955 HydrophobicContact SD-CB 4.41Å; M916-L955 HydrophobicContact SD-CD2 3.79Å; M916-L955 HydrophobicContact SD-CG 3.84Å; M916-K956 HydrophobicContact CE-CB 4.3Å; M916-K956 HydrophobicContact CE-CG 4.39Å; M916-C959 VanDerWaalsContact CG-SG 3.58Å
917	D	93.2	Very high	92.5	Very high	76 Å²	76	56.7 Å²	56.7	41%	0.406	27%	0.27	S	S	.	.	H	α-helix	trans	-67.4	-38.2	177	-79.8	-3.7	0	0	0	111.8	W854 R913 I914 R921	W854-D917 HydrophobicContact CH2-CB 3.64Å; W854-D917 HydrophobicContact CZ3-CB 3.64Å; R913-D917 WeakPolarHBondContact O-CB 3.49Å; R913-D917 PolarHBondContact O-N 3.47Å; I914-D917 PolarHBondContact O-N 3.03Å; D917-R921 WeakPolarHBondContact O-CB 3.25Å; D917-R921 VanDerWaalsContact O-CG 3.27Å; D917-R921 WeakPolarHBondContact O-CG 3.16Å; D917-R921 PolarHBondContact O-N 2.83Å; D917-R921 PolarHBondContact O-NE 3.16Å
918	I	92.7	Very high	91.8	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-48.1	172.8	-64.3	170.8	0	0	0	109.7	W854 E861 F863 F864 I914 L915 E920 R921 R922	W854-I918 HydrophobicContact CH2-CD1 4.46Å; W854-I918 HydrophobicContact CH2-CG1 3.71Å; W854-I918 HydrophobicContact CZ2-CD1 3.79Å; W854-I918 HydrophobicContact CZ2-CG1 3.42Å; W854-I918 VanDerWaalsContact CZ2-CG1 3.42Å; E861-I918 HydrophobicContact CB-CD1 4.13Å; E861-I918 HydrophobicContact CB-CG1 4.5Å; E861-I918 HydrophobicContact CB-CG2 4.43Å; E861-I918 HydrophobicContact CG-CD1 3.98Å; E861-I918 HydrophobicContact CG-CG1 3.92Å; E861-I918 HydrophobicContact CG-CG2 4.33Å; E861-I918 WeakPolarHBondContact OE2-CG2 3.31Å; F863-I918 HydrophobicContact CE2-CD1 3.87Å; F863-I918 HydrophobicContact CZ-CD1 3.87Å; F864-I918 HydrophobicContact CB-CD1 4.04Å; F864-I918 HydrophobicContact CB-CG2 4.08Å; F864-I918 HydrophobicContact CD1-CG2 3.9Å; F864-I918 HydrophobicContact CD2-CB 3.74Å; F864-I918 HydrophobicContact CD2-CD1 3.88Å; F864-I918 HydrophobicContact CD2-CG1 4.41Å; F864-I918 HydrophobicContact CD2-CG2 3.47Å; F864-I918 VanDerWaalsContact CD2-CG2 3.47Å; F864-I918 HydrophobicContact CE1-CG2 4.18Å; F864-I918 HydrophobicContact CE2-CB 3.89Å; F864-I918 HydrophobicContact CE2-CG2 3.75Å; F864-I918 HydrophobicContact CG-CB 4.31Å; F864-I918 HydrophobicContact CG-CD1 4.28Å; F864-I918 HydrophobicContact CG-CG2 3.55Å; F864-I918 HydrophobicContact CZ-CG2 4.1Å; I914-I918 HydrophobicContact CG2-CD1 4.23Å; I914-I918 WeakPolarHBondContact O-CG1 3.42Å; I914-I918 PolarHBondContact O-N 3.11Å; L915-I918 PolarHBondContact O-N 3.31Å; I918-E920 VanDerWaalsContact C-N 3.35Å; I918-E920 PolarHBondContact O-N 3.01Å; I918-R921 PolarHBondContact O-N 2.85Å; I918-R922 HydrophobicContact CG2-CG 4.25Å; I918-R922 WeakPolarHBondContact O-CB 3.3Å; I918-R922 WeakPolarHBondContact O-CG 3.48Å; I918-R922 PolarHBondContact O-N 3.08Å
919	W	93.5	Very high	91.4	Very high	32 Å²	32	62 Å²	62	12%	0.121	31%	0.305	C	S	.	.	H	α-helix	trans	-56.7	-47.5	178.5	173.9	81.1	0	0	0	111.8	F864 L915 M916 R922 R923 T929 L931	F864-W919 HydrophobicContact CE2-CB 4.48Å; F864-W919 HydrophobicContact CZ-CB 4.29Å; L915-W919 WeakPolarHBondContact O-CB 3.24Å; L915-W919 PolarHBondContact O-N 2.91Å; M916-W919 HydrophobicContact CE-CE3 3.98Å; M916-W919 HydrophobicContact CE-CZ3 4.06Å; M916-W919 WeakPolarHBondContact O-CB 3.22Å; M916-W919 PolarHBondContact O-N 3.3Å; M916-W919 HydrophobicContact SD-CE3 4.48Å; W919-R922 PolarHBondContact O-N 2.95Å; W919-R923 VanDerWaalsContact O-CB 3.26Å; W919-R923 WeakPolarHBondContact O-CB 3.36Å; W919-R923 PolarHBondContact O-N 2.91Å; W919-T929 PolarHBondContact NE1-OG1 3.41Å; W919-L931 PolarHBondContact NE1-O 3.03Å
920	E	91.5	Very high	91.1	Very high	82 Å²	82	63.8 Å²	63.8	38%	0.383	32%	0.317	S	S	.	.	H	α-helix	trans	-66.6	-39.9	179.8	-167.8	179.6	169.3	0	0	111.9	M916 I918 R923 K924	M916-E920 WeakPolarHBondContact O-CB 3.32Å; M916-E920 PolarHBondContact O-N 2.98Å; I918-E920 VanDerWaalsContact C-N 3.35Å; I918-E920 PolarHBondContact O-N 3.01Å; E920-R923 PolarHBondContact O-N 3.07Å; E920-K924 HydrophobicContact CG-CD 4.36Å; E920-K924 WeakPolarHBondContact O-CB 3.31Å; E920-K924 WeakPolarHBondContact O-CG 3.18Å; E920-K924 PolarHBondContact O-N 3.01Å; E920-K924 WeakPolarHBondContact OE1-CE 3.25Å; E920-K924 IonicContact OE1-NZ 2.71Å; E920-K924 PolarHBondContact OE1-NZ 2.78Å
921	R	90.8	Very high	91	Very high	88 Å²	88	61.6 Å²	61.6	33%	0.332	31%	0.307	S	S	.	.	H	α-helix	trans	-63.4	-47.7	175.3	-77	-171.8	-75.3	141	0.1	111.8	E861 D917 I918 R923 K924 M925	E861-R921 IonicContact OE1-CZ 3.02Å; E861-R921 IonicContact OE1-NE 2.93Å; E861-R921 IonicContact OE1-NH1 3.98Å; E861-R921 PolarHBondContact OE1-NH1 3.19Å; E861-R921 IonicContact OE1-NH2 2.66Å; E861-R921 PolarHBondContact OE1-NH2 3.47Å; D917-R921 WeakPolarHBondContact O-CB 3.25Å; D917-R921 VanDerWaalsContact O-CG 3.27Å; D917-R921 WeakPolarHBondContact O-CG 3.16Å; D917-R921 PolarHBondContact O-N 2.83Å; D917-R921 PolarHBondContact O-NE 3.16Å; I918-R921 PolarHBondContact O-N 2.85Å; R921-R923 PolarHBondContact O-N 3.17Å; R921-K924 PolarHBondContact O-N 3.38Å; R921-M925 WeakPolarHBondContact O-CG 3.46Å; R921-M925 PolarHBondContact O-N 2.77Å
922	R	91.1	Very high	90.9	Very high	40 Å²	40	66.6 Å²	66.6	15%	0.151	33%	0.33	C	S	.	.	H	α-helix	trans	-63.6	-40.3	177.5	-71.4	-174.5	177.3	-152	0.8	112.1	E861 D865 I918 W919 M925 G926 N927 T929	E861-R922 IonicContact OE2-NE 2.67Å; E861-R922 PolarHBondContact OE2-NE 2.87Å; E861-R922 IonicContact OE2-NH2 3.08Å; D865-R922 IonicContact OD1-CZ 2.88Å; D865-R922 IonicContact OD1-NH1 3.5Å; D865-R922 PolarHBondContact OD1-NH1 3.03Å; D865-R922 IonicContact OD1-NH2 3.93Å; D865-R922 PolarHBondContact OD1-NH2 3.42Å; D865-R922 IonicContact OD2-NH2 3.63Å; I918-R922 HydrophobicContact CG2-CG 4.25Å; I918-R922 WeakPolarHBondContact O-CB 3.3Å; I918-R922 WeakPolarHBondContact O-CG 3.48Å; I918-R922 PolarHBondContact O-N 3.08Å; W919-R922 PolarHBondContact O-N 2.95Å; R922-M925 PolarHBondContact O-N 3.3Å; R922-G926 PolarHBondContact O-N 2.78Å; R922-N927 HydrophobicContact CB-CB 4.27Å; R922-N927 PolarHBondContact O-N 3.16Å; R922-T929 HydrophobicContact CB-CG2 3.93Å
