A0A087X9N2_POEFO Loading...

Solute carrier family 12 member 1

AlphaFold DB , UniProt , Accession A0A087X9N2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,044 aa.

						>A0A087X9N2_POEFO|A0A087X9N2
MERLKSNGGGHVNSAFDSNLGDPPIYEETEFSNNEHRTVRPSVMSAFGHDTLDRVPNIDFYRNAGSVSGHRAVRPSLQELHDVFQKNGAISVPETVTDDGEGSEGTPSDDLESAAPIDVTKGAVKFGWIRGVLVRCMLNIWGVMLFIRLSWVFGQAGWGLGIVVIALSCVVTTITGLSMSAICTNGVVRGGGAYYLISRSLGPEFGGSIGLIFAFANAVAVAMYVVGFAETVVDLLKEYAHLMVDEMNDIRIIGCITVVLLLGISVAGMEWEAKAQIVLLVILLVAIVNVFVGTAIPATEDKKSKGFFGYNTKIFMENFTPDFRNGETFFSVFAIFFPAATGILAGANISGDLRDAQAAIPKGTLLAILITGITYLAVALCVSGTVVRDATGNTTDLVTSGIPCNGSSVVACELGYNFSSCETEPCKFGLMNNFQVMTMVSGFGPLITAGTFSATLSSALASLVSAPKVFQALCKDNIYKALHFFAKGHGKNNEPIRGYILTFIISIAFILIGDLNTIAPIISNFFLASYALINFSCFHASYAKSPGWRPAYKFYNMWLSLLGALLCCVVMFVINWWAALLTYGIEILLYIYVTVKKPDVNWGSSTQAVTFVSAVSNALSLSGVEDHVKNFRPQILVLTGSARARPALLDLAHSFTKNYGLCLSCEVLVGPRSEVLPAMNNGMERNQQWLHKNKRKAFYAAVACDNFREGAETLLQASGLGRMKPNTLMIGFKRNWRTAETDAVQSYVGLLHDAFDFEYGTLVLRMNQGLDVSHLVEEEEEMLKAAKEQRALDNEMMPNGGKTKGLFRKSRHSSQQVLTTRAVSVCGPPPPQVAKINEKLVEASGQFKKKQPKGTIDVWWLFDDGGLTLLLPYILTTRKKWKDCKLRIFIAGQPGRTEIDKQEMRSLLHKFRIKCIDITVVDDIHIKPRNDNIKKLEDMIEPFRLHEGSKGRDQAAGIQKEYPWKITDAELSSFEEKTHLQVRLNELLQEHSKSANLIVLSLPIARKGSISDFLYMAWLDILTKDLPPIMLVRGNHKSVLTFYS
					

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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	32.8	Very low	29.8	Very low	238 Å²	238	158.1 Å²	158.1	100%	1.172	88%	0.879	S	S	*	*				0	131.3	0	-59.2	145.2	179.6	0	0	106.9
2	E	29.3	Very low	29.8	Very low	186 Å²	186	156.4 Å²	156.4	87%	0.869	88%	0.876	S	S	*	*			cis	-153.1	167.5	-10	-109.7	-178	140.9	0	0	109.3
3	R	30.2	Very low	29.6	Very low	243 Å²	243	156.6 Å²	156.6	92%	0.917	87%	0.874	S	S	*	*			trans	-116.1	119.4	177.7	-82.2	-179.6	169.1	178.2	-3.6	110.9
4	L	29.7	Very low	29.7	Very low	169 Å²	169	153.4 Å²	153.4	89%	0.885	87%	0.867	S	S	*	*			trans	-135.3	98.3	160.7	-83.1	162	0	0	0	106.9
5	K	31.2	Very low	29.8	Very low	202 Å²	202	149.5 Å²	149.5	88%	0.878	86%	0.861	S	S	*	*				58.8	116.6	78.5	-95.6	-166.6	172.7	-173	0	114.6
6	S	34.3	Very low	29.8	Very low	107 Å²	107	153.3 Å²	153.3	75%	0.748	87%	0.865	S	S	*	*			trans	-60.3	149.6	167.9	174.4	0	0	0	0	112.5
7	N	27.5	Very low	29.8	Very low	166 Å²	166	153.6 Å²	153.6	89%	0.888	86%	0.864	S	S	*	*			trans	-144.1	147.4	139	-111.5	-9.3	0	0	0	108.9
8	G	29.1	Very low	30	Very low	77 Å²	77	150.4 Å²	150.4	79%	0.794	85%	0.854	S	S	*	*			trans	-94.2	164.8	-175.2	0	0	0	0	0	114.3
9	G	26.3	Very low	30	Very low	80 Å²	80	150.8 Å²	150.8	83%	0.825	85%	0.853	S	S	*	*			trans	-174.4	103.4	172.6	0	0	0	0	0	109.5
10	G	27.3	Very low	30.1	Very low	78 Å²	78	152.4 Å²	152.4	80%	0.804	86%	0.858	S	S	*	*			trans	-87.4	137.9	-176.7	0	0	0	0	0	112.2
11	H	30.2	Very low	30	Very low	193 Å²	193	148.5 Å²	148.5	89%	0.894	85%	0.853	S	S	*	*			trans	-118	108	161.4	-98.9	-74.2	0	0	0	109.6
12	V	29.9	Very low	29.9	Very low	138 Å²	138	144.8 Å²	144.8	84%	0.836	84%	0.837	S	S	*	*			trans	-70.6	140	162.9	176.7	0	0	0	0	107.8
13	N	27	Very low	29.9	Very low	159 Å²	159	141 Å²	141	85%	0.85	83%	0.829	S	S	*	*			trans	-124.3	130	170.5	-150.4	-0.9	0	0	0	109
14	S	31	Very low	29.9	Very low	111 Å²	111	134.7 Å²	134.7	78%	0.776	82%	0.819	S	S	*	*			trans	-98.9	103.2	-158.2	54.2	0	0	0	0	113
15	A	30.7	Very low	29.8	Very low	95 Å²	95	134.2 Å²	134.2	79%	0.785	82%	0.816	S	S	*	*			trans	-160.8	68.1	169.3	0	0	0	0	0	112.3
16	F	29.8	Very low	29.7	Very low	211 Å²	211	134.8 Å²	134.8	93%	0.925	81%	0.814	S	S	*	*			trans	-144.4	118.5	158.4	-131.9	-87	0	0	0	109
17	D	30.5	Very low	29.3	Very low	158 Å²	158	138.5 Å²	138.5	85%	0.845	82%	0.82	S	S	*	*			trans	-86.2	145.7	-178.3	-158.4	-8	0	0	0	109.9
18	S	33.4	Very low	29.3	Very low	96 Å²	96	140 Å²	140	67%	0.671	82%	0.821	S	S	*	*			trans	-122	92.3	-167.5	61.4	0	0	0	0	111.6
19	N	30.3	Very low	29.2	Very low	159 Å²	159	142.8 Å²	142.8	85%	0.85	82%	0.823	S	S	*	*			trans	-176	116.2	154.9	-95	-37.4	0	0	0	112
20	L	31.3	Very low	29.1	Very low	181 Å²	181	148.4 Å²	148.4	95%	0.948	83%	0.828	S	S	*	*			trans	158.5	124.6	134.9	-90.3	157	0	0	0	112.3
21	G	28.8	Very low	29	Very low	72 Å²	72	154.5 Å²	154.5	74%	0.742	83%	0.833	S	S	*	*			trans	103.6	83.8	159.8	0	0	0	0	0	116.1
22	D	30	Very low	28.8	Very low	159 Å²	159	150.8 Å²	150.8	85%	0.85	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-67.6	148.8	166.3	-64.8	-70.4	0	0	0	112.1
23	P	30	Very low	28.7	Very low	107 Å²	107	151 Å²	151	70%	0.695	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-74.9	148	172.4	32.2	-34.5	0	0	0	111.5	I25	P23-I25 PolarHBondContact O-N 3.31Å
24	P	30.2	Very low	28.6	Very low	110 Å²	110	150.9 Å²	150.9	71%	0.714	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-68.5	134.1	177.1	28.5	-34.3	0	0	0	111.7
25	I	27.5	Very low	28.5	Very low	160 Å²	160	153.7 Å²	153.7	82%	0.821	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-73.5	138.3	170.3	-62.3	165.8	0	0	0	108.6	P23	P23-I25 PolarHBondContact O-N 3.31Å
26	Y	27.6	Very low	28.3	Very low	214 Å²	214	157.4 Å²	157.4	84%	0.839	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-103.1	133.9	163.4	-85.8	-92	0	0	0	108.9
27	E	27.1	Very low	27.9	Very low	185 Å²	185	159.4 Å²	159.4	86%	0.864	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-73.6	148.4	-177.8	-64.3	176.4	125.3	0	0	112.1
28	E	26.5	Very low	27.7	Very low	196 Å²	196	158 Å²	158	92%	0.916	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-81.3	138.7	168.5	-61.9	-177.1	130.3	0	0	109.9
29	T	27	Very low	27.3	Very low	136 Å²	136	159.9 Å²	159.9	83%	0.834	83%	0.832	S	S	*	*			trans	-126.5	136.4	166.4	54	0	0	0	0	109.8
30	E	25.6	Very low	27	Very low	199 Å²	199	163.1 Å²	163.1	93%	0.93	83%	0.832	S	S	*	*			trans	-72.9	166.7	-162.3	-59.8	-178.9	117.9	0	0	115.3
31	F	25.5	Very low	26.9	Very low	206 Å²	206	161 Å²	161	90%	0.904	83%	0.829	S	S	*	*			trans	-73.5	134.9	-179.2	-80.1	-106.4	0	0	0	113.2
32	S	25.3	Very low	26.8	Very low	114 Å²	114	162.3 Å²	162.3	80%	0.797	83%	0.827	S	S	*	*			trans	-131.1	124.2	155.5	65.9	0	0	0	0	110.2	N34	S32-N34 PolarHBondContact O-N 3.17Å
33	N	28.3	Very low	26.8	Very low	144 Å²	144	159.3 Å²	159.3	77%	0.77	81%	0.814	S	S	*	*			trans	-71.2	126.6	-177.3	-67.7	-36.4	0	0	0	112
34	N	24.4	Very low	26.9	Very low	155 Å²	155	162.7 Å²	162.7	83%	0.829	82%	0.823	S	S	*	*				-168.3	156.8	112.2	-98.1	-11.6	0	0	0	114.1	S32	S32-N34 PolarHBondContact O-N 3.17Å
35	E	29.6	Very low	27.2	Very low	171 Å²	171	159.5 Å²	159.5	80%	0.799	80%	0.803	S	S	*	*			trans	-26.7	118	178.3	-54.2	178.9	151.9	0	0	117.6
36	H	25.8	Very low	27.8	Very low	172 Å²	172	152.3 Å²	152.3	80%	0.796	77%	0.768	S	S	*	*				-169.8	135.9	113	-101.4	48.7	0	0	0	110.4	T38	H36-T38 PolarHBondContact O-N 3.26Å
37	R	22.1	Very low	28.9	Very low	254 Å²	254	143.5 Å²	143.5	96%	0.958	73%	0.734	S	S	*	*			trans	-85.4	78.2	-172.6	-163.3	179.3	-166.3	174.4	5	111.5
38	T	24.4	Very low	29.7	Very low	127 Å²	127	138 Å²	138	78%	0.779	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-59.6	139.4	-179.6	48.2	0	0	0	0	112.8	H36	H36-T38 PolarHBondContact O-N 3.26Å
39	V	25.3	Very low	30.6	Very low	137 Å²	137	130.8 Å²	130.8	83%	0.83	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-71.7	137.9	175.6	178.2	0	0	0	0	109.3
40	R	24	Very low	31.2	Very low	226 Å²	226	131.8 Å²	131.8	85%	0.853	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-64.2	128.1	178.8	-77.1	-177.7	170.1	178.9	-4.1	111.3	S42	R40-S42 PolarHBondContact O-N 2.7Å
41	P	29.6	Very low	32.1	Very low	137 Å²	137	123.6 Å²	123.6	89%	0.89	66%	0.657	S	S	*	*			trans	-78	103	173.2	30.8	-32.7	0	0	0	110.5
42	S	27.9	Very low	33.2	Very low	99 Å²	99	116.9 Å²	116.9	69%	0.692	63%	0.63	S	S	*	*			trans	-141.1	13.4	172.9	68.1	0	0	0	0	114.6	R40	R40-S42 PolarHBondContact O-N 2.7Å
43	V	29.3	Very low	34.5	Very low	96 Å²	96	113 Å²	113	58%	0.582	60%	0.6	S	S	*	*			trans	-94.4	94.9	166.7	-177.9	0	0	0	0	107.4	S45	V43-S45 PolarHBondContact O-N 3.47Å
44	M	32.8	Very low	35.9	Very low	179 Å²	179	111 Å²	111	88%	0.882	58%	0.582	S	S	*	*			trans	-78.9	107.5	169.8	-154.7	174.3	-168	0	0	107.4	A46	M44-A46 PolarHBondContact O-N 3.02Å
45	S	36.1	Very low	37.8	Very low	43 Å²	43	106.1 Å²	106.1	30%	0.301	56%	0.557	S	S	.	*			trans	-59.7	127.4	-174.7	168.3	0	0	0	0	111.5	V43 G48 H49	V43-S45 PolarHBondContact O-N 3.47Å; S45-G48 VanDerWaalsContact OG-CA 3.28Å; S45-G48 WeakPolarHBondContact OG-CA 3.42Å; S45-G48 PolarHBondContact OG-N 3.44Å; S45-G48 VanDerWaalsContact OG-N 3.17Å; S45-H49 PolarHBondContact OG-N 3.24Å; S45-H49 PolarHBondContact OG-O 3.49Å
46	A	40.3	Very low	39.2	Very low	9 Å²	9	98.8 Å²	98.8	7%	0.074	53%	0.525	C	S	.	.	S	Bend	trans	-71.5	128.2	159.1	0	0	0	0	0	108.4	M44 G48 H49 V55	M44-A46 PolarHBondContact O-N 3.02Å; A46-G48 PolarHBondContact O-N 2.04Å; A46-H49 PolarHBondContact O-N 3.31Å; A46-V55 HydrophobicContact CB-CG2 4.37Å
47	F	50	Low	41.1	Very low	29 Å²	29	93.5 Å²	93.5	13%	0.127	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	65	10.4	168.1	-52.8	-45	0	0	0	116.9	H49 V55 F862 A891 H925	F47-H49 VanDerWaalsContact C-N 3.32Å; F47-H49 PolarHBondContact O-CD2 2.78Å; F47-H49 PolarHBondContact O-NE2 3.07Å; F47-V55 HydrophobicContact CE1-CG2 4.02Å; F47-V55 HydrophobicContact CE2-CG2 4.27Å; F47-V55 HydrophobicContact CZ-CG2 3.61Å; F47-F862 HydrophobicContact CE2-CE1 4.08Å; F47-A891 HydrophobicContact CD1-CB 4.47Å; F47-A891 HydrophobicContact CE1-CB 3.38Å; F47-A891 HydrophobicContact CZ-CB 3.41Å; F47-A891 VanDerWaalsContact CZ-CB 3.41Å; F47-H925 VanDerWaalsContact CB-CE1 3.43Å; F47-H925 WeakPolarHBondContact CB-CE1 3.49Å; F47-H925 AromaticContact CD1-CE1 3.68Å; F47-H925 AromaticContact CG-CE1 3.91Å; F47-H925 PolarHBondContact O-CE1 3.32Å; F47-H925 PolarHBondContact O-ND1 3.41Å
48	G	43.7	Very low	43	Very low	70 Å²	70	83.3 Å²	83.3	72%	0.722	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	4.3	-178.9	0	0	0	0	0	114.3	S45 A46	S45-G48 VanDerWaalsContact OG-CA 3.28Å; S45-G48 WeakPolarHBondContact OG-CA 3.42Å; S45-G48 PolarHBondContact OG-N 3.44Å; S45-G48 VanDerWaalsContact OG-N 3.17Å; A46-G48 PolarHBondContact O-N 2.04Å
49	H	46.2	Very low	44.6	Very low	44 Å²	44	80.5 Å²	80.5	20%	0.204	45%	0.447	C	S	.	.	S	Bend	trans	-113.6	156.1	-178.9	-51.1	-74	0	0	0	111.6	S45 A46 F47 T51 E976	S45-H49 PolarHBondContact OG-N 3.24Å; S45-H49 PolarHBondContact OG-O 3.49Å; A46-H49 PolarHBondContact O-N 3.31Å; F47-H49 VanDerWaalsContact C-N 3.32Å; F47-H49 PolarHBondContact O-CD2 2.78Å; F47-H49 PolarHBondContact O-NE2 3.07Å; H49-T51 PolarHBondContact O-N 3.07Å; H49-E976 IonicContact CE1-OE1 2.69Å; H49-E976 IonicContact CE1-OE2 3.67Å; H49-E976 PolarHBondContact CE1-OE2 2.86Å; H49-E976 IonicContact CG-OE2 3.6Å; H49-E976 VanDerWaalsContact ND1-CD 3.33Å; H49-E976 IonicContact ND1-OE1 3.54Å; H49-E976 IonicContact ND1-OE2 3.49Å; H49-E976 PolarHBondContact ND1-OE2 3.47Å
50	D	38.2	Very low	46.1	Very low	156 Å²	156	75.3 Å²	75.3	83%	0.834	41%	0.413	S	S	*	.			trans	-74.5	86.7	173.7	-94.4	-28.8	0	0	0	111.2
51	T	45.9	Very low	47.9	Very low	27 Å²	27	64.7 Å²	64.7	17%	0.166	37%	0.373	C	S	.	.			trans	-132.7	141.4	174.5	56.8	0	0	0	0	111.1	H49	H49-T51 PolarHBondContact O-N 3.07Å
52	L	49.1	Very low	49.2	Very low	65 Å²	65	65.1 Å²	65.1	34%	0.34	36%	0.357	S	S	.	.			trans	-87.7	-10.8	178.7	-65.4	179.8	0	0	0	113	L80	L52-L80 HydrophobicContact CB-CD2 3.54Å; L52-L80 HydrophobicContact CD1-CD2 4.39Å
53	D	52.3	Low	50.2	Low	33 Å²	33	64.2 Å²	64.2	18%	0.176	34%	0.344	C	S	.	.			trans	-64.6	142.3	172	-73.5	-85.3	0	0	0	110.8	F862 R1033	D53-F862 HydrophobicContact CB-CD1 3.78Å; D53-F862 HydrophobicContact CB-CE1 4.15Å; D53-R1033 IonicContact OD1-CZ 3Å; D53-R1033 VanDerWaalsContact OD1-CZ 3.26Å; D53-R1033 IonicContact OD1-NH1 3.68Å; D53-R1033 PolarHBondContact OD1-NH1 3.09Å; D53-R1033 IonicContact OD1-NH2 2.75Å; D53-R1033 PolarHBondContact OD1-NH2 3.07Å
54	R	57.9	Low	51	Low	103 Å²	103	64.9 Å²	64.9	39%	0.389	36%	0.36	S	S	.	.			trans	-116.1	145.3	178.4	-67.8	-170.8	-179.4	151.4	3.2	112.3	F60 V73 D863	R54-F60 HydrophobicContact CB-CE2 4.44Å; R54-F60 HydrophobicContact CB-CZ 4.32Å; R54-V73 PolarHBondContact NH1-O 3.16Å; R54-D863 PolarHBondContact O-N 2.84Å
55	V	62.7	Low	51.6	Low	51 Å²	51	59.3 Å²	59.3	31%	0.309	35%	0.348	S	S	.	.			trans	-66.3	145.7	172	-172.1	0	0	0	0	109.5	A46 F47 N57	A46-V55 HydrophobicContact CB-CG2 4.37Å; F47-V55 HydrophobicContact CE1-CG2 4.02Å; F47-V55 HydrophobicContact CE2-CG2 4.27Å; F47-V55 HydrophobicContact CZ-CG2 3.61Å; V55-N57 PolarHBondContact O-N 3.09Å
56	P	59.1	Low	51.6	Low	17 Å²	17	61.3 Å²	61.3	11%	0.11	36%	0.362	C	S	.	.			trans	-48.7	127.5	174.9	-32.9	38.6	0	0	0	114.5	W860 M904	P56-W860 HydrophobicContact CB-CD2 4.04Å; P56-W860 HydrophobicContact CB-CE3 3.79Å; P56-W860 HydrophobicContact CB-CH2 3.66Å; P56-W860 HydrophobicContact CB-CZ2 3.9Å; P56-W860 HydrophobicContact CB-CZ3 3.59Å; P56-W860 HydrophobicContact CG-CD2 3.47Å; P56-W860 VanDerWaalsContact CG-CD2 3.47Å; P56-W860 HydrophobicContact CG-CE3 3.72Å; P56-W860 HydrophobicContact CG-CG 3.94Å; P56-W860 HydrophobicContact CG-CH2 4.11Å; P56-W860 HydrophobicContact CG-CZ2 3.88Å; P56-W860 HydrophobicContact CG-CZ3 4.02Å; P56-M904 HydrophobicContact CB-CE 4.41Å; P56-M904 HydrophobicContact CB-SD 4.38Å
57	N	66.4	Low	51.5	Low	62 Å²	62	68.2 Å²	68.2	33%	0.332	40%	0.403	S	S	.	.			trans	-139.1	145.5	176.4	-171.8	-66	0	0	0	110.3	V55 D59 F60 Y61	V55-N57 PolarHBondContact O-N 3.09Å; N57-D59 PolarHBondContact O-N 2.99Å; N57-D59 PolarHBondContact OD1-N 2.95Å; N57-F60 HydrophobicContact CB-CD2 3.86Å; N57-F60 HydrophobicContact CB-CE2 3.62Å; N57-F60 HydrophobicContact CB-CZ 4.42Å; N57-Y61 WeakPolarHBondContact O-CD2 3.48Å
58	I	61.2	Low	50.8	Low	40 Å²	40	71.8 Å²	71.8	21%	0.205	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-60.9	-28.4	-179.3	-175.8	160.2	0	0	0	114	F60 Y61 L907 K910 F1042	I58-F60 VanDerWaalsContact C-N 3.31Å; I58-F60 PolarHBondContact O-N 3.3Å; I58-Y61 PolarHBondContact O-N 3.34Å; I58-Y61 VanDerWaalsContact O-N 3.12Å; I58-L907 HydrophobicContact CB-CD1 4.09Å; I58-L907 HydrophobicContact CD1-CD1 4.22Å; I58-L907 HydrophobicContact CG1-CD1 3.89Å; I58-K910 HydrophobicContact CD1-CD 3.81Å; I58-F1042 HydrophobicContact CG1-CE1 4.09Å; I58-F1042 HydrophobicContact CG1-CZ 4.27Å
59	D	59.6	Low	50.5	Low	68 Å²	68	71.5 Å²	71.5	36%	0.364	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-73.2	-22.7	-171.7	-74.5	-4.3	0	0	0	113.9	N57 Y61 R62	N57-D59 PolarHBondContact O-N 2.99Å; N57-D59 PolarHBondContact OD1-N 2.95Å; D59-Y61 PolarHBondContact O-N 2.94Å; D59-R62 PolarHBondContact O-N 3.46Å; D59-R62 IonicContact OD1-CZ 2.86Å; D59-R62 IonicContact OD1-NE 2.71Å; D59-R62 PolarHBondContact OD1-NE 2.78Å; D59-R62 IonicContact OD1-NH2 2.86Å; D59-R62 PolarHBondContact OD1-NH2 2.7Å; D59-R62 IonicContact OD2-CZ 2.8Å; D59-R62 IonicContact OD2-NH2 3.93Å; D59-R62 PolarHBondContact OD2-NH2 3.35Å
60	F	55.3	Low	49.8	Very low	27 Å²	27	79.3 Å²	79.3	12%	0.118	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-70.2	-5.7	171.9	-51.2	-54.6	0	0	0	114	R54 N57 I58 A72 R74 D863 S1038	R54-F60 HydrophobicContact CB-CE2 4.44Å; R54-F60 HydrophobicContact CB-CZ 4.32Å; N57-F60 HydrophobicContact CB-CD2 3.86Å; N57-F60 HydrophobicContact CB-CE2 3.62Å; N57-F60 HydrophobicContact CB-CZ 4.42Å; I58-F60 VanDerWaalsContact C-N 3.31Å; I58-F60 PolarHBondContact O-N 3.3Å; F60-A72 HydrophobicContact CD1-CB 4.38Å; F60-A72 HydrophobicContact CE1-CB 3.84Å; F60-R74 VanDerWaalsContact CB-NH2 3.3Å; F60-R74 HydrophobicContact CD1-CG 3.88Å; F60-R74 HydrophobicContact CE1-CG 4.27Å; F60-R74 HydrophobicContact CG-CG 4.24Å; F60-D863 HydrophobicContact CD2-CB 4.44Å; F60-D863 WeakPolarHBondContact CD2-OD2 3.04Å; F60-D863 WeakPolarHBondContact CG-OD2 3Å; F60-S1038 PolarHBondContact O-OG 3.03Å
61	Y	61.7	Low	49.9	Very low	3 Å²	3	81.9 Å²	81.9	1%	0.012	46%	0.463	C	S	.	.	G	3₁₀ helix	trans	-113.6	10.8	-177.6	-63.1	-86.1	0	0	0	113.4	N57 I58 D59 R74 W860 D863 G866 F911 L1040 F1042	N57-Y61 WeakPolarHBondContact O-CD2 3.48Å; I58-Y61 PolarHBondContact O-N 3.34Å; I58-Y61 VanDerWaalsContact O-N 3.12Å; D59-Y61 PolarHBondContact O-N 2.94Å; Y61-R74 VanDerWaalsContact CZ-NH2 3.3Å; Y61-R74 PolarHBondContact OH-NH2 3Å; Y61-W860 HydrophobicContact CE2-CH2 4.32Å; Y61-W860 WeakPolarHBondContact OH-CZ2 2.99Å; Y61-D863 PolarHBondContact OH-OD1 3.08Å; Y61-G866 PolarHBondContact OH-N 2.77Å; Y61-G866 VanDerWaalsContact OH-N 3.11Å; Y61-F911 HydrophobicContact CD1-CE1 4.29Å; Y61-F911 AromaticContact CD1-CZ 3.65Å; Y61-F911 HydrophobicContact CD1-CZ 3.65Å; Y61-F911 HydrophobicContact CD2-CZ 4.3Å; Y61-F911 HydrophobicContact CE1-CZ 4.16Å; Y61-F911 HydrophobicContact CG-CE1 4.49Å; Y61-F911 AromaticContact CG-CZ 3.73Å; Y61-F911 HydrophobicContact CG-CZ 3.73Å; Y61-L1040 HydrophobicContact CD1-CB 4.45Å; Y61-L1040 WeakPolarHBondContact CD1-O 3.45Å; Y61-L1040 HydrophobicContact CE1-CB 4.35Å; Y61-F1042 WeakPolarHBondContact O-CE1 3.44Å
62	R	58	Low	49.8	Very low	146 Å²	146	83 Å²	83	55%	0.551	48%	0.475	S	S	*	.	S	Bend	trans	-76	153.3	172.4	-62.9	-177	-174.1	-149.5	12.3	111.7	D59 F1042	D59-R62 PolarHBondContact O-N 3.46Å; D59-R62 IonicContact OD1-CZ 2.86Å; D59-R62 IonicContact OD1-NE 2.71Å; D59-R62 PolarHBondContact OD1-NE 2.78Å; D59-R62 IonicContact OD1-NH2 2.86Å; D59-R62 PolarHBondContact OD1-NH2 2.7Å; D59-R62 IonicContact OD2-CZ 2.8Å; D59-R62 IonicContact OD2-NH2 3.93Å; D59-R62 PolarHBondContact OD2-NH2 3.35Å; R62-F1042 HydrophobicContact CG-CZ 4.48Å
63	N	47.8	Very low	49.5	Very low	81 Å²	81	83.8 Å²	83.8	43%	0.433	48%	0.482	S	S	.	.			trans	-75	144.7	-175.4	-163.4	7.3	0	0	0	112.6	G65 Y1043	N63-G65 VanDerWaalsContact C-N 3.3Å; N63-G65 PolarHBondContact O-N 3.5Å; N63-Y1043 HydrophobicContact CB-CD2 3.94Å; N63-Y1043 HydrophobicContact CB-CG 4.08Å
64	A	46.2	Very low	49.5	Very low	109 Å²	109	84.3 Å²	84.3	90%	0.901	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-20.3	-171.9	0	0	0	0	0	114.8
65	G	45	Very low	48.9	Very low	63 Å²	63	81 Å²	81	65%	0.649	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	14.8	-178.4	0	0	0	0	0	116.1	N63 V67	N63-G65 VanDerWaalsContact C-N 3.3Å; N63-G65 PolarHBondContact O-N 3.5Å; G65-V67 PolarHBondContact O-N 3.23Å
66	S	37.3	Very low	48.4	Very low	84 Å²	84	80.6 Å²	80.6	59%	0.587	47%	0.473	S	S	*	.			trans	-86.4	108.7	-177.1	-177.3	0	0	0	0	111.9	S68	S66-S68 PolarHBondContact O-N 3.01Å
67	V	38.4	Very low	48.2	Very low	154 Å²	154	80.9 Å²	80.9	93%	0.933	47%	0.473	S	S	*	.			trans	-79	35.1	-171.4	-161.2	0	0	0	0	113.5	G65	G65-V67 PolarHBondContact O-N 3.23Å
68	S	35.1	Very low	47.4	Very low	104 Å²	104	84.5 Å²	84.5	73%	0.727	49%	0.488	S	S	*	.	S	Bend	trans	-159.4	137.6	171.1	-171.7	0	0	0	0	112.3	S66	S66-S68 PolarHBondContact O-N 3.01Å
69	G	37.1	Very low	47.2	Very low	64 Å²	64	87.5 Å²	87.5	66%	0.66	50%	0.502	S	S	*	.	S	Bend	trans	111.2	128.7	-179.1	0	0	0	0	0	113.4
70	H	32.2	Very low	46.9	Very low	209 Å²	209	85 Å²	85	97%	0.968	49%	0.488	S	S	*	.			trans	-67.1	131.8	171.1	-87.6	74.6	0	0	0	110.2
71	R	40	Very low	46.7	Very low	210 Å²	210	85.6 Å²	85.6	79%	0.792	49%	0.491	S	S	*	.			trans	-89	124.4	-169.5	179.4	-179.4	175.6	-167.4	-2.3	112.5	V73	R71-V73 HydrophobicContact CG-CG2 4.1Å; R71-V73 PolarHBondContact O-N 3.27Å; R71-V73 VanDerWaalsContact O-N 3.17Å
72	A	43.9	Very low	46.1	Very low	50 Å²	50	88.9 Å²	88.9	41%	0.413	51%	0.509	S	S	.	.			trans	-71.8	102.7	160.5	0	0	0	0	0	109.7	F60	F60-A72 HydrophobicContact CD1-CB 4.38Å; F60-A72 HydrophobicContact CE1-CB 3.84Å
73	V	41.4	Very low	45.4	Very low	82 Å²	82	86.3 Å²	86.3	50%	0.497	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-78.4	133	176.4	178.6	0	0	0	0	109.6	R54 R71	R54-V73 PolarHBondContact NH1-O 3.16Å; R71-V73 HydrophobicContact CG-CG2 4.1Å; R71-V73 PolarHBondContact O-N 3.27Å; R71-V73 VanDerWaalsContact O-N 3.17Å
74	R	53.4	Low	44.9	Very low	43 Å²	43	91.3 Å²	91.3	16%	0.162	53%	0.528	C	S	.	.	P	Polyproline II helix	trans	-77.1	138.2	165.1	-70.3	-175.3	179.6	130.1	4	108.6	F60 Y61 D863 H1036 S1038	F60-R74 VanDerWaalsContact CB-NH2 3.3Å; F60-R74 HydrophobicContact CD1-CG 3.88Å; F60-R74 HydrophobicContact CE1-CG 4.27Å; F60-R74 HydrophobicContact CG-CG 4.24Å; Y61-R74 VanDerWaalsContact CZ-NH2 3.3Å; Y61-R74 PolarHBondContact OH-NH2 3Å; R74-D863 IonicContact CZ-OD2 3.97Å; R74-D863 IonicContact NE-OD2 3.28Å; R74-D863 PolarHBondContact NE-OD2 3.08Å; R74-D863 IonicContact NH2-OD1 3.37Å; R74-D863 PolarHBondContact NH2-OD1 2.82Å; R74-D863 IonicContact NH2-OD2 2.71Å; R74-D863 PolarHBondContact NH2-OD2 3.26Å; R74-H1036 PolarHBondContact NH1-O 3.25Å; R74-S1038 PolarHBondContact NH1-OG 2.96Å
75	P	45.7	Very low	44.5	Very low	33 Å²	33	94.7 Å²	94.7	21%	0.214	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-56	144.6	164.3	-21.3	33.1	0	0	0	110.8	E79 L80	P75-E79 WeakPolarHBondContact CA-OE2 3.32Å; P75-E79 HydrophobicContact CB-CB 4.33Å; P75-L80 HydrophobicContact CB-CD2 3.98Å; P75-L80 HydrophobicContact CB-CG 4.08Å; P75-L80 HydrophobicContact CG-CD2 4.29Å
76	S	52.6	Low	44	Very low	44 Å²	44	101 Å²	101	31%	0.308	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-70.2	160	167.1	71	0	0	0	0	111.1	Q78 E79 L80	S76-Q78 PolarHBondContact O-N 3.27Å; S76-E79 WeakPolarHBondContact CB-OE1 3.31Å; S76-E79 PolarHBondContact N-OE2 2.03Å; S76-E79 PolarHBondContact O-N 3.24Å; S76-E79 VanDerWaalsContact O-N 3.16Å; S76-E79 WeakPolarHBondContact OG-CB 3.43Å; S76-E79 WeakPolarHBondContact OG-CG 3.27Å; S76-E79 PolarHBondContact OG-N 3.31Å; S76-E79 VanDerWaalsContact OG-N 3.1Å; S76-E79 PolarHBondContact OG-OE1 3.02Å; S76-L80 PolarHBondContact O-N 2.56Å
77	L	53.5	Low	43.6	Very low	22 Å²	22	105.3 Å²	105.3	12%	0.115	55%	0.551	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.1	-30.3	179.4	-168.1	58.6	0	0	0	111.5	F755 I1004	L77-F755 HydrophobicContact CD2-CB 3.75Å; L77-F755 HydrophobicContact CD2-CD1 4.1Å; L77-F755 HydrophobicContact CD2-CG 4.25Å; L77-F755 WeakPolarHBondContact CD2-O 3.45Å; L77-F755 HydrophobicContact CG-CB 4.16Å; L77-I1004 HydrophobicContact CD1-CD1 3.9Å
78	Q	50.5	Low	43	Very low	138 Å²	138	101.6 Å²	101.6	65%	0.645	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-38.1	173.6	-165	171.5	16	0	0	112.5	S76 L80 H81 D82	S76-Q78 PolarHBondContact O-N 3.27Å; Q78-L80 VanDerWaalsContact C-N 3.26Å; Q78-L80 PolarHBondContact O-N 3.14Å; Q78-H81 VanDerWaalsContact O-CB 3.29Å; Q78-H81 WeakPolarHBondContact O-CB 3.41Å; Q78-H81 PolarHBondContact O-N 3.03Å; Q78-D82 WeakPolarHBondContact CG-OD2 3.21Å; Q78-D82 PolarHBondContact O-N 3.17Å; Q78-D82 VanDerWaalsContact O-N 3.15Å
79	E	55.9	Low	42.5	Very low	104 Å²	104	101.7 Å²	101.7	49%	0.486	55%	0.55	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.1	-26	171.3	-76.9	151	-134.8	0	0	113.4	P75 S76 H81 V83	P75-E79 WeakPolarHBondContact CA-OE2 3.32Å; P75-E79 HydrophobicContact CB-CB 4.33Å; S76-E79 WeakPolarHBondContact CB-OE1 3.31Å; S76-E79 PolarHBondContact N-OE2 2.03Å; S76-E79 PolarHBondContact O-N 3.24Å; S76-E79 VanDerWaalsContact O-N 3.16Å; S76-E79 WeakPolarHBondContact OG-CB 3.43Å; S76-E79 WeakPolarHBondContact OG-CG 3.27Å; S76-E79 PolarHBondContact OG-N 3.31Å; S76-E79 VanDerWaalsContact OG-N 3.1Å; S76-E79 PolarHBondContact OG-OE1 3.02Å; E79-H81 PolarHBondContact O-N 3Å; E79-V83 WeakPolarHBondContact O-CG2 3.46Å
80	L	54.5	Low	42	Very low	16 Å²	16	106.3 Å²	106.3	8%	0.084	56%	0.558	C	S	.	*	T	Hydrogen-bonded Turn	trans	-71.8	-12.8	172.1	-69.4	173.4	0	0	0	112.9	L52 P75 S76 Q78 R1006	L52-L80 HydrophobicContact CB-CD2 3.54Å; L52-L80 HydrophobicContact CD1-CD2 4.39Å; P75-L80 HydrophobicContact CB-CD2 3.98Å; P75-L80 HydrophobicContact CB-CG 4.08Å; P75-L80 HydrophobicContact CG-CD2 4.29Å; S76-L80 PolarHBondContact O-N 2.56Å; Q78-L80 VanDerWaalsContact C-N 3.26Å; Q78-L80 PolarHBondContact O-N 3.14Å; L80-R1006 PolarHBondContact O-NE 2.95Å
81	H	51.4	Low	41.6	Very low	38 Å²	38	101.7 Å²	101.7	18%	0.176	55%	0.549	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-51	-163.9	-163.5	-102.8	0	0	0	113.1	Q78 E79 H752 D756 K1007	Q78-H81 VanDerWaalsContact O-CB 3.29Å; Q78-H81 WeakPolarHBondContact O-CB 3.41Å; Q78-H81 PolarHBondContact O-N 3.03Å; E79-H81 PolarHBondContact O-N 3Å; H81-H752 AromaticContact NE2-ND1 3.9Å; H81-D756 IonicContact CE1-OD1 2.84Å; H81-D756 IonicContact NE2-OD1 2.95Å; H81-K1007 VanDerWaalsContact CE1-CD 3.45Å; H81-K1007 WeakPolarHBondContact CE1-CD 3.38Å; H81-K1007 WeakPolarHBondContact NE2-CB 3.29Å
82	D	48	Very low	41.1	Very low	73 Å²	73	97.1 Å²	97.1	39%	0.39	55%	0.545	S	S	.	.			trans	-99	0.8	-159.5	-62.7	-20.2	0	0	0	116.7	Q78 F84 Q85	Q78-D82 WeakPolarHBondContact CG-OD2 3.21Å; Q78-D82 PolarHBondContact O-N 3.17Å; Q78-D82 VanDerWaalsContact O-N 3.15Å; D82-F84 VanDerWaalsContact C-N 3.25Å; D82-F84 PolarHBondContact O-N 3.3Å; D82-Q85 PolarHBondContact O-N 3.41Å
83	V	43.8	Very low	40.3	Very low	91 Å²	91	100.7 Å²	100.7	55%	0.552	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-19.3	-159.1	167.6	0	0	0	0	116.9	E79	E79-V83 WeakPolarHBondContact O-CG2 3.46Å
84	F	36.8	Very low	39.4	Very low	187 Å²	187	105.4 Å²	105.4	82%	0.82	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-4.5	-177.2	-85.2	-76.1	0	0	0	116.4	D82 K86	D82-F84 VanDerWaalsContact C-N 3.25Å; D82-F84 PolarHBondContact O-N 3.3Å; F84-K86 PolarHBondContact O-N 3.13Å
85	Q	37.7	Very low	38.1	Very low	180 Å²	180	109.4 Å²	109.4	84%	0.841	61%	0.61	S	S	*	*	S	Bend	trans	-84	0.5	-175.5	-74.3	-163.5	-7.7	0	0	116.1	D82	D82-Q85 PolarHBondContact O-N 3.41Å
86	K	34.6	Very low	37.2	Very low	196 Å²	196	113.9 Å²	113.9	85%	0.852	64%	0.636	S	S	*	*			trans	-109.9	82	-178.5	-77.2	-174.3	175	176.8	0	114	F84	F84-K86 PolarHBondContact O-N 3.13Å
87	N	28.8	Very low	35.9	Very low	174 Å²	174	117.6 Å²	117.6	93%	0.93	66%	0.657	S	S	*	*			trans	-143.2	89.6	151.7	-96.8	-29.4	0	0	0	108.4
88	G	26.3	Very low	34.5	Very low	76 Å²	76	123.2 Å²	123.2	78%	0.784	69%	0.687	S	S	*	*			trans	-164.8	148.3	-176.9	0	0	0	0	0	110.2
89	A	24.8	Very low	33.3	Very low	105 Å²	105	124.4 Å²	124.4	87%	0.868	70%	0.698	S	S	*	*			trans	-75.8	154.9	-164.6	0	0	0	0	0	114.6
90	I	26.5	Very low	31.8	Very low	161 Å²	161	122.9 Å²	122.9	83%	0.826	71%	0.71	S	S	*	*			trans	-76.7	135.7	169.1	-62.2	166.1	0	0	0	109.1	V92	I90-V92 HydrophobicContact CG2-CG2 4.33Å
91	S	24	Very low	30.5	Very low	112 Å²	112	132.1 Å²	132.1	78%	0.783	75%	0.753	S	S	*	*			trans	-139.5	142.7	156.2	56	0	0	0	0	110.3
92	V	28.3	Very low	29.3	Very low	115 Å²	115	134.3 Å²	134.3	70%	0.697	79%	0.786	S	S	*	*			trans	-128	142.1	175.8	-176.6	0	0	0	0	106.8	I90	I90-V92 HydrophobicContact CG2-CG2 4.33Å
93	P	26.8	Very low	28.2	Very low	124 Å²	124	136.6 Å²	136.6	81%	0.805	81%	0.808	S	S	*	*			trans	-126.6	159.4	139.9	6.5	15.3	0	0	0	112.3
94	E	23.7	Very low	27.3	Very low	182 Å²	182	141.9 Å²	141.9	85%	0.85	83%	0.826	S	S	*	*			trans	-101.3	-178.1	-177.1	-66	-179.9	115.1	0	0	113.4
95	T	25.6	Very low	26.8	Very low	127 Å²	127	135.8 Å²	135.8	78%	0.779	82%	0.816	S	S	*	*			trans	-62.1	173.9	178.7	52.3	0	0	0	0	114.9
96	V	26.7	Very low	26.2	Very low	127 Å²	127	134 Å²	134	77%	0.77	82%	0.818	S	S	*	*			cis	-128.7	-140.7	10.5	-140.3	0	0	0	0	111.1
97	T	25	Very low	26.2	Very low	121 Å²	121	129.9 Å²	129.9	74%	0.742	81%	0.811	S	S	*	*			cis	-158.2	-170.9	11.1	-22.9	0	0	0	0	110.8
98	D	24.6	Very low	26	Very low	141 Å²	141	126.3 Å²	126.3	75%	0.754	80%	0.799	S	S	*	*			trans	-51.2	167.7	169.5	-76.7	-58.5	0	0	0	116.4
99	D	25.5	Very low	25.9	Very low	163 Å²	163	130.1 Å²	130.1	87%	0.872	80%	0.802	S	S	*	*			cis	-105.2	-172.2	10.2	-34.9	-91.4	0	0	0	114.2
100	G	25.1	Very low	26	Very low	72 Å²	72	132.4 Å²	132.4	74%	0.742	80%	0.8	S	S	*	*			cis	-179	-163.3	7.6	0	0	0	0	0	114
101	E	26.4	Very low	25.9	Very low	209 Å²	209	132.7 Å²	132.7	98%	0.977	80%	0.802	S	S	*	*			trans	-95.4	157.7	-171.8	-63.1	-170.8	128.9	0	0	116.3
102	G	25.8	Very low	26.1	Very low	84 Å²	84	135.6 Å²	135.6	87%	0.866	80%	0.803	S	S	*	*			trans	176.6	87.2	169.9	0	0	0	0	0	114.1
103	S	25.3	Very low	25.9	Very low	122 Å²	122	136 Å²	136	85%	0.853	81%	0.811	S	S	*	*			trans	-104.7	134.6	-173.3	160.8	0	0	0	0	113.9
104	E	25.8	Very low	25.9	Very low	202 Å²	202	134.3 Å²	134.3	94%	0.944	81%	0.808	S	S	*	*			trans	-157.2	159.8	143.5	-129.7	175.8	-140.1	0	0	110.9
105	G	24.8	Very low	26.1	Very low	58 Å²	58	129.8 Å²	129.8	60%	0.598	80%	0.801	S	S	*	*			trans	178.3	160	177	0	0	0	0	0	118.4
106	T	25.6	Very low	26.4	Very low	144 Å²	144	129.9 Å²	129.9	88%	0.883	80%	0.804	S	S	*	*			trans	67.4	165.3	173	78.1	0	0	0	0	116.1
107	P	34.5	Very low	26.6	Very low	108 Å²	108	130.5 Å²	130.5	70%	0.701	80%	0.801	S	S	*	*			cis	-126.8	-157.6	-12	35.1	-14.9	0	0	0	112.4
108	S	24.6	Very low	26.7	Very low	99 Å²	99	132 Å²	132	69%	0.692	81%	0.805	S	S	*	*			trans	71.9	149.3	160.4	70.5	0	0	0	0	118.5
109	D	24	Very low	27	Very low	157 Å²	157	132 Å²	132	84%	0.84	81%	0.809	S	S	*	*			cis	-154.2	165.1	-11.8	-114.2	-0.8	0	0	0	111.3
110	D	26.5	Very low	27.2	Very low	153 Å²	153	130.2 Å²	130.2	82%	0.818	81%	0.805	S	S	*	*			trans	-68.6	143.4	169	-67.5	-59.7	0	0	0	112
111	L	25.7	Very low	27.6	Very low	167 Å²	167	136.7 Å²	136.7	87%	0.874	81%	0.813	S	S	*	*				-161.6	160.3	127.7	-137.2	60.8	0	0	0	115.9
112	E	27.2	Very low	28.1	Very low	172 Å²	172	130.4 Å²	130.4	80%	0.804	80%	0.804	S	S	*	*			trans	-70.7	152.9	-179.9	-52.1	172.1	112.2	0	0	113.8
113	S	25.1	Very low	29.3	Very low	125 Å²	125	130.8 Å²	130.8	87%	0.874	80%	0.799	S	S	*	*			trans	-127.3	55.9	164.6	54.4	0	0	0	0	112.1	A115	S113-A115 PolarHBondContact O-N 3.41Å
114	A	26.7	Very low	30.9	Very low	88 Å²	88	131.6 Å²	131.6	73%	0.727	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-69.2	117.5	170.1	0	0	0	0	0	110.6
115	A	28.5	Very low	33.2	Very low	86 Å²	86	127.7 Å²	127.7	71%	0.711	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-64.3	138.7	-176.1	0	0	0	0	0	112.9	S113	S113-A115 PolarHBondContact O-N 3.41Å
116	P	31.3	Very low	35.8	Very low	129 Å²	129	127.6 Å²	127.6	84%	0.838	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-70.7	154	174.1	31	-35.1	0	0	0	111.5
117	I	29.7	Very low	38.6	Very low	140 Å²	140	122.8 Å²	122.8	72%	0.718	74%	0.74	S	S	*	*			trans	-117.7	136.6	174.6	-63.6	175.5	0	0	0	108.5
118	D	27.7	Very low	41.2	Very low	153 Å²	153	122.3 Å²	122.3	82%	0.818	72%	0.724	S	S	*	*			trans	-54.6	133.6	-176.3	-78.2	-60.6	0	0	0	114.6
119	V	30.5	Very low	44.2	Very low	140 Å²	140	122 Å²	122	85%	0.848	71%	0.714	S	S	*	*			trans	-94.1	98.9	175.6	-179	0	0	0	0	109.9
120	T	30	Very low	47	Very low	126 Å²	126	120.6 Å²	120.6	77%	0.773	70%	0.697	S	S	*	*			trans	-102.5	111.9	171.2	33.7	0	0	0	0	112.4
121	K	33	Very low	49.6	Very low	209 Å²	209	113.3 Å²	113.3	91%	0.909	66%	0.658	S	S	*	*			trans	46.8	81.9	159.2	-62.5	-178.2	179.6	178.3	0	116.1
122	G	38.1	Very low	52.7	Low	76 Å²	76	105.4 Å²	105.4	78%	0.784	62%	0.617	S	S	*	*			trans	-71.9	141.6	176.7	0	0	0	0	0	114.8
123	A	51	Low	55.7	Low	93 Å²	93	98.1 Å²	98.1	77%	0.769	58%	0.583	S	S	*	*			trans	-69.5	161.5	158.9	0	0	0	0	0	111	K125	A123-K125 PolarHBondContact O-N 2.89Å
124	V	58.2	Low	58.7	Low	138 Å²	138	93.3 Å²	93.3	84%	0.836	55%	0.548	S	S	*	.			trans	-71.2	102.1	-178	-177.1	0	0	0	0	110.7
125	K	74.6	Confident	61.5	Low	120 Å²	120	90.9 Å²	90.9	52%	0.522	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-73.4	142.3	179.3	-72.9	-178	155.4	-127.5	0	113.1	A123 G351 D352 L353 R354	A123-K125 PolarHBondContact O-N 2.89Å; K125-G351 WeakPolarHBondContact CE-O 3.2Å; K125-G351 PolarHBondContact NZ-O 3.38Å; K125-D352 CarbonylContact C-O 3.58Å; K125-D352 VanDerWaalsContact CA-O 3.23Å; K125-D352 WeakPolarHBondContact CA-O 3.38Å; K125-D352 WeakPolarHBondContact CB-O 3.49Å; K125-L353 WeakPolarHBondContact CD-O 3.19Å; K125-L353 PolarHBondContact NZ-O 3.12Å; K125-R354 HydrophobicContact CB-CB 4.33Å
126	F	78.9	Confident	64.5	Low	57 Å²	57	86.8 Å²	86.8	25%	0.25	49%	0.487	C	S	.	.	B	Isolated β-bridge	trans	-81	146.6	-178.9	-60.3	-69.5	0	0	0	113.2	R130 I349 D352 L353 R354	F126-R130 HydrophobicContact CD1-CG 4.2Å; F126-I349 HydrophobicContact CD2-CD1 4.39Å; F126-D352 HydrophobicContact CD2-CB 4Å; F126-D352 HydrophobicContact CE2-CB 4.33Å; F126-D352 PolarHBondContact N-O 3.11Å; F126-L353 HydrophobicContact CB-CD2 4.39Å; F126-L353 WeakPolarHBondContact O-CA 3.45Å; F126-R354 PolarHBondContact O-N 3.38Å
127	G	84.5	Confident	67.3	Low	42 Å²	42	81.6 Å²	81.6	43%	0.433	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-84.4	164.5	167.2	0	0	0	0	0	112.7	I129 R130 G131	G127-I129 VanDerWaalsContact C-N 3.31Å; G127-I129 PolarHBondContact O-N 3.41Å; G127-R130 PolarHBondContact O-N 2.91Å; G127-G131 PolarHBondContact O-N 3.35Å
128	W	89.5	Confident	70	Confident	99 Å²	99	75 Å²	75	38%	0.375	42%	0.418	S	S	.	.	H	α-helix	trans	-56.8	-36.5	-171.3	72.9	-89.4	0	0	0	114.9	V132 L133 A359 K362 L366	W128-V132 WeakPolarHBondContact O-CA 3.37Å; W128-V132 WeakPolarHBondContact O-CB 3.45Å; W128-V132 PolarHBondContact O-N 2.93Å; W128-L133 HydrophobicContact CE3-CB 4.4Å; W128-L133 HydrophobicContact CZ3-CB 4.33Å; W128-L133 HydrophobicContact CZ3-CD2 4.02Å; W128-L133 PolarHBondContact O-N 2.78Å; W128-A359 HydrophobicContact CB-CB 3.46Å; W128-A359 VanDerWaalsContact CB-CB 3.46Å; W128-K362 HydrophobicContact CE3-CB 4.3Å; W128-L366 HydrophobicContact CH2-CD2 4.12Å; W128-L366 HydrophobicContact CZ3-CD2 4.05Å
129	I	88.2	Confident	72.9	Confident	93 Å²	93	68.3 Å²	68.3	48%	0.477	38%	0.382	S	S	.	.	I	π-helix	trans	-63	-56.3	178.5	-57.4	177.4	0	0	0	110.5	G127 L133 V134	G127-I129 VanDerWaalsContact C-N 3.31Å; G127-I129 PolarHBondContact O-N 3.41Å; I129-L133 HydrophobicContact CG2-CD2 4.39Å; I129-L133 WeakPolarHBondContact O-CB 3.3Å; I129-L133 PolarHBondContact O-N 2.9Å; I129-V134 WeakPolarHBondContact O-CG2 3.04Å; I129-V134 PolarHBondContact O-N 3.46Å
130	R	82.4	Confident	75.8	Confident	126 Å²	126	61.7 Å²	61.7	48%	0.475	34%	0.342	S	S	.	.	I	π-helix	trans	-74.8	-35.7	-175.8	-176.7	174.2	174.6	-178.9	2.3	112.9	F126 G127	F126-R130 HydrophobicContact CD1-CG 4.2Å; G127-R130 PolarHBondContact O-N 2.91Å
131	G	81.3	Confident	78.7	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.01	31%	0.306	C	S	.	.	I	π-helix	trans	-85	-37.1	-175.9	0	0	0	0	0	114.5	G127	G127-G131 PolarHBondContact O-N 3.35Å
132	V	89.5	Confident	81.1	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.264	C	S	.	.	I	π-helix	trans	-110.9	-63.2	-175.6	-174	0	0	0	0	111.1	W128 V134 R135 C136 L353 A359 I360	W128-V132 WeakPolarHBondContact O-CA 3.37Å; W128-V132 WeakPolarHBondContact O-CB 3.45Å; W128-V132 PolarHBondContact O-N 2.93Å; V132-V134 PolarHBondContact O-N 3.24Å; V132-R135 PolarHBondContact O-N 2.9Å; V132-C136 WeakPolarHBondContact O-CB 3.41Å; V132-C136 PolarHBondContact O-N 2.8Å; V132-C136 PolarHBondContact O-SG 3Å; V132-C136 VanDerWaalsContact O-SG 3.39Å; V132-L353 HydrophobicContact CG2-CD1 3.66Å; V132-L353 HydrophobicContact CG2-CD2 3.88Å; V132-L353 HydrophobicContact CG2-CG 4.46Å; V132-A359 HydrophobicContact CG2-CB 3.96Å; V132-I360 HydrophobicContact CG2-CG1 4.19Å
133	L	90.8	Very high	83.2	Confident	19 Å²	19	42.5 Å²	42.5	10%	0.099	23%	0.227	C	C	.	.	I	π-helix	trans	-56.7	-55.6	-171.2	-179	67.7	0	0	0	111.9	W128 I129 R135 C136 M137 G363 L366 A367 I370	W128-L133 HydrophobicContact CE3-CB 4.4Å; W128-L133 HydrophobicContact CZ3-CB 4.33Å; W128-L133 HydrophobicContact CZ3-CD2 4.02Å; W128-L133 PolarHBondContact O-N 2.78Å; I129-L133 HydrophobicContact CG2-CD2 4.39Å; I129-L133 WeakPolarHBondContact O-CB 3.3Å; I129-L133 PolarHBondContact O-N 2.9Å; L133-R135 VanDerWaalsContact C-N 3.33Å; L133-R135 PolarHBondContact O-N 2.99Å; L133-C136 PolarHBondContact O-N 2.86Å; L133-M137 HydrophobicContact CD1-CG 4.46Å; L133-M137 HydrophobicContact CD1-SD 3.83Å; L133-M137 HydrophobicContact CD2-SD 4.47Å; L133-M137 HydrophobicContact CG-SD 3.75Å; L133-M137 VanDerWaalsContact O-CG 3.3Å; L133-M137 WeakPolarHBondContact O-CG 3.42Å; L133-M137 PolarHBondContact O-N 3.24Å; L133-G363 WeakPolarHBondContact CD1-O 3.26Å; L133-L366 HydrophobicContact CD1-CB 3.98Å; L133-L366 HydrophobicContact CD1-CD2 4.09Å; L133-L366 HydrophobicContact CD1-CG 3.95Å; L133-L366 HydrophobicContact CD2-CD2 4.17Å; L133-A367 HydrophobicContact CD1-CB 4.05Å; L133-I370 HydrophobicContact CD1-CD1 4.44Å
134	V	87.5	Confident	84.9	Confident	24 Å²	24	38.2 Å²	38.2	15%	0.145	19%	0.191	C	C	.	.	H	α-helix	trans	-58.2	-42.2	178.2	162.8	0	0	0	0	112.1	I129 V132 L138 L280	I129-V134 WeakPolarHBondContact O-CG2 3.04Å; I129-V134 PolarHBondContact O-N 3.46Å; V132-V134 PolarHBondContact O-N 3.24Å; V134-L138 HydrophobicContact CG1-CD1 3.86Å; V134-L138 WeakPolarHBondContact O-CB 3.46Å; V134-L138 WeakPolarHBondContact O-CG 3.37Å; V134-L138 PolarHBondContact O-N 2.91Å; V134-L280 HydrophobicContact CB-CD2 4.5Å; V134-L280 HydrophobicContact CG1-CD2 3.93Å; V134-L280 HydrophobicContact CG2-CD2 3.91Å
135	R	86.5	Confident	86.4	Confident	37 Å²	37	31.8 Å²	31.8	14%	0.14	15%	0.152	C	C	.	.	H	α-helix	trans	-72	-36.4	-178.6	-79	-166.8	154.4	-147.8	-9.7	113	V132 L133 N139 E272 Q276	V132-R135 PolarHBondContact O-N 2.9Å; L133-R135 VanDerWaalsContact C-N 3.33Å; L133-R135 PolarHBondContact O-N 2.99Å; R135-N139 PolarHBondContact O-N 3.22Å; R135-N139 PolarHBondContact O-ND2 2.98Å; R135-E272 IonicContact CZ-OE1 2.76Å; R135-E272 IonicContact NH1-OE1 2.78Å; R135-E272 IonicContact NH2-OE1 3.17Å; R135-E272 PolarHBondContact NH2-OE1 2.99Å; R135-Q276 VanDerWaalsContact CZ-OE1 3.29Å; R135-Q276 VanDerWaalsContact NE-OE1 3.12Å
136	C	90.6	Very high	87.1	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.4	-49.1	172.5	-68	0	0	0	0	110.3	V132 L133 L138 N139 I140 G346 T364 A367	V132-C136 WeakPolarHBondContact O-CB 3.41Å; V132-C136 PolarHBondContact O-N 2.8Å; V132-C136 PolarHBondContact O-SG 3Å; V132-C136 VanDerWaalsContact O-SG 3.39Å; L133-C136 PolarHBondContact O-N 2.86Å; C136-L138 VanDerWaalsContact C-N 3.34Å; C136-L138 PolarHBondContact O-N 2.86Å; C136-N139 PolarHBondContact O-N 2.79Å; C136-N139 VanDerWaalsContact O-N 3.07Å; C136-I140 HydrophobicContact CB-CD1 4.31Å; C136-I140 WeakPolarHBondContact O-CD1 3.24Å; C136-I140 WeakPolarHBondContact O-CG1 3.24Å; C136-I140 PolarHBondContact O-N 3Å; C136-G346 PolarHBondContact SG-N 3.04Å; C136-G346 VanDerWaalsContact SG-N 3.41Å; C136-T364 PolarHBondContact SG-OG1 3.49Å; C136-T364 VanDerWaalsContact SG-OG1 3.36Å; C136-A367 HydrophobicContact CB-CB 3.49Å; C136-A367 VanDerWaalsContact CB-CB 3.49Å
137	M	90.6	Very high	87.5	Confident	20 Å²	20	23.4 Å²	23.4	10%	0.099	12%	0.115	C	C	.	.	H	α-helix	trans	-56.6	-44.2	177.8	-69.2	169.4	64.5	0	0	112.6	L133 N139 I140 W141 A367 I370 T371	L133-M137 HydrophobicContact CD1-CG 4.46Å; L133-M137 HydrophobicContact CD1-SD 3.83Å; L133-M137 HydrophobicContact CD2-SD 4.47Å; L133-M137 HydrophobicContact CG-SD 3.75Å; L133-M137 VanDerWaalsContact O-CG 3.3Å; L133-M137 WeakPolarHBondContact O-CG 3.42Å; L133-M137 PolarHBondContact O-N 3.24Å; M137-N139 VanDerWaalsContact C-N 3.28Å; M137-N139 PolarHBondContact O-N 3.42Å; M137-I140 PolarHBondContact O-N 2.98Å; M137-W141 HydrophobicContact CB-CE3 4.24Å; M137-W141 HydrophobicContact CB-CZ3 4.31Å; M137-W141 HydrophobicContact CE-CH2 3.23Å; M137-W141 HydrophobicContact CE-CZ2 3.92Å; M137-W141 HydrophobicContact CE-CZ3 3.58Å; M137-W141 WeakPolarHBondContact O-CB 3.32Å; M137-W141 PolarHBondContact O-N 3.24Å; M137-A367 HydrophobicContact CG-CB 3.88Å; M137-I370 HydrophobicContact CE-CG2 3.81Å; M137-I370 HydrophobicContact SD-CD1 4.39Å; M137-T371 HydrophobicContact CG-CG2 4.24Å
138	L	87.3	Confident	87.8	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-66.5	-18.4	177	-80.4	172.9	0	0	0	115.8	V134 C136 Q276 L280 L283 S458	V134-L138 HydrophobicContact CG1-CD1 3.86Å; V134-L138 WeakPolarHBondContact O-CB 3.46Å; V134-L138 WeakPolarHBondContact O-CG 3.37Å; V134-L138 PolarHBondContact O-N 2.91Å; C136-L138 VanDerWaalsContact C-N 3.34Å; C136-L138 PolarHBondContact O-N 2.86Å; L138-Q276 HydrophobicContact CD1-CB 3.82Å; L138-Q276 HydrophobicContact CD1-CG 4.24Å; L138-Q276 WeakPolarHBondContact CD1-O 3.05Å; L138-L280 HydrophobicContact CD1-CB 4.35Å; L138-L280 HydrophobicContact CD2-CB 3.95Å; L138-L280 HydrophobicContact CD2-CD1 3.95Å; L138-L280 HydrophobicContact CG-CB 4.36Å; L138-L280 HydrophobicContact CG-CD1 4.07Å; L138-L283 HydrophobicContact CD2-CD2 4.25Å; L138-S458 PolarHBondContact O-OG 2.93Å
139	N	87.6	Confident	87.9	Confident	13 Å²	13	17 Å²	17	7%	0.07	8%	0.078	C	C	.	.	H	α-helix	trans	-103.3	-18.4	177.8	-77	-94.6	0	0	0	112.6	R135 C136 M137 A345 A461	R135-N139 PolarHBondContact O-N 3.22Å; R135-N139 PolarHBondContact O-ND2 2.98Å; C136-N139 PolarHBondContact O-N 2.79Å; C136-N139 VanDerWaalsContact O-N 3.07Å; M137-N139 VanDerWaalsContact C-N 3.28Å; M137-N139 PolarHBondContact O-N 3.42Å; N139-A345 HydrophobicContact CB-CB 3.97Å; N139-A461 WeakPolarHBondContact OD1-CB 3.37Å
140	I	91.8	Very high	88.1	Confident	1 Å²	1	12.7 Å²	12.7	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-79.8	-50.7	170.7	-62.5	158.6	0	0	0	109.1	C136 M137 G142 A339 T341 I343 A367 T371 Y375	C136-I140 HydrophobicContact CB-CD1 4.31Å; C136-I140 WeakPolarHBondContact O-CD1 3.24Å; C136-I140 WeakPolarHBondContact O-CG1 3.24Å; C136-I140 PolarHBondContact O-N 3Å; M137-I140 PolarHBondContact O-N 2.98Å; I140-G142 VanDerWaalsContact C-N 3.26Å; I140-G142 PolarHBondContact O-N 3.3Å; I140-A339 WeakPolarHBondContact CG2-O 3.4Å; I140-T341 WeakPolarHBondContact CG1-O 3.34Å; I140-I343 HydrophobicContact CD1-CG2 4.37Å; I140-I343 HydrophobicContact CG1-CG2 4.46Å; I140-A367 HydrophobicContact CD1-CB 4.02Å; I140-T371 HydrophobicContact CB-CG2 3.89Å; I140-T371 HydrophobicContact CD1-CG2 4.01Å; I140-T371 HydrophobicContact CG2-CG2 3.7Å; I140-T371 WeakPolarHBondContact CG2-OG1 3.34Å; I140-Y375 HydrophobicContact CG2-CE2 4.09Å; I140-Y375 PolarHBondContact O-OH 2.97Å; I140-Y375 VanDerWaalsContact O-OH 3.05Å
141	W	90.5	Very high	88.5	Confident	4 Å²	4	7.3 Å²	7.3	2%	0.015	4%	0.036	C	C	.	.	S	Bend	trans	-72.3	71.5	177.1	-68.2	-30	0	0	0	113.1	M137 L145 L280 L283 L284 I287 I370 T371 T374 A454	M137-W141 HydrophobicContact CB-CE3 4.24Å; M137-W141 HydrophobicContact CB-CZ3 4.31Å; M137-W141 HydrophobicContact CE-CH2 3.23Å; M137-W141 HydrophobicContact CE-CZ2 3.92Å; M137-W141 HydrophobicContact CE-CZ3 3.58Å; M137-W141 WeakPolarHBondContact O-CB 3.32Å; M137-W141 PolarHBondContact O-N 3.24Å; W141-L145 HydrophobicContact CB-CD1 4.4Å; W141-L145 HydrophobicContact CG-CD1 4.05Å; W141-L280 HydrophobicContact CZ3-CD1 4.11Å; W141-L283 HydrophobicContact CB-CD2 3.92Å; W141-L283 HydrophobicContact CD2-CD2 4.45Å; W141-L283 HydrophobicContact CE3-CD2 3.78Å; W141-L283 HydrophobicContact CE3-CG 4.21Å; W141-L284 HydrophobicContact CH2-CD2 3.58Å; W141-L284 HydrophobicContact CZ3-CD2 3.65Å; W141-L284 HydrophobicContact CZ3-CG 4.38Å; W141-I287 HydrophobicContact CD2-CD1 4.23Å; W141-I287 HydrophobicContact CE3-CD1 4.33Å; W141-I287 HydrophobicContact CH2-CD1 4.29Å; W141-I287 HydrophobicContact CZ2-CD1 4.21Å; W141-I287 HydrophobicContact CZ3-CD1 4.35Å; W141-I370 HydrophobicContact CZ2-CG2 4.3Å; W141-T371 HydrophobicContact CD2-CG2 4.28Å; W141-T371 HydrophobicContact CG-CG2 4.28Å; W141-T371 HydrophobicContact CZ2-CG2 4.4Å; W141-T374 HydrophobicContact CZ2-CG2 3.96Å; W141-T374 PolarHBondContact NE1-OG1 3.12Å; W141-A454 WeakPolarHBondContact O-CB 3.46Å
142	G	83.1	Confident	89.1	Confident	3 Å²	3	7.3 Å²	7.3	3%	0.031	4%	0.036	C	C	.	.			trans	-96.7	-167.8	172.5	0	0	0	0	0	114.4	I140 M144 L145	I140-G142 VanDerWaalsContact C-N 3.26Å; I140-G142 PolarHBondContact O-N 3.3Å; G142-M144 PolarHBondContact O-N 3.05Å; G142-L145 PolarHBondContact O-N 2.97Å; G142-L145 VanDerWaalsContact O-N 3.09Å
143	V	82.1	Confident	89.2	Confident	1 Å²	1	7.3 Å²	7.3	1%	0.006	4%	0.036	C	C	.	.	T	Hydrogen-bonded Turn	trans	-29.9	-52	177	177.6	0	0	0	0	114	L145 F146 I147 Y224 T455 L515	V143-L145 PolarHBondContact O-N 2.96Å; V143-F146 PolarHBondContact O-N 3.19Å; V143-I147 HydrophobicContact CG1-CB 4.3Å; V143-I147 HydrophobicContact CG1-CD1 3.8Å; V143-I147 HydrophobicContact CG1-CG1 4.18Å; V143-I147 PolarHBondContact O-N 2.77Å; V143-Y224 HydrophobicContact CG2-CD1 3.99Å; V143-T455 HydrophobicContact CB-CG2 4.26Å; V143-T455 HydrophobicContact CG2-CG2 3.44Å; V143-T455 VanDerWaalsContact CG2-CG2 3.44Å; V143-L515 HydrophobicContact CG1-CD1 4.4Å; V143-L515 HydrophobicContact CG1-CD2 3.72Å
144	M	87.5	Confident	89.2	Confident	3 Å²	3	6.4 Å²	6.4	2%	0.015	3%	0.031	C	C	.	.	H	α-helix	trans	-60.5	-24	-168.6	-58.4	-51.9	-176.2	0	0	113.7	G142 R148 L149 M223 I335 A339 L515 A519	G142-M144 PolarHBondContact O-N 3.05Å; M144-R148 PolarHBondContact O-N 3.04Å; M144-R148 HydrophobicContact SD-CB 3.87Å; M144-R148 HydrophobicContact SD-CG 3.78Å; M144-L149 PolarHBondContact O-N 3.17Å; M144-M223 HydrophobicContact CE-CG 4.27Å; M144-M223 HydrophobicContact CE-SD 3.74Å; M144-I335 WeakPolarHBondContact CE-O 3.47Å; M144-A339 HydrophobicContact CB-CB 3.65Å; M144-A339 HydrophobicContact CG-CB 4.09Å; M144-L515 HydrophobicContact CE-CD2 4.17Å; M144-L515 HydrophobicContact CE-CG 4.21Å; M144-L515 HydrophobicContact SD-CD2 4.14Å; M144-A519 HydrophobicContact CE-CB 3.72Å
145	L	89.6	Confident	89.3	Confident	2 Å²	2	5.4 Å²	5.4	1%	0.01	3%	0.025	C	C	.	.	H	α-helix	trans	-61.6	-48.7	178.8	-169.3	150.9	0	0	0	111.8	W141 G142 V143 L149 I287 Y375 M437	W141-L145 HydrophobicContact CB-CD1 4.4Å; W141-L145 HydrophobicContact CG-CD1 4.05Å; G142-L145 PolarHBondContact O-N 2.97Å; G142-L145 VanDerWaalsContact O-N 3.09Å; V143-L145 PolarHBondContact O-N 2.96Å; L145-L149 WeakPolarHBondContact O-CB 3.35Å; L145-I287 HydrophobicContact CD1-CD1 4.28Å; L145-I287 HydrophobicContact CD2-CG1 4.35Å; L145-Y375 HydrophobicContact CB-CE1 3.68Å; L145-Y375 HydrophobicContact CD1-CD1 4.36Å; L145-Y375 HydrophobicContact CD1-CE1 3.84Å; L145-Y375 HydrophobicContact CG-CD1 4.31Å; L145-Y375 HydrophobicContact CG-CE1 3.81Å; L145-M437 WeakPolarHBondContact O-CE 3.19Å; L145-M437 VanDerWaalsContact O-SD 3.4Å
146	F	89.1	Confident	89.6	Confident	2 Å²	2	3.7 Å²	3.7	1%	0.009	2%	0.018	C	C	.	.	H	α-helix	trans	-91.1	-34.7	-175.7	-65	-66.6	0	0	0	113.5	V143 L283 A286 I287 V290 M437 I447 T451	V143-F146 PolarHBondContact O-N 3.19Å; F146-L283 HydrophobicContact CE2-CD1 3.54Å; F146-L283 HydrophobicContact CZ-CD1 3.81Å; F146-A286 HydrophobicContact CE1-CB 4.42Å; F146-A286 HydrophobicContact CZ-CB 3.93Å; F146-I287 HydrophobicContact CZ-CG1 4.16Å; F146-V290 HydrophobicContact CE1-CG2 4.49Å; F146-M437 HydrophobicContact CD1-CB 4.46Å; F146-M437 HydrophobicContact CD1-SD 4Å; F146-M437 WeakPolarHBondContact O-CG 3.31Å; F146-I447 HydrophobicContact CD1-CG2 3.77Å; F146-I447 HydrophobicContact CE1-CD1 4.38Å; F146-I447 HydrophobicContact CE1-CG2 4.19Å; F146-I447 HydrophobicContact CG-CG2 4.32Å; F146-T451 HydrophobicContact CB-CG2 4.48Å; F146-T451 WeakPolarHBondContact CB-OG1 3.43Å; F146-T451 WeakPolarHBondContact CD2-OG1 3.35Å; F146-T451 WeakPolarHBondContact CG-OG1 3.22Å
147	I	87.7	Confident	89.7	Confident	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-98.6	-29.5	-166.6	-45.7	-169.8	0	0	0	113.4	V143 G227 T231 F434 T451	V143-I147 HydrophobicContact CG1-CB 4.3Å; V143-I147 HydrophobicContact CG1-CD1 3.8Å; V143-I147 HydrophobicContact CG1-CG1 4.18Å; V143-I147 PolarHBondContact O-N 2.77Å; I147-G227 WeakPolarHBondContact CD1-O 3.41Å; I147-T231 WeakPolarHBondContact CD1-OG1 3.3Å; I147-F434 HydrophobicContact CG2-CB 3.81Å; I147-F434 WeakPolarHBondContact O-CB 3.49Å; I147-T451 HydrophobicContact CD1-CG2 3.81Å; I147-T451 HydrophobicContact CG1-CG2 3.99Å