923	R	87.3	Confident	90.7	Very high	163 Å²	163	68 Å²	68	62%	0.615	34%	0.34	S	S	*	.	H	α-helix	trans	-60.6	-45.2	173.8	-179	-177.2	164.8	-173.5	-3.4	112.1	W919 E920 R921 M925 G926	W919-R923 VanDerWaalsContact O-CB 3.26Å; W919-R923 WeakPolarHBondContact O-CB 3.36Å; W919-R923 PolarHBondContact O-N 2.91Å; E920-R923 PolarHBondContact O-N 3.07Å; R921-R923 PolarHBondContact O-N 3.17Å; R923-M925 VanDerWaalsContact C-N 3.27Å; R923-M925 PolarHBondContact O-N 2.88Å; R923-G926 PolarHBondContact O-N 3.46Å; R923-G926 VanDerWaalsContact O-N 3.09Å
924	K	89.5	Confident	90.6	Very high	155 Å²	155	66.9 Å²	66.9	67%	0.674	35%	0.346	S	S	*	.	H	α-helix	trans	-64.2	-31.1	176.7	-75.8	173.3	-176.6	165.9	0	112.7	E920 R921 G926	E920-K924 HydrophobicContact CG-CD 4.36Å; E920-K924 WeakPolarHBondContact O-CB 3.31Å; E920-K924 WeakPolarHBondContact O-CG 3.18Å; E920-K924 PolarHBondContact O-N 3.01Å; E920-K924 WeakPolarHBondContact OE1-CE 3.25Å; E920-K924 IonicContact OE1-NZ 2.71Å; E920-K924 PolarHBondContact OE1-NZ 2.78Å; R921-K924 PolarHBondContact O-N 3.38Å; K924-G926 PolarHBondContact O-N 2.9Å
925	M	88.7	Confident	90.6	Very high	142 Å²	142	67.1 Å²	67.1	70%	0.7	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.3	174.2	-68.3	177.7	66.9	0	0	113.8	R921 R922 R923	R921-M925 WeakPolarHBondContact O-CG 3.46Å; R921-M925 PolarHBondContact O-N 2.77Å; R922-M925 PolarHBondContact O-N 3.3Å; R923-M925 VanDerWaalsContact C-N 3.27Å; R923-M925 PolarHBondContact O-N 2.88Å
926	G	85.4	Confident	90.6	Very high	59 Å²	59	70.3 Å²	70.3	61%	0.608	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	13.4	-177.7	0	0	0	0	0	114.6	R922 R923 K924 P928	R922-G926 PolarHBondContact O-N 2.78Å; R923-G926 PolarHBondContact O-N 3.46Å; R923-G926 VanDerWaalsContact O-N 3.09Å; K924-G926 PolarHBondContact O-N 2.9Å; G926-P928 WeakPolarHBondContact O-CD 3.21Å
927	N	82.1	Confident	90.7	Very high	83 Å²	83	69 Å²	69	44%	0.444	35%	0.354	S	S	.	.			trans	-87.8	114.1	175.2	-73.2	-17.3	0	0	0	109.9	R922	R922-N927 HydrophobicContact CB-CB 4.27Å; R922-N927 PolarHBondContact O-N 3.16Å
928	P	80.4	Confident	90.9	Very high	126 Å²	126	65.4 Å²	65.4	82%	0.818	34%	0.335	S	S	*	.			trans	-66.2	135.8	176.6	26.6	-32.4	0	0	0	110.6	G926	G926-P928 WeakPolarHBondContact O-CD 3.21Å
929	T	88.4	Confident	91.1	Very high	25 Å²	25	65.4 Å²	65.4	15%	0.153	34%	0.335	C	S	.	.			trans	-117.4	141.9	178.1	43.2	0	0	0	0	109.3	F864 W919 R922 L931	F864-T929 HydrophobicContact CE1-CG2 3.86Å; F864-T929 HydrophobicContact CZ-CG2 4.22Å; W919-T929 PolarHBondContact NE1-OG1 3.41Å; R922-T929 HydrophobicContact CB-CG2 3.93Å; T929-L931 PolarHBondContact OG1-O 2.95Å
930	V	90.1	Very high	91.3	Very high	61 Å²	61	63.9 Å²	63.9	37%	0.37	33%	0.329	S	S	.	.	S	Bend	trans	-80.5	-35.3	175.9	179	0	0	0	0	110.3	E868 L871 K872 Q932	E868-V930 VanDerWaalsContact CD-N 3.28Å; E868-V930 PolarHBondContact OE1-N 3.1Å; E868-V930 WeakPolarHBondContact OE2-CB 3.36Å; E868-V930 WeakPolarHBondContact OE2-CG2 3.31Å; E868-V930 PolarHBondContact OE2-N 3.08Å; L871-V930 HydrophobicContact CB-CG1 3.85Å; K872-V930 HydrophobicContact CD-CG2 4.13Å; K872-V930 HydrophobicContact CG-CB 4.32Å; K872-V930 HydrophobicContact CG-CG1 4.32Å; K872-V930 HydrophobicContact CG-CG2 3.62Å; V930-Q932 PolarHBondContact O-N 3.33Å
931	L	93.2	Very high	91.5	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	-63.1	128.1	165.5	-170.2	76.4	0	0	0	108.9	F864 I867 E868 L871 L915 W919 T929 T935 L955 I972	F864-L931 HydrophobicContact CD2-CD2 4.33Å; F864-L931 HydrophobicContact CE2-CD2 3.35Å; F864-L931 HydrophobicContact CZ-CB 4.05Å; F864-L931 HydrophobicContact CZ-CD2 3.57Å; F864-L931 HydrophobicContact CZ-CG 4.45Å; I867-L931 HydrophobicContact CG2-CD1 4.41Å; E868-L931 WeakPolarHBondContact OE1-CB 3.08Å; E868-L931 PolarHBondContact OE1-N 2.77Å; L871-L931 HydrophobicContact CD1-CB 3.96Å; L871-L931 HydrophobicContact CD1-CD1 3.64Å; L871-L931 HydrophobicContact CD1-CG 4.44Å; L915-L931 HydrophobicContact CB-CD2 4.37Å; W919-L931 PolarHBondContact NE1-O 3.03Å; T929-L931 PolarHBondContact OG1-O 2.95Å; L931-T935 HydrophobicContact CD1-CG2 3.97Å; L931-L955 HydrophobicContact CD1-CD2 4.14Å; L931-L955 HydrophobicContact CD2-CD2 3.64Å; L931-L955 HydrophobicContact CG-CD2 3.89Å; L931-I972 HydrophobicContact CD1-CG2 3.83Å
932	Q	92.9	Very high	91.5	Very high	106 Å²	106	56.5 Å²	56.5	50%	0.495	30%	0.298	S	S	.	.			trans	-118.6	160.2	176.6	-62.8	-174	-18.5	0	0	109.8	V930 T934 T935	V930-Q932 PolarHBondContact O-N 3.33Å; Q932-T934 PolarHBondContact O-N 3.36Å; Q932-T934 VanDerWaalsContact O-N 3.16Å; Q932-T934 PolarHBondContact OE1-OG1 3.27Å; Q932-T935 PolarHBondContact N-OG1 2.89Å; Q932-T935 VanDerWaalsContact O-CB 3.31Å; Q932-T935 WeakPolarHBondContact O-CB 3.22Å; Q932-T935 PolarHBondContact O-N 3.16Å; Q932-T935 PolarHBondContact O-OG1 3.19Å
933	S	91.7	Very high	91.6	Very high	29 Å²	29	55.5 Å²	55.5	20%	0.203	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.8	173.2	57.1	0	0	0	0	113.1	L955 K956	S933-L955 PolarHBondContact O-N 3.07Å; S933-K956 WeakPolarHBondContact O-CB 3.47Å; S933-K956 PolarHBondContact O-N 2.94Å
934	T	93.9	Very high	91.6	Very high	93 Å²	93	49.6 Å²	49.6	57%	0.571	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-8.7	176.3	48.1	0	0	0	0	113.7	Q932 R936	Q932-T934 PolarHBondContact O-N 3.36Å; Q932-T934 VanDerWaalsContact O-N 3.16Å; Q932-T934 PolarHBondContact OE1-OG1 3.27Å; T934-R936 PolarHBondContact O-N 2.67Å
935	T	95.7	Very high	91.6	Very high	23 Å²	23	43.9 Å²	43.9	14%	0.141	26%	0.259	C	S	.	.			trans	-58.6	130.2	179.2	-60.5	0	0	0	0	109.5	L931 Q932 S954 L955 I972	L931-T935 HydrophobicContact CD1-CG2 3.97Å; Q932-T935 PolarHBondContact N-OG1 2.89Å; Q932-T935 VanDerWaalsContact O-CB 3.31Å; Q932-T935 WeakPolarHBondContact O-CB 3.22Å; Q932-T935 PolarHBondContact O-N 3.16Å; Q932-T935 PolarHBondContact O-OG1 3.19Å; T935-S954 CarbonylContact O-C 3.6Å; T935-L955 PolarHBondContact O-N 3Å; T935-I972 HydrophobicContact CG2-CG2 4.11Å
936	R	95.9	Very high	91.6	Very high	66 Å²	66	47 Å²	47	25%	0.249	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	139.7	177.7	-65.3	-173.6	-54.9	-176.1	-1.5	110.2	T934 V973 T976 D981	T934-R936 PolarHBondContact O-N 2.67Å; R936-V973 HydrophobicContact CB-CB 4.06Å; R936-V973 HydrophobicContact CB-CG2 4.1Å; R936-V973 WeakPolarHBondContact O-CB 3.35Å; R936-V973 WeakPolarHBondContact O-CG2 3.38Å; R936-V973 PolarHBondContact O-N 3.39Å; R936-T976 VanDerWaalsContact NH2-CG2 3.27Å; R936-T976 PolarHBondContact NH2-OG1 3.49Å; R936-D981 IonicContact CZ-OD1 3.59Å; R936-D981 IonicContact NH1-OD1 2.77Å; R936-D981 PolarHBondContact NH1-OD1 3.48Å; R936-D981 IonicContact NH2-OD1 3.36Å; R936-D981 PolarHBondContact NH2-OD1 3.23Å
937	C	96.5	Very high	91.8	Very high	1 Å²	1	47 Å²	47	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	149.5	171.2	66	0	0	0	0	109.8	C952 R953 M958 V970 A971 I972	C937-C952 WeakPolarHBondContact O-CA 3.49Å; C937-R953 PolarHBondContact N-O 3.19Å; C937-R953 PolarHBondContact O-N 3.49Å; C937-R953 PolarHBondContact SG-O 3.2Å; C937-M958 WeakPolarHBondContact O-CE 3.47Å; C937-M958 WeakPolarHBondContact SG-CB 3.4Å; C937-V970 HydrophobicContact CB-CG1 4.35Å; C937-A971 CarbonylContact C-O 3.58Å; C937-A971 VanDerWaalsContact CA-O 3.24Å; C937-A971 WeakPolarHBondContact CA-O 3.36Å; C937-I972 HydrophobicContact CB-CD1 3.78Å
938	V	97.9	Very high	92.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122	175.9	-168.3	0	0	0	0	108.1	C838 L940 I950 V951 C952 V970 A971 V973 L984	C838-V938 HydrophobicContact CB-CB 4.5Å; C838-V938 HydrophobicContact CB-CG1 3.85Å; V938-L940 HydrophobicContact CB-CD1 4.14Å; V938-L940 HydrophobicContact CG1-CD1 3.93Å; V938-L940 HydrophobicContact CG1-CG 4.02Å; V938-L940 WeakPolarHBondContact O-CD1 3.33Å; V938-I950 HydrophobicContact CG1-CG2 3.46Å; V938-I950 VanDerWaalsContact CG1-CG2 3.46Å; V938-V951 CarbonylContact C-O 3.58Å; V938-V951 WeakPolarHBondContact CA-O 3.33Å; V938-C952 HydrophobicContact CG2-CB 4.42Å; V938-V970 CarbonylContact O-C 3.59Å; V938-V970 WeakPolarHBondContact O-CA 3.44Å; V938-A971 HydrophobicContact CB-CB 4.28Å; V938-A971 PolarHBondContact N-O 2.93Å; V938-A971 PolarHBondContact O-N 2.77Å; V938-V973 HydrophobicContact CG2-CG2 4.06Å; V938-L984 HydrophobicContact CG2-CD2 3.49Å; V938-L984 VanDerWaalsContact CG2-CD2 3.49Å
939	G	97.6	Very high	93	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.9	167.3	0	0	0	0	0	108.3	I950 V951 L963	G939-I950 WeakPolarHBondContact O-CA 3.35Å; G939-V951 PolarHBondContact N-O 3.2Å; G939-V951 PolarHBondContact O-N 3.07Å; G939-L963 VanDerWaalsContact C-CD1 3.45Å; G939-L963 WeakPolarHBondContact O-CD1 3.43Å
940	L	96.8	Very high	93.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	135.5	177.4	-53.8	93	0	0	0	108.9	I835 C838 V938 I943 Q949 I950 H968 S969 A971	I835-L940 HydrophobicContact CD1-CD1 3.5Å; I835-L940 HydrophobicContact CD1-CD2 3.65Å; I835-L940 HydrophobicContact CD1-CG 4.18Å; C838-L940 HydrophobicContact CB-CD2 3.85Å; V938-L940 HydrophobicContact CB-CD1 4.14Å; V938-L940 HydrophobicContact CG1-CD1 3.93Å; V938-L940 HydrophobicContact CG1-CG 4.02Å; V938-L940 WeakPolarHBondContact O-CD1 3.33Å; L940-I943 HydrophobicContact CB-CD1 3.8Å; L940-I943 HydrophobicContact CB-CG1 3.9Å; L940-I943 HydrophobicContact CD2-CD1 3.75Å; L940-I943 HydrophobicContact CD2-CG1 4.13Å; L940-I943 HydrophobicContact CG-CD1 4.35Å; L940-Q949 CarbonylContact C-O 3.46Å; L940-Q949 WeakPolarHBondContact CA-O 3.47Å; L940-I950 HydrophobicContact CD2-CD1 4.27Å; L940-I950 HydrophobicContact CD2-CG1 4.24Å; L940-I950 HydrophobicContact CD2-CG2 4.48Å; L940-I950 HydrophobicContact CG-CG1 4.49Å; L940-I950 HydrophobicContact CG-CG2 4.38Å; L940-H968 CarbonylContact O-C 3.49Å; L940-H968 WeakPolarHBondContact O-CA 3.45Å; L940-S969 PolarHBondContact N-O 2.68Å; L940-S969 PolarHBondContact O-N 3.04Å; L940-A971 HydrophobicContact CD1-CB 4.32Å
941	A	94.6	Very high	93.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	134.3	175.2	0	0	0	0	0	109.9	I943 Q948 Q949 L963 L967 H968	A941-I943 PolarHBondContact O-N 2.88Å; A941-Q948 WeakPolarHBondContact O-CA 3.06Å; A941-Q949 HydrophobicContact CB-CB 4.43Å; A941-Q949 PolarHBondContact N-O 3.44Å; A941-Q949 PolarHBondContact O-N 2.96Å; A941-L963 HydrophobicContact CB-CB 3.74Å; A941-L963 HydrophobicContact CB-CD1 4.31Å; A941-L967 CarbonylContact C-O 3.54Å; A941-L967 WeakPolarHBondContact CA-O 3.25Å; A941-H968 WeakPolarHBondContact CB-CD2 3.41Å; A941-H968 WeakPolarHBondContact CB-NE2 3.33Å