148	R	91.3	Very high	89.7	Confident	5 Å²	5	5 Å²	5	2%	0.019	2%	0.022	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122	-17.1	-173	-67	-64.4	-169.4	-89.9	-7.9	115.2	M144 S150 W151 V152 E230 F434 L515 N516	M144-R148 PolarHBondContact O-N 3.04Å; M144-R148 HydrophobicContact SD-CB 3.87Å; M144-R148 HydrophobicContact SD-CG 3.78Å; R148-S150 VanDerWaalsContact C-N 3.34Å; R148-S150 PolarHBondContact O-N 3.13Å; R148-W151 PolarHBondContact O-N 3.02Å; R148-V152 VanDerWaalsContact O-CG2 3.32Å; R148-V152 WeakPolarHBondContact O-CG2 3.48Å; R148-V152 PolarHBondContact O-N 2.72Å; R148-E230 IonicContact CZ-OE1 3.24Å; R148-E230 VanDerWaalsContact CZ-OE1 3.23Å; R148-E230 IonicContact CZ-OE2 2.9Å; R148-E230 IonicContact NH1-OE1 3.54Å; R148-E230 PolarHBondContact NH1-OE1 3.41Å; R148-E230 IonicContact NH1-OE2 2.78Å; R148-E230 IonicContact NH2-OE1 3.81Å; R148-E230 PolarHBondContact NH2-OE1 3.26Å; R148-E230 IonicContact NH2-OE2 2.91Å; R148-E230 PolarHBondContact NH2-OE2 2.69Å; R148-F434 VanDerWaalsContact NH1-CD1 3.28Å; R148-F434 VanDerWaalsContact NH1-CD2 3.3Å; R148-L515 HydrophobicContact CG-CD2 4.1Å; R148-N516 PolarHBondContact NE-OD1 3.02Å; R148-N516 PolarHBondContact NH2-OD1 3.15Å
149	L	91.4	Very high	89.9	Confident	1 Å²	1	5.9 Å²	5.9	1%	0.005	3%	0.032	C	C	.	.	H	α-helix	trans	-61.7	-38.2	-178.9	-171.7	68.9	0	0	0	113.3	M144 L145 F153 F336 Y375 V378 A379 M437	M144-L149 PolarHBondContact O-N 3.17Å; L145-L149 WeakPolarHBondContact O-CB 3.35Å; L149-F153 HydrophobicContact CD1-CD2 4.44Å; L149-F153 HydrophobicContact CD1-CE2 4.34Å; L149-F153 PolarHBondContact O-N 3.46Å; L149-F336 HydrophobicContact CD1-CD2 4.33Å; L149-F336 HydrophobicContact CD1-CE2 3.82Å; L149-Y375 HydrophobicContact CD1-CD1 4.01Å; L149-Y375 HydrophobicContact CD2-CD1 3.96Å; L149-V378 HydrophobicContact CD2-CB 4.16Å; L149-V378 HydrophobicContact CD2-CG1 4.05Å; L149-A379 HydrophobicContact CD1-CB 4.17Å; L149-A379 HydrophobicContact CD2-CB 3.99Å; L149-A379 HydrophobicContact CG-CB 3.95Å; L149-M437 HydrophobicContact CB-CE 3.81Å; L149-M437 HydrophobicContact CD2-CE 3.87Å; L149-M437 HydrophobicContact CG-CE 4.27Å
150	S	91.4	Very high	90.2	Very high	2 Å²	2	8.1 Å²	8.1	1%	0.014	4%	0.043	C	C	.	.	H	α-helix	trans	-61.1	-48.3	172.8	44.2	0	0	0	0	111.6	R148 F153 G154	R148-S150 VanDerWaalsContact C-N 3.34Å; R148-S150 PolarHBondContact O-N 3.13Å; S150-F153 PolarHBondContact O-N 3.08Å; S150-G154 PolarHBondContact O-N 2.88Å
151	W	92.4	Very high	90.2	Very high	13 Å²	13	8 Å²	8	5%	0.049	4%	0.043	C	C	.	.	H	α-helix	trans	-63.4	-42.9	179.1	178.8	87.7	0	0	0	112.6	R148 F153 G154 Q155 E327 V332 I335 M431 F434	R148-W151 PolarHBondContact O-N 3.02Å; W151-F153 VanDerWaalsContact C-N 3.27Å; W151-F153 PolarHBondContact O-N 3.29Å; W151-G154 PolarHBondContact O-N 2.86Å; W151-G154 VanDerWaalsContact O-N 3.15Å; W151-Q155 HydrophobicContact CD2-CG 4.02Å; W151-Q155 HydrophobicContact CE3-CG 4.47Å; W151-Q155 HydrophobicContact CG-CG 4.48Å; W151-Q155 HydrophobicContact CH2-CG 4.38Å; W151-Q155 HydrophobicContact CZ2-CG 3.92Å; W151-Q155 WeakPolarHBondContact O-CG 3.11Å; W151-Q155 PolarHBondContact O-N 3.49Å; W151-E327 HydrophobicContact CH2-CG 3.96Å; W151-E327 HydrophobicContact CZ2-CG 3.93Å; W151-V332 HydrophobicContact CH2-CG2 4.17Å; W151-V332 HydrophobicContact CZ3-CG2 4.18Å; W151-I335 HydrophobicContact CH2-CD1 3.65Å; W151-I335 HydrophobicContact CZ3-CB 4.46Å; W151-I335 HydrophobicContact CZ3-CD1 3.76Å; W151-I335 HydrophobicContact CZ3-CG2 4.17Å; W151-M431 VanDerWaalsContact CD1-O 3.29Å; W151-F434 HydrophobicContact CB-CD1 4.14Å; W151-F434 HydrophobicContact CB-CE1 4.11Å; W151-F434 AromaticContact CD1-CE1 3.59Å; W151-F434 HydrophobicContact CD2-CE1 4.41Å; W151-F434 HydrophobicContact CG-CD1 4.32Å; W151-F434 AromaticContact CG-CE1 3.79Å; W151-F434 HydrophobicContact CG-CE1 3.79Å
152	V	92.3	Very high	90.4	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.006	6%	0.056	C	C	.	.	H	α-helix	trans	-55.4	-43.2	174.6	167.4	0	0	0	0	111.1	R148 A156 V164 V332 F336	R148-V152 VanDerWaalsContact O-CG2 3.32Å; R148-V152 WeakPolarHBondContact O-CG2 3.48Å; R148-V152 PolarHBondContact O-N 2.72Å; V152-A156 VanDerWaalsContact O-CB 3.25Å; V152-A156 WeakPolarHBondContact O-CB 3.41Å; V152-A156 PolarHBondContact O-N 2.92Å; V152-V164 HydrophobicContact CG1-CG1 4.46Å; V152-V332 HydrophobicContact CB-CG1 4.23Å; V152-V332 HydrophobicContact CG1-CG1 3.82Å; V152-V332 HydrophobicContact CG2-CG1 4.14Å; V152-F336 HydrophobicContact CG2-CB 4.22Å
153	F	92.3	Very high	91	Very high	1 Å²	1	13.7 Å²	13.7	0%	0.004	7%	0.074	C	C	.	.	H	α-helix	trans	-80.6	-24.2	179.1	-87.1	-115.6	0	0	0	113.6	L149 S150 W151 G157 W158 I165 A379 S383	L149-F153 HydrophobicContact CD1-CD2 4.44Å; L149-F153 HydrophobicContact CD1-CE2 4.34Å; L149-F153 PolarHBondContact O-N 3.46Å; S150-F153 PolarHBondContact O-N 3.08Å; W151-F153 VanDerWaalsContact C-N 3.27Å; W151-F153 PolarHBondContact O-N 3.29Å; F153-G157 CarbonylContact O-C 3.42Å; F153-G157 WeakPolarHBondContact O-CA 3.47Å; F153-G157 PolarHBondContact O-N 3.12Å; F153-G157 VanDerWaalsContact O-N 3.08Å; F153-W158 HydrophobicContact CD1-CB 3.72Å; F153-W158 HydrophobicContact CE1-CB 3.95Å; F153-I165 HydrophobicContact CE2-CD1 3.71Å; F153-I165 HydrophobicContact CE2-CG1 4.25Å; F153-I165 HydrophobicContact CZ-CD1 3.65Å; F153-I165 HydrophobicContact CZ-CG1 4.42Å; F153-A379 HydrophobicContact CD1-CB 3.76Å; F153-A379 HydrophobicContact CD2-CB 3.71Å; F153-A379 HydrophobicContact CE1-CB 3.59Å; F153-A379 HydrophobicContact CE2-CB 3.55Å; F153-A379 HydrophobicContact CG-CB 3.83Å; F153-A379 HydrophobicContact CZ-CB 3.49Å; F153-A379 VanDerWaalsContact CZ-CB 3.49Å; F153-S383 WeakPolarHBondContact CD1-OG 3.16Å
154	G	89.7	Confident	91.6	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.8	-52.9	167.4	0	0	0	0	0	111.8	S150 W151	S150-G154 PolarHBondContact O-N 2.88Å; W151-G154 PolarHBondContact O-N 2.86Å; W151-G154 VanDerWaalsContact O-N 3.15Å
155	Q	91.6	Very high	91.9	Very high	3 Å²	3	13.9 Å²	13.9	1%	0.014	8%	0.076	C	C	.	.	H	α-helix	trans	-66.5	-52.8	-179.5	-63.4	-69	-28.2	0	0	112.5	W151 G157 D322 F323 V332	W151-Q155 HydrophobicContact CD2-CG 4.02Å; W151-Q155 HydrophobicContact CE3-CG 4.47Å; W151-Q155 HydrophobicContact CG-CG 4.48Å; W151-Q155 HydrophobicContact CH2-CG 4.38Å; W151-Q155 HydrophobicContact CZ2-CG 3.92Å; W151-Q155 WeakPolarHBondContact O-CG 3.11Å; W151-Q155 PolarHBondContact O-N 3.49Å; Q155-G157 VanDerWaalsContact C-N 3.33Å; Q155-G157 PolarHBondContact O-N 3.32Å; Q155-D322 CarbonylContact O-C 3.6Å; Q155-D322 VanDerWaalsContact O-C 3.32Å; Q155-D322 PolarHBondContact O-N 2.82Å; Q155-D322 PolarHBondContact OE1-O 2.95Å; Q155-F323 HydrophobicContact CB-CD1 4.33Å; Q155-V332 HydrophobicContact CB-CG2 4.14Å
156	A	91.6	Very high	92.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-81.3	-11.4	-174.5	0	0	0	0	0	113.8	V152 L160 P321 F323	V152-A156 VanDerWaalsContact O-CB 3.25Å; V152-A156 WeakPolarHBondContact O-CB 3.41Å; V152-A156 PolarHBondContact O-N 2.92Å; A156-L160 HydrophobicContact CB-CB 4.13Å; A156-L160 WeakPolarHBondContact O-CB 3.44Å; A156-P321 WeakPolarHBondContact O-CA 3.46Å; A156-P321 WeakPolarHBondContact O-CB 3.4Å; A156-F323 HydrophobicContact CB-CE1 4.3Å; A156-F323 HydrophobicContact CB-CZ 4.38Å
157	G	92	Very high	92.4	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	63.9	164.8	-159.7	0	0	0	0	0	111.9	F153 Q155 G159 G161 N318	F153-G157 CarbonylContact O-C 3.42Å; F153-G157 WeakPolarHBondContact O-CA 3.47Å; F153-G157 PolarHBondContact O-N 3.12Å; F153-G157 VanDerWaalsContact O-N 3.08Å; Q155-G157 VanDerWaalsContact C-N 3.33Å; Q155-G157 PolarHBondContact O-N 3.32Å; G157-G159 PolarHBondContact O-N 2.93Å; G157-G161 WeakPolarHBondContact O-CA 3.45Å; G157-G161 PolarHBondContact O-N 3.48Å; G157-N318 CarbonylContact C-O 3.59Å; G157-N318 WeakPolarHBondContact CA-O 3.5Å
158	W	91.4	Very high	92.7	Very high	48 Å²	48	17.8 Å²	17.8	18%	0.182	10%	0.103	C	C	.	.	H	α-helix	trans	-68.5	-24.2	178	71.2	-103.1	0	0	0	112.7	F153 I162 F315 N318 F319 L380	F153-W158 HydrophobicContact CD1-CB 3.72Å; F153-W158 HydrophobicContact CE1-CB 3.95Å; W158-I162 HydrophobicContact CE3-CD1 3.71Å; W158-I162 HydrophobicContact CZ3-CD1 3.96Å; W158-I162 VanDerWaalsContact O-CG1 3.28Å; W158-I162 WeakPolarHBondContact O-CG1 3.13Å; W158-I162 PolarHBondContact O-N 3.4Å; W158-I162 VanDerWaalsContact O-N 3.14Å; W158-F315 HydrophobicContact CD2-CE2 4.26Å; W158-F315 HydrophobicContact CD2-CZ 4.02Å; W158-F315 AromaticContact CE2-CE1 3.72Å; W158-F315 AromaticContact CE2-CE2 3.91Å; W158-F315 AromaticContact CE2-CZ 3.46Å; W158-F315 VanDerWaalsContact CE2-CZ 3.46Å; W158-F315 HydrophobicContact CG-CE2 4.38Å; W158-F315 HydrophobicContact CH2-CE1 4.16Å; W158-F315 HydrophobicContact CH2-CZ 4.06Å; W158-F315 HydrophobicContact CZ2-CD1 4.25Å; W158-F315 AromaticContact CZ2-CE1 3.41Å; W158-F315 HydrophobicContact CZ2-CE1 3.41Å; W158-F315 VanDerWaalsContact CZ2-CE1 3.41Å; W158-F315 HydrophobicContact CZ2-CE2 4.39Å; W158-F315 AromaticContact CZ2-CZ 3.5Å; W158-F315 HydrophobicContact CZ2-CZ 3.5Å; W158-F315 VanDerWaalsContact CZ2-CZ 3.5Å; W158-F315 AromaticContact NE1-CE1 3.93Å; W158-F315 AromaticContact NE1-CE2 3.79Å; W158-F315 AromaticContact NE1-CZ 3.75Å; W158-F315 PolarHBondContact NE1-O 3.01Å; W158-N318 VanDerWaalsContact CD1-O 3.3Å; W158-N318 PolarHBondContact N-O 3.47Å; W158-F319 AromaticContact CD2-CD2 3.97Å; W158-F319 HydrophobicContact CD2-CD2 3.97Å; W158-F319 AromaticContact CE2-CD2 3.56Å; W158-F319 HydrophobicContact CE3-CD2 4.24Å; W158-F319 AromaticContact CH2-CD2 3.79Å; W158-F319 HydrophobicContact CH2-CD2 3.79Å; W158-F319 AromaticContact CH2-CE2 3.97Å; W158-F319 HydrophobicContact CH2-CE2 3.97Å; W158-F319 HydrophobicContact CZ2-CB 4.35Å; W158-F319 AromaticContact CZ2-CD2 3.46Å; W158-F319 HydrophobicContact CZ2-CD2 3.46Å; W158-F319 VanDerWaalsContact CZ2-CD2 3.46Å; W158-F319 HydrophobicContact CZ2-CE2 4.12Å; W158-F319 HydrophobicContact CZ2-CG 4.2Å; W158-F319 HydrophobicContact CZ3-CD2 4.16Å; W158-F319 HydrophobicContact CZ3-CE2 4.23Å; W158-L380 HydrophobicContact CB-CD2 4.08Å; W158-L380 HydrophobicContact CD2-CD2 4.22Å; W158-L380 HydrophobicContact CE3-CD2 4.03Å; W158-L380 HydrophobicContact CG-CD2 4.29Å
159	G	91.8	Very high	92.9	Very high	21 Å²	21	19.1 Å²	19.1	22%	0.216	11%	0.113	C	C	.	.	H	α-helix	trans	-60.6	-58.6	175.8	0	0	0	0	0	113.2	G157 F319	G157-G159 PolarHBondContact O-N 2.93Å; G159-F319 PolarHBondContact N-O 2.97Å
160	L	92.7	Very high	93.1	Very high	59 Å²	59	22.5 Å²	22.5	31%	0.309	13%	0.133	S	C	.	.	H	α-helix	trans	-79.4	-23.8	176.8	-63.9	179.9	0	0	0	112.6	A156 I162 V163 V164 P321 F323 F329	A156-L160 HydrophobicContact CB-CB 4.13Å; A156-L160 WeakPolarHBondContact O-CB 3.44Å; L160-I162 VanDerWaalsContact C-N 3.29Å; L160-I162 PolarHBondContact O-N 3.1Å; L160-V163 HydrophobicContact CD2-CG2 4.37Å; L160-V163 WeakPolarHBondContact O-CA 3.45Å; L160-V163 WeakPolarHBondContact O-CB 3.21Å; L160-V163 PolarHBondContact O-N 3.12Å; L160-V164 PolarHBondContact O-N 3.04Å; L160-P321 HydrophobicContact CD1-CB 4.08Å; L160-P321 HydrophobicContact CD1-CG 3.9Å; L160-F323 HydrophobicContact CD1-CE2 4.37Å; L160-F323 HydrophobicContact CD1-CZ 4.36Å; L160-F329 HydrophobicContact CB-CD2 4.2Å; L160-F329 HydrophobicContact CB-CE2 4.18Å; L160-F329 HydrophobicContact CD1-CD2 4.24Å
161	G	92.9	Very high	93.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-56.4	-40.6	171.6	0	0	0	0	0	112.8	G157 V163 V164 I165	G157-G161 WeakPolarHBondContact O-CA 3.45Å; G157-G161 PolarHBondContact O-N 3.48Å; G161-V163 VanDerWaalsContact C-N 3.31Å; G161-V163 PolarHBondContact O-N 3Å; G161-V164 PolarHBondContact O-N 3.23Å; G161-I165 PolarHBondContact O-N 2.93Å; G161-I165 VanDerWaalsContact O-N 3.13Å
162	I	94.7	Very high	93.5	Very high	57 Å²	57	21.9 Å²	21.9	29%	0.292	13%	0.131	S	C	.	.	H	α-helix	trans	-59.4	-42	171.2	-69.7	171.1	0	0	0	111.2	W158 L160 I165 A166 L376 L380	W158-I162 HydrophobicContact CE3-CD1 3.71Å; W158-I162 HydrophobicContact CZ3-CD1 3.96Å; W158-I162 VanDerWaalsContact O-CG1 3.28Å; W158-I162 WeakPolarHBondContact O-CG1 3.13Å; W158-I162 PolarHBondContact O-N 3.4Å; W158-I162 VanDerWaalsContact O-N 3.14Å; L160-I162 VanDerWaalsContact C-N 3.29Å; L160-I162 PolarHBondContact O-N 3.1Å; I162-I165 PolarHBondContact O-N 2.99Å; I162-A166 VanDerWaalsContact O-CB 3.24Å; I162-A166 WeakPolarHBondContact O-CB 3.38Å; I162-A166 PolarHBondContact O-N 2.88Å; I162-L376 HydrophobicContact CD1-CD1 4.3Å; I162-L376 HydrophobicContact CG1-CD1 3.69Å; I162-L380 HydrophobicContact CD1-CD2 4.4Å
163	V	94.9	Very high	93.6	Very high	68 Å²	68	24.4 Å²	24.4	41%	0.412	15%	0.146	S	C	.	.	H	α-helix	trans	-66.6	-37.8	-179.8	-173.4	0	0	0	0	111.4	L160 G161 A166 L167 F329	L160-V163 HydrophobicContact CD2-CG2 4.37Å; L160-V163 WeakPolarHBondContact O-CA 3.45Å; L160-V163 WeakPolarHBondContact O-CB 3.21Å; L160-V163 PolarHBondContact O-N 3.12Å; G161-V163 VanDerWaalsContact C-N 3.31Å; G161-V163 PolarHBondContact O-N 3Å; V163-A166 PolarHBondContact O-N 3.01Å; V163-L167 VanDerWaalsContact O-CB 3.25Å; V163-L167 WeakPolarHBondContact O-CB 3.43Å; V163-L167 PolarHBondContact O-N 3.23Å; V163-F329 HydrophobicContact CB-CE2 4.31Å; V163-F329 HydrophobicContact CB-CZ 4.41Å; V163-F329 HydrophobicContact CG1-CE2 4.33Å; V163-F329 HydrophobicContact CG1-CZ 4Å
164	V	94.6	Very high	93.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.2	-46.6	174	170.4	0	0	0	0	111.4	V152 L160 G161 S168 F329 F333 F336	V152-V164 HydrophobicContact CG1-CG1 4.46Å; L160-V164 PolarHBondContact O-N 3.04Å; G161-V164 PolarHBondContact O-N 3.23Å; V164-S168 WeakPolarHBondContact O-CB 3.39Å; V164-S168 PolarHBondContact O-N 3.14Å; V164-S168 PolarHBondContact O-OG 3.5Å; V164-F329 HydrophobicContact CG2-CD2 4.12Å; V164-F329 HydrophobicContact CG2-CE2 3.55Å; V164-F329 HydrophobicContact CG2-CZ 3.91Å; V164-F333 HydrophobicContact CG1-CB 4.43Å; V164-F333 HydrophobicContact CG1-CD2 4.11Å; V164-F336 HydrophobicContact CG1-CB 3.76Å; V164-F336 HydrophobicContact CG1-CD1 3.6Å; V164-F336 HydrophobicContact CG1-CE1 4.48Å; V164-F336 HydrophobicContact CG1-CG 3.78Å
165	I	94.8	Very high	94.1	Very high	9 Å²	9	25 Å²	25	5%	0.046	15%	0.149	C	C	.	.	H	α-helix	trans	-64.6	-49.2	175.8	-62.4	175.9	0	0	0	110	F153 G161 I162 L167 S168 C169 F336	F153-I165 HydrophobicContact CE2-CD1 3.71Å; F153-I165 HydrophobicContact CE2-CG1 4.25Å; F153-I165 HydrophobicContact CZ-CD1 3.65Å; F153-I165 HydrophobicContact CZ-CG1 4.42Å; G161-I165 PolarHBondContact O-N 2.93Å; G161-I165 VanDerWaalsContact O-N 3.13Å; I162-I165 PolarHBondContact O-N 2.99Å; I165-L167 PolarHBondContact O-N 2.97Å; I165-S168 WeakPolarHBondContact O-CB 3.43Å; I165-S168 PolarHBondContact O-N 2.97Å; I165-C169 PolarHBondContact O-N 2.71Å; I165-C169 PolarHBondContact O-SG 2.69Å; I165-F336 HydrophobicContact CG1-CE1 4.12Å; I165-F336 HydrophobicContact CG1-CE2 4.33Å; I165-F336 HydrophobicContact CG1-CZ 3.81Å
166	A	94.9	Very high	94.3	Very high	48 Å²	48	24.9 Å²	24.9	40%	0.397	15%	0.149	S	C	.	.	H	α-helix	trans	-61	-43.8	-176.5	0	0	0	0	0	112.6	I162 V163 S168 C169 V170	I162-A166 VanDerWaalsContact O-CB 3.24Å; I162-A166 WeakPolarHBondContact O-CB 3.38Å; I162-A166 PolarHBondContact O-N 2.88Å; V163-A166 PolarHBondContact O-N 3.01Å; A166-S168 VanDerWaalsContact C-N 3.34Å; A166-S168 PolarHBondContact O-N 3.31Å; A166-C169 PolarHBondContact O-N 3.32Å; A166-V170 WeakPolarHBondContact O-CG2 3.47Å; A166-V170 PolarHBondContact O-N 2.91Å
167	L	94.6	Very high	94.4	Very high	37 Å²	37	26 Å²	26	19%	0.194	16%	0.155	C	C	.	.	H	α-helix	trans	-60.9	-43.6	175.4	179.9	57.8	0	0	0	111.5	V163 I165 V170 V171 F333 L566	V163-L167 VanDerWaalsContact O-CB 3.25Å; V163-L167 WeakPolarHBondContact O-CB 3.43Å; V163-L167 PolarHBondContact O-N 3.23Å; I165-L167 PolarHBondContact O-N 2.97Å; L167-V170 PolarHBondContact O-N 3.38Å; L167-V171 WeakPolarHBondContact O-CG2 3.49Å; L167-V171 PolarHBondContact O-N 2.95Å; L167-F333 HydrophobicContact CB-CE2 3.96Å; L167-F333 HydrophobicContact CD2-CD2 3.92Å; L167-F333 HydrophobicContact CD2-CE2 3.62Å; L167-F333 HydrophobicContact CD2-CZ 4.2Å; L167-F333 HydrophobicContact CG-CD2 4.36Å; L167-F333 HydrophobicContact CG-CE2 3.63Å; L167-F333 HydrophobicContact CG-CZ 4.18Å; L167-L566 HydrophobicContact CD1-CD1 4.14Å; L167-L566 HydrophobicContact CD1-CD2 4.24Å
168	S	94.3	Very high	94.6	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.8	-44.3	175.2	-55.2	0	0	0	0	111.7	V164 I165 A166 T172 F333 F336	V164-S168 WeakPolarHBondContact O-CB 3.39Å; V164-S168 PolarHBondContact O-N 3.14Å; V164-S168 PolarHBondContact O-OG 3.5Å; I165-S168 WeakPolarHBondContact O-CB 3.43Å; I165-S168 PolarHBondContact O-N 2.97Å; A166-S168 VanDerWaalsContact C-N 3.34Å; A166-S168 PolarHBondContact O-N 3.31Å; S168-T172 WeakPolarHBondContact O-CB 3.44Å; S168-T172 WeakPolarHBondContact O-CG2 3.48Å; S168-T172 PolarHBondContact O-N 2.95Å; S168-T172 VanDerWaalsContact O-N 3.07Å; S168-T172 PolarHBondContact O-OG1 2.78Å; S168-F333 VanDerWaalsContact OG-CE2 3.3Å; S168-F333 WeakPolarHBondContact OG-CE2 3.32Å; S168-F336 WeakPolarHBondContact OG-CD1 2.99Å
169	C	94.9	Very high	94.6	Very high	34 Å²	34	24.1 Å²	24.1	23%	0.23	15%	0.148	C	C	.	.	H	α-helix	trans	-64.1	-36.6	175.3	-73.9	0	0	0	0	112.9	I165 A166 T172 T173	I165-C169 PolarHBondContact O-N 2.71Å; I165-C169 PolarHBondContact O-SG 2.69Å; A166-C169 PolarHBondContact O-N 3.32Å; C169-T172 WeakPolarHBondContact CA-OG1 3.35Å; C169-T172 PolarHBondContact O-OG1 3.07Å; C169-T173 WeakPolarHBondContact O-CB 3.33Å; C169-T173 PolarHBondContact O-N 3.28Å; C169-T173 PolarHBondContact O-OG1 2.95Å
170	V	95.8	Very high	94.6	Very high	71 Å²	71	23.2 Å²	23.2	43%	0.43	14%	0.139	S	C	.	.	H	α-helix	trans	-66.3	-50.6	175.6	167.3	0	0	0	0	111.1	A166 L167 T172 T173 I174 L566	A166-V170 WeakPolarHBondContact O-CG2 3.47Å; A166-V170 PolarHBondContact O-N 2.91Å; L167-V170 PolarHBondContact O-N 3.38Å; V170-T172 VanDerWaalsContact C-N 3.31Å; V170-T172 PolarHBondContact O-N 3.5Å; V170-T173 PolarHBondContact O-N 2.68Å; V170-I174 HydrophobicContact CG1-CD1 3.81Å; V170-I174 WeakPolarHBondContact O-CG1 3.4Å; V170-I174 PolarHBondContact O-N 3.34Å; V170-L566 HydrophobicContact CG1-CD2 4.03Å
171	V	95.6	Very high	94.6	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-55.7	-46.6	178	165.7	0	0	0	0	111.4	L167 T175 F337 L527 Y530 L566	L167-V171 WeakPolarHBondContact O-CG2 3.49Å; L167-V171 PolarHBondContact O-N 2.95Å; V171-T175 WeakPolarHBondContact O-CB 3.26Å; V171-T175 PolarHBondContact O-N 3.15Å; V171-T175 VanDerWaalsContact O-N 3.12Å; V171-T175 PolarHBondContact O-OG1 3.32Å; V171-F337 HydrophobicContact CB-CE2 4.34Å; V171-F337 HydrophobicContact CG1-CE2 3.84Å; V171-F337 HydrophobicContact CG1-CZ 4.06Å; V171-L527 HydrophobicContact CG1-CD2 4.21Å; V171-Y530 HydrophobicContact CG1-CD2 4.34Å; V171-L566 HydrophobicContact CG2-CD2 3.68Å; V171-L566 HydrophobicContact CG2-CG 4.01Å
172	T	95.4	Very high	94.5	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.012	12%	0.124	C	C	.	.	H	α-helix	trans	-74.4	-35.8	-177.6	51.5	0	0	0	0	112.8	S168 C169 V170 T175 G176 A340 I343 Y530	S168-T172 WeakPolarHBondContact O-CB 3.44Å; S168-T172 WeakPolarHBondContact O-CG2 3.48Å; S168-T172 PolarHBondContact O-N 2.95Å; S168-T172 VanDerWaalsContact O-N 3.07Å; S168-T172 PolarHBondContact O-OG1 2.78Å; C169-T172 WeakPolarHBondContact CA-OG1 3.35Å; C169-T172 PolarHBondContact O-OG1 3.07Å; V170-T172 VanDerWaalsContact C-N 3.31Å; V170-T172 PolarHBondContact O-N 3.5Å; T172-T175 PolarHBondContact O-N 3.26Å; T172-G176 PolarHBondContact O-N 3.02Å; T172-A340 HydrophobicContact CG2-CB 3.99Å; T172-A340 WeakPolarHBondContact CG2-O 3.37Å; T172-I343 HydrophobicContact CG2-CD1 4.49Å; T172-I343 HydrophobicContact CG2-CG2 4.41Å; T172-Y530 HydrophobicContact CG2-CE2 4.32Å
173	T	95.9	Very high	94.2	Very high	53 Å²	53	17.8 Å²	17.8	33%	0.325	11%	0.11	S	C	.	.	H	α-helix	trans	-64.8	-48.1	173.9	-61.4	0	0	0	0	111.3	C169 V170 T175 G176 L177 L365	C169-T173 WeakPolarHBondContact O-CB 3.33Å; C169-T173 PolarHBondContact O-N 3.28Å; C169-T173 PolarHBondContact O-OG1 2.95Å; V170-T173 PolarHBondContact O-N 2.68Å; T173-T175 VanDerWaalsContact C-N 3.29Å; T173-T175 PolarHBondContact O-N 3.25Å; T173-G176 CarbonylContact O-C 3.56Å; T173-G176 WeakPolarHBondContact O-CA 3.48Å; T173-G176 PolarHBondContact O-N 3.5Å; T173-G176 VanDerWaalsContact O-N 3.09Å; T173-L177 HydrophobicContact CG2-CD1 4.44Å; T173-L177 WeakPolarHBondContact O-CG 3.49Å; T173-L177 PolarHBondContact O-N 3.16Å; T173-L365 HydrophobicContact CG2-CD2 4.44Å
174	I	96.2	Very high	93.9	Very high	12 Å²	12	15.5 Å²	15.5	6%	0.062	10%	0.097	C	C	.	.	H	α-helix	trans	-60.1	-42.6	177.6	-65.5	169.3	0	0	0	110.5	V170 G176 L177 S178 L559	V170-I174 HydrophobicContact CG1-CD1 3.81Å; V170-I174 WeakPolarHBondContact O-CG1 3.4Å; V170-I174 PolarHBondContact O-N 3.34Å; I174-G176 VanDerWaalsContact C-N 3.32Å; I174-G176 PolarHBondContact O-N 2.98Å; I174-L177 WeakPolarHBondContact O-CB 3.38Å; I174-L177 PolarHBondContact O-N 3.12Å; I174-S178 PolarHBondContact O-N 3.3Å; I174-S178 PolarHBondContact O-OG 2.86Å; I174-L559 HydrophobicContact CD1-CD1 3.94Å; I174-L559 HydrophobicContact CG1-CD1 3.95Å; I174-L559 HydrophobicContact CG1-CG 4.16Å; I174-L559 HydrophobicContact CG2-CG 4.25Å; I174-L559 VanDerWaalsContact CG2-O 3.3Å; I174-L559 WeakPolarHBondContact CG2-O 3.49Å
175	T	95.7	Very high	93.5	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-66	-35.2	176.3	-50.6	0	0	0	0	112	V171 T172 T173 S178 M179 I343 Y530 I533 N534	V171-T175 WeakPolarHBondContact O-CB 3.26Å; V171-T175 PolarHBondContact O-N 3.15Å; V171-T175 VanDerWaalsContact O-N 3.12Å; V171-T175 PolarHBondContact O-OG1 3.32Å; T172-T175 PolarHBondContact O-N 3.26Å; T173-T175 VanDerWaalsContact C-N 3.29Å; T173-T175 PolarHBondContact O-N 3.25Å; T175-S178 PolarHBondContact O-N 2.89Å; T175-M179 WeakPolarHBondContact O-CB 3.34Å; T175-M179 PolarHBondContact O-N 3.41Å; T175-I343 HydrophobicContact CG2-CD1 4.15Å; T175-Y530 HydrophobicContact CG2-CD1 3.89Å; T175-Y530 HydrophobicContact CG2-CD2 4.41Å; T175-Y530 HydrophobicContact CG2-CG 3.79Å; T175-I533 HydrophobicContact CG2-CG2 4.29Å; T175-N534 WeakPolarHBondContact CA-OD1 3.42Å; T175-N534 PolarHBondContact OG1-ND2 3.27Å
176	G	94.8	Very high	92.7	Very high	1 Å²	1	18 Å²	18	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-65.5	-35.7	171.8	0	0	0	0	0	113.6	T172 T173 I174 S180	T172-G176 PolarHBondContact O-N 3.02Å; T173-G176 CarbonylContact O-C 3.56Å; T173-G176 WeakPolarHBondContact O-CA 3.48Å; T173-G176 PolarHBondContact O-N 3.5Å; T173-G176 VanDerWaalsContact O-N 3.09Å; I174-G176 VanDerWaalsContact C-N 3.32Å; I174-G176 PolarHBondContact O-N 2.98Å; G176-S180 WeakPolarHBondContact O-CB 3.31Å; G176-S180 PolarHBondContact O-N 3.24Å; G176-S180 PolarHBondContact O-OG 3.21Å
177	L	95	Very high	91.7	Very high	24 Å²	24	21.7 Å²	21.7	13%	0.126	14%	0.138	C	C	.	.	H	α-helix	trans	-68.1	-44.4	172.6	-64.9	171.1	0	0	0	111.2	T173 I174 S180 A181 L365 Y552 F554 L559	T173-L177 HydrophobicContact CG2-CD1 4.44Å; T173-L177 WeakPolarHBondContact O-CG 3.49Å; T173-L177 PolarHBondContact O-N 3.16Å; I174-L177 WeakPolarHBondContact O-CB 3.38Å; I174-L177 PolarHBondContact O-N 3.12Å; L177-S180 WeakPolarHBondContact O-CB 3.44Å; L177-S180 PolarHBondContact O-N 3.05Å; L177-A181 PolarHBondContact O-N 2.52Å; L177-L365 HydrophobicContact CD2-CD1 4.06Å; L177-L365 HydrophobicContact CD2-CD2 4.4Å; L177-Y552 HydrophobicContact CD2-CE1 3.7Å; L177-F554 HydrophobicContact CD2-CB 4.14Å; L177-L559 HydrophobicContact CD1-CD2 3.6Å
178	S	95.1	Very high	90.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-43.4	173.3	-62.6	0	0	0	0	111.9	I174 T175 S180 A181 I182 N534 S560	I174-S178 PolarHBondContact O-N 3.3Å; I174-S178 PolarHBondContact O-OG 2.86Å; T175-S178 PolarHBondContact O-N 2.89Å; S178-S180 VanDerWaalsContact C-N 3.32Å; S178-S180 PolarHBondContact O-N 3.18Å; S178-A181 WeakPolarHBondContact O-CB 3.48Å; S178-A181 PolarHBondContact O-N 2.74Å; S178-I182 PolarHBondContact O-N 3.48Å; S178-I182 VanDerWaalsContact O-N 3.1Å; S178-N534 WeakPolarHBondContact CB-OD1 3.42Å; S178-N534 PolarHBondContact OG-OD1 3.3Å; S178-S560 PolarHBondContact OG-OG 3.11Å
179	M	91.6	Very high	88.9	Confident	9 Å²	9	29 Å²	29	4%	0.044	17%	0.166	C	C	.	.	H	α-helix	trans	-65.2	-35.6	174.7	-168.9	67.8	-141.9	0	0	112	T175 A181 I182 C183 L196 I197 L344 A347	T175-M179 WeakPolarHBondContact O-CB 3.34Å; T175-M179 PolarHBondContact O-N 3.41Å; M179-A181 VanDerWaalsContact C-N 3.3Å; M179-A181 PolarHBondContact O-N 2.81Å; M179-I182 HydrophobicContact CE-CB 4.2Å; M179-I182 HydrophobicContact CE-CG2 3.95Å; M179-I182 PolarHBondContact O-N 2.83Å; M179-I182 HydrophobicContact SD-CD1 4.16Å; M179-C183 VanDerWaalsContact CE-SG 3.51Å; M179-C183 WeakPolarHBondContact O-CB 3.21Å; M179-C183 PolarHBondContact O-N 3.22Å; M179-C183 PolarHBondContact O-SG 2.9Å; M179-C183 VanDerWaalsContact O-SG 3.37Å; M179-L196 HydrophobicContact CE-CB 4.01Å; M179-L196 HydrophobicContact CE-CD1 3.92Å; M179-I197 HydrophobicContact CE-CG1 4.38Å; M179-I197 HydrophobicContact SD-CD1 4.5Å; M179-I197 HydrophobicContact SD-CG1 4.36Å; M179-L344 HydrophobicContact CG-CD2 3.78Å; M179-L344 HydrophobicContact SD-CD2 3.52Å; M179-L344 VanDerWaalsContact SD-CD2 3.52Å; M179-A347 HydrophobicContact CE-CB 4.14Å
180	S	92.1	Very high	87.3	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.014	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-33.4	174.7	-61.2	0	0	0	0	112.4	G176 L177 S178 T184 P361	G176-S180 WeakPolarHBondContact O-CB 3.31Å; G176-S180 PolarHBondContact O-N 3.24Å; G176-S180 PolarHBondContact O-OG 3.21Å; L177-S180 WeakPolarHBondContact O-CB 3.44Å; L177-S180 PolarHBondContact O-N 3.05Å; S178-S180 VanDerWaalsContact C-N 3.32Å; S178-S180 PolarHBondContact O-N 3.18Å; S180-T184 WeakPolarHBondContact O-CG2 3.31Å; S180-T184 PolarHBondContact O-N 3.47Å; S180-T184 VanDerWaalsContact O-N 3.13Å; S180-T184 PolarHBondContact O-OG1 2.73Å; S180-P361 WeakPolarHBondContact OG-CA 3.31Å; S180-P361 WeakPolarHBondContact OG-CB 3.45Å
181	A	92.3	Very high	85.9	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.8	-44.3	171	0	0	0	0	0	112.2	L177 S178 M179 T184 N185 W548 P550 Y555	L177-A181 PolarHBondContact O-N 2.52Å; S178-A181 WeakPolarHBondContact O-CB 3.48Å; S178-A181 PolarHBondContact O-N 2.74Å; M179-A181 VanDerWaalsContact C-N 3.3Å; M179-A181 PolarHBondContact O-N 2.81Å; A181-T184 PolarHBondContact O-N 3.32Å; A181-T184 PolarHBondContact O-OG1 3.19Å; A181-N185 PolarHBondContact O-N 2.7Å; A181-N185 VanDerWaalsContact O-N 3.11Å; A181-W548 HydrophobicContact CB-CH2 4.32Å; A181-W548 HydrophobicContact CB-CZ2 4.28Å; A181-P550 HydrophobicContact CB-CB 3.65Å; A181-P550 HydrophobicContact CB-CG 4.41Å; A181-Y555 HydrophobicContact CB-CD1 4.16Å; A181-Y555 HydrophobicContact CB-CD2 3.35Å; A181-Y555 HydrophobicContact CB-CE1 4.48Å; A181-Y555 HydrophobicContact CB-CE2 3.71Å; A181-Y555 HydrophobicContact CB-CG 3.6Å
182	I	91	Very high	85.2	Confident	1 Å²	1	29 Å²	29	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-58.3	-50	172.6	-62.7	171.3	0	0	0	110.4	S178 M179 T184 N185 L196 I197 L201 I533 W548	S178-I182 PolarHBondContact O-N 3.48Å; S178-I182 VanDerWaalsContact O-N 3.1Å; M179-I182 HydrophobicContact CE-CB 4.2Å; M179-I182 HydrophobicContact CE-CG2 3.95Å; M179-I182 PolarHBondContact O-N 2.83Å; M179-I182 HydrophobicContact SD-CD1 4.16Å; I182-T184 PolarHBondContact O-N 3.41Å; I182-N185 PolarHBondContact O-N 3.05Å; I182-N185 VanDerWaalsContact O-N 3.1Å; I182-L196 HydrophobicContact CG2-CB 4.06Å; I182-I197 HydrophobicContact CD1-CG1 4.16Å; I182-L201 HydrophobicContact CD1-CD1 3.78Å; I182-L201 HydrophobicContact CG1-CD1 4.3Å; I182-I533 HydrophobicContact CD1-CG2 4.13Å; I182-W548 HydrophobicContact CG1-CH2 3.95Å; I182-W548 HydrophobicContact CG1-CZ3 4.14Å
183	C	88.9	Confident	84.4	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.4	-18.2	-179.4	-72.3	0	0	0	0	114.8	M179 V188 Q357 I360	M179-C183 VanDerWaalsContact CE-SG 3.51Å; M179-C183 WeakPolarHBondContact O-CB 3.21Å; M179-C183 PolarHBondContact O-N 3.22Å; M179-C183 PolarHBondContact O-SG 2.9Å; M179-C183 VanDerWaalsContact O-SG 3.37Å; C183-V188 VanDerWaalsContact O-CG2 3.32Å; C183-V188 WeakPolarHBondContact O-CG2 3.43Å; C183-Q357 WeakPolarHBondContact O-CG 3.43Å; C183-I360 HydrophobicContact CB-CB 4.45Å
184	T	88.8	Confident	83.9	Confident	20 Å²	20	26.6 Å²	26.6	12%	0.123	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	2.3	176.3	53.6	0	0	0	0	113	S180 A181 I182 G186 A551 Y552	S180-T184 WeakPolarHBondContact O-CG2 3.31Å; S180-T184 PolarHBondContact O-N 3.47Å; S180-T184 VanDerWaalsContact O-N 3.13Å; S180-T184 PolarHBondContact O-OG1 2.73Å; A181-T184 PolarHBondContact O-N 3.32Å; A181-T184 PolarHBondContact O-OG1 3.19Å; I182-T184 PolarHBondContact O-N 3.41Å; T184-G186 PolarHBondContact O-N 3.29Å; T184-A551 PolarHBondContact OG1-N 3.24Å; T184-Y552 WeakPolarHBondContact OG1-CB 3.34Å; T184-Y552 PolarHBondContact OG1-N 3.09Å
185	N	85.4	Confident	83.3	Confident	19 Å²	19	29 Å²	29	10%	0.102	18%	0.18	C	C	.	.	S	Bend	trans	-88.2	83.7	175.8	-174.1	45	0	0	0	111.3	A181 I182 G547 W548 R549	A181-N185 PolarHBondContact O-N 2.7Å; A181-N185 VanDerWaalsContact O-N 3.11Å; I182-N185 PolarHBondContact O-N 3.05Å; I182-N185 VanDerWaalsContact O-N 3.1Å; N185-G547 PolarHBondContact ND2-O 3.29Å; N185-G547 PolarHBondContact OD1-O 3.01Å; N185-W548 HydrophobicContact CB-CE3 4.28Å; N185-W548 HydrophobicContact CB-CZ3 4.31Å; N185-W548 WeakPolarHBondContact OD1-CA 3.41Å; N185-R549 PolarHBondContact OD1-N 3Å
186	G	78.3	Confident	82.7	Confident	44 Å²	44	29.3 Å²	29.3	45%	0.454	18%	0.182	S	C	.	.	S	Bend	trans	82.5	-177	178.8	0	0	0	0	0	114.5	T184 V188 Q357	T184-G186 PolarHBondContact O-N 3.29Å; G186-V188 PolarHBondContact O-N 3.34Å; G186-Q357 PolarHBondContact O-NE2 3.31Å
187	V	74.4	Confident	82.2	Confident	124 Å²	124	29.5 Å²	29.5	75%	0.752	18%	0.182	S	C	*	.			trans	-74.7	115.1	-171.5	-179.4	0	0	0	0	111.5	R189	V187-R189 PolarHBondContact O-N 2.83Å; V187-R189 VanDerWaalsContact O-N 3.07Å
188	V	67.9	Low	81.7	Confident	31 Å²	31	28.3 Å²	28.3	19%	0.188	18%	0.176	C	C	.	.			trans	-71	102.1	176.4	179.9	0	0	0	0	110.6	C183 G186 L196 A356 Q357	C183-V188 VanDerWaalsContact O-CG2 3.32Å; C183-V188 WeakPolarHBondContact O-CG2 3.43Å; G186-V188 PolarHBondContact O-N 3.34Å; V188-L196 HydrophobicContact CB-CD2 4.19Å; V188-L196 HydrophobicContact CG1-CD2 3.68Å; V188-L196 HydrophobicContact CG1-CG 4.4Å; V188-L196 HydrophobicContact CG2-CD2 3.64Å; V188-A356 HydrophobicContact CB-CB 3.98Å; V188-A356 HydrophobicContact CG1-CB 3.55Å; V188-A356 HydrophobicContact CG2-CB 4.42Å; V188-Q357 HydrophobicContact CG2-CG 3.83Å
189	R	62.6	Low	81.2	Confident	160 Å²	160	32.7 Å²	32.7	60%	0.604	19%	0.193	S	C	*	.			trans	-87.2	157.7	167.4	-63.4	-174.3	178.4	-164.2	-0.8	110.6	V187 G191 Y195	V187-R189 PolarHBondContact O-N 2.83Å; V187-R189 VanDerWaalsContact O-N 3.07Å; R189-G191 PolarHBondContact O-N 3.2Å; R189-Y195 HydrophobicContact CB-CE1 3.99Å
190	G	60.7	Low	80.7	Confident	58 Å²	58	33.2 Å²	33.2	60%	0.598	20%	0.197	S	C	*	.	S	Bend	trans	-70	113.8	-175.3	0	0	0	0	0	113.6
191	G	66.1	Low	80.1	Confident	36 Å²	36	33.4 Å²	33.4	37%	0.371	20%	0.198	S	C	.	.	S	Bend	trans	-167.7	6.9	175.7	0	0	0	0	0	116	R189 Y195	R189-G191 PolarHBondContact O-N 3.2Å; G191-Y195 VanDerWaalsContact C-CB 3.49Å; G191-Y195 VanDerWaalsContact O-CB 3.26Å; G191-Y195 WeakPolarHBondContact O-CB 3.29Å
192	G	80.7	Confident	79.7	Confident	11 Å²	11	33.5 Å²	33.5	11%	0.113	20%	0.199	C	C	.	.	H	α-helix	trans	75.8	-169	-179.1	0	0	0	0	0	114.4	Y195 L196 A347 N348 S350	G192-Y195 PolarHBondContact O-N 2.89Å; G192-L196 PolarHBondContact O-N 3.35Å; G192-A347 CarbonylContact C-O 3.55Å; G192-A347 VanDerWaalsContact C-O 3.26Å; G192-A347 WeakPolarHBondContact CA-O 3.12Å; G192-N348 VanDerWaalsContact CA-O 3.22Å; G192-N348 WeakPolarHBondContact CA-O 3.27Å; G192-S350 VanDerWaalsContact CA-OG 3.29Å; G192-S350 WeakPolarHBondContact CA-OG 3.33Å; G192-S350 PolarHBondContact N-OG 3.25Å; G192-S350 PolarHBondContact O-OG 3.29Å
193	A	78.6	Confident	79.4	Confident	1 Å²	1	34 Å²	34	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-41	-172.9	0	0	0	0	0	112.6	Y195 L196 I197 A347 N348	A193-Y195 VanDerWaalsContact C-N 3.35Å; A193-Y195 PolarHBondContact O-N 3.2Å; A193-L196 WeakPolarHBondContact O-CB 3.45Å; A193-L196 PolarHBondContact O-N 3.2Å; A193-I197 WeakPolarHBondContact O-CD1 3.26Å; A193-I197 VanDerWaalsContact O-CG1 3.24Å; A193-I197 WeakPolarHBondContact O-CG1 3.33Å; A193-I197 PolarHBondContact O-N 3.27Å; A193-A347 HydrophobicContact CB-CB 3.9Å; A193-A347 PolarHBondContact N-O 3.27Å; A193-A347 VanDerWaalsContact N-O 3.12Å; A193-N348 VanDerWaalsContact CB-OD1 3.24Å; A193-N348 WeakPolarHBondContact CB-OD1 3.37Å
194	Y	86.2	Confident	79.2	Confident	5 Å²	5	34.8 Å²	34.8	2%	0.02	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-40.4	177.1	159.7	-95.1	0	0	0	112.4	I197 S198 G206 A472 L473 D476	Y194-I197 PolarHBondContact O-N 2.8Å; Y194-S198 VanDerWaalsContact O-CB 3.26Å; Y194-S198 WeakPolarHBondContact O-CB 3.39Å; Y194-S198 PolarHBondContact O-N 3.15Å; Y194-S198 PolarHBondContact O-OG 3.37Å; Y194-G206 WeakPolarHBondContact CE2-O 3.17Å; Y194-A472 HydrophobicContact CD1-CB 3.52Å; Y194-A472 HydrophobicContact CE1-CB 3.86Å; Y194-L473 HydrophobicContact CE1-CB 4.49Å; Y194-L473 HydrophobicContact CE2-CB 4.17Å; Y194-L473 HydrophobicContact CE2-CD1 3.73Å; Y194-D476 WeakPolarHBondContact CE1-OD2 3.38Å; Y194-D476 PolarHBondContact OH-OD2 3.39Å
195	Y	82.9	Confident	79.1	Confident	61 Å²	61	34.4 Å²	34.4	24%	0.239	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-40.1	177.9	-177.4	-90.2	0	0	0	112.1	R189 G191 G192 A193 R199	R189-Y195 HydrophobicContact CB-CE1 3.99Å; G191-Y195 VanDerWaalsContact C-CB 3.49Å; G191-Y195 VanDerWaalsContact O-CB 3.26Å; G191-Y195 WeakPolarHBondContact O-CB 3.29Å; G192-Y195 PolarHBondContact O-N 2.89Å; A193-Y195 VanDerWaalsContact C-N 3.35Å; A193-Y195 PolarHBondContact O-N 3.2Å; Y195-R199 HydrophobicContact CD1-CG 4.24Å; Y195-R199 HydrophobicContact CD2-CG 4.13Å; Y195-R199 HydrophobicContact CE1-CG 4.07Å; Y195-R199 HydrophobicContact CE2-CG 3.97Å; Y195-R199 HydrophobicContact CG-CG 4.26Å; Y195-R199 WeakPolarHBondContact O-CB 3.42Å; Y195-R199 WeakPolarHBondContact O-CG 3.44Å; Y195-R199 PolarHBondContact O-N 3.2Å; Y195-R199 VanDerWaalsContact O-N 3.1Å
196	L	82.4	Confident	79.1	Confident	8 Å²	8	33.5 Å²	33.5	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-54.6	172	-78.6	165	0	0	0	111	M179 I182 V188 G192 A193 S198 S200 A347 I360	M179-L196 HydrophobicContact CE-CB 4.01Å; M179-L196 HydrophobicContact CE-CD1 3.92Å; I182-L196 HydrophobicContact CG2-CB 4.06Å; V188-L196 HydrophobicContact CB-CD2 4.19Å; V188-L196 HydrophobicContact CG1-CD2 3.68Å; V188-L196 HydrophobicContact CG1-CG 4.4Å; V188-L196 HydrophobicContact CG2-CD2 3.64Å; G192-L196 PolarHBondContact O-N 3.35Å; A193-L196 WeakPolarHBondContact O-CB 3.45Å; A193-L196 PolarHBondContact O-N 3.2Å; L196-S198 PolarHBondContact O-N 2.8Å; L196-S200 WeakPolarHBondContact O-CB 3.25Å; L196-S200 PolarHBondContact O-N 2.71Å; L196-S200 VanDerWaalsContact O-N 3.13Å; L196-S200 PolarHBondContact O-OG 3.4Å; L196-S200 VanDerWaalsContact O-OG 3.11Å; L196-A347 HydrophobicContact CD1-CB 4.35Å; L196-I360 HydrophobicContact CD1-CD1 4.18Å
197	I	85.6	Confident	79.6	Confident	5 Å²	5	31.4 Å²	31.4	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-60.9	-48.5	-178.1	-66.4	164.6	0	0	0	110.7	M179 I182 A193 Y194 R199 L201 I209 I533	M179-I197 HydrophobicContact CE-CG1 4.38Å; M179-I197 HydrophobicContact SD-CD1 4.5Å; M179-I197 HydrophobicContact SD-CG1 4.36Å; I182-I197 HydrophobicContact CD1-CG1 4.16Å; A193-I197 WeakPolarHBondContact O-CD1 3.26Å; A193-I197 VanDerWaalsContact O-CG1 3.24Å; A193-I197 WeakPolarHBondContact O-CG1 3.33Å; A193-I197 PolarHBondContact O-N 3.27Å; Y194-I197 PolarHBondContact O-N 2.8Å; I197-R199 PolarHBondContact O-N 3.4Å; I197-L201 HydrophobicContact CG2-CD1 3.88Å; I197-L201 VanDerWaalsContact O-CB 3.29Å; I197-L201 WeakPolarHBondContact O-CB 3.3Å; I197-L201 PolarHBondContact O-N 2.96Å; I197-L201 VanDerWaalsContact O-N 3.1Å; I197-I209 HydrophobicContact CD1-CG2 4.04Å; I197-I209 HydrophobicContact CG2-CB 4.18Å; I197-I209 HydrophobicContact CG2-CD1 3.69Å; I197-I209 HydrophobicContact CG2-CG2 4.11Å; I197-I533 HydrophobicContact CD1-CD1 4.21Å; I197-I533 HydrophobicContact CD1-CG1 4.4Å
198	S	84.4	Confident	80.4	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-71.1	-33.1	-173.1	76.4	0	0	0	0	113.8	Y194 L196 G202 W602	Y194-S198 VanDerWaalsContact O-CB 3.26Å; Y194-S198 WeakPolarHBondContact O-CB 3.39Å; Y194-S198 PolarHBondContact O-N 3.15Å; Y194-S198 PolarHBondContact O-OG 3.37Å; L196-S198 PolarHBondContact O-N 2.8Å; S198-G202 CarbonylContact O-C 3.56Å; S198-G202 WeakPolarHBondContact O-CA 3.49Å; S198-G202 PolarHBondContact O-N 3.32Å; S198-G202 VanDerWaalsContact O-N 3.09Å; S198-W602 VanDerWaalsContact O-CE3 3.32Å
199	R	83.8	Confident	81.5	Confident	92 Å²	92	24.3 Å²	24.3	35%	0.347	13%	0.133	S	C	.	.	H	α-helix	trans	-83.2	-27.8	178.7	-58.2	-62.5	166.9	128.1	-3.8	113.4	Y195 I197 D476 W602	Y195-R199 HydrophobicContact CD1-CG 4.24Å; Y195-R199 HydrophobicContact CD2-CG 4.13Å; Y195-R199 HydrophobicContact CE1-CG 4.07Å; Y195-R199 HydrophobicContact CE2-CG 3.97Å; Y195-R199 HydrophobicContact CG-CG 4.26Å; Y195-R199 WeakPolarHBondContact O-CB 3.42Å; Y195-R199 WeakPolarHBondContact O-CG 3.44Å; Y195-R199 PolarHBondContact O-N 3.2Å; Y195-R199 VanDerWaalsContact O-N 3.1Å; I197-R199 PolarHBondContact O-N 3.4Å; R199-D476 IonicContact NH2-OD1 3.84Å; R199-D476 PolarHBondContact NH2-OD1 3.19Å; R199-W602 VanDerWaalsContact NE-CE2 3.31Å; R199-W602 VanDerWaalsContact NH2-CZ2 3.32Å
200	S	81.5	Confident	82.8	Confident	20 Å²	20	16.8 Å²	16.8	14%	0.14	11%	0.106	C	C	.	.	H	α-helix	trans	-84.7	-26.1	175.9	-57.4	0	0	0	0	114.1	L196	L196-S200 WeakPolarHBondContact O-CB 3.25Å; L196-S200 PolarHBondContact O-N 2.71Å; L196-S200 VanDerWaalsContact O-N 3.13Å; L196-S200 PolarHBondContact O-OG 3.4Å; L196-S200 VanDerWaalsContact O-OG 3.11Å
201	L	80.5	Confident	84.3	Confident	6 Å²	6	15.9 Å²	15.9	3%	0.031	9%	0.087	C	C	.	.	H	α-helix	trans	-117.1	-13.6	-170.7	-59	162.9	0	0	0	114.1	I182 I197 F205 S536 A540 W548	I182-L201 HydrophobicContact CD1-CD1 3.78Å; I182-L201 HydrophobicContact CG1-CD1 4.3Å; I197-L201 HydrophobicContact CG2-CD1 3.88Å; I197-L201 VanDerWaalsContact O-CB 3.29Å; I197-L201 WeakPolarHBondContact O-CB 3.3Å; I197-L201 PolarHBondContact O-N 2.96Å; I197-L201 VanDerWaalsContact O-N 3.1Å; L201-F205 HydrophobicContact CB-CB 4.29Å; L201-S536 WeakPolarHBondContact CD1-OG 3.25Å; L201-A540 HydrophobicContact CD2-CB 4Å; L201-W548 HydrophobicContact CD2-CE3 4.11Å; L201-W548 HydrophobicContact CD2-CH2 4.12Å; L201-W548 HydrophobicContact CD2-CZ3 3.65Å; L201-W548 HydrophobicContact CG-CZ3 4.38Å
202	G	82.4	Confident	85.5	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.01	7%	0.072	C	C	.	.			trans	94.8	167.6	-179.1	0	0	0	0	0	114	S198 E204 G206	S198-G202 CarbonylContact O-C 3.56Å; S198-G202 WeakPolarHBondContact O-CA 3.49Å; S198-G202 PolarHBondContact O-N 3.32Å; S198-G202 VanDerWaalsContact O-N 3.09Å; G202-E204 VanDerWaalsContact C-N 3.31Å; G202-E204 PolarHBondContact O-N 3.42Å; G202-G206 PolarHBondContact O-N 2.84Å
203	P	84.3	Confident	86	Confident	13 Å²	13	14.6 Å²	14.6	8%	0.084	7%	0.069	C	C	.	.	H	α-helix	trans	-68.2	-25.4	-171.1	26.3	-34.7	0	0	0	114.2	G207 I478 V593 W602	P203-G207 WeakPolarHBondContact O-CA 3.39Å; P203-G207 PolarHBondContact O-N 2.89Å; P203-I478 HydrophobicContact CB-CD1 4.11Å; P203-V593 HydrophobicContact CB-CG1 4.45Å; P203-W602 HydrophobicContact CB-CE3 3.93Å; P203-W602 HydrophobicContact CB-CZ3 3.8Å; P203-W602 HydrophobicContact CG-CE3 4.43Å
204	E	84.9	Confident	86.6	Confident	16 Å²	16	14.8 Å²	14.8	8%	0.075	7%	0.07	C	C	.	.	H	α-helix	trans	-66.5	-52	-178.1	-58.2	171.9	134.4	0	0	111.2	G202 S208 Y590 V593 T594 S604 T606	G202-E204 VanDerWaalsContact C-N 3.31Å; G202-E204 PolarHBondContact O-N 3.42Å; E204-S208 PolarHBondContact O-OG 3.37Å; E204-Y590 HydrophobicContact CB-CD2 3.97Å; E204-Y590 HydrophobicContact CB-CE2 3.6Å; E204-Y590 HydrophobicContact CG-CE2 4.48Å; E204-V593 HydrophobicContact CG-CG1 4.05Å; E204-T594 PolarHBondContact OE1-OG1 3.36Å; E204-S604 PolarHBondContact OE2-OG 2.92Å; E204-T606 WeakPolarHBondContact OE2-CG2 3.44Å; E204-T606 PolarHBondContact OE2-OG1 3.13Å
205	F	86.4	Confident	86.9	Confident	11 Å²	11	17.9 Å²	17.9	5%	0.048	8%	0.083	C	C	.	.	H	α-helix	trans	-75.2	-46.2	174.8	-67.8	-71.9	0	0	0	111.8	L201 G207 S208 I209 F535 H539 Y590	L201-F205 HydrophobicContact CB-CB 4.29Å; F205-G207 VanDerWaalsContact C-N 3.34Å; F205-G207 PolarHBondContact O-N 3.13Å; F205-S208 PolarHBondContact O-N 3.43Å; F205-S208 VanDerWaalsContact O-N 3.14Å; F205-I209 HydrophobicContact CB-CD1 4.24Å; F205-I209 WeakPolarHBondContact O-CB 3.42Å; F205-I209 VanDerWaalsContact O-CG1 3.31Å; F205-I209 WeakPolarHBondContact O-CG1 3.4Å; F205-I209 PolarHBondContact O-N 3.06Å; F205-F535 AromaticContact CE1-CD1 3.95Å; F205-F535 HydrophobicContact CE1-CD1 3.95Å; F205-F535 HydrophobicContact CE1-CE1 4.02Å; F205-F535 HydrophobicContact CZ-CD1 4.44Å; F205-F535 HydrophobicContact CZ-CE1 4.17Å; F205-H539 AromaticContact CE2-ND1 3.69Å; F205-H539 HydrophobicContact CZ-CB 4.49Å; F205-H539 AromaticContact CZ-ND1 3.96Å; F205-Y590 HydrophobicContact CE1-CE2 4.32Å; F205-Y590 HydrophobicContact CE2-CE2 4.42Å; F205-Y590 HydrophobicContact CZ-CE2 4.18Å
206	G	87.4	Confident	87.4	Confident	0 Å²	0	15 Å²	15	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-58.9	-42.6	-178.8	0	0	0	0	0	113.4	Y194 G202 S208 G210	Y194-G206 WeakPolarHBondContact CE2-O 3.17Å; G202-G206 PolarHBondContact O-N 2.84Å; G206-S208 VanDerWaalsContact C-N 3.33Å; G206-S208 PolarHBondContact O-N 3.29Å; G206-G210 PolarHBondContact O-N 3.07Å
207	G	88.1	Confident	87.8	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-66.2	-32.3	177.2	0	0	0	0	0	113.7	P203 F205 Y479	P203-G207 WeakPolarHBondContact O-CA 3.39Å; P203-G207 PolarHBondContact O-N 2.89Å; F205-G207 VanDerWaalsContact C-N 3.34Å; F205-G207 PolarHBondContact O-N 3.13Å; G207-Y479 VanDerWaalsContact C-OH 3.23Å; G207-Y479 VanDerWaalsContact O-CE2 3.31Å; G207-Y479 WeakPolarHBondContact O-CE2 3.21Å; G207-Y479 PolarHBondContact O-OH 2.91Å
208	S	90.4	Very high	88.2	Confident	4 Å²	4	15 Å²	15	3%	0.028	7%	0.073	C	C	.	.	H	α-helix	trans	-79.2	-51.1	179.7	-53.9	0	0	0	0	111.1	E204 F205 G206 G210 L211 I212	E204-S208 PolarHBondContact O-OG 3.37Å; F205-S208 PolarHBondContact O-N 3.43Å; F205-S208 VanDerWaalsContact O-N 3.14Å; G206-S208 VanDerWaalsContact C-N 3.33Å; G206-S208 PolarHBondContact O-N 3.29Å; S208-G210 VanDerWaalsContact C-N 3.35Å; S208-G210 PolarHBondContact O-N 2.99Å; S208-L211 PolarHBondContact O-N 3.32Å; S208-I212 PolarHBondContact O-N 2.77Å
209	I	91.1	Very high	88.7	Confident	2 Å²	2	15 Å²	15	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-59.5	-44.8	177.4	-64.4	163.9	0	0	0	110.9	I197 F205 L211 I212 F213 L532 I533	I197-I209 HydrophobicContact CD1-CG2 4.04Å; I197-I209 HydrophobicContact CG2-CB 4.18Å; I197-I209 HydrophobicContact CG2-CD1 3.69Å; I197-I209 HydrophobicContact CG2-CG2 4.11Å; F205-I209 HydrophobicContact CB-CD1 4.24Å; F205-I209 WeakPolarHBondContact O-CB 3.42Å; F205-I209 VanDerWaalsContact O-CG1 3.31Å; F205-I209 WeakPolarHBondContact O-CG1 3.4Å; F205-I209 PolarHBondContact O-N 3.06Å; I209-L211 VanDerWaalsContact C-N 3.33Å; I209-L211 PolarHBondContact O-N 3.2Å; I209-I212 PolarHBondContact O-N 3.13Å; I209-F213 WeakPolarHBondContact O-CB 3.17Å; I209-F213 PolarHBondContact O-N 3.45Å; I209-L532 HydrophobicContact CD1-CB 4.06Å; I209-L532 HydrophobicContact CG1-CB 3.57Å; I209-L532 HydrophobicContact CG1-CD1 3.86Å; I209-L532 HydrophobicContact CG1-CG 4.38Å; I209-I533 HydrophobicContact CD1-CG1 4.11Å; I209-I533 HydrophobicContact CG2-CD1 4.2Å; I209-I533 HydrophobicContact CG2-CG1 3.92Å
210	G	90.2	Very high	89.1	Confident	3 Å²	3	10.7 Å²	10.7	3%	0.031	6%	0.057	C	C	.	.	H	α-helix	trans	-61.1	-38.4	-179	0	0	0	0	0	113.6	G206 S208 A214 V469	G206-G210 PolarHBondContact O-N 3.07Å; S208-G210 VanDerWaalsContact C-N 3.35Å; S208-G210 PolarHBondContact O-N 2.99Å; G210-A214 VanDerWaalsContact O-CB 3.31Å; G210-A214 WeakPolarHBondContact O-CB 3.43Å; G210-A214 PolarHBondContact O-N 3.28Å; G210-V469 VanDerWaalsContact O-CG1 3.26Å; G210-V469 WeakPolarHBondContact O-CG1 3.43Å
211	L	91.3	Very high	89.7	Confident	38 Å²	38	9.7 Å²	9.7	20%	0.199	5%	0.05	C	C	.	.	H	α-helix	trans	-70.3	-45.8	179.8	-165.7	73.9	0	0	0	111.5	S208 I209 A214 F215 F470 L473 L482 L589	S208-L211 PolarHBondContact O-N 3.32Å; I209-L211 VanDerWaalsContact C-N 3.33Å; I209-L211 PolarHBondContact O-N 3.2Å; L211-A214 PolarHBondContact O-N 3.03Å; L211-F215 PolarHBondContact O-N 3.42Å; L211-F470 HydrophobicContact CD1-CD2 4.18Å; L211-F470 HydrophobicContact CD1-CE2 3.65Å; L211-L473 HydrophobicContact CB-CD2 3.89Å; L211-L473 HydrophobicContact CD1-CD2 3.7Å; L211-L473 HydrophobicContact CG-CD2 4.43Å; L211-L482 HydrophobicContact CD1-CD1 3.81Å; L211-L589 HydrophobicContact CD2-CD1 3.69Å; L211-L589 HydrophobicContact CD2-CD2 3.73Å; L211-L589 HydrophobicContact CD2-CG 4.39Å
212	I	91.9	Very high	90.4	Very high	12 Å²	12	9.4 Å²	9.4	6%	0.062	5%	0.048	C	C	.	.	H	α-helix	trans	-71.3	-40.5	-178	-67	174.5	0	0	0	111	S208 I209 A214 F215 A216 F525 L532 E586	S208-I212 PolarHBondContact O-N 2.77Å; I209-I212 PolarHBondContact O-N 3.13Å; I212-A214 PolarHBondContact O-N 3.21Å; I212-F215 PolarHBondContact O-N 2.73Å; I212-A216 WeakPolarHBondContact O-CB 3.25Å; I212-A216 PolarHBondContact O-N 3.12Å; I212-F525 HydrophobicContact CG2-CD1 4.33Å; I212-L532 HydrophobicContact CD1-CD1 4.35Å; I212-E586 HydrophobicContact CD1-CG 3.24Å; I212-E586 WeakPolarHBondContact CD1-OE1 3.29Å
213	F	90.8	Very high	90.9	Very high	9 Å²	9	9.5 Å²	9.5	4%	0.039	5%	0.048	C	C	.	.	H	α-helix	trans	-63.6	-40	173.7	-176.9	-115.2	0	0	0	111.6	I209 F215 A216 N217 L344 V469 F526	I209-F213 WeakPolarHBondContact O-CB 3.17Å; I209-F213 PolarHBondContact O-N 3.45Å; F213-F215 VanDerWaalsContact C-N 3.34Å; F213-F215 PolarHBondContact O-N 3.34Å; F213-A216 PolarHBondContact O-N 2.99Å; F213-N217 WeakPolarHBondContact CD2-ND2 3.33Å; F213-N217 WeakPolarHBondContact CE1-ND2 3.36Å; F213-N217 WeakPolarHBondContact CE2-ND2 3.41Å; F213-N217 WeakPolarHBondContact CZ-ND2 3.13Å; F213-N217 PolarHBondContact O-N 3.14Å; F213-N217 VanDerWaalsContact O-N 3.07Å; F213-N217 PolarHBondContact O-ND2 3.44Å; F213-L344 HydrophobicContact CD2-CD1 3.91Å; F213-L344 HydrophobicContact CE2-CB 4.05Å; F213-L344 HydrophobicContact CE2-CD1 3.43Å; F213-L344 VanDerWaalsContact CE2-CD1 3.43Å; F213-L344 HydrophobicContact CE2-CG 4.36Å; F213-L344 HydrophobicContact CZ-CB 3.72Å; F213-L344 HydrophobicContact CZ-CD1 3.8Å; F213-L344 HydrophobicContact CZ-CG 4.41Å; F213-V469 HydrophobicContact CD1-CG1 4.15Å; F213-V469 HydrophobicContact CD1-CG2 3.93Å; F213-V469 HydrophobicContact CE1-CG2 3.95Å; F213-F526 HydrophobicContact CD2-CE1 4.05Å; F213-F526 AromaticContact CE2-CE1 3.9Å; F213-F526 HydrophobicContact CE2-CE1 3.9Å
214	A	91.8	Very high	91.4	Very high	4 Å²	4	9.2 Å²	9.2	3%	0.033	5%	0.046	C	C	.	.	H	α-helix	trans	-61	-41.9	173	0	0	0	0	0	112.2	G210 L211 I212 A218 A466 V469 F470	G210-A214 VanDerWaalsContact O-CB 3.31Å; G210-A214 WeakPolarHBondContact O-CB 3.43Å; G210-A214 PolarHBondContact O-N 3.28Å; L211-A214 PolarHBondContact O-N 3.03Å; I212-A214 PolarHBondContact O-N 3.21Å; A214-A218 WeakPolarHBondContact O-CB 3.39Å; A214-A218 PolarHBondContact O-N 2.9Å; A214-A218 VanDerWaalsContact O-N 3.12Å; A214-A466 VanDerWaalsContact O-CB 3.29Å; A214-A466 WeakPolarHBondContact O-CB 3.45Å; A214-V469 HydrophobicContact CB-CB 4.27Å; A214-V469 HydrophobicContact CB-CG1 3.92Å; A214-F470 HydrophobicContact CB-CB 4.15Å; A214-F470 HydrophobicContact CB-CD2 4.14Å