942	R	92.5	Very high	94	Very high	15 Å²	15	43 Å²	43	6%	0.057	23%	0.226	C	C	.	.	S	Bend	trans	55.4	51	169.7	-56.8	171.2	-58.1	-81.6	-4.6	112.4	G944 W945 S947 Q948 L963 P965 L967	R942-G944 PolarHBondContact O-N 3.33Å; R942-W945 HydrophobicContact CB-CB 4.03Å; R942-W945 HydrophobicContact CB-CD2 3.78Å; R942-W945 HydrophobicContact CB-CE3 3.59Å; R942-W945 HydrophobicContact CB-CG 3.99Å; R942-W945 HydrophobicContact CB-CZ3 4.28Å; R942-W945 HydrophobicContact CG-CD2 4.24Å; R942-W945 HydrophobicContact CG-CE3 3.59Å; R942-W945 HydrophobicContact CG-CZ3 3.8Å; R942-W945 WeakPolarHBondContact O-CB 3.47Å; R942-W945 PolarHBondContact O-N 3.04Å; R942-S947 VanDerWaalsContact CD-OG 3.32Å; R942-S947 WeakPolarHBondContact CD-OG 3.39Å; R942-S947 VanDerWaalsContact CZ-O 3.27Å; R942-S947 PolarHBondContact NE-O 2.96Å; R942-S947 PolarHBondContact NE-OG 3.41Å; R942-S947 PolarHBondContact NH2-O 3.41Å; R942-Q948 WeakPolarHBondContact O-CA 3.34Å; R942-Q948 WeakPolarHBondContact O-CB 3.49Å; R942-L963 PolarHBondContact NH1-O 3.46Å; R942-L963 PolarHBondContact NH2-O 3.01Å; R942-L963 VanDerWaalsContact NH2-O 3.09Å; R942-P965 PolarHBondContact NH1-O 2.89Å; R942-L967 PolarHBondContact N-O 3.44Å
943	I	91.8	Very high	94.2	Very high	18 Å²	18	42.3 Å²	42.3	9%	0.092	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	129.6	-178.3	-60.2	168.4	0	0	0	109.9	L708 V831 A834 I835 L940 A941 W945	L708-I943 HydrophobicContact CD1-CG2 4.49Å; V831-I943 HydrophobicContact CG2-CD1 4.12Å; A834-I943 HydrophobicContact CB-CG2 3.71Å; I835-I943 HydrophobicContact CD1-CD1 4.24Å; L940-I943 HydrophobicContact CB-CD1 3.8Å; L940-I943 HydrophobicContact CB-CG1 3.9Å; L940-I943 HydrophobicContact CD2-CD1 3.75Å; L940-I943 HydrophobicContact CD2-CG1 4.13Å; L940-I943 HydrophobicContact CG-CD1 4.35Å; A941-I943 PolarHBondContact O-N 2.88Å; I943-W945 VanDerWaalsContact C-N 3.3Å
944	G	88.5	Confident	94.4	Very high	39 Å²	39	42.1 Å²	42.1	40%	0.402	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	-9.5	-176.7	0	0	0	0	0	114.6	R942	R942-G944 PolarHBondContact O-N 3.33Å
945	W	89.5	Confident	94.5	Very high	35 Å²	35	37.8 Å²	37.8	13%	0.133	19%	0.191	C	C	.	.	S	Bend	trans	-89.8	158.7	179.3	-57.1	6.6	0	0	0	110.7	L708 L736 L737 P738 R942 I943 S947 Q948	L708-W945 PolarHBondContact O-NE1 3.23Å; L736-W945 HydrophobicContact CB-CH2 4.48Å; L736-W945 WeakPolarHBondContact O-CZ2 3.46Å; L737-W945 WeakPolarHBondContact O-CH2 3.46Å; P738-W945 VanDerWaalsContact CA-CH2 3.47Å; P738-W945 VanDerWaalsContact CA-CZ3 3.49Å; P738-W945 HydrophobicContact CB-CD2 4.04Å; P738-W945 HydrophobicContact CB-CE3 4.05Å; P738-W945 HydrophobicContact CB-CH2 4.48Å; P738-W945 HydrophobicContact CB-CZ2 4.44Å; P738-W945 HydrophobicContact CB-CZ3 4.3Å; P738-W945 HydrophobicContact CG-CD2 3.77Å; P738-W945 HydrophobicContact CG-CE3 4.28Å; P738-W945 HydrophobicContact CG-CG 4.08Å; P738-W945 HydrophobicContact CG-CZ2 4.01Å; R942-W945 HydrophobicContact CB-CB 4.03Å; R942-W945 HydrophobicContact CB-CD2 3.78Å; R942-W945 HydrophobicContact CB-CE3 3.59Å; R942-W945 HydrophobicContact CB-CG 3.99Å; R942-W945 HydrophobicContact CB-CZ3 4.28Å; R942-W945 HydrophobicContact CG-CD2 4.24Å; R942-W945 HydrophobicContact CG-CE3 3.59Å; R942-W945 HydrophobicContact CG-CZ3 3.8Å; R942-W945 WeakPolarHBondContact O-CB 3.47Å; R942-W945 PolarHBondContact O-N 3.04Å; I943-W945 VanDerWaalsContact C-N 3.3Å; W945-S947 PolarHBondContact O-N 3.45Å; W945-S947 VanDerWaalsContact O-N 3.12Å; W945-Q948 VanDerWaalsContact O-CB 3.27Å; W945-Q948 WeakPolarHBondContact O-CB 3.45Å; W945-Q948 PolarHBondContact O-N 3.08Å
946	H	87.5	Confident	94.5	Very high	209 Å²	209	42.3 Å²	42.3	97%	0.968	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-23.9	174.2	-70.4	-56.3	0	0	0	113.9
947	S	90.5	Very high	94.6	Very high	58 Å²	58	43.1 Å²	43.1	41%	0.406	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	17.2	177.3	61.8	0	0	0	0	113.4	R942 W945 Q949	R942-S947 VanDerWaalsContact CD-OG 3.32Å; R942-S947 WeakPolarHBondContact CD-OG 3.39Å; R942-S947 VanDerWaalsContact CZ-O 3.27Å; R942-S947 PolarHBondContact NE-O 2.96Å; R942-S947 PolarHBondContact NE-OG 3.41Å; R942-S947 PolarHBondContact NH2-O 3.41Å; W945-S947 PolarHBondContact O-N 3.45Å; W945-S947 VanDerWaalsContact O-N 3.12Å; S947-Q949 PolarHBondContact O-N 3.18Å
948	Q	93.1	Very high	94.6	Very high	73 Å²	73	43.1 Å²	43.1	34%	0.341	22%	0.218	S	C	.	.			trans	-52.8	136.2	179.1	-178.2	179.2	-77.4	0	0	111.5	A941 R942 W945 I950	A941-Q948 WeakPolarHBondContact O-CA 3.06Å; R942-Q948 WeakPolarHBondContact O-CA 3.34Å; R942-Q948 WeakPolarHBondContact O-CB 3.49Å; W945-Q948 VanDerWaalsContact O-CB 3.27Å; W945-Q948 WeakPolarHBondContact O-CB 3.45Å; W945-Q948 PolarHBondContact O-N 3.08Å; Q948-I950 HydrophobicContact CG-CG1 4.35Å
949	Q	95	Very high	94.5	Very high	88 Å²	88	43.6 Å²	43.6	41%	0.411	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140	172.1	-70.6	-172.4	-8.9	0	0	110.8	L940 A941 S947 L963	L940-Q949 CarbonylContact C-O 3.46Å; L940-Q949 WeakPolarHBondContact CA-O 3.47Å; A941-Q949 HydrophobicContact CB-CB 4.43Å; A941-Q949 PolarHBondContact N-O 3.44Å; A941-Q949 PolarHBondContact O-N 2.96Å; S947-Q949 PolarHBondContact O-N 3.18Å; Q949-L963 HydrophobicContact CB-CD2 4.42Å; Q949-L963 PolarHBondContact OE1-O 3.22Å
950	I	96.7	Very high	94.4	Very high	18 Å²	18	51 Å²	51	9%	0.092	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.8	178.8	-54.9	-179.6	0	0	0	107	C837 C838 V938 G939 L940 Q948 W987	C837-I950 HydrophobicContact CB-CD1 4.43Å; C838-I950 HydrophobicContact CB-CG2 4.02Å; V938-I950 HydrophobicContact CG1-CG2 3.46Å; V938-I950 VanDerWaalsContact CG1-CG2 3.46Å; G939-I950 WeakPolarHBondContact O-CA 3.35Å; L940-I950 HydrophobicContact CD2-CD1 4.27Å; L940-I950 HydrophobicContact CD2-CG1 4.24Å; L940-I950 HydrophobicContact CD2-CG2 4.48Å; L940-I950 HydrophobicContact CG-CG1 4.49Å; L940-I950 HydrophobicContact CG-CG2 4.38Å; Q948-I950 HydrophobicContact CG-CG1 4.35Å; I950-W987 HydrophobicContact CB-CD2 4.04Å; I950-W987 HydrophobicContact CB-CE3 4.15Å; I950-W987 HydrophobicContact CB-CG 4.32Å; I950-W987 HydrophobicContact CD1-CZ2 4.33Å; I950-W987 HydrophobicContact CG2-CB 4.14Å; I950-W987 HydrophobicContact CG2-CD2 3.84Å; I950-W987 HydrophobicContact CG2-CE3 4.44Å; I950-W987 HydrophobicContact CG2-CG 3.66Å