215	F	92.8	Very high	91.9	Very high	70 Å²	70	8.4 Å²	8.4	31%	0.307	4%	0.042	S	C	.	.	H	α-helix	trans	-66.1	-46.3	176.5	-168.9	-99.2	0	0	0	112.3	L211 I212 F213 N217 A218 V219 I505 F509 F525	L211-F215 PolarHBondContact O-N 3.42Å; I212-F215 PolarHBondContact O-N 2.73Å; F213-F215 VanDerWaalsContact C-N 3.34Å; F213-F215 PolarHBondContact O-N 3.34Å; F215-N217 VanDerWaalsContact C-N 3.34Å; F215-N217 PolarHBondContact O-N 3.11Å; F215-A218 WeakPolarHBondContact O-CA 3.38Å; F215-A218 WeakPolarHBondContact O-CB 3.42Å; F215-A218 PolarHBondContact O-N 3.01Å; F215-V219 HydrophobicContact CD1-CG2 4.03Å; F215-V219 HydrophobicContact CE1-CG2 3.61Å; F215-V219 HydrophobicContact CZ-CG2 3.9Å; F215-V219 PolarHBondContact O-N 3.47Å; F215-I505 HydrophobicContact CD2-CD1 4.22Å; F215-I505 HydrophobicContact CE2-CD1 4.2Å; F215-I505 HydrophobicContact CE2-CG2 4.15Å; F215-F509 HydrophobicContact CZ-CE2 4.25Å; F215-F525 HydrophobicContact CD1-CD1 4.28Å; F215-F525 HydrophobicContact CD1-CD2 4.03Å; F215-F525 HydrophobicContact CD1-CE1 4.22Å; F215-F525 AromaticContact CD1-CE2 3.97Å; F215-F525 HydrophobicContact CD1-CE2 3.97Å; F215-F525 HydrophobicContact CD1-CG 4.2Å; F215-F525 HydrophobicContact CD1-CZ 4.07Å; F215-F525 AromaticContact CE1-CD2 4Å; F215-F525 HydrophobicContact CE1-CD2 4Å; F215-F525 HydrophobicContact CE1-CE1 4.35Å; F215-F525 AromaticContact CE1-CE2 3.56Å; F215-F525 HydrophobicContact CE1-CE2 3.56Å; F215-F525 AromaticContact CE1-CZ 3.75Å; F215-F525 HydrophobicContact CE1-CZ 3.75Å
216	A	92.8	Very high	92.2	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-56.2	-46	177.6	0	0	0	0	0	112.1	I212 F213 A218 V219 A220 F525 F526	I212-A216 WeakPolarHBondContact O-CB 3.25Å; I212-A216 PolarHBondContact O-N 3.12Å; F213-A216 PolarHBondContact O-N 2.99Å; A216-A218 VanDerWaalsContact C-N 3.33Å; A216-A218 PolarHBondContact O-N 3.45Å; A216-V219 PolarHBondContact O-N 2.97Å; A216-A220 WeakPolarHBondContact O-CB 3.32Å; A216-A220 PolarHBondContact O-N 3.28Å; A216-F525 HydrophobicContact CB-CB 3.88Å; A216-F526 HydrophobicContact CB-CD1 4.1Å; A216-F526 HydrophobicContact CB-CD2 4.23Å; A216-F526 HydrophobicContact CB-CE1 3.91Å; A216-F526 HydrophobicContact CB-CE2 4.06Å; A216-F526 HydrophobicContact CB-CG 4.25Å; A216-F526 HydrophobicContact CB-CZ 3.9Å
217	N	91.8	Very high	92.5	Very high	12 Å²	12	7.9 Å²	7.9	6%	0.064	4%	0.04	C	C	.	.	H	α-helix	trans	-63.4	-36.4	174.5	-76.2	-91.9	0	0	0	112	F213 F215 A220 V221 S465 A466	F213-N217 WeakPolarHBondContact CD2-ND2 3.33Å; F213-N217 WeakPolarHBondContact CE1-ND2 3.36Å; F213-N217 WeakPolarHBondContact CE2-ND2 3.41Å; F213-N217 WeakPolarHBondContact CZ-ND2 3.13Å; F213-N217 PolarHBondContact O-N 3.14Å; F213-N217 VanDerWaalsContact O-N 3.07Å; F213-N217 PolarHBondContact O-ND2 3.44Å; F215-N217 VanDerWaalsContact C-N 3.34Å; F215-N217 PolarHBondContact O-N 3.11Å; N217-A220 PolarHBondContact O-N 2.8Å; N217-V221 PolarHBondContact O-N 3.45Å; N217-S465 PolarHBondContact OD1-OG 3.07Å; N217-A466 HydrophobicContact CB-CB 3.76Å
218	A	94.1	Very high	92.8	Very high	2 Å²	2	9.1 Å²	9.1	2%	0.017	5%	0.045	C	C	.	.	H	α-helix	trans	-69.4	-32.8	178.4	0	0	0	0	0	113.4	A214 F215 A216 A466 T502 I505 S506	A214-A218 WeakPolarHBondContact O-CB 3.39Å; A214-A218 PolarHBondContact O-N 2.9Å; A214-A218 VanDerWaalsContact O-N 3.12Å; F215-A218 WeakPolarHBondContact O-CA 3.38Å; F215-A218 WeakPolarHBondContact O-CB 3.42Å; F215-A218 PolarHBondContact O-N 3.01Å; A216-A218 VanDerWaalsContact C-N 3.33Å; A216-A218 PolarHBondContact O-N 3.45Å; A218-A466 HydrophobicContact CB-CB 4.17Å; A218-T502 HydrophobicContact CB-CG2 3.87Å; A218-I505 HydrophobicContact CB-CB 4.36Å; A218-I505 HydrophobicContact CB-CD1 4.34Å; A218-I505 HydrophobicContact CB-CG2 3.99Å; A218-S506 PolarHBondContact O-OG 3.38Å
219	V	94	Very high	92.9	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-76.9	-34.7	171.4	-173.4	0	0	0	0	111	F215 A216 V221 A222 M223 I505 F509 I522	F215-V219 HydrophobicContact CD1-CG2 4.03Å; F215-V219 HydrophobicContact CE1-CG2 3.61Å; F215-V219 HydrophobicContact CZ-CG2 3.9Å; F215-V219 PolarHBondContact O-N 3.47Å; A216-V219 PolarHBondContact O-N 2.97Å; V219-V221 VanDerWaalsContact C-N 3.3Å; V219-V221 PolarHBondContact O-N 3.4Å; V219-A222 VanDerWaalsContact O-CB 3.3Å; V219-A222 WeakPolarHBondContact O-CB 3.28Å; V219-A222 PolarHBondContact O-N 2.94Å; V219-M223 PolarHBondContact O-N 3.02Å; V219-I505 HydrophobicContact CG2-CG2 4.23Å; V219-F509 HydrophobicContact CB-CD2 4.46Å; V219-F509 HydrophobicContact CG1-CB 4.5Å; V219-F509 HydrophobicContact CG1-CD1 3.8Å; V219-F509 HydrophobicContact CG1-CD2 4.01Å; V219-F509 HydrophobicContact CG1-CE1 3.96Å; V219-F509 HydrophobicContact CG1-CE2 4.16Å; V219-F509 HydrophobicContact CG1-CG 3.84Å; V219-F509 HydrophobicContact CG1-CZ 4.14Å; V219-F509 HydrophobicContact CG2-CD2 3.94Å; V219-F509 HydrophobicContact CG2-CE2 3.6Å; V219-F509 HydrophobicContact CG2-CZ 3.99Å; V219-I522 HydrophobicContact CB-CG1 4.1Å; V219-I522 HydrophobicContact CG1-CD1 4.07Å; V219-I522 HydrophobicContact CG1-CG1 3.57Å
220	A	92.9	Very high	93	Very high	1 Å²	1	9.6 Å²	9.6	1%	0.008	5%	0.047	C	C	.	.	H	α-helix	trans	-59.2	-37	177.8	0	0	0	0	0	113.3	A216 N217 A222 M223 Y224 F526	A216-A220 WeakPolarHBondContact O-CB 3.32Å; A216-A220 PolarHBondContact O-N 3.28Å; N217-A220 PolarHBondContact O-N 2.8Å; A220-A222 PolarHBondContact O-N 2.97Å; A220-M223 PolarHBondContact O-N 3.31Å; A220-Y224 HydrophobicContact CB-CD2 4.3Å; A220-Y224 HydrophobicContact CB-CE2 3.83Å; A220-Y224 WeakPolarHBondContact O-CD2 3.5Å; A220-Y224 PolarHBondContact O-N 3.28Å; A220-F526 HydrophobicContact CB-CE2 4.31Å
221	V	94.5	Very high	93	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-51.8	-43.1	171.5	176.4	0	0	0	0	111.4	N217 V219 Y224 V225 V258 L463 S506	N217-V221 PolarHBondContact O-N 3.45Å; V219-V221 VanDerWaalsContact C-N 3.3Å; V219-V221 PolarHBondContact O-N 3.4Å; V221-Y224 PolarHBondContact O-N 2.84Å; V221-V225 HydrophobicContact CG1-CG2 4.35Å; V221-V225 WeakPolarHBondContact O-CB 3.16Å; V221-V225 VanDerWaalsContact O-CG2 3.29Å; V221-V225 WeakPolarHBondContact O-CG2 3.45Å; V221-V225 PolarHBondContact O-N 3.2Å; V221-V258 HydrophobicContact CG1-CG2 4.09Å; V221-L463 HydrophobicContact CG1-CB 4.5Å; V221-L463 HydrophobicContact CG2-CB 3.84Å; V221-L463 HydrophobicContact CG2-CD1 4.49Å; V221-S506 WeakPolarHBondContact CB-OG 3.25Å
222	A	94.6	Very high	93.1	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-64.5	-46.6	-179.8	0	0	0	0	0	112.1	V219 A220 Y224 V225 V226 S506 F509 I510	V219-A222 VanDerWaalsContact O-CB 3.3Å; V219-A222 WeakPolarHBondContact O-CB 3.28Å; V219-A222 PolarHBondContact O-N 2.94Å; A220-A222 PolarHBondContact O-N 2.97Å; A222-Y224 PolarHBondContact O-N 3.48Å; A222-V225 PolarHBondContact O-N 3.37Å; A222-V226 WeakPolarHBondContact O-CB 3.42Å; A222-V226 VanDerWaalsContact O-CG2 3.3Å; A222-V226 WeakPolarHBondContact O-CG2 3.42Å; A222-V226 PolarHBondContact O-N 2.92Å; A222-S506 WeakPolarHBondContact CB-O 3.45Å; A222-F509 HydrophobicContact CB-CB 3.43Å; A222-F509 VanDerWaalsContact CB-CB 3.43Å; A222-I510 HydrophobicContact CB-CG1 3.88Å
223	M	93.5	Very high	93	Very high	2 Å²	2	8.6 Å²	8.6	1%	0.01	4%	0.042	C	C	.	.	H	α-helix	trans	-60.3	-44.6	176.7	178.4	-166.3	75	0	0	112.3	M144 V219 A220 V225 V226 G227 P338 L515 I518 A519 I522	M144-M223 HydrophobicContact CE-CG 4.27Å; M144-M223 HydrophobicContact CE-SD 3.74Å; V219-M223 PolarHBondContact O-N 3.02Å; A220-M223 PolarHBondContact O-N 3.31Å; M223-V225 VanDerWaalsContact C-N 3.33Å; M223-V225 PolarHBondContact O-N 3.02Å; M223-V226 PolarHBondContact O-N 3.07Å; M223-G227 PolarHBondContact O-N 3.17Å; M223-P338 HydrophobicContact CE-CB 3.85Å; M223-P338 HydrophobicContact SD-CB 3.65Å; M223-P338 HydrophobicContact SD-CG 4.06Å; M223-L515 HydrophobicContact CB-CD1 4.37Å; M223-L515 HydrophobicContact CG-CD1 3.53Å; M223-L515 WeakPolarHBondContact O-CD1 3.41Å; M223-I518 HydrophobicContact CB-CG2 3.93Å; M223-A519 HydrophobicContact SD-CB 4.48Å; M223-I522 HydrophobicContact CB-CD1 3.3Å; M223-I522 HydrophobicContact CE-CD1 4.36Å; M223-I522 HydrophobicContact CG-CD1 3.93Å; M223-I522 HydrophobicContact SD-CD1 3.59Å; M223-I522 VanDerWaalsContact SD-CD1 3.59Å
224	Y	93.9	Very high	92.9	Very high	7 Å²	7	9.7 Å²	9.7	3%	0.027	5%	0.049	C	C	.	.	H	α-helix	trans	-64.9	-37.3	178.1	-63.3	-52.5	0	0	0	112.2	V143 A220 V221 A222 F228 T455 S462	V143-Y224 HydrophobicContact CG2-CD1 3.99Å; A220-Y224 HydrophobicContact CB-CD2 4.3Å; A220-Y224 HydrophobicContact CB-CE2 3.83Å; A220-Y224 WeakPolarHBondContact O-CD2 3.5Å; A220-Y224 PolarHBondContact O-N 3.28Å; V221-Y224 PolarHBondContact O-N 2.84Å; A222-Y224 PolarHBondContact O-N 3.48Å; Y224-F228 PolarHBondContact O-N 3.43Å; Y224-T455 WeakPolarHBondContact O-CB 3.32Å; Y224-S462 WeakPolarHBondContact CE2-OG 3.31Å
225	V	94.8	Very high	92.7	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-75	-36.2	176.9	169.9	0	0	0	0	112.7	V221 A222 M223 F228 A229 G254 T257 V258 L261 A459 I510	V221-V225 HydrophobicContact CG1-CG2 4.35Å; V221-V225 WeakPolarHBondContact O-CB 3.16Å; V221-V225 VanDerWaalsContact O-CG2 3.29Å; V221-V225 WeakPolarHBondContact O-CG2 3.45Å; V221-V225 PolarHBondContact O-N 3.2Å; A222-V225 PolarHBondContact O-N 3.37Å; M223-V225 VanDerWaalsContact C-N 3.33Å; M223-V225 PolarHBondContact O-N 3.02Å; V225-F228 WeakPolarHBondContact O-CB 3.49Å; V225-F228 PolarHBondContact O-N 3Å; V225-A229 WeakPolarHBondContact O-CB 3.37Å; V225-A229 PolarHBondContact O-N 3.19Å; V225-G254 VanDerWaalsContact CG1-CA 3.49Å; V225-G254 VanDerWaalsContact CG1-O 3.26Å; V225-G254 WeakPolarHBondContact CG1-O 3.35Å; V225-T257 HydrophobicContact CG1-CG2 4.27Å; V225-T257 HydrophobicContact CG2-CG2 4.44Å; V225-V258 HydrophobicContact CG1-CB 4.45Å; V225-V258 HydrophobicContact CG2-CB 4.48Å; V225-L261 HydrophobicContact CG2-CD1 3.79Å; V225-A459 HydrophobicContact CG2-CB 3.98Å; V225-I510 HydrophobicContact CB-CD1 4.11Å; V225-I510 HydrophobicContact CB-CG1 4.46Å; V225-I510 HydrophobicContact CG1-CD1 3.72Å; V225-I510 HydrophobicContact CG1-CG1 4.22Å
226	V	94.6	Very high	92.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-65.2	-46.7	174.5	166.7	0	0	0	0	110.5	A222 M223 F228 A229 E230 I250 I510 G513 L515 I518	A222-V226 WeakPolarHBondContact O-CB 3.42Å; A222-V226 VanDerWaalsContact O-CG2 3.3Å; A222-V226 WeakPolarHBondContact O-CG2 3.42Å; A222-V226 PolarHBondContact O-N 2.92Å; M223-V226 PolarHBondContact O-N 3.07Å; V226-F228 VanDerWaalsContact C-N 3.28Å; V226-F228 PolarHBondContact O-N 3.16Å; V226-A229 CarbonylContact O-C 3.32Å; V226-A229 PolarHBondContact O-N 3.3Å; V226-E230 WeakPolarHBondContact O-CB 3.48Å; V226-E230 PolarHBondContact O-N 2.9Å; V226-I250 HydrophobicContact CG1-CG2 4.19Å; V226-I510 HydrophobicContact CG2-CB 4.42Å; V226-I510 HydrophobicContact CG2-CG1 4.22Å; V226-I510 HydrophobicContact CG2-CG2 4.48Å; V226-G513 WeakPolarHBondContact CG1-O 3.46Å; V226-L515 HydrophobicContact CB-CD1 4.48Å; V226-L515 HydrophobicContact CG1-CB 4.2Å; V226-L515 HydrophobicContact CG1-CD1 4.26Å; V226-I518 HydrophobicContact CB-CD1 4.44Å; V226-I518 HydrophobicContact CG1-CD1 4.47Å; V226-I518 HydrophobicContact CG2-CD1 3.94Å
227	G	92.3	Very high	92.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-65.4	-28	176.3	0	0	0	0	0	114.1	I147 M223 T231	I147-G227 WeakPolarHBondContact CD1-O 3.41Å; M223-G227 PolarHBondContact O-N 3.17Å; G227-T231 PolarHBondContact O-N 3.22Å; G227-T231 PolarHBondContact O-OG1 3.41Å
228	F	94.1	Very high	91.8	Very high	26 Å²	26	20 Å²	20	11%	0.114	10%	0.098	C	C	.	.	H	α-helix	trans	-64.7	-51.6	166.9	173.2	-98.7	0	0	0	111	Y224 V225 V226 E230 T231 V232 I253 T257 F452 T455 L456	Y224-F228 PolarHBondContact O-N 3.43Å; V225-F228 WeakPolarHBondContact O-CB 3.49Å; V225-F228 PolarHBondContact O-N 3Å; V226-F228 VanDerWaalsContact C-N 3.28Å; V226-F228 PolarHBondContact O-N 3.16Å; F228-E230 PolarHBondContact O-N 3.39Å; F228-T231 WeakPolarHBondContact O-CB 3.32Å; F228-T231 PolarHBondContact O-N 2.87Å; F228-V232 HydrophobicContact CD1-CG2 4.27Å; F228-V232 HydrophobicContact CE1-CG2 3.81Å; F228-V232 HydrophobicContact CE2-CG2 4.09Å; F228-V232 HydrophobicContact CZ-CG2 3.7Å; F228-V232 WeakPolarHBondContact O-CG2 3.32Å; F228-V232 PolarHBondContact O-N 3.25Å; F228-I253 HydrophobicContact CE1-CG2 4.32Å; F228-T257 HydrophobicContact CD1-CG2 3.76Å; F228-T257 HydrophobicContact CE1-CG2 3.91Å; F228-T257 WeakPolarHBondContact CE1-OG1 3.28Å; F228-F452 HydrophobicContact CD2-CB 4.35Å; F228-F452 AromaticContact CD2-CD1 3.58Å; F228-F452 HydrophobicContact CD2-CD1 3.58Å; F228-F452 HydrophobicContact CD2-CE1 4.16Å; F228-F452 HydrophobicContact CD2-CG 4.15Å; F228-F452 HydrophobicContact CE2-CB 4.09Å; F228-F452 AromaticContact CE2-CD1 3.45Å; F228-F452 HydrophobicContact CE2-CD1 3.45Å; F228-F452 VanDerWaalsContact CE2-CD1 3.45Å; F228-F452 HydrophobicContact CE2-CD2 4.37Å; F228-F452 AromaticContact CE2-CE1 3.89Å; F228-F452 HydrophobicContact CE2-CE1 3.89Å; F228-F452 AromaticContact CE2-CG 3.73Å; F228-F452 HydrophobicContact CE2-CG 3.73Å; F228-T455 HydrophobicContact CB-CG2 4.38Å; F228-L456 HydrophobicContact CD1-CD2 4.43Å; F228-L456 HydrophobicContact CD2-CD1 4.23Å; F228-L456 HydrophobicContact CD2-CD2 3.95Å; F228-L456 HydrophobicContact CD2-CG 3.94Å; F228-L456 HydrophobicContact CE2-CD1 3.86Å; F228-L456 HydrophobicContact CE2-CD2 4.15Å; F228-L456 HydrophobicContact CE2-CG 4.09Å; F228-L456 HydrophobicContact CG-CD2 4.11Å; F228-L456 HydrophobicContact CZ-CD1 4.46Å; F228-L456 HydrophobicContact CZ-CD2 4.47Å
229	A	94.1	Very high	91.4	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.4	-39.4	-178	0	0	0	0	0	112.6	V225 V226 T231 V232 V233 I250 I253	V225-A229 WeakPolarHBondContact O-CB 3.37Å; V225-A229 PolarHBondContact O-N 3.19Å; V226-A229 CarbonylContact O-C 3.32Å; V226-A229 PolarHBondContact O-N 3.3Å; A229-T231 PolarHBondContact O-N 3.01Å; A229-V232 PolarHBondContact O-N 2.95Å; A229-V232 VanDerWaalsContact O-N 3.17Å; A229-V233 WeakPolarHBondContact O-CG2 3.42Å; A229-V233 PolarHBondContact O-N 2.61Å; A229-I250 HydrophobicContact CB-CG2 4.08Å; A229-I250 WeakPolarHBondContact CB-O 3.33Å; A229-I253 HydrophobicContact CB-CB 4.02Å; A229-I253 HydrophobicContact CB-CG2 3.79Å
230	E	92	Very high	90.8	Very high	15 Å²	15	31.7 Å²	31.7	7%	0.07	16%	0.161	C	C	.	.	H	α-helix	trans	-54.3	-49.1	171.3	-172.8	177.5	171.3	0	0	111.1	R148 V226 F228 V232 V233 D234 I250	R148-E230 IonicContact CZ-OE1 3.24Å; R148-E230 VanDerWaalsContact CZ-OE1 3.23Å; R148-E230 IonicContact CZ-OE2 2.9Å; R148-E230 IonicContact NH1-OE1 3.54Å; R148-E230 PolarHBondContact NH1-OE1 3.41Å; R148-E230 IonicContact NH1-OE2 2.78Å; R148-E230 IonicContact NH2-OE1 3.81Å; R148-E230 PolarHBondContact NH2-OE1 3.26Å; R148-E230 IonicContact NH2-OE2 2.91Å; R148-E230 PolarHBondContact NH2-OE2 2.69Å; V226-E230 WeakPolarHBondContact O-CB 3.48Å; V226-E230 PolarHBondContact O-N 2.9Å; F228-E230 PolarHBondContact O-N 3.39Å; E230-V232 VanDerWaalsContact C-N 3.34Å; E230-V232 PolarHBondContact O-N 2.8Å; E230-V233 PolarHBondContact O-N 2.77Å; E230-D234 PolarHBondContact O-N 2.82Å; E230-I250 HydrophobicContact CB-CD1 4.37Å
231	T	91.2	Very high	90.5	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-37.2	176.5	-49	0	0	0	0	112.8	I147 G227 F228 A229 L235 T451 F452	I147-T231 WeakPolarHBondContact CD1-OG1 3.3Å; G227-T231 PolarHBondContact O-N 3.22Å; G227-T231 PolarHBondContact O-OG1 3.41Å; F228-T231 WeakPolarHBondContact O-CB 3.32Å; F228-T231 PolarHBondContact O-N 2.87Å; A229-T231 PolarHBondContact O-N 3.01Å; T231-L235 WeakPolarHBondContact O-CG 3.49Å; T231-L235 PolarHBondContact O-N 3.3Å; T231-T451 HydrophobicContact CG2-CG2 4.09Å; T231-T451 WeakPolarHBondContact OG1-CG2 3.45Å; T231-F452 HydrophobicContact CG2-CD1 4.27Å; T231-F452 HydrophobicContact CG2-CE1 3.7Å
232	V	92	Very high	90	Very high	30 Å²	30	42 Å²	42	18%	0.182	21%	0.212	C	C	.	.	H	α-helix	trans	-71.1	-39.4	177.3	176.5	0	0	0	0	111	F228 A229 E230 L235 L236 I253 F452	F228-V232 HydrophobicContact CD1-CG2 4.27Å; F228-V232 HydrophobicContact CE1-CG2 3.81Å; F228-V232 HydrophobicContact CE2-CG2 4.09Å; F228-V232 HydrophobicContact CZ-CG2 3.7Å; F228-V232 WeakPolarHBondContact O-CG2 3.32Å; F228-V232 PolarHBondContact O-N 3.25Å; A229-V232 PolarHBondContact O-N 2.95Å; A229-V232 VanDerWaalsContact O-N 3.17Å; E230-V232 VanDerWaalsContact C-N 3.34Å; E230-V232 PolarHBondContact O-N 2.8Å; V232-L235 PolarHBondContact O-N 3.32Å; V232-L236 HydrophobicContact CG1-CD1 4.27Å; V232-L236 WeakPolarHBondContact O-CG 3.45Å; V232-L236 PolarHBondContact O-N 3.19Å; V232-I253 HydrophobicContact CB-CG2 4.27Å; V232-I253 HydrophobicContact CG1-CD1 3.95Å; V232-I253 HydrophobicContact CG1-CG2 4.27Å; V232-F452 HydrophobicContact CG2-CE1 3.67Å; V232-F452 HydrophobicContact CG2-CZ 3.81Å
233	V	91.6	Very high	89.4	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-68.6	-38.4	177.2	172.1	0	0	0	0	111.2	A229 E230 L235 L236 K237 L242 E246 D249 I250 I253	A229-V233 WeakPolarHBondContact O-CG2 3.42Å; A229-V233 PolarHBondContact O-N 2.61Å; E230-V233 PolarHBondContact O-N 2.77Å; V233-L235 VanDerWaalsContact C-N 3.32Å; V233-L235 PolarHBondContact O-N 2.85Å; V233-L236 CarbonylContact O-C 3.51Å; V233-L236 PolarHBondContact O-N 3.27Å; V233-L236 VanDerWaalsContact O-N 3.11Å; V233-K237 WeakPolarHBondContact O-CG 3.32Å; V233-K237 PolarHBondContact O-N 3.26Å; V233-L242 HydrophobicContact CG1-CD2 4.21Å; V233-E246 HydrophobicContact CG1-CG 4.22Å; V233-D249 HydrophobicContact CG1-CB 4.43Å; V233-D249 HydrophobicContact CG2-CB 3.74Å; V233-I250 HydrophobicContact CB-CG1 4.09Å; V233-I250 HydrophobicContact CG1-CG1 4.41Å; V233-I250 HydrophobicContact CG2-CG1 3.84Å; V233-I253 HydrophobicContact CG2-CD1 3.56Å
234	D	87.6	Confident	89.1	Confident	33 Å²	33	52.1 Å²	52.1	18%	0.176	27%	0.267	C	S	.	.	H	α-helix	trans	-58.3	-42.1	171.9	-77.5	-20	0	0	0	112.4	E230 K237 E238 Q435	E230-D234 PolarHBondContact O-N 2.82Å; D234-K237 WeakPolarHBondContact O-CB 3.39Å; D234-K237 PolarHBondContact O-N 2.86Å; D234-K237 IonicContact OD1-NZ 3.16Å; D234-K237 PolarHBondContact OD1-NZ 2.82Å; D234-E238 PolarHBondContact O-N 2.9Å; D234-Q435 HydrophobicContact CB-CG 4.35Å; D234-Q435 WeakPolarHBondContact OD2-CG 3.37Å; D234-Q435 PolarHBondContact OD2-NE2 3.09Å
235	L	88.3	Confident	88.8	Confident	44 Å²	44	54.5 Å²	54.5	23%	0.23	28%	0.28	C	S	.	.	H	α-helix	trans	-66.7	-37.2	173.7	-73.1	164.5	0	0	0	112.2	T231 V232 V233 K237 E238 Y239 T448 F452	T231-L235 WeakPolarHBondContact O-CG 3.49Å; T231-L235 PolarHBondContact O-N 3.3Å; V232-L235 PolarHBondContact O-N 3.32Å; V233-L235 VanDerWaalsContact C-N 3.32Å; V233-L235 PolarHBondContact O-N 2.85Å; L235-K237 VanDerWaalsContact C-N 3.35Å; L235-E238 PolarHBondContact O-N 3.11Å; L235-Y239 WeakPolarHBondContact O-CD2 3Å; L235-Y239 PolarHBondContact O-N 3.41Å; L235-T448 HydrophobicContact CD1-CG2 4.25Å; L235-T448 HydrophobicContact CD2-CG2 4.37Å; L235-F452 HydrophobicContact CD1-CZ 3.79Å
236	L	88.1	Confident	88.4	Confident	44 Å²	44	58.9 Å²	58.9	23%	0.23	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-33.6	173.6	-70.4	170	0	0	0	112.3	V232 V233 A240 H241 I253	V232-L236 HydrophobicContact CG1-CD1 4.27Å; V232-L236 WeakPolarHBondContact O-CG 3.45Å; V232-L236 PolarHBondContact O-N 3.19Å; V233-L236 CarbonylContact O-C 3.51Å; V233-L236 PolarHBondContact O-N 3.27Å; V233-L236 VanDerWaalsContact O-N 3.11Å; L236-A240 PolarHBondContact O-N 3.47Å; L236-A240 VanDerWaalsContact O-N 3.15Å; L236-H241 HydrophobicContact CD2-CB 3.94Å; L236-H241 PolarHBondContact O-N 3.39Å; L236-I253 HydrophobicContact CD1-CD1 3.85Å
237	K	86	Confident	88.2	Confident	69 Å²	69	62.2 Å²	62.2	30%	0.3	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-46.6	169.9	-64.8	169.2	-166.7	162.4	0	110.9	V233 D234 L235 Y239 A240 L242 E246	V233-K237 WeakPolarHBondContact O-CG 3.32Å; V233-K237 PolarHBondContact O-N 3.26Å; D234-K237 WeakPolarHBondContact O-CB 3.39Å; D234-K237 PolarHBondContact O-N 2.86Å; D234-K237 IonicContact OD1-NZ 3.16Å; D234-K237 PolarHBondContact OD1-NZ 2.82Å; L235-K237 VanDerWaalsContact C-N 3.35Å; K237-Y239 VanDerWaalsContact C-N 3.29Å; K237-Y239 PolarHBondContact O-N 3.41Å; K237-A240 PolarHBondContact O-N 3.04Å; K237-L242 HydrophobicContact CG-CD1 4.36Å; K237-L242 HydrophobicContact CG-CD2 4.09Å; K237-L242 HydrophobicContact CG-CG 4.34Å; K237-E246 WeakPolarHBondContact CE-OE1 3.42Å; K237-E246 WeakPolarHBondContact CE-OE2 2.91Å; K237-E246 IonicContact NZ-OE1 2.82Å; K237-E246 PolarHBondContact NZ-OE1 3.14Å; K237-E246 IonicContact NZ-OE2 2.68Å; K237-E246 PolarHBondContact NZ-OE2 2.81Å
238	E	82.9	Confident	88.2	Confident	146 Å²	146	65.1 Å²	65.1	68%	0.682	33%	0.333	S	S	*	.	H	α-helix	trans	-59.8	-37.3	-177.7	-171.3	171.6	-155.1	0	0	112.5	D234 L235	D234-E238 PolarHBondContact O-N 2.9Å; L235-E238 PolarHBondContact O-N 3.11Å
239	Y	86.1	Confident	88.1	Confident	159 Å²	159	63.9 Å²	63.9	62%	0.624	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	8.8	174.4	-66.9	-72.9	0	0	0	114.7	L235 K237 H241	L235-Y239 WeakPolarHBondContact O-CD2 3Å; L235-Y239 PolarHBondContact O-N 3.41Å; K237-Y239 VanDerWaalsContact C-N 3.29Å; K237-Y239 PolarHBondContact O-N 3.41Å; Y239-H241 PolarHBondContact O-CE1 2.83Å; Y239-H241 PolarHBondContact O-N 3.17Å; Y239-H241 PolarHBondContact O-ND1 3.26Å
240	A	80.8	Confident	88.1	Confident	87 Å²	87	64.2 Å²	64.2	72%	0.719	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	45.3	-178.3	0	0	0	0	0	114.2	L236 K237	L236-A240 PolarHBondContact O-N 3.47Å; L236-A240 VanDerWaalsContact O-N 3.15Å; K237-A240 PolarHBondContact O-N 3.04Å
241	H	87.3	Confident	88.2	Confident	126 Å²	126	66.9 Å²	66.9	58%	0.583	34%	0.338	S	S	*	.			trans	-122.4	35.7	-178	-67.2	-13.7	0	0	0	112.8	L236 Y239	L236-H241 HydrophobicContact CD2-CB 3.94Å; L236-H241 PolarHBondContact O-N 3.39Å; Y239-H241 PolarHBondContact O-CE1 2.83Å; Y239-H241 PolarHBondContact O-N 3.17Å; Y239-H241 PolarHBondContact O-ND1 3.26Å
242	L	84.2	Confident	88.4	Confident	92 Å²	92	70.3 Å²	70.3	48%	0.482	36%	0.356	S	S	.	.			trans	-58.3	140.7	167.8	-76.5	165.4	0	0	0	110.8	V233 K237	V233-L242 HydrophobicContact CG1-CD2 4.21Å; K237-L242 HydrophobicContact CG-CD1 4.36Å; K237-L242 HydrophobicContact CG-CD2 4.09Å; K237-L242 HydrophobicContact CG-CG 4.34Å
243	M	82.7	Confident	88.5	Confident	109 Å²	109	69.8 Å²	69.8	54%	0.537	35%	0.352	S	S	.	.	S	Bend	trans	-96.6	-44.8	-175.6	-59.7	177.6	-68.5	0	0	112.2	D249 I253	M243-D249 HydrophobicContact CE-CB 4.05Å; M243-D249 PolarHBondContact N-OD2 3.44Å; M243-I253 HydrophobicContact CE-CD1 3.93Å; M243-I253 HydrophobicContact CE-CG1 4.11Å
244	V	87.1	Confident	88.7	Confident	105 Å²	105	69.8 Å²	69.8	64%	0.636	35%	0.352	S	S	*	.	S	Bend	trans	-136.5	-68.6	178.8	-171	0	0	0	0	110.6	D249	V244-D249 PolarHBondContact N-OD1 2.95Å; V244-D249 PolarHBondContact N-OD2 2.99Å
245	D	87.9	Confident	89	Confident	58 Å²	58	69.9 Å²	69.9	31%	0.31	36%	0.355	S	S	.	.			trans	-161.6	155.4	178.5	66.4	-95.6	0	0	0	109.3	M247 N248 D249	D245-M247 VanDerWaalsContact C-N 3.31Å; D245-M247 PolarHBondContact O-N 3.17Å; D245-M247 PolarHBondContact OD2-N 3.5Å; D245-N248 PolarHBondContact O-N 2.81Å; D245-N248 WeakPolarHBondContact OD1-CB 3.46Å; D245-N248 PolarHBondContact OD1-ND2 3.48Å; D245-N248 PolarHBondContact OD2-N 3.29Å; D245-N248 PolarHBondContact OD2-ND2 3.5Å; D245-D249 PolarHBondContact N-OD1 3.34Å; D245-D249 VanDerWaalsContact O-CB 3.25Å; D245-D249 WeakPolarHBondContact O-CB 3.46Å; D245-D249 PolarHBondContact O-N 2.81Å
246	E	86.4	Confident	89.4	Confident	91 Å²	91	72.3 Å²	72.3	43%	0.425	37%	0.367	S	S	.	.	H	α-helix	trans	-51.5	-45	-174.4	175.5	166.6	178.3	0	0	114.1	V233 K237 I250	V233-E246 HydrophobicContact CG1-CG 4.22Å; K237-E246 WeakPolarHBondContact CE-OE1 3.42Å; K237-E246 WeakPolarHBondContact CE-OE2 2.91Å; K237-E246 IonicContact NZ-OE1 2.82Å; K237-E246 PolarHBondContact NZ-OE1 3.14Å; K237-E246 IonicContact NZ-OE2 2.68Å; K237-E246 PolarHBondContact NZ-OE2 2.81Å; E246-I250 HydrophobicContact CG-CD1 4.32Å; E246-I250 WeakPolarHBondContact O-CD1 3.34Å; E246-I250 VanDerWaalsContact O-CG1 3.23Å; E246-I250 WeakPolarHBondContact O-CG1 3.47Å; E246-I250 PolarHBondContact O-N 3.45Å; E246-I250 VanDerWaalsContact O-N 3.14Å
247	M	89.4	Confident	89.7	Confident	70 Å²	70	70.9 Å²	70.9	35%	0.345	36%	0.36	S	S	.	.	H	α-helix	trans	-76.1	-36.7	-174.8	-67.9	-58.6	-61.3	0	0	112.4	D245 R251 D514	D245-M247 VanDerWaalsContact C-N 3.31Å; D245-M247 PolarHBondContact O-N 3.17Å; D245-M247 PolarHBondContact OD2-N 3.5Å; M247-R251 WeakPolarHBondContact O-CD 3.48Å; M247-R251 VanDerWaalsContact O-CG 3.28Å; M247-R251 WeakPolarHBondContact O-CG 3.47Å; M247-R251 PolarHBondContact O-N 2.82Å; M247-D514 HydrophobicContact CE-CB 4.2Å
248	N	91.8	Very high	90.1	Very high	62 Å²	62	67.6 Å²	67.6	33%	0.332	35%	0.346	S	S	.	.	H	α-helix	trans	-79.9	-30.7	175.8	-67	-43.3	0	0	0	112.8	D245 I250 R251 I252	D245-N248 PolarHBondContact O-N 2.81Å; D245-N248 WeakPolarHBondContact OD1-CB 3.46Å; D245-N248 PolarHBondContact OD1-ND2 3.48Å; D245-N248 PolarHBondContact OD2-N 3.29Å; D245-N248 PolarHBondContact OD2-ND2 3.5Å; N248-I250 VanDerWaalsContact C-N 3.34Å; N248-I250 PolarHBondContact O-N 3.22Å; N248-R251 WeakPolarHBondContact O-CB 3.48Å; N248-R251 PolarHBondContact O-N 2.86Å; N248-R251 VanDerWaalsContact O-N 3.17Å; N248-R251 WeakPolarHBondContact OD1-CD 3.23Å; N248-R251 PolarHBondContact OD1-NH1 3.43Å; N248-I252 WeakPolarHBondContact O-CB 3.45Å; N248-I252 WeakPolarHBondContact O-CD1 3.18Å; N248-I252 WeakPolarHBondContact O-CG1 3.44Å; N248-I252 PolarHBondContact O-N 3.27Å
249	D	93.2	Very high	90.7	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.3	-41.6	172.7	-72.6	8.7	0	0	0	110.2	V233 M243 V244 D245 R251 I252 I253	V233-D249 HydrophobicContact CG1-CB 4.43Å; V233-D249 HydrophobicContact CG2-CB 3.74Å; M243-D249 HydrophobicContact CE-CB 4.05Å; M243-D249 PolarHBondContact N-OD2 3.44Å; V244-D249 PolarHBondContact N-OD1 2.95Å; V244-D249 PolarHBondContact N-OD2 2.99Å; D245-D249 PolarHBondContact N-OD1 3.34Å; D245-D249 VanDerWaalsContact O-CB 3.25Å; D245-D249 WeakPolarHBondContact O-CB 3.46Å; D245-D249 PolarHBondContact O-N 2.81Å; D249-R251 PolarHBondContact O-N 3.18Å; D249-I252 PolarHBondContact O-N 2.79Å; D249-I253 WeakPolarHBondContact O-CB 3.29Å; D249-I253 WeakPolarHBondContact O-CD1 3.4Å; D249-I253 WeakPolarHBondContact O-CG1 3.23Å; D249-I253 PolarHBondContact O-N 3.04Å
250	I	93.1	Very high	90.9	Very high	6 Å²	6	62 Å²	62	3%	0.031	33%	0.334	C	S	.	.	H	α-helix	trans	-57.8	-46.3	171.1	-71.7	168.5	0	0	0	110.9	V226 A229 E230 V233 E246 N248 G254 G513	V226-I250 HydrophobicContact CG1-CG2 4.19Å; A229-I250 HydrophobicContact CB-CG2 4.08Å; A229-I250 WeakPolarHBondContact CB-O 3.33Å; E230-I250 HydrophobicContact CB-CD1 4.37Å; V233-I250 HydrophobicContact CB-CG1 4.09Å; V233-I250 HydrophobicContact CG1-CG1 4.41Å; V233-I250 HydrophobicContact CG2-CG1 3.84Å; E246-I250 HydrophobicContact CG-CD1 4.32Å; E246-I250 WeakPolarHBondContact O-CD1 3.34Å; E246-I250 VanDerWaalsContact O-CG1 3.23Å; E246-I250 WeakPolarHBondContact O-CG1 3.47Å; E246-I250 PolarHBondContact O-N 3.45Å; E246-I250 VanDerWaalsContact O-N 3.14Å; N248-I250 VanDerWaalsContact C-N 3.34Å; N248-I250 PolarHBondContact O-N 3.22Å; I250-G254 PolarHBondContact O-N 3.41Å; I250-G513 WeakPolarHBondContact CG2-O 3.46Å
251	R	95.1	Very high	91.4	Very high	71 Å²	71	58.3 Å²	58.3	27%	0.268	30%	0.302	S	S	.	.	H	α-helix	trans	-63.6	-42.2	178.1	-69.6	165.4	177.1	141.6	7.6	112.3	M247 N248 D249 C255 L511 I512	M247-R251 WeakPolarHBondContact O-CD 3.48Å; M247-R251 VanDerWaalsContact O-CG 3.28Å; M247-R251 WeakPolarHBondContact O-CG 3.47Å; M247-R251 PolarHBondContact O-N 2.82Å; N248-R251 WeakPolarHBondContact O-CB 3.48Å; N248-R251 PolarHBondContact O-N 2.86Å; N248-R251 VanDerWaalsContact O-N 3.17Å; N248-R251 WeakPolarHBondContact OD1-CD 3.23Å; N248-R251 PolarHBondContact OD1-NH1 3.43Å; D249-R251 PolarHBondContact O-N 3.18Å; R251-C255 WeakPolarHBondContact O-CB 3.48Å; R251-C255 PolarHBondContact O-N 3.04Å; R251-C255 PolarHBondContact O-SG 3.3Å; R251-L511 PolarHBondContact NE-O 3.24Å; R251-I512 PolarHBondContact NH2-O 2.91Å
252	I	94.6	Very high	91.5	Very high	73 Å²	73	53.8 Å²	53.8	37%	0.374	28%	0.282	S	S	.	.	H	α-helix	trans	-66	-52.4	-180	-71	162.1	0	0	0	110.1	N248 D249 G254 C255 I256	N248-I252 WeakPolarHBondContact O-CB 3.45Å; N248-I252 WeakPolarHBondContact O-CD1 3.18Å; N248-I252 WeakPolarHBondContact O-CG1 3.44Å; N248-I252 PolarHBondContact O-N 3.27Å; D249-I252 PolarHBondContact O-N 2.79Å; I252-G254 VanDerWaalsContact C-N 3.32Å; I252-G254 PolarHBondContact O-N 3.45Å; I252-C255 PolarHBondContact O-N 3.45Å; I252-I256 HydrophobicContact CG2-CD1 3.87Å; I252-I256 WeakPolarHBondContact O-CG1 3.37Å; I252-I256 PolarHBondContact O-N 2.86Å
253	I	94.9	Very high	91.7	Very high	20 Å²	20	51.6 Å²	51.6	10%	0.103	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-39.4	179.8	-69.1	160.1	0	0	0	110.4	F228 A229 V232 V233 L236 M243 D249 I256 T257	F228-I253 HydrophobicContact CE1-CG2 4.32Å; A229-I253 HydrophobicContact CB-CB 4.02Å; A229-I253 HydrophobicContact CB-CG2 3.79Å; V232-I253 HydrophobicContact CB-CG2 4.27Å; V232-I253 HydrophobicContact CG1-CD1 3.95Å; V232-I253 HydrophobicContact CG1-CG2 4.27Å; V233-I253 HydrophobicContact CG2-CD1 3.56Å; L236-I253 HydrophobicContact CD1-CD1 3.85Å; M243-I253 HydrophobicContact CE-CD1 3.93Å; M243-I253 HydrophobicContact CE-CG1 4.11Å; D249-I253 WeakPolarHBondContact O-CB 3.29Å; D249-I253 WeakPolarHBondContact O-CD1 3.4Å; D249-I253 WeakPolarHBondContact O-CG1 3.23Å; D249-I253 PolarHBondContact O-N 3.04Å; I253-I256 PolarHBondContact O-N 3.46Å; I253-T257 VanDerWaalsContact O-CB 3.26Å; I253-T257 WeakPolarHBondContact O-CB 3.47Å; I253-T257 PolarHBondContact O-N 3.4Å; I253-T257 PolarHBondContact O-OG1 3.5Å
254	G	94.8	Very high	91.8	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.9	-47.3	174	0	0	0	0	0	112.9	V225 I250 I252 I256 T257 V258	V225-G254 VanDerWaalsContact CG1-CA 3.49Å; V225-G254 VanDerWaalsContact CG1-O 3.26Å; V225-G254 WeakPolarHBondContact CG1-O 3.35Å; I250-G254 PolarHBondContact O-N 3.41Å; I252-G254 VanDerWaalsContact C-N 3.32Å; I252-G254 PolarHBondContact O-N 3.45Å; G254-I256 PolarHBondContact O-N 2.9Å; G254-T257 PolarHBondContact O-N 3.28Å; G254-V258 PolarHBondContact O-N 2.89Å
255	C	95.2	Very high	91.6	Very high	35 Å²	35	45.8 Å²	45.8	24%	0.236	25%	0.248	C	C	.	.	H	α-helix	trans	-61.8	-41.9	176.4	-78.5	0	0	0	0	112.9	R251 I252 V258 V259	R251-C255 WeakPolarHBondContact O-CB 3.48Å; R251-C255 PolarHBondContact O-N 3.04Å; R251-C255 PolarHBondContact O-SG 3.3Å; I252-C255 PolarHBondContact O-N 3.45Å; C255-V258 WeakPolarHBondContact O-CG1 3.32Å; C255-V259 WeakPolarHBondContact O-CG2 3.38Å; C255-V259 PolarHBondContact O-N 2.96Å
256	I	95.6	Very high	91.4	Very high	96 Å²	96	47 Å²	47	49%	0.492	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-45.5	174.6	-66.7	165.2	0	0	0	110.3	I252 I253 G254 V258 V259 L260	I252-I256 HydrophobicContact CG2-CD1 3.87Å; I252-I256 WeakPolarHBondContact O-CG1 3.37Å; I252-I256 PolarHBondContact O-N 2.86Å; I253-I256 PolarHBondContact O-N 3.46Å; G254-I256 PolarHBondContact O-N 2.9Å; I256-V258 PolarHBondContact O-N 3.31Å; I256-V259 PolarHBondContact O-N 3Å; I256-L260 HydrophobicContact CG2-CD1 4.14Å; I256-L260 WeakPolarHBondContact O-CG 3.47Å; I256-L260 PolarHBondContact O-N 3.23Å; I256-L260 VanDerWaalsContact O-N 3.1Å
257	T	94.7	Very high	90.9	Very high	13 Å²	13	46.4 Å²	46.4	8%	0.08	27%	0.268	C	S	.	.	H	α-helix	trans	-63.5	-44.3	-177.6	-58.2	0	0	0	0	112.1	V225 F228 I253 G254 V259 L260 L261 L456	V225-T257 HydrophobicContact CG1-CG2 4.27Å; V225-T257 HydrophobicContact CG2-CG2 4.44Å; F228-T257 HydrophobicContact CD1-CG2 3.76Å; F228-T257 HydrophobicContact CE1-CG2 3.91Å; F228-T257 WeakPolarHBondContact CE1-OG1 3.28Å; I253-T257 VanDerWaalsContact O-CB 3.26Å; I253-T257 WeakPolarHBondContact O-CB 3.47Å; I253-T257 PolarHBondContact O-N 3.4Å; I253-T257 PolarHBondContact O-OG1 3.5Å; G254-T257 PolarHBondContact O-N 3.28Å; T257-V259 VanDerWaalsContact C-N 3.32Å; T257-V259 PolarHBondContact O-N 2.95Å; T257-L260 PolarHBondContact O-N 2.98Å; T257-L261 HydrophobicContact CG2-CD1 4.05Å; T257-L261 HydrophobicContact CG2-CG 4.38Å; T257-L261 WeakPolarHBondContact O-CG 3.45Å; T257-L261 PolarHBondContact O-N 3.45Å; T257-L456 HydrophobicContact CG2-CD2 3.8Å
258	V	94.6	Very high	89.9	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69.3	-28.6	179.6	74.6	0	0	0	0	112.7	V221 V225 G254 C255 I256 L262 F503 I507 I510	V221-V258 HydrophobicContact CG1-CG2 4.09Å; V225-V258 HydrophobicContact CG1-CB 4.45Å; V225-V258 HydrophobicContact CG2-CB 4.48Å; G254-V258 PolarHBondContact O-N 2.89Å; C255-V258 WeakPolarHBondContact O-CG1 3.32Å; I256-V258 PolarHBondContact O-N 3.31Å; V258-L262 WeakPolarHBondContact O-CB 3.21Å; V258-L262 PolarHBondContact O-N 3.27Å; V258-F503 HydrophobicContact CG1-CD2 4.35Å; V258-F503 HydrophobicContact CG1-CE2 4.04Å; V258-F503 HydrophobicContact CG2-CD2 4.23Å; V258-I507 HydrophobicContact CG1-CD1 4.29Å; V258-I507 HydrophobicContact CG1-CG1 3.83Å; V258-I510 HydrophobicContact CB-CD1 3.85Å; V258-I510 HydrophobicContact CG1-CD1 3.76Å; V258-I510 HydrophobicContact CG2-CD1 4.24Å
259	V	94.8	Very high	88.7	Confident	79 Å²	79	44.7 Å²	44.7	48%	0.479	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-44.4	170	169.2	0	0	0	0	111.4	C255 I256 T257 L262 G263 F503	C255-V259 WeakPolarHBondContact O-CG2 3.38Å; C255-V259 PolarHBondContact O-N 2.96Å; I256-V259 PolarHBondContact O-N 3Å; T257-V259 VanDerWaalsContact C-N 3.32Å; T257-V259 PolarHBondContact O-N 2.95Å; V259-L262 PolarHBondContact O-N 2.98Å; V259-G263 PolarHBondContact O-N 3.42Å; V259-F503 HydrophobicContact CB-CE2 4.5Å; V259-F503 HydrophobicContact CG2-CE2 3.69Å; V259-F503 HydrophobicContact CG2-CZ 3.74Å
260	L	91.7	Very high	87.7	Confident	110 Å²	110	51.5 Å²	51.5	58%	0.576	30%	0.295	S	S	*	.	H	α-helix	trans	-65.2	-44.3	177.1	-67.4	172	0	0	0	111.8	I256 T257 L262 G263 I264	I256-L260 HydrophobicContact CG2-CD1 4.14Å; I256-L260 WeakPolarHBondContact O-CG 3.47Å; I256-L260 PolarHBondContact O-N 3.23Å; I256-L260 VanDerWaalsContact O-N 3.1Å; T257-L260 PolarHBondContact O-N 2.98Å; L260-L262 VanDerWaalsContact C-N 3.34Å; L260-L262 PolarHBondContact O-N 3.25Å; L260-G263 PolarHBondContact O-N 3.49Å; L260-I264 WeakPolarHBondContact O-CG1 3.35Å; L260-I264 PolarHBondContact O-N 3.44Å
261	L	90.4	Very high	86.7	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.047	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-38.2	175.5	-71	174.3	0	0	0	112.3	V225 T257 I264 S265 L456 A459 L460 L463	V225-L261 HydrophobicContact CG2-CD1 3.79Å; T257-L261 HydrophobicContact CG2-CD1 4.05Å; T257-L261 HydrophobicContact CG2-CG 4.38Å; T257-L261 WeakPolarHBondContact O-CG 3.45Å; T257-L261 PolarHBondContact O-N 3.45Å; L261-I264 PolarHBondContact O-N 3.18Å; L261-S265 WeakPolarHBondContact O-CB 3.43Å; L261-S265 PolarHBondContact O-N 3.31Å; L261-S265 PolarHBondContact O-OG 2.96Å; L261-L456 HydrophobicContact CD1-CD2 4.27Å; L261-L456 HydrophobicContact CD2-CD2 4.32Å; L261-A459 HydrophobicContact CD1-CB 3.68Å; L261-L460 HydrophobicContact CD2-CB 4.3Å; L261-L460 HydrophobicContact CD2-CD1 4.39Å; L261-L463 HydrophobicContact CB-CD2 3.91Å
262	L	90	Very high	85.7	Confident	31 Å²	31	57.3 Å²	57.3	16%	0.162	32%	0.317	C	S	.	.	H	α-helix	trans	-60	-47.1	172	178.2	64.9	0	0	0	110.9	V258 V259 L260 I264 S265 V266 F503	V258-L262 WeakPolarHBondContact O-CB 3.21Å; V258-L262 PolarHBondContact O-N 3.27Å; V259-L262 PolarHBondContact O-N 2.98Å; L260-L262 VanDerWaalsContact C-N 3.34Å; L260-L262 PolarHBondContact O-N 3.25Å; L262-I264 VanDerWaalsContact C-N 3.34Å; L262-I264 PolarHBondContact O-N 3.07Å; L262-S265 PolarHBondContact O-N 3.41Å; L262-S265 PolarHBondContact O-OG 2.73Å; L262-V266 HydrophobicContact CD1-CG2 4.17Å; L262-V266 WeakPolarHBondContact O-CG2 3.48Å; L262-V266 PolarHBondContact O-N 3.2Å; L262-F503 HydrophobicContact CB-CD2 4.22Å; L262-F503 HydrophobicContact CD2-CB 4.23Å; L262-F503 HydrophobicContact CD2-CD1 4.32Å; L262-F503 HydrophobicContact CD2-CD2 3.64Å; L262-F503 HydrophobicContact CD2-CE2 3.96Å; L262-F503 HydrophobicContact CD2-CG 3.83Å; L262-F503 HydrophobicContact CD2-CZ 4.42Å; L262-F503 HydrophobicContact CG-CD2 4.46Å
263	G	87.6	Confident	84.6	Confident	45 Å²	45	54.9 Å²	54.9	46%	0.464	31%	0.308	S	S	.	.	H	α-helix	trans	-55.7	-45.9	175.6	0	0	0	0	0	113	V259 L260 V266 A267	V259-G263 PolarHBondContact O-N 3.42Å; L260-G263 PolarHBondContact O-N 3.49Å; G263-V266 PolarHBondContact O-N 2.86Å; G263-A267 PolarHBondContact O-N 3.09Å; G263-A267 VanDerWaalsContact O-N 3.15Å
264	I	85.9	Confident	83.7	Confident	86 Å²	86	59.5 Å²	59.5	44%	0.441	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-45.6	175.8	-65.4	165.4	0	0	0	111.2	L260 L261 L262 V266 A267 L460	L260-I264 WeakPolarHBondContact O-CG1 3.35Å; L260-I264 PolarHBondContact O-N 3.44Å; L261-I264 PolarHBondContact O-N 3.18Å; L262-I264 VanDerWaalsContact C-N 3.34Å; L262-I264 PolarHBondContact O-N 3.07Å; I264-V266 VanDerWaalsContact C-N 3.3Å; I264-V266 PolarHBondContact O-N 3.14Å; I264-A267 PolarHBondContact O-N 3.06Å; I264-L460 HydrophobicContact CB-CD1 4.4Å; I264-L460 HydrophobicContact CG2-CD1 4Å; I264-L460 HydrophobicContact CG2-CD2 4.15Å
265	S	83	Confident	82.9	Confident	7 Å²	7	61.4 Å²	61.4	5%	0.049	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-34.6	-178.9	73.2	0	0	0	0	113.2	L261 L262	L261-S265 WeakPolarHBondContact O-CB 3.43Å; L261-S265 PolarHBondContact O-N 3.31Å; L261-S265 PolarHBondContact O-OG 2.96Å; L262-S265 PolarHBondContact O-N 3.41Å; L262-S265 PolarHBondContact O-OG 2.73Å
266	V	81.9	Confident	81.9	Confident	83 Å²	83	60.2 Å²	60.2	50%	0.503	33%	0.334	S	S	.	.	H	α-helix	trans	-78.6	-24.7	178.1	174.7	0	0	0	0	112.2	L262 G263 I264	L262-V266 HydrophobicContact CD1-CG2 4.17Å; L262-V266 WeakPolarHBondContact O-CG2 3.48Å; L262-V266 PolarHBondContact O-N 3.2Å; G263-V266 PolarHBondContact O-N 2.86Å; I264-V266 VanDerWaalsContact C-N 3.3Å; I264-V266 PolarHBondContact O-N 3.14Å
267	A	76.5	Confident	81.2	Confident	79 Å²	79	58.8 Å²	58.8	65%	0.653	33%	0.327	S	S	*	.	H	α-helix	trans	-70.9	-25.7	177.6	0	0	0	0	0	113.9	G263 I264	G263-A267 PolarHBondContact O-N 3.09Å; G263-A267 VanDerWaalsContact O-N 3.15Å; I264-A267 PolarHBondContact O-N 3.06Å
268	G	67.7	Low	80.8	Confident	18 Å²	18	62.6 Å²	62.6	19%	0.186	35%	0.35	C	S	.	.			trans	130.2	148.9	161.6	0	0	0	0	0	117	E270 W271	G268-E270 VanDerWaalsContact C-N 3.27Å; G268-E270 PolarHBondContact O-N 3.25Å; G268-E270 VanDerWaalsContact O-N 3.09Å; G268-W271 PolarHBondContact O-N 2.87Å
269	M	68.3	Low	80.3	Confident	77 Å²	77	64.4 Å²	64.4	38%	0.379	36%	0.359	S	S	.	.	H	α-helix	trans	-54.9	-27.9	-173.4	-72.4	-169.5	-73.5	0	0	116.3	W271 E272 A273 K468	M269-W271 PolarHBondContact O-N 3.47Å; M269-E272 WeakPolarHBondContact O-CB 3.37Å; M269-E272 PolarHBondContact O-N 2.97Å; M269-A273 PolarHBondContact O-N 3.07Å; M269-K468 VanDerWaalsContact CG-NZ 3.32Å; M269-K468 PolarHBondContact SD-NZ 3.02Å
270	E	71.7	Confident	79.8	Confident	144 Å²	144	61.7 Å²	61.7	67%	0.673	34%	0.342	S	S	*	.	H	α-helix	trans	-66.2	-27.1	-176.1	-68.8	-170.6	-160.5	0	0	113.3	G268 K274	G268-E270 VanDerWaalsContact C-N 3.27Å; G268-E270 PolarHBondContact O-N 3.25Å; G268-E270 VanDerWaalsContact O-N 3.09Å; E270-K274 WeakPolarHBondContact O-CD 3.24Å; E270-K274 WeakPolarHBondContact O-CG 3.27Å
271	W	71.8	Confident	79.7	Confident	187 Å²	187	60.5 Å²	60.5	71%	0.708	34%	0.339	S	S	*	.	H	α-helix	trans	-79.7	-41.4	174.8	-68.6	96.2	0	0	0	111.3	G268 M269 A273 K274 A275	G268-W271 PolarHBondContact O-N 2.87Å; M269-W271 PolarHBondContact O-N 3.47Å; W271-A273 PolarHBondContact O-N 3.41Å; W271-K274 PolarHBondContact O-N 3Å; W271-K274 VanDerWaalsContact O-N 3.17Å; W271-A275 WeakPolarHBondContact O-CB 3.4Å; W271-A275 PolarHBondContact O-N 3.4Å
272	E	74.9	Confident	79.7	Confident	12 Å²	12	62.9 Å²	62.9	6%	0.056	35%	0.351	C	S	.	.	H	α-helix	trans	-52.3	-51.5	173.3	-176	-141.4	136.6	0	0	111.6	R135 M269 K274 A275 Q276 L460	R135-E272 IonicContact CZ-OE1 2.76Å; R135-E272 IonicContact NH1-OE1 2.78Å; R135-E272 IonicContact NH2-OE1 3.17Å; R135-E272 PolarHBondContact NH2-OE1 2.99Å; M269-E272 WeakPolarHBondContact O-CB 3.37Å; M269-E272 PolarHBondContact O-N 2.97Å; E272-K274 PolarHBondContact O-N 3.48Å; E272-A275 PolarHBondContact O-N 3.02Å; E272-Q276 WeakPolarHBondContact O-CG 3.47Å; E272-Q276 PolarHBondContact O-N 2.96Å; E272-Q276 PolarHBondContact OE1-NE2 3.17Å; E272-L460 HydrophobicContact CB-CD2 4.37Å; E272-L460 HydrophobicContact CG-CD2 3.92Å; E272-L460 HydrophobicContact CG-CG 4.2Å
273	A	71.1	Confident	79.8	Confident	21 Å²	21	61.4 Å²	61.4	17%	0.174	34%	0.343	C	S	.	.	H	α-helix	trans	-72.5	-11.2	-177.3	0	0	0	0	0	114.8	M269 W271	M269-A273 PolarHBondContact O-N 3.07Å; W271-A273 PolarHBondContact O-N 3.41Å
274	K	76.4	Confident	79.9	Confident	117 Å²	117	62.7 Å²	62.7	51%	0.509	34%	0.339	S	S	.	.	H	α-helix	trans	-91.1	-47.4	169.4	-72.6	168.5	-176.7	162.9	0	110.5	E270 W271 E272 Q276 I277	E270-K274 WeakPolarHBondContact O-CD 3.24Å; E270-K274 WeakPolarHBondContact O-CG 3.27Å; W271-K274 PolarHBondContact O-N 3Å; W271-K274 VanDerWaalsContact O-N 3.17Å; E272-K274 PolarHBondContact O-N 3.48Å; K274-Q276 PolarHBondContact O-N 3.31Å; K274-I277 PolarHBondContact O-N 3.21Å
275	A	76.9	Confident	80.2	Confident	41 Å²	41	62 Å²	62	34%	0.339	34%	0.339	S	S	.	.	H	α-helix	trans	-57.4	-45.9	179.3	0	0	0	0	0	112.1	W271 E272 I277 V278 L279	W271-A275 WeakPolarHBondContact O-CB 3.4Å; W271-A275 PolarHBondContact O-N 3.4Å; E272-A275 PolarHBondContact O-N 3.02Å; A275-I277 PolarHBondContact O-N 3.28Å; A275-V278 PolarHBondContact O-N 3Å; A275-L279 WeakPolarHBondContact O-CG 3.4Å; A275-L279 PolarHBondContact O-N 2.84Å
276	Q	74.5	Confident	80.7	Confident	10 Å²	10	61.7 Å²	61.7	5%	0.047	34%	0.337	C	S	.	.	H	α-helix	trans	-51.2	-32.8	178.3	-81.4	167.7	-1.8	0	0	114.3	R135 L138 E272 K274 L280	R135-Q276 VanDerWaalsContact CZ-OE1 3.29Å; R135-Q276 VanDerWaalsContact NE-OE1 3.12Å; L138-Q276 HydrophobicContact CD1-CB 3.82Å; L138-Q276 HydrophobicContact CD1-CG 4.24Å; L138-Q276 WeakPolarHBondContact CD1-O 3.05Å; E272-Q276 WeakPolarHBondContact O-CG 3.47Å; E272-Q276 PolarHBondContact O-N 2.96Å; E272-Q276 PolarHBondContact OE1-NE2 3.17Å; K274-Q276 PolarHBondContact O-N 3.31Å; Q276-L280 WeakPolarHBondContact O-CB 3.31Å; Q276-L280 PolarHBondContact O-N 3.13Å
277	I	80.5	Confident	81.1	Confident	66 Å²	66	58.2 Å²	58.2	34%	0.338	32%	0.315	S	S	.	.	H	α-helix	trans	-75.2	-40.3	179.9	-59.6	174.5	0	0	0	111	K274 A275 L279 L280 V281	K274-I277 PolarHBondContact O-N 3.21Å; A275-I277 PolarHBondContact O-N 3.28Å; I277-L279 VanDerWaalsContact C-N 3.35Å; I277-L280 PolarHBondContact O-N 3.17Å; I277-V281 WeakPolarHBondContact O-CG2 3.48Å; I277-V281 PolarHBondContact O-N 3.24Å
278	V	85.9	Confident	81.9	Confident	92 Å²	92	58.5 Å²	58.5	56%	0.558	31%	0.309	S	S	*	.	H	α-helix	trans	-64.4	-44	174.7	-177.6	0	0	0	0	110.1	A275 L280 V281 I282	A275-V278 PolarHBondContact O-N 3Å; V278-L280 PolarHBondContact O-N 2.95Å; V278-V281 PolarHBondContact O-N 3.08Å; V278-I282 HydrophobicContact CG1-CD1 4.23Å; V278-I282 WeakPolarHBondContact O-CG1 3.41Å; V278-I282 PolarHBondContact O-N 3.45Å; V278-I282 VanDerWaalsContact O-N 3.17Å
279	L	84.4	Confident	83	Confident	39 Å²	39	58.4 Å²	58.4	20%	0.204	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-41.7	177.1	-65.1	-177.1	0	0	0	112	A275 I277 V281 I282 L283 S453	A275-L279 WeakPolarHBondContact O-CG 3.4Å; A275-L279 PolarHBondContact O-N 2.84Å; I277-L279 VanDerWaalsContact C-N 3.35Å; L279-V281 VanDerWaalsContact C-N 3.34Å; L279-V281 PolarHBondContact O-N 3.47Å; L279-I282 PolarHBondContact O-N 2.77Å; L279-L283 WeakPolarHBondContact O-CB 3.31Å; L279-L283 PolarHBondContact O-N 3.01Å; L279-S453 WeakPolarHBondContact CA-OG 3.24Å; L279-S453 WeakPolarHBondContact CB-OG 3.41Å; L279-S453 WeakPolarHBondContact CD2-OG 3.43Å; L279-S453 PolarHBondContact O-OG 3.23Å
280	L	84.6	Confident	84.1	Confident	21 Å²	21	54.8 Å²	54.8	11%	0.11	29%	0.286	C	S	.	.	H	α-helix	trans	-57.2	-44	173.3	-179.1	71.6	0	0	0	112.5	V134 L138 W141 Q276 I277 V278 L283 L284	V134-L280 HydrophobicContact CB-CD2 4.5Å; V134-L280 HydrophobicContact CG1-CD2 3.93Å; V134-L280 HydrophobicContact CG2-CD2 3.91Å; L138-L280 HydrophobicContact CD1-CB 4.35Å; L138-L280 HydrophobicContact CD2-CB 3.95Å; L138-L280 HydrophobicContact CD2-CD1 3.95Å; L138-L280 HydrophobicContact CG-CB 4.36Å; L138-L280 HydrophobicContact CG-CD1 4.07Å; W141-L280 HydrophobicContact CZ3-CD1 4.11Å; Q276-L280 WeakPolarHBondContact O-CB 3.31Å; Q276-L280 PolarHBondContact O-N 3.13Å; I277-L280 PolarHBondContact O-N 3.17Å; V278-L280 PolarHBondContact O-N 2.95Å; L280-L283 PolarHBondContact O-N 3.19Å; L280-L284 HydrophobicContact CD1-CD1 4.23Å; L280-L284 HydrophobicContact CD1-CG 4.25Å; L280-L284 HydrophobicContact CD2-CD1 4.32Å; L280-L284 HydrophobicContact CG-CD1 3.89Å; L280-L284 HydrophobicContact CG-CG 4.3Å; L280-L284 WeakPolarHBondContact O-CB 3.44Å; L280-L284 WeakPolarHBondContact O-CG 3.31Å; L280-L284 PolarHBondContact O-N 2.89Å
281	V	89.9	Confident	85	Confident	85 Å²	85	51.1 Å²	51.1	52%	0.515	27%	0.268	S	S	.	.	H	α-helix	trans	-64.5	-44.6	-178.7	174.1	0	0	0	0	110.7	I277 V278 L279 L283 L284 V285	I277-V281 WeakPolarHBondContact O-CG2 3.48Å; I277-V281 PolarHBondContact O-N 3.24Å; V278-V281 PolarHBondContact O-N 3.08Å; L279-V281 VanDerWaalsContact C-N 3.34Å; L279-V281 PolarHBondContact O-N 3.47Å; V281-L283 VanDerWaalsContact C-N 3.31Å; V281-L283 PolarHBondContact O-N 3.32Å; V281-L284 PolarHBondContact O-N 2.88Å; V281-V285 HydrophobicContact CG1-CG2 4.48Å; V281-V285 WeakPolarHBondContact O-CB 3.41Å; V281-V285 VanDerWaalsContact O-CG2 3.27Å; V281-V285 WeakPolarHBondContact O-CG2 3.27Å; V281-V285 PolarHBondContact O-N 3.17Å
282	I	91.2	Very high	85.9	Confident	60 Å²	60	46 Å²	46	31%	0.308	26%	0.258	S	S	.	.	H	α-helix	trans	-59.6	-44	175.7	-63.4	166.9	0	0	0	110.6	V278 L279 V285 A286 A449	V278-I282 HydrophobicContact CG1-CD1 4.23Å; V278-I282 WeakPolarHBondContact O-CG1 3.41Å; V278-I282 PolarHBondContact O-N 3.45Å; V278-I282 VanDerWaalsContact O-N 3.17Å; L279-I282 PolarHBondContact O-N 2.77Å; I282-V285 PolarHBondContact O-N 3.1Å; I282-A286 WeakPolarHBondContact O-CB 3.23Å; I282-A286 PolarHBondContact O-N 3.32Å; I282-A449 HydrophobicContact CG2-CB 4.28Å
283	L	90.2	Very high	86.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.3	-45.8	179.6	177.4	54.9	0	0	0	112.7	L138 W141 F146 L279 L280 V281 V285 A286 I287 A454	L138-L283 HydrophobicContact CD2-CD2 4.25Å; W141-L283 HydrophobicContact CB-CD2 3.92Å; W141-L283 HydrophobicContact CD2-CD2 4.45Å; W141-L283 HydrophobicContact CE3-CD2 3.78Å; W141-L283 HydrophobicContact CE3-CG 4.21Å; F146-L283 HydrophobicContact CE2-CD1 3.54Å; F146-L283 HydrophobicContact CZ-CD1 3.81Å; L279-L283 WeakPolarHBondContact O-CB 3.31Å; L279-L283 PolarHBondContact O-N 3.01Å; L280-L283 PolarHBondContact O-N 3.19Å; V281-L283 VanDerWaalsContact C-N 3.31Å; V281-L283 PolarHBondContact O-N 3.32Å; L283-V285 PolarHBondContact O-N 3.39Å; L283-A286 PolarHBondContact O-N 2.84Å; L283-I287 HydrophobicContact CD1-CD1 4.12Å; L283-I287 HydrophobicContact CD1-CG1 4.41Å; L283-I287 HydrophobicContact CG-CD1 4.23Å; L283-I287 WeakPolarHBondContact O-CG1 3.45Å; L283-I287 PolarHBondContact O-N 2.8Å; L283-A454 HydrophobicContact CD1-CB 4.06Å; L283-A454 HydrophobicContact CD2-CB 4.35Å
284	L	91.1	Very high	87.3	Confident	71 Å²	71	44.7 Å²	44.7	37%	0.372	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-43.1	176.4	-73.5	171.4	0	0	0	111.8	W141 L280 V281 A286 I287 V288	W141-L284 HydrophobicContact CH2-CD2 3.58Å; W141-L284 HydrophobicContact CZ3-CD2 3.65Å; W141-L284 HydrophobicContact CZ3-CG 4.38Å; L280-L284 HydrophobicContact CD1-CD1 4.23Å; L280-L284 HydrophobicContact CD1-CG 4.25Å; L280-L284 HydrophobicContact CD2-CD1 4.32Å; L280-L284 HydrophobicContact CG-CD1 3.89Å; L280-L284 HydrophobicContact CG-CG 4.3Å; L280-L284 WeakPolarHBondContact O-CB 3.44Å; L280-L284 WeakPolarHBondContact O-CG 3.31Å; L280-L284 PolarHBondContact O-N 2.89Å; V281-L284 PolarHBondContact O-N 2.88Å; L284-A286 VanDerWaalsContact C-N 3.35Å; L284-I287 PolarHBondContact O-N 3.46Å; L284-V288 WeakPolarHBondContact O-CG2 3.06Å; L284-V288 PolarHBondContact O-N 3.03Å; L284-V288 VanDerWaalsContact O-N 3.07Å