951	V	97.4	Very high	94.3	Very high	30 Å²	30	52.4 Å²	52.4	18%	0.182	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	131.1	178	172.7	0	0	0	0	109	V938 G939 R953 M958 V961 L963 W987	V938-V951 CarbonylContact C-O 3.58Å; V938-V951 WeakPolarHBondContact CA-O 3.33Å; G939-V951 PolarHBondContact N-O 3.2Å; G939-V951 PolarHBondContact O-N 3.07Å; V951-R953 HydrophobicContact CG1-CG 3.84Å; V951-M958 WeakPolarHBondContact O-CE 3.49Å; V951-V961 HydrophobicContact CG1-CG1 4.21Å; V951-L963 HydrophobicContact CB-CD2 3.86Å; V951-L963 HydrophobicContact CG2-CD2 3.4Å; V951-L963 VanDerWaalsContact CG2-CD2 3.4Å; V951-W987 CarbonylContact C-O 3.14Å; V951-W987 WeakPolarHBondContact CA-O 3.15Å
952	C	97.5	Very high	94.2	Very high	1 Å²	1	58.1 Å²	58.1	1%	0.007	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.3	173.8	-174.7	0	0	0	0	109.5	C937 V938 W987 E988	C937-C952 WeakPolarHBondContact O-CA 3.49Å; V938-C952 HydrophobicContact CG2-CB 4.42Å; C952-W987 HydrophobicContact CB-CB 3.93Å; C952-W987 PolarHBondContact N-O 3.18Å; C952-E988 HydrophobicContact CB-CG 4Å
953	R	96.8	Very high	94.3	Very high	92 Å²	92	57.6 Å²	57.6	35%	0.347	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	165.7	176.6	-72.3	-63.9	-178.8	-81.8	12.4	110.6	C937 V951 D957 M958 V961 W987 E988	C937-R953 PolarHBondContact N-O 3.19Å; C937-R953 PolarHBondContact O-N 3.49Å; C937-R953 PolarHBondContact SG-O 3.2Å; V951-R953 HydrophobicContact CG1-CG 3.84Å; R953-D957 HydrophobicContact CB-CB 4.05Å; R953-D957 HydrophobicContact CG-CB 4.42Å; R953-M958 HydrophobicContact CB-CE 4.07Å; R953-V961 HydrophobicContact CG-CG2 4.02Å; R953-W987 PolarHBondContact NH1-O 3.46Å; R953-E988 PolarHBondContact NH1-O 3.04Å; R953-E988 PolarHBondContact NH2-O 2.67Å
954	S	97.1	Very high	94.2	Very high	26 Å²	26	58 Å²	58	18%	0.182	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	150.5	163.7	79.2	0	0	0	0	110	T935 K956 D957 M958	T935-S954 CarbonylContact O-C 3.6Å; S954-K956 PolarHBondContact O-N 3.18Å; S954-D957 PolarHBondContact O-N 3.29Å; S954-D957 WeakPolarHBondContact OG-CB 3.33Å; S954-D957 PolarHBondContact OG-N 3.13Å; S954-D957 PolarHBondContact OG-OD2 2.84Å; S954-M958 PolarHBondContact O-N 3.3Å
955	L	96	Very high	94.3	Very high	1 Å²	1	60.3 Å²	60.3	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-53.7	-39.9	179.4	-177.8	65	0	0	0	111.9	A912 L915 M916 L931 S933 T935 C959 I972	A912-L955 HydrophobicContact CB-CD1 4.07Å; L915-L955 HydrophobicContact CB-CD1 4.29Å; L915-L955 HydrophobicContact CB-CD2 4.3Å; L915-L955 HydrophobicContact CD1-CD1 4.17Å; M916-L955 HydrophobicContact CG-CD2 4.25Å; M916-L955 HydrophobicContact CG-CG 4Å; M916-L955 HydrophobicContact SD-CB 4.41Å; M916-L955 HydrophobicContact SD-CD2 3.79Å; M916-L955 HydrophobicContact SD-CG 3.84Å; L931-L955 HydrophobicContact CD1-CD2 4.14Å; L931-L955 HydrophobicContact CD2-CD2 3.64Å; L931-L955 HydrophobicContact CG-CD2 3.89Å; S933-L955 PolarHBondContact O-N 3.07Å; T935-L955 PolarHBondContact O-N 3Å; L955-C959 PolarHBondContact O-SG 3.21Å; L955-I972 HydrophobicContact CD1-CD1 4.4Å
956	K	95.5	Very high	94.2	Very high	119 Å²	119	60.3 Å²	60.3	52%	0.517	32%	0.315	S	S	.	.	H	α-helix	trans	-62.5	-44.3	175.7	-174.5	-176.5	177.1	-170.5	0	112.6	M916 S933 S954 C959	M916-K956 HydrophobicContact CE-CB 4.3Å; M916-K956 HydrophobicContact CE-CG 4.39Å; S933-K956 WeakPolarHBondContact O-CB 3.47Å; S933-K956 PolarHBondContact O-N 2.94Å; S954-K956 PolarHBondContact O-N 3.18Å; K956-C959 WeakPolarHBondContact O-CB 3.45Å; K956-C959 PolarHBondContact O-N 2.85Å
957	D	96.9	Very high	94.3	Very high	82 Å²	82	52 Å²	52	44%	0.439	28%	0.277	S	S	.	.	H	α-helix	trans	-74.7	-32	-177.7	-60.6	-34.4	0	0	0	111.3	R953 S954 C959 H960	R953-D957 HydrophobicContact CB-CB 4.05Å; R953-D957 HydrophobicContact CG-CB 4.42Å; S954-D957 PolarHBondContact O-N 3.29Å; S954-D957 WeakPolarHBondContact OG-CB 3.33Å; S954-D957 PolarHBondContact OG-N 3.13Å; S954-D957 PolarHBondContact OG-OD2 2.84Å; D957-C959 PolarHBondContact O-N 2.83Å; D957-H960 PolarHBondContact O-N 3.17Å
958	M	96.8	Very high	94.5	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-58.2	-28.6	175.1	-170.6	61.1	70.5	0	0	112.5	N909 A912 C937 V951 R953 S954 H960 V961	N909-M958 WeakPolarHBondContact CA-O 3.42Å; N909-M958 VanDerWaalsContact CB-O 3.25Å; N909-M958 WeakPolarHBondContact CB-O 3.44Å; A912-M958 HydrophobicContact CB-CB 3.95Å; A912-M958 HydrophobicContact CB-CG 3.86Å; C937-M958 WeakPolarHBondContact O-CE 3.47Å; C937-M958 WeakPolarHBondContact SG-CB 3.4Å; V951-M958 WeakPolarHBondContact O-CE 3.49Å; R953-M958 HydrophobicContact CB-CE 4.07Å; S954-M958 PolarHBondContact O-N 3.3Å; M958-H960 PolarHBondContact O-N 3.16Å; M958-H960 VanDerWaalsContact O-N 3.08Å; M958-V961 PolarHBondContact O-N 3.03Å; M958-V961 HydrophobicContact SD-CB 4.05Å; M958-V961 HydrophobicContact SD-CG1 4.41Å; M958-V961 HydrophobicContact SD-CG2 4.25Å
959	C	95.9	Very high	94.6	Very high	11 Å²	11	47 Å²	47	7%	0.074	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-19.8	173.3	-64.2	0	0	0	0	114.1	A912 R913 M916 L955 K956 D957	A912-C959 VanDerWaalsContact C-SG 3.56Å; R913-C959 HydrophobicContact CG-CB 3.75Å; M916-C959 VanDerWaalsContact CG-SG 3.58Å; L955-C959 PolarHBondContact O-SG 3.21Å; K956-C959 WeakPolarHBondContact O-CB 3.45Å; K956-C959 PolarHBondContact O-N 2.85Å; D957-C959 PolarHBondContact O-N 2.83Å
960	H	95.6	Very high	94.7	Very high	155 Å²	155	42.9 Å²	42.9	72%	0.718	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-3.7	-177.2	-57.9	-61.8	0	0	0	113.6	D957 M958	D957-H960 PolarHBondContact O-N 3.17Å; M958-H960 PolarHBondContact O-N 3.16Å; M958-H960 VanDerWaalsContact O-N 3.08Å
961	V	94.5	Very high	94.8	Very high	30 Å²	30	42 Å²	42	18%	0.182	23%	0.226	C	C	.	.			trans	-79	139.9	-179.7	177.6	0	0	0	0	110.7	N909 V951 R953 M958 L963	N909-V961 VanDerWaalsContact CB-O 3.24Å; N909-V961 WeakPolarHBondContact CB-O 3.48Å; N909-V961 PolarHBondContact ND2-O 2.77Å; N909-V961 VanDerWaalsContact ND2-O 3.16Å; V951-V961 HydrophobicContact CG1-CG1 4.21Å; R953-V961 HydrophobicContact CG-CG2 4.02Å; M958-V961 PolarHBondContact O-N 3.03Å; M958-V961 HydrophobicContact SD-CB 4.05Å; M958-V961 HydrophobicContact SD-CG1 4.41Å; M958-V961 HydrophobicContact SD-CG2 4.25Å; V961-L963 HydrophobicContact CG1-CD2 3.72Å; V961-L963 HydrophobicContact CG1-CG 4.03Å
962	N	93.5	Very high	94.8	Very high	119 Å²	119	40.7 Å²	40.7	64%	0.636	22%	0.217	S	C	*	.			trans	-117.8	110.9	172	-175.6	2.6	0	0	0	110	G964	N962-G964 VanDerWaalsContact C-N 3.33Å; N962-G964 PolarHBondContact OD1-N 2.98Å
963	L	93.4	Very high	94.8	Very high	5 Å²	5	41 Å²	41	3%	0.026	22%	0.219	C	C	.	.			trans	-94.1	11.2	177.4	-54.4	174	0	0	0	113	A908 G939 A941 R942 Q949 V951 V961	A908-L963 HydrophobicContact CB-CD1 4.19Å; G939-L963 VanDerWaalsContact C-CD1 3.45Å; G939-L963 WeakPolarHBondContact O-CD1 3.43Å; A941-L963 HydrophobicContact CB-CB 3.74Å; A941-L963 HydrophobicContact CB-CD1 4.31Å; R942-L963 PolarHBondContact NH1-O 3.46Å; R942-L963 PolarHBondContact NH2-O 3.01Å; R942-L963 VanDerWaalsContact NH2-O 3.09Å; Q949-L963 HydrophobicContact CB-CD2 4.42Å; Q949-L963 PolarHBondContact OE1-O 3.22Å; V951-L963 HydrophobicContact CB-CD2 3.86Å; V951-L963 HydrophobicContact CG2-CD2 3.4Å; V951-L963 VanDerWaalsContact CG2-CD2 3.4Å; V961-L963 HydrophobicContact CG1-CD2 3.72Å; V961-L963 HydrophobicContact CG1-CG 4.03Å
964	G	91.5	Very high	94.8	Very high	27 Å²	27	37.4 Å²	37.4	28%	0.278	21%	0.211	S	C	.	.			trans	84.1	-146.9	178.3	0	0	0	0	0	113.9	N962 H968	N962-G964 VanDerWaalsContact C-N 3.33Å; N962-G964 PolarHBondContact OD1-N 2.98Å; G964-H968 PolarHBondContact O-CE1 3.35Å; G964-H968 PolarHBondContact O-NE2 3.06Å
965	P	89	Confident	94.6	Very high	87 Å²	87	43.2 Å²	43.2	57%	0.565	24%	0.235	S	C	*	.	S	Bend	trans	-68.1	157.3	-176.3	-21.7	33.8	0	0	0	114.7	R942 H968	R942-P965 PolarHBondContact NH1-O 2.89Å; P965-H968 PolarHBondContact O-CD2 3.46Å; P965-H968 PolarHBondContact O-NE2 3.22Å
966	P	88	Confident	94.6	Very high	35 Å²	35	45.1 Å²	45.1	23%	0.227	25%	0.247	C	C	.	.	S	Bend	trans	-60.8	163.5	172.8	28.5	-36.4	0	0	0	113	L736 F905	L736-P966 HydrophobicContact CD1-CB 4.36Å; L736-P966 HydrophobicContact CD1-CG 4.22Å; F905-P966 HydrophobicContact CB-CB 3.44Å; F905-P966 VanDerWaalsContact CB-CB 3.44Å; F905-P966 HydrophobicContact CB-CG 3.87Å; F905-P966 HydrophobicContact CD1-CB 4.34Å; F905-P966 HydrophobicContact CD2-CB 4.05Å; F905-P966 HydrophobicContact CD2-CG 3.6Å; F905-P966 HydrophobicContact CE2-CG 4.38Å; F905-P966 HydrophobicContact CG-CB 3.68Å; F905-P966 HydrophobicContact CG-CG 3.79Å
967	L	89.9	Confident	94.5	Very high	34 Å²	34	44 Å²	44	18%	0.178	24%	0.243	C	C	.	.	P	Polyproline II helix	cis	-91.5	143.2	5.6	-68.8	168.4	0	0	0	113.5	S735 L736 L883 F905 A941 R942	S735-L967 WeakPolarHBondContact OG-CD1 3.35Å; L736-L967 HydrophobicContact CB-CD1 3.86Å; L736-L967 HydrophobicContact CB-CD2 4.37Å; L736-L967 HydrophobicContact CB-CG 3.96Å; L736-L967 HydrophobicContact CD1-CD2 3.95Å; L736-L967 HydrophobicContact CD1-CG 4.05Å; L736-L967 HydrophobicContact CG-CD2 4.17Å; L736-L967 HydrophobicContact CG-CG 4.27Å; L883-L967 HydrophobicContact CD2-CD2 4.31Å; F905-L967 HydrophobicContact CD1-CD2 3.65Å; F905-L967 HydrophobicContact CE1-CD2 4.15Å; F905-L967 HydrophobicContact CG-CD2 4.48Å; A941-L967 CarbonylContact C-O 3.54Å; A941-L967 WeakPolarHBondContact CA-O 3.25Å; R942-L967 PolarHBondContact N-O 3.44Å
968	H	94.4	Very high	94.3	Very high	11 Å²	11	47.6 Å²	47.6	5%	0.051	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	156.4	178.4	-69.5	-160.4	0	0	0	111.2	L881 A908 L940 A941 G964 P965	L881-H968 HydrophobicContact CD1-CB 3.82Å; A908-H968 HydrophobicContact CB-CB 4.33Å; A908-H968 PolarHBondContact N-ND1 3.07Å; L940-H968 CarbonylContact O-C 3.49Å; L940-H968 WeakPolarHBondContact O-CA 3.45Å; A941-H968 WeakPolarHBondContact CB-CD2 3.41Å; A941-H968 WeakPolarHBondContact CB-NE2 3.33Å; G964-H968 PolarHBondContact O-CE1 3.35Å; G964-H968 PolarHBondContact O-NE2 3.06Å; P965-H968 PolarHBondContact O-CD2 3.46Å; P965-H968 PolarHBondContact O-NE2 3.22Å
969	S	95.2	Very high	94.1	Very high	16 Å²	16	52.9 Å²	52.9	11%	0.112	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	156.9	169.6	-62.7	0	0	0	0	108.8	L940	L940-S969 PolarHBondContact N-O 2.68Å; L940-S969 PolarHBondContact O-N 3.04Å
970	V	97.6	Very high	94	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.9	175.8	173.3	0	0	0	0	109	C879 L881 A908 A911 C937 V938 I972	C879-V970 WeakPolarHBondContact CA-O 3.26Å; C879-V970 HydrophobicContact CB-CB 4.11Å; C879-V970 VanDerWaalsContact CB-O 3.28Å; C879-V970 WeakPolarHBondContact CB-O 3.5Å; C879-V970 PolarHBondContact N-O 2.87Å; C879-V970 PolarHBondContact O-N 3.36Å; L881-V970 HydrophobicContact CD1-CG2 4.24Å; L881-V970 HydrophobicContact CD2-CG2 4.3Å; A908-V970 HydrophobicContact CB-CG2 3.72Å; A911-V970 HydrophobicContact CB-CG2 4.27Å; C937-V970 HydrophobicContact CB-CG1 4.35Å; V938-V970 CarbonylContact O-C 3.59Å; V938-V970 WeakPolarHBondContact O-CA 3.44Å; V970-I972 HydrophobicContact CG1-CD1 3.84Å