285	V	92.6	Very high	87.8	Confident	73 Å²	73	42.9 Å²	42.9	44%	0.442	26%	0.255	S	S	.	.	H	α-helix	trans	-66.2	-37.6	177.6	172.7	0	0	0	0	111.2	V281 I282 L283 V288 N289 L446	V281-V285 HydrophobicContact CG1-CG2 4.48Å; V281-V285 WeakPolarHBondContact O-CB 3.41Å; V281-V285 VanDerWaalsContact O-CG2 3.27Å; V281-V285 WeakPolarHBondContact O-CG2 3.27Å; V281-V285 PolarHBondContact O-N 3.17Å; I282-V285 PolarHBondContact O-N 3.1Å; L283-V285 PolarHBondContact O-N 3.39Å; V285-V288 PolarHBondContact O-N 3.15Å; V285-N289 WeakPolarHBondContact O-CB 3.5Å; V285-N289 PolarHBondContact O-N 3.43Å; V285-L446 HydrophobicContact CG1-CD1 4.05Å; V285-L446 HydrophobicContact CG1-CD2 3.93Å; V285-L446 HydrophobicContact CG1-CG 4.44Å
286	A	92.3	Very high	88.3	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.2	-42.2	173.4	0	0	0	0	0	112.7	F146 I282 L283 L284 V288 N289 V290 L446 I447	F146-A286 HydrophobicContact CE1-CB 4.42Å; F146-A286 HydrophobicContact CZ-CB 3.93Å; I282-A286 WeakPolarHBondContact O-CB 3.23Å; I282-A286 PolarHBondContact O-N 3.32Å; L283-A286 PolarHBondContact O-N 2.84Å; L284-A286 VanDerWaalsContact C-N 3.35Å; A286-V288 PolarHBondContact O-N 2.97Å; A286-N289 WeakPolarHBondContact O-CB 3.46Å; A286-N289 PolarHBondContact O-N 2.88Å; A286-V290 PolarHBondContact O-N 3.26Å; A286-L446 WeakPolarHBondContact CB-O 3.3Å; A286-I447 HydrophobicContact CB-CD1 4.3Å; A286-I447 WeakPolarHBondContact O-CD1 3.37Å
287	I	91.1	Very high	88.6	Confident	10 Å²	10	50 Å²	50	5%	0.051	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-44.4	175.5	-69	165.5	0	0	0	110.8	W141 L145 F146 L283 L284 N289 V290 F291 V378	W141-I287 HydrophobicContact CD2-CD1 4.23Å; W141-I287 HydrophobicContact CE3-CD1 4.33Å; W141-I287 HydrophobicContact CH2-CD1 4.29Å; W141-I287 HydrophobicContact CZ2-CD1 4.21Å; W141-I287 HydrophobicContact CZ3-CD1 4.35Å; L145-I287 HydrophobicContact CD1-CD1 4.28Å; L145-I287 HydrophobicContact CD2-CG1 4.35Å; F146-I287 HydrophobicContact CZ-CG1 4.16Å; L283-I287 HydrophobicContact CD1-CD1 4.12Å; L283-I287 HydrophobicContact CD1-CG1 4.41Å; L283-I287 HydrophobicContact CG-CD1 4.23Å; L283-I287 WeakPolarHBondContact O-CG1 3.45Å; L283-I287 PolarHBondContact O-N 2.8Å; L284-I287 PolarHBondContact O-N 3.46Å; I287-N289 VanDerWaalsContact C-N 3.33Å; I287-N289 PolarHBondContact O-N 3.07Å; I287-V290 PolarHBondContact O-N 2.96Å; I287-F291 HydrophobicContact CG2-CD2 4.41Å; I287-F291 HydrophobicContact CG2-CE2 3.9Å; I287-F291 VanDerWaalsContact O-CD2 3.31Å; I287-F291 WeakPolarHBondContact O-CD2 3.26Å; I287-V378 HydrophobicContact CG2-CG2 4.49Å
288	V	91.9	Very high	88.5	Confident	85 Å²	85	47.7 Å²	47.7	52%	0.515	28%	0.284	S	S	.	.	H	α-helix	trans	-63.7	-37.4	176.4	173.9	0	0	0	0	112	L284 V285 A286 V290 F291 V292	L284-V288 WeakPolarHBondContact O-CG2 3.06Å; L284-V288 PolarHBondContact O-N 3.03Å; L284-V288 VanDerWaalsContact O-N 3.07Å; V285-V288 PolarHBondContact O-N 3.15Å; A286-V288 PolarHBondContact O-N 2.97Å; V288-V290 VanDerWaalsContact C-N 3.26Å; V288-V290 PolarHBondContact O-N 3.31Å; V288-F291 PolarHBondContact O-N 2.95Å; V288-V292 HydrophobicContact CG1-CG2 4.16Å; V288-V292 WeakPolarHBondContact O-CG2 3.26Å; V288-V292 PolarHBondContact O-N 2.93Å
289	N	92.8	Very high	88.3	Confident	16 Å²	16	47.3 Å²	47.3	9%	0.086	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-25.3	176.2	175.4	47.5	0	0	0	113.7	V285 A286 I287 G293 G442 F443 L446 I447	V285-N289 WeakPolarHBondContact O-CB 3.5Å; V285-N289 PolarHBondContact O-N 3.43Å; A286-N289 WeakPolarHBondContact O-CB 3.46Å; A286-N289 PolarHBondContact O-N 2.88Å; I287-N289 VanDerWaalsContact C-N 3.33Å; I287-N289 PolarHBondContact O-N 3.07Å; N289-G293 PolarHBondContact O-N 3.49Å; N289-G442 PolarHBondContact O-N 2.9Å; N289-G442 PolarHBondContact OD1-N 3.41Å; N289-F443 PolarHBondContact ND2-O 2.97Å; N289-F443 PolarHBondContact OD1-N 2.7Å; N289-L446 HydrophobicContact CB-CD2 3.84Å; N289-L446 HydrophobicContact CB-CG 4.36Å; N289-I447 HydrophobicContact CB-CD1 4.31Å; N289-I447 WeakPolarHBondContact ND2-CD1 3.38Å
290	V	90.2	Very high	88	Confident	1 Å²	1	52 Å²	52	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-67.9	-51.8	169.8	-177.4	0	0	0	0	110.5	F146 A286 I287 V288 V292 G293 T294 V378 I447	F146-V290 HydrophobicContact CE1-CG2 4.49Å; A286-V290 PolarHBondContact O-N 3.26Å; I287-V290 PolarHBondContact O-N 2.96Å; V288-V290 VanDerWaalsContact C-N 3.26Å; V288-V290 PolarHBondContact O-N 3.31Å; V290-V292 PolarHBondContact O-N 3.25Å; V290-G293 WeakPolarHBondContact O-CA 3.41Å; V290-G293 PolarHBondContact O-N 3.04Å; V290-G293 VanDerWaalsContact O-N 3.12Å; V290-T294 PolarHBondContact O-N 2.98Å; V290-V378 HydrophobicContact CG1-CG1 4.37Å; V290-I447 HydrophobicContact CG2-CD1 3.57Å
291	F	91.2	Very high	87.9	Confident	67 Å²	67	54.9 Å²	54.9	29%	0.294	32%	0.318	S	S	.	.	H	α-helix	trans	-60.8	-45.3	179.8	-67.5	-72	0	0	0	112.1	I287 V288 G293 T294 A377 V378 C381	I287-F291 HydrophobicContact CG2-CD2 4.41Å; I287-F291 HydrophobicContact CG2-CE2 3.9Å; I287-F291 VanDerWaalsContact O-CD2 3.31Å; I287-F291 WeakPolarHBondContact O-CD2 3.26Å; V288-F291 PolarHBondContact O-N 2.95Å; F291-G293 VanDerWaalsContact C-N 3.31Å; F291-G293 PolarHBondContact O-N 3.29Å; F291-T294 PolarHBondContact O-N 3.45Å; F291-T294 PolarHBondContact O-OG1 2.86Å; F291-A377 HydrophobicContact CE1-CB 4.08Å; F291-A377 HydrophobicContact CZ-CB 3.83Å; F291-V378 HydrophobicContact CE1-CG2 4.39Å; F291-V378 HydrophobicContact CE2-CG2 3.79Å; F291-V378 HydrophobicContact CZ-CB 4.47Å; F291-V378 HydrophobicContact CZ-CG2 3.54Å; F291-C381 HydrophobicContact CD1-CB 4.49Å; F291-C381 HydrophobicContact CE1-CB 4.36Å
292	V	90.5	Very high	87.7	Confident	80 Å²	80	53 Å²	53	49%	0.485	30%	0.303	S	S	.	.	H	α-helix	trans	-61.1	-40.9	174.4	175.5	0	0	0	0	111.1	V288 V290 T294 A295 I296	V288-V292 HydrophobicContact CG1-CG2 4.16Å; V288-V292 WeakPolarHBondContact O-CG2 3.26Å; V288-V292 PolarHBondContact O-N 2.93Å; V290-V292 PolarHBondContact O-N 3.25Å; V292-T294 PolarHBondContact O-N 3.48Å; V292-A295 PolarHBondContact O-N 3.27Å; V292-I296 HydrophobicContact CG1-CD1 4.33Å
293	G	87.9	Confident	87.3	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-45.7	175.8	0	0	0	0	0	113.9	N289 V290 F291 A295 I296 V440	N289-G293 PolarHBondContact O-N 3.49Å; V290-G293 WeakPolarHBondContact O-CA 3.41Å; V290-G293 PolarHBondContact O-N 3.04Å; V290-G293 VanDerWaalsContact O-N 3.12Å; F291-G293 VanDerWaalsContact C-N 3.31Å; F291-G293 PolarHBondContact O-N 3.29Å; G293-A295 PolarHBondContact O-N 2.9Å; G293-A295 VanDerWaalsContact O-N 3.13Å; G293-I296 PolarHBondContact O-N 3.4Å; G293-V440 CarbonylContact C-O 3.5Å; G293-V440 VanDerWaalsContact C-O 3.32Å; G293-V440 WeakPolarHBondContact CA-O 3.36Å
294	T	87.7	Confident	86.9	Confident	4 Å²	4	53.5 Å²	53.5	3%	0.025	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-22	178.9	61.3	0	0	0	0	114.4	V290 F291 V292 Y310 C381 T385 V440	V290-T294 PolarHBondContact O-N 2.98Å; F291-T294 PolarHBondContact O-N 3.45Å; F291-T294 PolarHBondContact O-OG1 2.86Å; V292-T294 PolarHBondContact O-N 3.48Å; T294-Y310 WeakPolarHBondContact CB-OH 3.38Å; T294-Y310 WeakPolarHBondContact O-CD2 3.28Å; T294-Y310 VanDerWaalsContact O-CE2 3.29Å; T294-Y310 WeakPolarHBondContact O-CE2 3.39Å; T294-Y310 WeakPolarHBondContact OG1-CE2 3.48Å; T294-Y310 PolarHBondContact OG1-OH 3.14Å; T294-C381 HydrophobicContact CG2-CB 4.33Å; T294-T385 HydrophobicContact CG2-CG2 4.3Å; T294-V440 HydrophobicContact CG2-CG1 3.4Å; T294-V440 VanDerWaalsContact CG2-CG1 3.4Å
295	A	87.1	Confident	86.6	Confident	79 Å²	79	52.4 Å²	52.4	65%	0.653	30%	0.295	S	S	*	.	H	α-helix	trans	-89.7	-10.7	178.7	0	0	0	0	0	113.7	V292 G293	V292-A295 PolarHBondContact O-N 3.27Å; G293-A295 PolarHBondContact O-N 2.9Å; G293-A295 VanDerWaalsContact O-N 3.13Å
296	I	87.1	Confident	86.2	Confident	85 Å²	85	48.9 Å²	48.9	44%	0.436	27%	0.274	S	S	.	.	S	Bend	trans	-85.8	131.3	177.3	-65.5	168.5	0	0	0	108.7	V292 G293	V292-I296 HydrophobicContact CG1-CD1 4.33Å; G293-I296 PolarHBondContact O-N 3.4Å
297	P	80.1	Confident	86.1	Confident	115 Å²	115	49 Å²	49	75%	0.747	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-62.5	140.4	-179.1	25.1	-34.4	0	0	0	112.3	T299	P297-T299 PolarHBondContact O-N 3Å
298	A	78.3	Confident	85.8	Confident	17 Å²	17	50 Å²	50	14%	0.14	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-68.7	128.1	-175.9	0	0	0	0	0	112.9	K302 K303 F307	A298-K302 HydrophobicContact CB-CB 4.49Å; A298-K303 HydrophobicContact CB-CG 3.78Å; A298-K303 VanDerWaalsContact O-CE 3.3Å; A298-K303 WeakPolarHBondContact O-CE 3.36Å; A298-F307 HydrophobicContact CB-CD1 3.52Å; A298-F307 HydrophobicContact CB-CE1 3.72Å; A298-F307 VanDerWaalsContact CB-O 3.26Å; A298-F307 WeakPolarHBondContact CB-O 3.36Å
299	T	82.9	Confident	85.5	Confident	85 Å²	85	46.5 Å²	46.5	52%	0.521	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-71.9	160.2	164.3	54.1	0	0	0	0	110.8	P297 D301 K302 K303	P297-T299 PolarHBondContact O-N 3Å; T299-D301 VanDerWaalsContact C-N 3.3Å; T299-D301 PolarHBondContact O-N 3.07Å; T299-K302 PolarHBondContact O-N 3.27Å; T299-K303 PolarHBondContact O-N 2.71Å
300	E	78.6	Confident	85.2	Confident	136 Å²	136	52 Å²	52	64%	0.636	28%	0.28	S	S	*	.	H	α-helix	trans	-60.8	-36.2	-175.4	-61.9	-179.6	156.7	0	0	113.2	K303 S304	E300-K303 PolarHBondContact O-N 3.36Å; E300-S304 PolarHBondContact O-N 3.07Å
301	D	82.1	Confident	85	Confident	83 Å²	83	54 Å²	54	44%	0.444	29%	0.291	S	S	.	.	H	α-helix	trans	-66.1	-32.5	172.3	174	83.5	0	0	0	113.4	T299 S304 K305	T299-D301 VanDerWaalsContact C-N 3.3Å; T299-D301 PolarHBondContact O-N 3.07Å; D301-S304 PolarHBondContact O-OG 3.34Å; D301-K305 VanDerWaalsContact O-CD 3.31Å; D301-K305 WeakPolarHBondContact O-CD 3.43Å; D301-K305 VanDerWaalsContact O-CG 3.31Å; D301-K305 WeakPolarHBondContact O-CG 3.38Å; D301-K305 WeakPolarHBondContact OD1-CE 3.35Å; D301-K305 IonicContact OD1-NZ 2.7Å; D301-K305 PolarHBondContact OD1-NZ 3.36Å; D301-K305 IonicContact OD2-NZ 2.7Å; D301-K305 PolarHBondContact OD2-NZ 2.95Å
302	K	84.3	Confident	84.8	Confident	45 Å²	45	56.3 Å²	56.3	20%	0.196	31%	0.311	C	S	.	.	H	α-helix	trans	-74.3	-33.3	171.9	-72.5	-164.5	179.7	-157.7	0	111.7	A298 T299 K305 G306 F307 M439 S441	A298-K302 HydrophobicContact CB-CB 4.49Å; T299-K302 PolarHBondContact O-N 3.27Å; K302-K305 CarbonylContact O-C 3.51Å; K302-K305 PolarHBondContact O-N 2.88Å; K302-G306 PolarHBondContact O-N 3.18Å; K302-F307 HydrophobicContact CB-CB 4.34Å; K302-F307 HydrophobicContact CB-CD1 3.95Å; K302-F307 HydrophobicContact CD-CD1 3.92Å; K302-F307 HydrophobicContact CD-CE1 4.29Å; K302-F307 PolarHBondContact O-N 2.76Å; K302-M439 WeakPolarHBondContact CE-O 3.48Å; K302-M439 PolarHBondContact NZ-O 3.18Å; K302-S441 PolarHBondContact NZ-O 3.16Å
303	K	83.9	Confident	84.5	Confident	70 Å²	70	56.8 Å²	56.8	30%	0.304	31%	0.306	S	S	.	.	H	α-helix	trans	-67.8	-45.2	176.5	-68.1	176.9	-174.3	172	0	112.6	A298 T299 E300 K305 G306 F307 F308 Y416	A298-K303 HydrophobicContact CB-CG 3.78Å; A298-K303 VanDerWaalsContact O-CE 3.3Å; A298-K303 WeakPolarHBondContact O-CE 3.36Å; T299-K303 PolarHBondContact O-N 2.71Å; E300-K303 PolarHBondContact O-N 3.36Å; K303-K305 PolarHBondContact O-N 3.43Å; K303-G306 WeakPolarHBondContact O-CA 3.2Å; K303-G306 PolarHBondContact O-N 2.98Å; K303-F307 WeakPolarHBondContact CA-O 3.44Å; K303-F308 HydrophobicContact CB-CD1 4.43Å; K303-F308 HydrophobicContact CB-CE1 4.08Å; K303-F308 HydrophobicContact CG-CD1 4.19Å; K303-F308 HydrophobicContact CG-CE1 4.3Å; K303-Y416 HydrophobicContact CB-CE1 4.34Å; K303-Y416 HydrophobicContact CB-CE2 3.81Å; K303-Y416 WeakPolarHBondContact CB-OH 3.37Å; K303-Y416 HydrophobicContact CD-CE2 4.08Å
304	S	82.5	Confident	84.4	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-29.1	176.3	67	0	0	0	0	112.6	E300 D301 G306 G392 N393	E300-S304 PolarHBondContact O-N 3.07Å; D301-S304 PolarHBondContact O-OG 3.34Å; S304-G306 VanDerWaalsContact C-N 3.32Å; S304-G392 WeakPolarHBondContact CB-O 3.46Å; S304-G392 WeakPolarHBondContact O-CA 3.05Å; S304-G392 PolarHBondContact O-N 2.97Å; S304-G392 PolarHBondContact OG-O 2.97Å; S304-N393 WeakPolarHBondContact CB-O 3.36Å
305	K	83.1	Confident	84.5	Confident	48 Å²	48	59.6 Å²	59.6	21%	0.209	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	1.5	174.5	-62.6	169.1	-168	165.2	0	113.9	D301 K302 K303 F428 M439	D301-K305 VanDerWaalsContact O-CD 3.31Å; D301-K305 WeakPolarHBondContact O-CD 3.43Å; D301-K305 VanDerWaalsContact O-CG 3.31Å; D301-K305 WeakPolarHBondContact O-CG 3.38Å; D301-K305 WeakPolarHBondContact OD1-CE 3.35Å; D301-K305 IonicContact OD1-NZ 2.7Å; D301-K305 PolarHBondContact OD1-NZ 3.36Å; D301-K305 IonicContact OD2-NZ 2.7Å; D301-K305 PolarHBondContact OD2-NZ 2.95Å; K302-K305 CarbonylContact O-C 3.51Å; K302-K305 PolarHBondContact O-N 2.88Å; K303-K305 PolarHBondContact O-N 3.43Å; K305-F428 HydrophobicContact CB-CB 4.28Å; K305-F428 HydrophobicContact CB-CD1 4.1Å; K305-F428 HydrophobicContact CB-CG 4.13Å; K305-F428 HydrophobicContact CD-CD1 4.41Å; K305-F428 HydrophobicContact CD-CE1 4.16Å; K305-F428 HydrophobicContact CD-CZ 4.45Å; K305-F428 HydrophobicContact CG-CD1 3.99Å; K305-F428 HydrophobicContact CG-CD2 4.27Å; K305-F428 HydrophobicContact CG-CE1 4.11Å; K305-F428 HydrophobicContact CG-CE2 4.38Å; K305-F428 HydrophobicContact CG-CG 4.08Å; K305-F428 HydrophobicContact CG-CZ 4.3Å; K305-F428 WeakPolarHBondContact O-CB 3.47Å; K305-M439 HydrophobicContact CB-CE 3.73Å; K305-M439 HydrophobicContact CB-SD 3.66Å; K305-M439 WeakPolarHBondContact O-CE 3.19Å
306	G	84.9	Confident	84.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	102	3.6	168.9	0	0	0	0	0	116.9	K302 K303 S304 F308 V386 V387	K302-G306 PolarHBondContact O-N 3.18Å; K303-G306 WeakPolarHBondContact O-CA 3.2Å; K303-G306 PolarHBondContact O-N 2.98Å; S304-G306 VanDerWaalsContact C-N 3.32Å; G306-F308 WeakPolarHBondContact O-CD2 3.38Å; G306-V386 WeakPolarHBondContact O-CA 3.49Å; G306-V387 PolarHBondContact O-N 3.39Å; G306-V387 VanDerWaalsContact O-N 3.1Å
307	F	89.4	Confident	84.5	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.009	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-93.6	117.3	176	172.4	-102.9	0	0	0	111.5	A298 K302 K303 T385 V386 M439 V440	A298-F307 HydrophobicContact CB-CD1 3.52Å; A298-F307 HydrophobicContact CB-CE1 3.72Å; A298-F307 VanDerWaalsContact CB-O 3.26Å; A298-F307 WeakPolarHBondContact CB-O 3.36Å; K302-F307 HydrophobicContact CB-CB 4.34Å; K302-F307 HydrophobicContact CB-CD1 3.95Å; K302-F307 HydrophobicContact CD-CD1 3.92Å; K302-F307 HydrophobicContact CD-CE1 4.29Å; K302-F307 PolarHBondContact O-N 2.76Å; K303-F307 WeakPolarHBondContact CA-O 3.44Å; F307-T385 WeakPolarHBondContact CD2-O 3.25Å; F307-T385 HydrophobicContact CE2-CG2 4.34Å; F307-V386 HydrophobicContact CD2-CG2 4.12Å; F307-M439 HydrophobicContact CB-SD 4.22Å; F307-V440 HydrophobicContact CD2-CB 4.48Å; F307-V440 HydrophobicContact CD2-CG1 4.36Å; F307-V440 HydrophobicContact CD2-CG2 3.89Å; F307-V440 HydrophobicContact CE2-CG1 4.02Å; F307-V440 HydrophobicContact CE2-CG2 4.38Å
308	F	84.7	Confident	85	Confident	32 Å²	32	54.8 Å²	54.8	14%	0.14	27%	0.272	C	S	.	.			trans	-114.3	-1.4	-176.6	-68.9	-84.5	0	0	0	113.9	K303 G306 I314 T385 V387 L414 Y416 F418	K303-F308 HydrophobicContact CB-CD1 4.43Å; K303-F308 HydrophobicContact CB-CE1 4.08Å; K303-F308 HydrophobicContact CG-CD1 4.19Å; K303-F308 HydrophobicContact CG-CE1 4.3Å; G306-F308 WeakPolarHBondContact O-CD2 3.38Å; F308-I314 HydrophobicContact CB-CD1 3.72Å; F308-I314 HydrophobicContact CD2-CD1 3.89Å; F308-I314 HydrophobicContact CG-CD1 4.1Å; F308-T385 PolarHBondContact N-O 3.08Å; F308-V387 HydrophobicContact CD2-CG1 4.12Å; F308-V387 HydrophobicContact CE2-CG1 4.1Å; F308-V387 HydrophobicContact CE2-CG2 4.14Å; F308-L414 HydrophobicContact CB-CD1 4.32Å; F308-L414 HydrophobicContact CD1-CB 4.21Å; F308-L414 HydrophobicContact CD1-CD1 4.11Å; F308-L414 HydrophobicContact CD2-CD1 4.45Å; F308-L414 HydrophobicContact CE1-CB 4.1Å; F308-L414 HydrophobicContact CG-CD1 4.04Å; F308-Y416 AromaticContact CE1-CD2 3.61Å; F308-Y416 HydrophobicContact CE1-CD2 3.61Å; F308-Y416 AromaticContact CE1-CE2 3.97Å; F308-Y416 HydrophobicContact CE1-CE2 3.97Å; F308-Y416 HydrophobicContact CE1-CG 4.33Å; F308-Y416 AromaticContact CZ-CD2 3.9Å; F308-Y416 HydrophobicContact CZ-CD2 3.9Å; F308-Y416 HydrophobicContact CZ-CG 4.16Å; F308-F418 HydrophobicContact CE2-CE2 4.19Å; F308-F418 HydrophobicContact CZ-CE2 4.17Å; F308-F418 HydrophobicContact CZ-CZ 4.44Å
309	G	85.5	Confident	85.5	Confident	11 Å²	11	58.7 Å²	58.7	11%	0.113	29%	0.285	C	S	.	.			trans	74.3	-177.3	-167.7	0	0	0	0	0	112.2	N311 T385	G309-N311 PolarHBondContact O-N 2.85Å; G309-N311 VanDerWaalsContact O-N 3.13Å; G309-T385 WeakPolarHBondContact O-CA 3.49Å
310	Y	87.9	Confident	85.9	Confident	132 Å²	132	58.5 Å²	58.5	52%	0.518	28%	0.284	S	S	.	.	S	Bend	trans	-64.8	113.7	-171.6	-75.5	-78.9	0	0	0	112.2	T294 C381 G384 T385	T294-Y310 WeakPolarHBondContact CB-OH 3.38Å; T294-Y310 WeakPolarHBondContact O-CD2 3.28Å; T294-Y310 VanDerWaalsContact O-CE2 3.29Å; T294-Y310 WeakPolarHBondContact O-CE2 3.39Å; T294-Y310 WeakPolarHBondContact OG1-CE2 3.48Å; T294-Y310 PolarHBondContact OG1-OH 3.14Å; Y310-C381 PolarHBondContact OH-SG 3.18Å; Y310-G384 WeakPolarHBondContact CA-O 3.41Å; Y310-T385 HydrophobicContact CD1-CG2 3.67Å; Y310-T385 HydrophobicContact CD2-CG2 3.98Å; Y310-T385 HydrophobicContact CE1-CG2 3.74Å; Y310-T385 HydrophobicContact CE2-CG2 4.04Å; Y310-T385 HydrophobicContact CG-CG2 3.79Å
311	N	86.3	Confident	86.4	Confident	42 Å²	42	55 Å²	55	23%	0.225	27%	0.273	C	S	.	.			trans	-136	128.6	-178.7	-165.1	-50.9	0	0	0	111.8	G309 K313 I314 F315 G384 L414	G309-N311 PolarHBondContact O-N 2.85Å; G309-N311 VanDerWaalsContact O-N 3.13Å; N311-K313 VanDerWaalsContact C-N 3.28Å; N311-K313 PolarHBondContact O-N 2.81Å; N311-K313 WeakPolarHBondContact OD1-CB 3.48Å; N311-K313 PolarHBondContact OD1-N 3.31Å; N311-I314 HydrophobicContact CB-CB 4.31Å; N311-I314 HydrophobicContact CB-CD1 3.97Å; N311-I314 HydrophobicContact CB-CG1 4.07Å; N311-I314 PolarHBondContact O-N 2.97Å; N311-F315 WeakPolarHBondContact O-CB 3.43Å; N311-F315 PolarHBondContact O-N 2.94Å; N311-G384 PolarHBondContact N-O 3.28Å; N311-G384 VanDerWaalsContact N-O 3.17Å; N311-L414 WeakPolarHBondContact ND2-CD2 3.43Å
312	T	85.7	Confident	86.8	Confident	116 Å²	116	53.3 Å²	53.3	71%	0.712	26%	0.264	S	S	*	.	H	α-helix	trans	-64.8	-29.3	-179.2	49.1	0	0	0	0	113.3	M316	T312-M316 VanDerWaalsContact O-CG 3.32Å; T312-M316 WeakPolarHBondContact O-CG 3.36Å; T312-M316 PolarHBondContact O-N 2.93Å; T312-M316 VanDerWaalsContact O-N 3.11Å
313	K	85.3	Confident	87	Confident	89 Å²	89	54.4 Å²	54.4	39%	0.387	27%	0.269	S	S	.	.	H	α-helix	trans	-70.5	-48	177.3	-62.7	-171.8	172.1	-172.4	0	111.5	N311 F315 M316 E317 V410 E413	N311-K313 VanDerWaalsContact C-N 3.28Å; N311-K313 PolarHBondContact O-N 2.81Å; N311-K313 WeakPolarHBondContact OD1-CB 3.48Å; N311-K313 PolarHBondContact OD1-N 3.31Å; K313-F315 VanDerWaalsContact C-N 3.29Å; K313-F315 PolarHBondContact O-N 3.21Å; K313-M316 PolarHBondContact O-N 3.29Å; K313-M316 VanDerWaalsContact O-N 3.12Å; K313-E317 WeakPolarHBondContact O-CB 3.48Å; K313-E317 PolarHBondContact O-N 3.41Å; K313-V410 HydrophobicContact CB-CB 4.5Å; K313-V410 HydrophobicContact CB-CG1 3.52Å; K313-V410 HydrophobicContact CB-CG2 4.13Å; K313-E413 VanDerWaalsContact CD-OE2 3.27Å; K313-E413 WeakPolarHBondContact CD-OE2 3.31Å; K313-E413 WeakPolarHBondContact CE-OE2 3.48Å; K313-E413 IonicContact NZ-OE1 3.93Å; K313-E413 PolarHBondContact NZ-OE1 3.04Å; K313-E413 IonicContact NZ-OE2 2.71Å; K313-E413 PolarHBondContact NZ-OE2 2.98Å
314	I	86	Confident	87.1	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.4	-41.8	175.6	-60.9	177.4	0	0	0	110.2	F308 N311 M316 E317 N318 V386 V387 V410 L414	F308-I314 HydrophobicContact CB-CD1 3.72Å; F308-I314 HydrophobicContact CD2-CD1 3.89Å; F308-I314 HydrophobicContact CG-CD1 4.1Å; N311-I314 HydrophobicContact CB-CB 4.31Å; N311-I314 HydrophobicContact CB-CD1 3.97Å; N311-I314 HydrophobicContact CB-CG1 4.07Å; N311-I314 PolarHBondContact O-N 2.97Å; I314-M316 VanDerWaalsContact C-N 3.3Å; I314-M316 PolarHBondContact O-N 3.05Å; I314-E317 PolarHBondContact O-N 3.01Å; I314-N318 WeakPolarHBondContact O-CB 3.45Å; I314-N318 PolarHBondContact O-N 2.89Å; I314-N318 PolarHBondContact O-ND2 2.95Å; I314-V386 WeakPolarHBondContact CG2-O 3.46Å; I314-V387 HydrophobicContact CD1-CG1 3.89Å; I314-V387 HydrophobicContact CG1-CG1 4Å; I314-V387 HydrophobicContact CG2-CG1 4.32Å; I314-V410 HydrophobicContact CG1-CG1 3.72Å; I314-L414 HydrophobicContact CD1-CD1 3.89Å; I314-L414 HydrophobicContact CG1-CD1 4.22Å
315	F	88.7	Confident	87	Confident	65 Å²	65	61.7 Å²	61.7	29%	0.285	31%	0.307	S	S	.	.	H	α-helix	trans	-63.6	-32.8	176.8	-172.4	-103.8	0	0	0	113.2	W158 N311 K313 L380	W158-F315 HydrophobicContact CD2-CE2 4.26Å; W158-F315 HydrophobicContact CD2-CZ 4.02Å; W158-F315 AromaticContact CE2-CE1 3.72Å; W158-F315 AromaticContact CE2-CE2 3.91Å; W158-F315 AromaticContact CE2-CZ 3.46Å; W158-F315 VanDerWaalsContact CE2-CZ 3.46Å; W158-F315 HydrophobicContact CG-CE2 4.38Å; W158-F315 HydrophobicContact CH2-CE1 4.16Å; W158-F315 HydrophobicContact CH2-CZ 4.06Å; W158-F315 HydrophobicContact CZ2-CD1 4.25Å; W158-F315 AromaticContact CZ2-CE1 3.41Å; W158-F315 HydrophobicContact CZ2-CE1 3.41Å; W158-F315 VanDerWaalsContact CZ2-CE1 3.41Å; W158-F315 HydrophobicContact CZ2-CE2 4.39Å; W158-F315 AromaticContact CZ2-CZ 3.5Å; W158-F315 HydrophobicContact CZ2-CZ 3.5Å; W158-F315 VanDerWaalsContact CZ2-CZ 3.5Å; W158-F315 AromaticContact NE1-CE1 3.93Å; W158-F315 AromaticContact NE1-CE2 3.79Å; W158-F315 AromaticContact NE1-CZ 3.75Å; W158-F315 PolarHBondContact NE1-O 3.01Å; N311-F315 WeakPolarHBondContact O-CB 3.43Å; N311-F315 PolarHBondContact O-N 2.94Å; K313-F315 VanDerWaalsContact C-N 3.29Å; K313-F315 PolarHBondContact O-N 3.21Å; F315-L380 HydrophobicContact CE2-CD2 4.25Å
316	M	88.6	Confident	87	Confident	134 Å²	134	62.9 Å²	62.9	66%	0.66	33%	0.333	S	S	*	.	H	α-helix	trans	-78	-40.9	174.6	-71.6	-67.5	-179.9	0	0	112.5	T312 K313 I314 N318 F319	T312-M316 VanDerWaalsContact O-CG 3.32Å; T312-M316 WeakPolarHBondContact O-CG 3.36Å; T312-M316 PolarHBondContact O-N 2.93Å; T312-M316 VanDerWaalsContact O-N 3.11Å; K313-M316 PolarHBondContact O-N 3.29Å; K313-M316 VanDerWaalsContact O-N 3.12Å; I314-M316 VanDerWaalsContact C-N 3.3Å; I314-M316 PolarHBondContact O-N 3.05Å; M316-N318 VanDerWaalsContact C-N 3.29Å; M316-N318 PolarHBondContact O-N 2.98Å; M316-F319 VanDerWaalsContact O-CB 3.24Å; M316-F319 WeakPolarHBondContact O-CB 3.11Å; M316-F319 PolarHBondContact O-N 3.34Å; M316-F319 VanDerWaalsContact O-N 3.13Å
317	E	85.9	Confident	87.2	Confident	44 Å²	44	65 Å²	65	21%	0.206	34%	0.343	C	S	.	.	H	α-helix	trans	-58.3	-40.6	174.2	-176.7	176.4	-115.1	0	0	111.6	K313 I314 F319 V410	K313-E317 WeakPolarHBondContact O-CB 3.48Å; K313-E317 PolarHBondContact O-N 3.41Å; I314-E317 PolarHBondContact O-N 3.01Å; E317-F319 PolarHBondContact O-N 3.4Å; E317-V410 HydrophobicContact CB-CG2 4.15Å; E317-V410 HydrophobicContact CG-CG2 4.38Å; E317-V410 WeakPolarHBondContact OE1-CB 3.41Å; E317-V410 VanDerWaalsContact OE1-CG2 3.31Å; E317-V410 WeakPolarHBondContact OE1-CG2 3.32Å