971	A	97.8	Very high	94	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	121.5	166.4	0	0	0	0	0	109.5	I835 L840 F845 T877 C937 V938 L940	I835-A971 HydrophobicContact CD1-CB 4.4Å; L840-A971 HydrophobicContact CD1-CB 3.99Å; F845-A971 HydrophobicContact CE1-CB 4.27Å; F845-A971 HydrophobicContact CZ-CB 4.42Å; T877-A971 CarbonylContact O-C 3.47Å; T877-A971 VanDerWaalsContact O-CA 3.26Å; T877-A971 WeakPolarHBondContact O-CA 3.23Å; C937-A971 CarbonylContact C-O 3.58Å; C937-A971 VanDerWaalsContact CA-O 3.24Å; C937-A971 WeakPolarHBondContact CA-O 3.36Å; V938-A971 HydrophobicContact CB-CB 4.28Å; V938-A971 PolarHBondContact N-O 2.93Å; V938-A971 PolarHBondContact O-N 2.77Å; L940-A971 HydrophobicContact CD1-CB 4.32Å
972	I	98.1	Very high	94	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	125.3	170.9	-55	-58.9	0	0	0	108	I867 L871 H876 T877 L915 L931 T935 C937 L955 V970	I867-I972 HydrophobicContact CG2-CB 4.42Å; I867-I972 HydrophobicContact CG2-CG1 4.26Å; I867-I972 HydrophobicContact CG2-CG2 4.16Å; L871-I972 HydrophobicContact CD1-CG2 4.13Å; L871-I972 HydrophobicContact CD2-CG2 4.05Å; L871-I972 HydrophobicContact CG-CG2 4.34Å; H876-I972 CarbonylContact C-O 3.46Å; H876-I972 VanDerWaalsContact CA-O 3.23Å; H876-I972 WeakPolarHBondContact CA-O 3.34Å; T877-I972 PolarHBondContact N-O 2.88Å; T877-I972 PolarHBondContact O-N 3.36Å; L915-I972 HydrophobicContact CD1-CD1 3.86Å; L915-I972 HydrophobicContact CD1-CG1 4.46Å; L931-I972 HydrophobicContact CD1-CG2 3.83Å; T935-I972 HydrophobicContact CG2-CG2 4.11Å; C937-I972 HydrophobicContact CB-CD1 3.78Å; L955-I972 HydrophobicContact CD1-CD1 4.4Å; V970-I972 HydrophobicContact CG1-CD1 3.84Å
973	V	97.5	Very high	94	Very high	7 Å²	7	47.5 Å²	47.5	4%	0.042	26%	0.264	C	S	.	.			trans	-87.5	115.2	-172.9	-174.5	0	0	0	0	109.7	L840 R936 V938 T976 L984	L840-V973 HydrophobicContact CD1-CG2 4.23Å; L840-V973 HydrophobicContact CD2-CG1 4.2Å; L840-V973 HydrophobicContact CD2-CG2 4.49Å; R936-V973 HydrophobicContact CB-CB 4.06Å; R936-V973 HydrophobicContact CB-CG2 4.1Å; R936-V973 WeakPolarHBondContact O-CB 3.35Å; R936-V973 WeakPolarHBondContact O-CG2 3.38Å; R936-V973 PolarHBondContact O-N 3.39Å; V938-V973 HydrophobicContact CG2-CG2 4.06Å; V973-T976 HydrophobicContact CG1-CG2 3.44Å; V973-T976 VanDerWaalsContact CG1-CG2 3.44Å; V973-L984 HydrophobicContact CG1-CD1 3.97Å; V973-L984 HydrophobicContact CG2-CD1 4.25Å
974	G	95.9	Very high	94.1	Very high	17 Å²	17	47.2 Å²	47.2	18%	0.175	26%	0.263	C	S	.	.			trans	-74.9	-145.5	164.6	0	0	0	0	0	114	H876	H876-G974 PolarHBondContact ND1-N 3.17Å; H876-G974 VanDerWaalsContact ND1-N 3.15Å
975	E	94.7	Very high	94.2	Very high	148 Å²	148	48.9 Å²	48.9	69%	0.692	27%	0.27	S	S	*	.	S	Bend	trans	-70.8	137.2	174.6	-71	179	-175.5	0	0	109.8	G874 H876	G874-E975 PolarHBondContact O-N 3.36Å; H876-E975 PolarHBondContact CE1-O 2.86Å
976	T	95.2	Very high	94.4	Very high	41 Å²	41	50.1 Å²	50.1	25%	0.252	27%	0.271	S	S	.	.			trans	-115.3	145.9	-175.3	44.1	0	0	0	0	112.7	L840 R936 V973 E980 D981 L984	L840-T976 HydrophobicContact CD2-CG2 4.34Å; R936-T976 VanDerWaalsContact NH2-CG2 3.27Å; R936-T976 PolarHBondContact NH2-OG1 3.49Å; V973-T976 HydrophobicContact CG1-CG2 3.44Å; V973-T976 VanDerWaalsContact CG1-CG2 3.44Å; T976-E980 VanDerWaalsContact CA-OE2 3.27Å; T976-E980 WeakPolarHBondContact CA-OE2 3.34Å; T976-E980 HydrophobicContact CG2-CB 4.07Å; T976-D981 PolarHBondContact OG1-OD1 3.24Å; T976-D981 PolarHBondContact OG1-OD2 2.96Å; T976-L984 HydrophobicContact CG2-CD1 4.14Å
977	H	92.6	Very high	94.6	Very high	95 Å²	95	52 Å²	52	44%	0.44	27%	0.274	S	S	.	.			trans	-79	154.4	163.8	-171	-91.3	0	0	0	110.6	L979 E980 D981	H977-L979 PolarHBondContact ND1-N 3.04Å; H977-L979 PolarHBondContact O-N 3.37Å; H977-E980 HydrophobicContact CB-CG 4.31Å; H977-E980 PolarHBondContact N-OE2 3.26Å; H977-E980 WeakPolarHBondContact O-CA 3.42Å; H977-E980 WeakPolarHBondContact O-CB 3.48Å; H977-E980 PolarHBondContact O-N 2.98Å; H977-D981 PolarHBondContact O-N 2.94Å
978	E	92.6	Very high	94.5	Very high	158 Å²	158	56.9 Å²	56.9	74%	0.738	30%	0.296	S	S	*	.	H	α-helix	trans	-52.8	-33.1	-179.8	-63.7	-177.5	168.9	0	0	113.6	S982	E978-S982 WeakPolarHBondContact O-CB 3.26Å; E978-S982 PolarHBondContact O-N 3Å; E978-S982 PolarHBondContact O-OG 3Å
979	L	92.5	Very high	94.6	Very high	112 Å²	112	59.2 Å²	59.2	59%	0.586	31%	0.308	S	S	*	.	H	α-helix	trans	-69.7	-39.8	175.2	-74.1	168.3	0	0	0	112.8	H977 S982 M983	H977-L979 PolarHBondContact ND1-N 3.04Å; H977-L979 PolarHBondContact O-N 3.37Å; L979-S982 PolarHBondContact O-N 2.96Å; L979-M983 WeakPolarHBondContact O-CG 3.47Å; L979-M983 PolarHBondContact O-N 3.45Å
980	E	95.6	Very high	94.5	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.009	32%	0.318	C	S	.	.	H	α-helix	trans	-66.8	-42.2	176	-64.1	175.7	135.2	0	0	109.6	L840 Q841 N844 H876 T976 H977 S982 M983 L984	L840-E980 HydrophobicContact CD2-CB 4.37Å; Q841-E980 WeakPolarHBondContact CA-OE1 3.39Å; Q841-E980 WeakPolarHBondContact CB-OE1 3.43Å; Q841-E980 HydrophobicContact CG-CG 3.88Å; Q841-E980 VanDerWaalsContact CG-OE1 3.29Å; Q841-E980 WeakPolarHBondContact CG-OE1 3.25Å; Q841-E980 PolarHBondContact N-OE1 3.37Å; N844-E980 PolarHBondContact ND2-OE1 2.78Å; H876-E980 IonicContact CD2-OE1 2.68Å; H876-E980 IonicContact CE1-OE2 2.98Å; H876-E980 IonicContact NE2-OE1 3.18Å; H876-E980 PolarHBondContact NE2-OE1 2.64Å; H876-E980 VanDerWaalsContact NE2-OE1 3.08Å; H876-E980 IonicContact NE2-OE2 3.29Å; T976-E980 VanDerWaalsContact CA-OE2 3.27Å; T976-E980 WeakPolarHBondContact CA-OE2 3.34Å; T976-E980 HydrophobicContact CG2-CB 4.07Å; H977-E980 HydrophobicContact CB-CG 4.31Å; H977-E980 PolarHBondContact N-OE2 3.26Å; H977-E980 WeakPolarHBondContact O-CA 3.42Å; H977-E980 WeakPolarHBondContact O-CB 3.48Å; H977-E980 PolarHBondContact O-N 2.98Å; E980-S982 VanDerWaalsContact C-N 3.35Å; E980-S982 PolarHBondContact O-N 2.86Å; E980-M983 PolarHBondContact O-N 3.44Å; E980-L984 WeakPolarHBondContact O-CB 3.27Å; E980-L984 VanDerWaalsContact O-CG 3.25Å; E980-L984 WeakPolarHBondContact O-CG 3.35Å; E980-L984 PolarHBondContact O-N 3.27Å
981	D	95.1	Very high	94.4	Very high	54 Å²	54	64.8 Å²	64.8	29%	0.289	34%	0.335	S	S	.	.	H	α-helix	trans	-59.3	-44.9	174	-77.1	-44.2	0	0	0	112.4	R936 T976 H977 M983 L984 S985	R936-D981 IonicContact CZ-OD1 3.59Å; R936-D981 IonicContact NH1-OD1 2.77Å; R936-D981 PolarHBondContact NH1-OD1 3.48Å; R936-D981 IonicContact NH2-OD1 3.36Å; R936-D981 PolarHBondContact NH2-OD1 3.23Å; T976-D981 PolarHBondContact OG1-OD1 3.24Å; T976-D981 PolarHBondContact OG1-OD2 2.96Å; H977-D981 PolarHBondContact O-N 2.94Å; D981-M983 VanDerWaalsContact C-N 3.3Å; D981-M983 PolarHBondContact O-N 2.88Å; D981-L984 PolarHBondContact O-N 3.49Å; D981-S985 PolarHBondContact O-N 2.89Å
982	S	94.5	Very high	94.1	Very high	72 Å²	72	68.6 Å²	68.6	50%	0.503	36%	0.355	S	S	.	.	H	α-helix	trans	-60	-41.5	175.8	-60.2	0	0	0	0	111.6	E978 L979 E980 S985	E978-S982 WeakPolarHBondContact O-CB 3.26Å; E978-S982 PolarHBondContact O-N 3Å; E978-S982 PolarHBondContact O-OG 3Å; L979-S982 PolarHBondContact O-N 2.96Å; E980-S982 VanDerWaalsContact C-N 3.35Å; E980-S982 PolarHBondContact O-N 2.86Å; S982-S985 PolarHBondContact O-OG 3.42Å
983	M	93.5	Very high	93.9	Very high	74 Å²	74	72.8 Å²	72.8	37%	0.365	38%	0.377	S	S	.	.	H	α-helix	trans	-69.9	-42	176.7	-74	-69.7	-65.9	0	0	112.8	L979 E980 D981 S985 L986 W987	L979-M983 WeakPolarHBondContact O-CG 3.47Å; L979-M983 PolarHBondContact O-N 3.45Å; E980-M983 PolarHBondContact O-N 3.44Å; D981-M983 VanDerWaalsContact C-N 3.3Å; D981-M983 PolarHBondContact O-N 2.88Å; M983-S985 PolarHBondContact O-N 3.03Å; M983-L986 VanDerWaalsContact O-CB 3.3Å; M983-L986 WeakPolarHBondContact O-CB 3.35Å; M983-L986 PolarHBondContact O-N 2.66Å; M983-L986 VanDerWaalsContact O-N 3.12Å; M983-L986 HydrophobicContact SD-CD1 4.06Å; M983-W987 PolarHBondContact O-NE1 3.42Å
984	L	95	Very high	93.7	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-62.8	-34.5	179	-72.6	177.6	0	0	0	111.7	L840 V938 V973 T976 E980 D981 L986 W987 E988	L840-L984 HydrophobicContact CD2-CD1 3.91Å; L840-L984 HydrophobicContact CD2-CD2 4.08Å; L840-L984 HydrophobicContact CD2-CG 4.19Å; L840-L984 HydrophobicContact CG-CD2 4.3Å; V938-L984 HydrophobicContact CG2-CD2 3.49Å; V938-L984 VanDerWaalsContact CG2-CD2 3.49Å; V973-L984 HydrophobicContact CG1-CD1 3.97Å; V973-L984 HydrophobicContact CG2-CD1 4.25Å; T976-L984 HydrophobicContact CG2-CD1 4.14Å; E980-L984 WeakPolarHBondContact O-CB 3.27Å; E980-L984 VanDerWaalsContact O-CG 3.25Å; E980-L984 WeakPolarHBondContact O-CG 3.35Å; E980-L984 PolarHBondContact O-N 3.27Å; D981-L984 PolarHBondContact O-N 3.49Å; L984-L986 PolarHBondContact O-N 3.4Å; L984-W987 PolarHBondContact O-N 2.87Å; L984-E988 PolarHBondContact O-N 3.28Å
985	S	93.7	Very high	93.5	Very high	62 Å²	62	81.5 Å²	81.5	43%	0.434	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-20.6	176.2	77.9	0	0	0	0	113.9	D981 S982 M983 W987	D981-S985 PolarHBondContact O-N 2.89Å; S982-S985 PolarHBondContact O-OG 3.42Å; M983-S985 PolarHBondContact O-N 3.03Å; S985-W987 PolarHBondContact O-N 3.02Å
986	L	93	Very high	93.4	Very high	113 Å²	113	76.4 Å²	76.4	59%	0.592	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-19.9	172.8	-59.9	172.4	0	0	0	112.7	M983 L984	M983-L986 VanDerWaalsContact O-CB 3.3Å; M983-L986 WeakPolarHBondContact O-CB 3.35Å; M983-L986 PolarHBondContact O-N 2.66Å; M983-L986 VanDerWaalsContact O-N 3.12Å; M983-L986 HydrophobicContact SD-CD1 4.06Å; L984-L986 PolarHBondContact O-N 3.4Å
987	W	92.9	Very high	93.3	Very high	75 Å²	75	79.3 Å²	79.3	28%	0.284	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-6.5	-176.2	-44.1	124.9	0	0	0	113.1	C838 I950 V951 C952 R953 M983 L984 S985	C838-W987 PolarHBondContact O-NE1 3.09Å; I950-W987 HydrophobicContact CB-CD2 4.04Å; I950-W987 HydrophobicContact CB-CE3 4.15Å; I950-W987 HydrophobicContact CB-CG 4.32Å; I950-W987 HydrophobicContact CD1-CZ2 4.33Å; I950-W987 HydrophobicContact CG2-CB 4.14Å; I950-W987 HydrophobicContact CG2-CD2 3.84Å; I950-W987 HydrophobicContact CG2-CE3 4.44Å; I950-W987 HydrophobicContact CG2-CG 3.66Å; V951-W987 CarbonylContact C-O 3.14Å; V951-W987 WeakPolarHBondContact CA-O 3.15Å; C952-W987 HydrophobicContact CB-CB 3.93Å; C952-W987 PolarHBondContact N-O 3.18Å; R953-W987 PolarHBondContact NH1-O 3.46Å; M983-W987 PolarHBondContact O-NE1 3.42Å; L984-W987 PolarHBondContact O-N 2.87Å; S985-W987 PolarHBondContact O-N 3.02Å
988	E	88.4	Confident	93.3	Very high	135 Å²	135	77.9 Å²	77.9	63%	0.631	40%	0.403	S	S	*	.			trans	-71.9	0	166.2	-68.1	-178.3	179.2	0	0	109.6	C952 R953 L984	C952-E988 HydrophobicContact CB-CG 4Å; R953-E988 PolarHBondContact NH1-O 3.04Å; R953-E988 PolarHBondContact NH2-O 2.67Å; L984-E988 PolarHBondContact O-N 3.28Å

Retrieved 988 of 988 residues in 824.7 ms (Link to these results)

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