318	N	90.1	Very high	87.4	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	2.9	177.4	-81	-38.4	0	0	0	115.3	G157 W158 I314 M316 S383 V386 R388 L430	G157-N318 CarbonylContact C-O 3.59Å; G157-N318 WeakPolarHBondContact CA-O 3.5Å; W158-N318 VanDerWaalsContact CD1-O 3.3Å; W158-N318 PolarHBondContact N-O 3.47Å; I314-N318 WeakPolarHBondContact O-CB 3.45Å; I314-N318 PolarHBondContact O-N 2.89Å; I314-N318 PolarHBondContact O-ND2 2.95Å; M316-N318 VanDerWaalsContact C-N 3.29Å; M316-N318 PolarHBondContact O-N 2.98Å; N318-S383 PolarHBondContact ND2-O 2.96Å; N318-V386 PolarHBondContact ND2-O 2.72Å; N318-R388 PolarHBondContact O-NH2 3.31Å; N318-R388 VanDerWaalsContact OD1-CG 3.22Å; N318-R388 WeakPolarHBondContact OD1-CG 3.33Å; N318-R388 PolarHBondContact OD1-NE 2.98Å; N318-L430 WeakPolarHBondContact ND2-CD1 3.37Å; N318-L430 WeakPolarHBondContact OD1-CD1 3.48Å
319	F	90.2	Very high	87.7	Confident	98 Å²	98	68.7 Å²	68.7	43%	0.43	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-47.2	-177.3	176.4	-122.4	0	0	0	113.5	W158 G159 M316 E317	W158-F319 AromaticContact CD2-CD2 3.97Å; W158-F319 HydrophobicContact CD2-CD2 3.97Å; W158-F319 AromaticContact CE2-CD2 3.56Å; W158-F319 HydrophobicContact CE3-CD2 4.24Å; W158-F319 AromaticContact CH2-CD2 3.79Å; W158-F319 HydrophobicContact CH2-CD2 3.79Å; W158-F319 AromaticContact CH2-CE2 3.97Å; W158-F319 HydrophobicContact CH2-CE2 3.97Å; W158-F319 HydrophobicContact CZ2-CB 4.35Å; W158-F319 AromaticContact CZ2-CD2 3.46Å; W158-F319 HydrophobicContact CZ2-CD2 3.46Å; W158-F319 VanDerWaalsContact CZ2-CD2 3.46Å; W158-F319 HydrophobicContact CZ2-CE2 4.12Å; W158-F319 HydrophobicContact CZ2-CG 4.2Å; W158-F319 HydrophobicContact CZ3-CD2 4.16Å; W158-F319 HydrophobicContact CZ3-CE2 4.23Å; G159-F319 PolarHBondContact N-O 2.97Å; M316-F319 VanDerWaalsContact O-CB 3.24Å; M316-F319 WeakPolarHBondContact O-CB 3.11Å; M316-F319 PolarHBondContact O-N 3.34Å; M316-F319 VanDerWaalsContact O-N 3.13Å; E317-F319 PolarHBondContact O-N 3.4Å
320	T	89.5	Confident	88	Confident	81 Å²	81	71.5 Å²	71.5	50%	0.497	38%	0.375	S	S	.	.	S	Bend	trans	-83.8	144.1	-172.7	45.2	0	0	0	0	112.3	R388	T320-R388 VanDerWaalsContact O-CZ 3.31Å; T320-R388 PolarHBondContact O-NH1 3.08Å; T320-R388 PolarHBondContact O-NH2 2.97Å
321	P	90.9	Very high	88.2	Confident	62 Å²	62	66.9 Å²	66.9	40%	0.403	36%	0.361	S	S	.	.			trans	-64.3	146.9	175.4	26.8	-34.9	0	0	0	112.5	A156 L160 F323	A156-P321 WeakPolarHBondContact O-CA 3.46Å; A156-P321 WeakPolarHBondContact O-CB 3.4Å; L160-P321 HydrophobicContact CD1-CB 4.08Å; L160-P321 HydrophobicContact CD1-CG 3.9Å; P321-F323 HydrophobicContact CB-CD2 4Å; P321-F323 HydrophobicContact CB-CE2 3.59Å; P321-F323 HydrophobicContact CB-CZ 4.15Å; P321-F323 HydrophobicContact CG-CE2 4.39Å
322	D	88.8	Confident	88.5	Confident	49 Å²	49	64.9 Å²	64.9	26%	0.262	35%	0.351	S	S	.	.			trans	-140.5	86.1	170.3	177.1	12.7	0	0	0	107.2	Q155 R324 R388 M431	Q155-D322 CarbonylContact O-C 3.6Å; Q155-D322 VanDerWaalsContact O-C 3.32Å; Q155-D322 PolarHBondContact O-N 2.82Å; Q155-D322 PolarHBondContact OE1-O 2.95Å; D322-R324 PolarHBondContact O-N 2.9Å; D322-R324 IonicContact OD1-NE 3.14Å; D322-R324 IonicContact OD2-CZ 2.67Å; D322-R324 VanDerWaalsContact OD2-CZ 3.24Å; D322-R324 IonicContact OD2-NE 3.31Å; D322-R324 PolarHBondContact OD2-NE 3.42Å; D322-R324 IonicContact OD2-NH2 2.73Å; D322-R324 PolarHBondContact OD2-NH2 3.31Å; D322-R388 VanDerWaalsContact CB-NH1 3.26Å; D322-M431 HydrophobicContact CB-CE 3.94Å; D322-M431 WeakPolarHBondContact O-CE 3.33Å
323	F	89.6	Confident	88.9	Confident	68 Å²	68	59.3 Å²	59.3	30%	0.298	32%	0.317	S	S	.	.			trans	-83.6	108.4	-177.5	-66.9	-72.2	0	0	0	110.1	Q155 A156 L160 P321 E327 F329 V332	Q155-F323 HydrophobicContact CB-CD1 4.33Å; A156-F323 HydrophobicContact CB-CE1 4.3Å; A156-F323 HydrophobicContact CB-CZ 4.38Å; L160-F323 HydrophobicContact CD1-CE2 4.37Å; L160-F323 HydrophobicContact CD1-CZ 4.36Å; P321-F323 HydrophobicContact CB-CD2 4Å; P321-F323 HydrophobicContact CB-CE2 3.59Å; P321-F323 HydrophobicContact CB-CZ 4.15Å; P321-F323 HydrophobicContact CG-CE2 4.39Å; F323-E327 WeakPolarHBondContact CB-O 3.46Å; F323-F329 HydrophobicContact CZ-CB 4.05Å; F323-V332 HydrophobicContact CD1-CG2 4.29Å; F323-V332 HydrophobicContact CE1-CG2 4.11Å
324	R	85.7	Confident	89.2	Confident	60 Å²	60	55.1 Å²	55.1	23%	0.226	30%	0.299	C	S	.	.			trans	-101.7	171.2	179.9	-58.7	-172	-172.7	167.8	8.7	111.5	D322 G326 E327 D389 M431	D322-R324 PolarHBondContact O-N 2.9Å; D322-R324 IonicContact OD1-NE 3.14Å; D322-R324 IonicContact OD2-CZ 2.67Å; D322-R324 VanDerWaalsContact OD2-CZ 3.24Å; D322-R324 IonicContact OD2-NE 3.31Å; D322-R324 PolarHBondContact OD2-NE 3.42Å; D322-R324 IonicContact OD2-NH2 2.73Å; D322-R324 PolarHBondContact OD2-NH2 3.31Å; R324-G326 PolarHBondContact O-N 3.49Å; R324-E327 WeakPolarHBondContact O-CB 3.27Å; R324-E327 PolarHBondContact O-N 2.92Å; R324-D389 IonicContact CZ-OD1 2.62Å; R324-D389 IonicContact CZ-OD2 2.82Å; R324-D389 VanDerWaalsContact CZ-OD2 3.28Å; R324-D389 IonicContact NH1-OD1 3.76Å; R324-D389 PolarHBondContact NH1-OD1 2.96Å; R324-D389 IonicContact NH1-OD2 2.69Å; R324-D389 PolarHBondContact NH1-OD2 3.39Å; R324-D389 IonicContact NH2-OD2 3.26Å; R324-D389 PolarHBondContact NH2-OD2 3.24Å; R324-M431 HydrophobicContact CG-CE 3.87Å; R324-M431 PolarHBondContact NH2-SD 3.21Å
325	N	81.1	Confident	89.5	Confident	162 Å²	162	55.3 Å²	55.3	87%	0.866	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.7	19.5	174.2	-57.3	-17	0	0	0	116.2
326	G	81.7	Confident	89.7	Confident	74 Å²	74	52.5 Å²	52.5	76%	0.763	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	8.7	-177	0	0	0	0	0	114.6	R324	R324-G326 PolarHBondContact O-N 3.49Å
327	E	89.8	Confident	90	Very high	43 Å²	43	46.1 Å²	46.1	20%	0.201	26%	0.256	C	S	.	.			trans	-66.5	160.9	173.6	-70.8	-66.8	171.3	0	0	112.6	W151 F323 R324 S331 V332	W151-E327 HydrophobicContact CH2-CG 3.96Å; W151-E327 HydrophobicContact CZ2-CG 3.93Å; F323-E327 WeakPolarHBondContact CB-O 3.46Å; R324-E327 WeakPolarHBondContact O-CB 3.27Å; R324-E327 PolarHBondContact O-N 2.92Å; E327-S331 WeakPolarHBondContact OE2-CB 3.45Å; E327-S331 PolarHBondContact OE2-OG 3.27Å; E327-V332 HydrophobicContact CB-CG2 4.21Å
328	T	92.8	Very high	90.3	Very high	72 Å²	72	44.1 Å²	44.1	44%	0.442	25%	0.246	S	C	.	.			trans	-144.3	167.1	-179.8	66.1	0	0	0	0	110	F330 S331 V332	T328-F330 PolarHBondContact O-N 2.9Å; T328-F330 VanDerWaalsContact O-N 3.16Å; T328-F330 PolarHBondContact OG1-N 3.15Å; T328-S331 PolarHBondContact N-OG 3.44Å; T328-S331 PolarHBondContact O-N 3.03Å; T328-S331 PolarHBondContact O-OG 2.91Å; T328-S331 VanDerWaalsContact O-OG 3.12Å; T328-S331 PolarHBondContact OG1-N 3.02Å; T328-S331 PolarHBondContact OG1-OG 3.27Å; T328-S331 VanDerWaalsContact OG1-OG 3.05Å; T328-V332 WeakPolarHBondContact O-CB 3.48Å; T328-V332 WeakPolarHBondContact O-CG2 3.46Å; T328-V332 PolarHBondContact O-N 3.4Å
329	F	92.6	Very high	90.4	Very high	41 Å²	41	44.2 Å²	44.2	18%	0.18	25%	0.247	C	C	.	.	H	α-helix	trans	-51.4	-39.7	173.6	179.1	-92.3	0	0	0	113.1	L160 V163 V164 F323 F333	L160-F329 HydrophobicContact CB-CD2 4.2Å; L160-F329 HydrophobicContact CB-CE2 4.18Å; L160-F329 HydrophobicContact CD1-CD2 4.24Å; V163-F329 HydrophobicContact CB-CE2 4.31Å; V163-F329 HydrophobicContact CB-CZ 4.41Å; V163-F329 HydrophobicContact CG1-CE2 4.33Å; V163-F329 HydrophobicContact CG1-CZ 4Å; V164-F329 HydrophobicContact CG2-CD2 4.12Å; V164-F329 HydrophobicContact CG2-CE2 3.55Å; V164-F329 HydrophobicContact CG2-CZ 3.91Å; F323-F329 HydrophobicContact CZ-CB 4.05Å; F329-F333 VanDerWaalsContact O-CB 3.26Å; F329-F333 WeakPolarHBondContact O-CB 3.38Å; F329-F333 PolarHBondContact O-N 2.95Å
330	F	91.4	Very high	90.5	Very high	70 Å²	70	40 Å²	40	31%	0.307	23%	0.231	S	C	.	.	H	α-helix	trans	-84	-27.8	-176.1	-77.8	-78.6	0	0	0	114.3	T328 A334 V573	T328-F330 PolarHBondContact O-N 2.9Å; T328-F330 VanDerWaalsContact O-N 3.16Å; T328-F330 PolarHBondContact OG1-N 3.15Å; F330-A334 WeakPolarHBondContact O-CB 3.39Å; F330-A334 PolarHBondContact O-N 3.32Å; F330-V573 HydrophobicContact CB-CG1 4.05Å; F330-V573 HydrophobicContact CD1-CB 4.28Å; F330-V573 HydrophobicContact CD1-CG1 3.74Å; F330-V573 HydrophobicContact CD2-CG1 3.44Å; F330-V573 VanDerWaalsContact CD2-CG1 3.44Å; F330-V573 HydrophobicContact CE1-CB 4.41Å; F330-V573 HydrophobicContact CE1-CG1 4.01Å; F330-V573 HydrophobicContact CE2-CG1 3.73Å; F330-V573 HydrophobicContact CG-CB 4.43Å; F330-V573 HydrophobicContact CG-CG1 3.45Å; F330-V573 VanDerWaalsContact CG-CG1 3.45Å; F330-V573 HydrophobicContact CZ-CG1 4Å
331	S	91.1	Very high	90.6	Very high	34 Å²	34	36.2 Å²	36.2	24%	0.238	21%	0.207	C	C	.	.	H	α-helix	trans	-73.7	-41.7	170.5	55.5	0	0	0	0	111.4	E327 T328 F333 A334 I335	E327-S331 WeakPolarHBondContact OE2-CB 3.45Å; E327-S331 PolarHBondContact OE2-OG 3.27Å; T328-S331 PolarHBondContact N-OG 3.44Å; T328-S331 PolarHBondContact O-N 3.03Å; T328-S331 PolarHBondContact O-OG 2.91Å; T328-S331 VanDerWaalsContact O-OG 3.12Å; T328-S331 PolarHBondContact OG1-N 3.02Å; T328-S331 PolarHBondContact OG1-OG 3.27Å; T328-S331 VanDerWaalsContact OG1-OG 3.05Å; S331-F333 VanDerWaalsContact C-N 3.32Å; S331-F333 PolarHBondContact O-N 2.91Å; S331-A334 WeakPolarHBondContact O-CA 3.5Å; S331-A334 WeakPolarHBondContact O-CB 3.39Å; S331-A334 PolarHBondContact O-N 3.26Å; S331-I335 WeakPolarHBondContact O-CG1 3.32Å; S331-I335 PolarHBondContact O-N 3.16Å
332	V	92.6	Very high	90.5	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60.8	-41	171	172.7	0	0	0	0	111	W151 V152 Q155 F323 E327 T328 I335 F336	W151-V332 HydrophobicContact CH2-CG2 4.17Å; W151-V332 HydrophobicContact CZ3-CG2 4.18Å; V152-V332 HydrophobicContact CB-CG1 4.23Å; V152-V332 HydrophobicContact CG1-CG1 3.82Å; V152-V332 HydrophobicContact CG2-CG1 4.14Å; Q155-V332 HydrophobicContact CB-CG2 4.14Å; F323-V332 HydrophobicContact CD1-CG2 4.29Å; F323-V332 HydrophobicContact CE1-CG2 4.11Å; E327-V332 HydrophobicContact CB-CG2 4.21Å; T328-V332 WeakPolarHBondContact O-CB 3.48Å; T328-V332 WeakPolarHBondContact O-CG2 3.46Å; T328-V332 PolarHBondContact O-N 3.4Å; V332-I335 PolarHBondContact O-N 2.97Å; V332-F336 WeakPolarHBondContact O-CB 3.27Å; V332-F336 PolarHBondContact O-N 3.26Å
333	F	93.8	Very high	90.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-61	-42.6	169.8	176.3	-84.2	0	0	0	112.3	V164 L167 S168 F329 S331 I335 F336 F337 V570 I574	V164-F333 HydrophobicContact CG1-CB 4.43Å; V164-F333 HydrophobicContact CG1-CD2 4.11Å; L167-F333 HydrophobicContact CB-CE2 3.96Å; L167-F333 HydrophobicContact CD2-CD2 3.92Å; L167-F333 HydrophobicContact CD2-CE2 3.62Å; L167-F333 HydrophobicContact CD2-CZ 4.2Å; L167-F333 HydrophobicContact CG-CD2 4.36Å; L167-F333 HydrophobicContact CG-CE2 3.63Å; L167-F333 HydrophobicContact CG-CZ 4.18Å; S168-F333 VanDerWaalsContact OG-CE2 3.3Å; S168-F333 WeakPolarHBondContact OG-CE2 3.32Å; F329-F333 VanDerWaalsContact O-CB 3.26Å; F329-F333 WeakPolarHBondContact O-CB 3.38Å; F329-F333 PolarHBondContact O-N 2.95Å; S331-F333 VanDerWaalsContact C-N 3.32Å; S331-F333 PolarHBondContact O-N 2.91Å; F333-I335 VanDerWaalsContact C-N 3.29Å; F333-I335 PolarHBondContact O-N 3.1Å; F333-F336 PolarHBondContact O-N 3.21Å; F333-F337 HydrophobicContact CD1-CB 4.35Å; F333-F337 HydrophobicContact CE1-CB 3.9Å; F333-F337 AromaticContact CE1-CD2 3.91Å; F333-F337 HydrophobicContact CE1-CD2 3.91Å; F333-F337 HydrophobicContact CE1-CG 4.07Å; F333-F337 HydrophobicContact CE2-CD2 4.4Å; F333-F337 HydrophobicContact CZ-CB 4.17Å; F333-F337 AromaticContact CZ-CD2 3.54Å; F333-F337 HydrophobicContact CZ-CD2 3.54Å; F333-F337 HydrophobicContact CZ-CE2 4.31Å; F333-F337 HydrophobicContact CZ-CG 4.15Å; F333-F337 VanDerWaalsContact O-CB 3.32Å; F333-F337 WeakPolarHBondContact O-CB 3.35Å; F333-F337 PolarHBondContact O-N 2.73Å; F333-V570 HydrophobicContact CD1-CG1 4.02Å; F333-V570 HydrophobicContact CE1-CG1 3.38Å; F333-V570 HydrophobicContact CZ-CG1 3.99Å; F333-I574 HydrophobicContact CD1-CD1 3.94Å; F333-I574 HydrophobicContact CE1-CD1 4.09Å
334	A	92.2	Very high	90.6	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-65.9	-29.4	180	0	0	0	0	0	113.5	F330 S331 P520 S523 I574	F330-A334 WeakPolarHBondContact O-CB 3.39Å; F330-A334 PolarHBondContact O-N 3.32Å; S331-A334 WeakPolarHBondContact O-CA 3.5Å; S331-A334 WeakPolarHBondContact O-CB 3.39Å; S331-A334 PolarHBondContact O-N 3.26Å; A334-P520 HydrophobicContact CB-CB 3.99Å; A334-P520 HydrophobicContact CB-CG 4.05Å; A334-S523 PolarHBondContact O-OG 3.47Å; A334-I574 HydrophobicContact CB-CB 4.43Å; A334-I574 HydrophobicContact CB-CD1 3.97Å; A334-I574 HydrophobicContact CB-CG1 3.99Å; A334-I574 HydrophobicContact CB-CG2 3.58Å
335	I	92.4	Very high	90.5	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.015	17%	0.165	C	C	.	.	H	α-helix	trans	-77.1	-37.6	172.4	-66.7	165	0	0	0	111	M144 W151 S331 V332 F333 P338 N516 P520	M144-I335 WeakPolarHBondContact CE-O 3.47Å; W151-I335 HydrophobicContact CH2-CD1 3.65Å; W151-I335 HydrophobicContact CZ3-CB 4.46Å; W151-I335 HydrophobicContact CZ3-CD1 3.76Å; W151-I335 HydrophobicContact CZ3-CG2 4.17Å; S331-I335 WeakPolarHBondContact O-CG1 3.32Å; S331-I335 PolarHBondContact O-N 3.16Å; V332-I335 PolarHBondContact O-N 2.97Å; F333-I335 VanDerWaalsContact C-N 3.29Å; F333-I335 PolarHBondContact O-N 3.1Å; I335-P338 WeakPolarHBondContact O-CD 3.48Å; I335-N516 HydrophobicContact CD1-CB 4.23Å; I335-P520 HydrophobicContact CG1-CG 4.41Å
336	F	93.9	Very high	90.6	Very high	6 Å²	6	18.7 Å²	18.7	3%	0.026	12%	0.123	C	C	.	.	H	α-helix	trans	-74.3	-41.3	177.5	178.7	-98.5	0	0	0	113.8	L149 V152 V164 I165 S168 V332 F333 P338 A339 Y375	L149-F336 HydrophobicContact CD1-CD2 4.33Å; L149-F336 HydrophobicContact CD1-CE2 3.82Å; V152-F336 HydrophobicContact CG2-CB 4.22Å; V164-F336 HydrophobicContact CG1-CB 3.76Å; V164-F336 HydrophobicContact CG1-CD1 3.6Å; V164-F336 HydrophobicContact CG1-CE1 4.48Å; V164-F336 HydrophobicContact CG1-CG 3.78Å; I165-F336 HydrophobicContact CG1-CE1 4.12Å; I165-F336 HydrophobicContact CG1-CE2 4.33Å; I165-F336 HydrophobicContact CG1-CZ 3.81Å; S168-F336 WeakPolarHBondContact OG-CD1 2.99Å; V332-F336 WeakPolarHBondContact O-CB 3.27Å; V332-F336 PolarHBondContact O-N 3.26Å; F333-F336 PolarHBondContact O-N 3.21Å; F336-P338 VanDerWaalsContact C-N 3.32Å; F336-P338 WeakPolarHBondContact O-CD 3.25Å; F336-A339 HydrophobicContact CD2-CB 4.23Å; F336-A339 HydrophobicContact CE2-CB 3.94Å; F336-A339 HydrophobicContact CZ-CB 4.2Å; F336-A339 WeakPolarHBondContact O-CB 3.49Å; F336-A339 PolarHBondContact O-N 3.22Å; F336-Y375 HydrophobicContact CE2-CD1 4.27Å; F336-Y375 HydrophobicContact CZ-CG 4.37Å
337	F	93.8	Very high	90.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-52	-33.5	-169	-178.6	-97.6	0	0	0	116.1	V171 F333 A339 A340 T341 F526 L527 Y530	V171-F337 HydrophobicContact CB-CE2 4.34Å; V171-F337 HydrophobicContact CG1-CE2 3.84Å; V171-F337 HydrophobicContact CG1-CZ 4.06Å; F333-F337 HydrophobicContact CD1-CB 4.35Å; F333-F337 HydrophobicContact CE1-CB 3.9Å; F333-F337 AromaticContact CE1-CD2 3.91Å; F333-F337 HydrophobicContact CE1-CD2 3.91Å; F333-F337 HydrophobicContact CE1-CG 4.07Å; F333-F337 HydrophobicContact CE2-CD2 4.4Å; F333-F337 HydrophobicContact CZ-CB 4.17Å; F333-F337 AromaticContact CZ-CD2 3.54Å; F333-F337 HydrophobicContact CZ-CD2 3.54Å; F333-F337 HydrophobicContact CZ-CE2 4.31Å; F333-F337 HydrophobicContact CZ-CG 4.15Å; F333-F337 VanDerWaalsContact O-CB 3.32Å; F333-F337 WeakPolarHBondContact O-CB 3.35Å; F333-F337 PolarHBondContact O-N 2.73Å; F337-A339 PolarHBondContact O-N 3.34Å; F337-A339 VanDerWaalsContact O-N 3.14Å; F337-A340 PolarHBondContact O-N 3.48Å; F337-T341 HydrophobicContact CD1-CG2 4.13Å; F337-T341 HydrophobicContact CE1-CG2 3.85Å; F337-F526 HydrophobicContact CE1-CB 4.12Å; F337-L527 HydrophobicContact CD1-CG 4.26Å; F337-L527 HydrophobicContact CE1-CD2 3.9Å; F337-L527 HydrophobicContact CE1-CG 3.72Å; F337-L527 HydrophobicContact CE2-CD2 3.88Å; F337-L527 HydrophobicContact CZ-CD2 3.49Å; F337-L527 VanDerWaalsContact CZ-CD2 3.49Å; F337-L527 HydrophobicContact CZ-CG 3.88Å; F337-Y530 HydrophobicContact CZ-CD2 4.08Å; F337-Y530 HydrophobicContact CZ-CE2 4Å
338	P	92.5	Very high	90.6	Very high	2 Å²	2	15.1 Å²	15.1	1%	0.013	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-56.9	-28.7	173.4	-25.3	37.7	0	0	0	113.3	M223 I335 F336 A340 T341 A519 I522 S523	M223-P338 HydrophobicContact CE-CB 3.85Å; M223-P338 HydrophobicContact SD-CB 3.65Å; M223-P338 HydrophobicContact SD-CG 4.06Å; I335-P338 WeakPolarHBondContact O-CD 3.48Å; F336-P338 VanDerWaalsContact C-N 3.32Å; F336-P338 WeakPolarHBondContact O-CD 3.25Å; P338-A340 PolarHBondContact O-N 3.34Å; P338-T341 PolarHBondContact O-N 3.31Å; P338-T341 VanDerWaalsContact O-N 3.08Å; P338-T341 PolarHBondContact O-OG1 3.4Å; P338-A519 HydrophobicContact CG-CB 4.14Å; P338-I522 HydrophobicContact CB-CG2 4.19Å; P338-I522 HydrophobicContact CG-CG2 4.17Å; P338-S523 VanDerWaalsContact CD-OG 3.26Å; P338-S523 WeakPolarHBondContact CD-OG 3.36Å; P338-S523 WeakPolarHBondContact CG-OG 3.27Å
339	A	91.5	Very high	89.9	Confident	2 Å²	2	12.5 Å²	12.5	2%	0.017	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-65.8	-11.8	174.3	0	0	0	0	0	114.4	I140 M144 F336 F337 Y375	I140-A339 WeakPolarHBondContact CG2-O 3.4Å; M144-A339 HydrophobicContact CB-CB 3.65Å; M144-A339 HydrophobicContact CG-CB 4.09Å; F336-A339 HydrophobicContact CD2-CB 4.23Å; F336-A339 HydrophobicContact CE2-CB 3.94Å; F336-A339 HydrophobicContact CZ-CB 4.2Å; F336-A339 WeakPolarHBondContact O-CB 3.49Å; F336-A339 PolarHBondContact O-N 3.22Å; F337-A339 PolarHBondContact O-N 3.34Å; F337-A339 VanDerWaalsContact O-N 3.14Å; A339-Y375 HydrophobicContact CB-CE1 4.3Å; A339-Y375 WeakPolarHBondContact O-CE2 3.36Å; A339-Y375 PolarHBondContact O-OH 2.94Å
340	A	92.4	Very high	89.3	Confident	10 Å²	10	10.7 Å²	10.7	8%	0.083	6%	0.064	C	C	.	.	G	3₁₀ helix	trans	-107.1	-3	174.2	0	0	0	0	0	112.7	T172 F337 P338	T172-A340 HydrophobicContact CG2-CB 3.99Å; T172-A340 WeakPolarHBondContact CG2-O 3.37Å; F337-A340 PolarHBondContact O-N 3.48Å; P338-A340 PolarHBondContact O-N 3.34Å
341	T	91.6	Very high	88.4	Confident	1 Å²	1	8.3 Å²	8.3	1%	0.006	6%	0.059	C	C	.	.			trans	-77.3	-166.5	178.7	69.2	0	0	0	0	111.6	I140 F337 P338 I343 F526 Y530	I140-T341 WeakPolarHBondContact CG1-O 3.34Å; F337-T341 HydrophobicContact CD1-CG2 4.13Å; F337-T341 HydrophobicContact CE1-CG2 3.85Å; P338-T341 PolarHBondContact O-N 3.31Å; P338-T341 VanDerWaalsContact O-N 3.08Å; P338-T341 PolarHBondContact O-OG1 3.4Å; T341-I343 VanDerWaalsContact C-N 3.26Å; T341-I343 PolarHBondContact O-N 2.98Å; T341-F526 HydrophobicContact CG2-CB 3.84Å; T341-F526 HydrophobicContact CG2-CD1 4.43Å; T341-F526 HydrophobicContact CG2-CD2 3.69Å; T341-F526 HydrophobicContact CG2-CE2 4.33Å; T341-F526 HydrophobicContact CG2-CG 3.74Å; T341-Y530 WeakPolarHBondContact CA-OH 3.43Å
342	G	88.7	Confident	87.8	Confident	15 Å²	15	10.4 Å²	10.4	16%	0.155	7%	0.067	C	C	.	.			trans	78.1	-4.5	-179.7	0	0	0	0	0	116.1	L344 A345	G342-L344 PolarHBondContact O-N 3.47Å; G342-A345 WeakPolarHBondContact O-CB 3.33Å; G342-A345 PolarHBondContact O-N 3.21Å
343	I	92.7	Very high	87.3	Confident	4 Å²	4	10.5 Å²	10.5	2%	0.021	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-19.2	-179	68.1	174.6	0	0	0	115.3	I140 T172 T175 T341 T364 I368 Y530	I140-I343 HydrophobicContact CD1-CG2 4.37Å; I140-I343 HydrophobicContact CG1-CG2 4.46Å; T172-I343 HydrophobicContact CG2-CD1 4.49Å; T172-I343 HydrophobicContact CG2-CG2 4.41Å; T175-I343 HydrophobicContact CG2-CD1 4.15Å; T341-I343 VanDerWaalsContact C-N 3.26Å; T341-I343 PolarHBondContact O-N 2.98Å; I343-T364 HydrophobicContact CB-CG2 4.04Å; I343-T364 VanDerWaalsContact O-CG2 3.31Å; I343-T364 WeakPolarHBondContact O-CG2 3.49Å; I343-T364 PolarHBondContact O-OG1 3.43Å; I343-I368 HydrophobicContact CB-CD1 4.25Å; I343-I368 HydrophobicContact CG2-CD1 3.79Å; I343-I368 HydrophobicContact CG2-CG1 3.67Å; I343-Y530 HydrophobicContact CD1-CE2 4.42Å
344	L	87.6	Confident	86.6	Confident	3 Å²	3	20.6 Å²	20.6	2%	0.016	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-5.6	177.3	-70.2	168.4	0	0	0	113.7	M179 F213 G342 G346 A347 N348 Y530 I533	M179-L344 HydrophobicContact CG-CD2 3.78Å; M179-L344 HydrophobicContact SD-CD2 3.52Å; M179-L344 VanDerWaalsContact SD-CD2 3.52Å; F213-L344 HydrophobicContact CD2-CD1 3.91Å; F213-L344 HydrophobicContact CE2-CB 4.05Å; F213-L344 HydrophobicContact CE2-CD1 3.43Å; F213-L344 VanDerWaalsContact CE2-CD1 3.43Å; F213-L344 HydrophobicContact CE2-CG 4.36Å; F213-L344 HydrophobicContact CZ-CB 3.72Å; F213-L344 HydrophobicContact CZ-CD1 3.8Å; F213-L344 HydrophobicContact CZ-CG 4.41Å; G342-L344 PolarHBondContact O-N 3.47Å; L344-G346 VanDerWaalsContact C-N 3.3Å; L344-G346 PolarHBondContact O-N 3.47Å; L344-A347 WeakPolarHBondContact O-CB 3.47Å; L344-A347 PolarHBondContact O-N 2.79Å; L344-N348 PolarHBondContact O-N 3.02Å; L344-N348 VanDerWaalsContact O-N 3.1Å; L344-Y530 HydrophobicContact CD1-CE1 4.18Å; L344-I533 HydrophobicContact CD1-CD1 4.03Å
345	A	85.6	Confident	86.2	Confident	12 Å²	12	24.3 Å²	24.3	10%	0.099	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-37.9	-177.1	0	0	0	0	0	113.3	N139 G342 N348	N139-A345 HydrophobicContact CB-CB 3.97Å; G342-A345 WeakPolarHBondContact O-CB 3.33Å; G342-A345 PolarHBondContact O-N 3.21Å; A345-N348 PolarHBondContact O-N 2.92Å
346	G	83.1	Confident	85.9	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-27.5	174.2	0	0	0	0	0	114.3	C136 L344	C136-G346 PolarHBondContact SG-N 3.04Å; C136-G346 VanDerWaalsContact SG-N 3.41Å; L344-G346 VanDerWaalsContact C-N 3.3Å; L344-G346 PolarHBondContact O-N 3.47Å
347	A	86	Confident	85.6	Confident	1 Å²	1	28 Å²	28	1%	0.008	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-26	175	0	0	0	0	0	112.4	M179 G192 A193 L196 L344 I349 S350 I360	M179-A347 HydrophobicContact CE-CB 4.14Å; G192-A347 CarbonylContact C-O 3.55Å; G192-A347 VanDerWaalsContact C-O 3.26Å; G192-A347 WeakPolarHBondContact CA-O 3.12Å; A193-A347 HydrophobicContact CB-CB 3.9Å; A193-A347 PolarHBondContact N-O 3.27Å; A193-A347 VanDerWaalsContact N-O 3.12Å; L196-A347 HydrophobicContact CD1-CB 4.35Å; L344-A347 WeakPolarHBondContact O-CB 3.47Å; L344-A347 PolarHBondContact O-N 2.79Å; A347-I349 PolarHBondContact O-N 3.26Å; A347-S350 WeakPolarHBondContact O-CB 3.35Å; A347-S350 PolarHBondContact O-N 3Å; A347-I360 HydrophobicContact CB-CD1 4.31Å; A347-I360 HydrophobicContact CB-CG2 4.35Å
348	N	83.9	Confident	85.2	Confident	40 Å²	40	29.6 Å²	29.6	21%	0.214	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.5	177.5	-81.4	-19.1	0	0	0	114.1	G192 A193 L344 A345 S465	G192-N348 VanDerWaalsContact CA-O 3.22Å; G192-N348 WeakPolarHBondContact CA-O 3.27Å; A193-N348 VanDerWaalsContact CB-OD1 3.24Å; A193-N348 WeakPolarHBondContact CB-OD1 3.37Å; L344-N348 PolarHBondContact O-N 3.02Å; L344-N348 VanDerWaalsContact O-N 3.1Å; A345-N348 PolarHBondContact O-N 2.92Å; N348-S465 PolarHBondContact ND2-OG 3.4Å
349	I	78.3	Confident	85.1	Confident	18 Å²	18	29.8 Å²	29.8	9%	0.092	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.4	32.7	175.2	62.8	159.4	0	0	0	113.7	F126 A347 G351 D352	F126-I349 HydrophobicContact CD2-CD1 4.39Å; A347-I349 PolarHBondContact O-N 3.26Å; I349-G351 PolarHBondContact O-N 3.22Å; I349-D352 HydrophobicContact CB-CB 4.37Å; I349-D352 PolarHBondContact O-N 3.08Å
350	S	79.6	Confident	85.1	Confident	3 Å²	3	29.8 Å²	29.8	2%	0.021	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-24.8	-179.6	60.5	0	0	0	0	115.3	G192 A347	G192-S350 VanDerWaalsContact CA-OG 3.29Å; G192-S350 WeakPolarHBondContact CA-OG 3.33Å; G192-S350 PolarHBondContact N-OG 3.25Å; G192-S350 PolarHBondContact O-OG 3.29Å; A347-S350 WeakPolarHBondContact O-CB 3.35Å; A347-S350 PolarHBondContact O-N 3Å
351	G	73.6	Confident	85.1	Confident	20 Å²	20	29.6 Å²	29.6	21%	0.206	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-30.5	175.4	0	0	0	0	0	115.1	K125 I349 L353	K125-G351 WeakPolarHBondContact CE-O 3.2Å; K125-G351 PolarHBondContact NZ-O 3.38Å; I349-G351 PolarHBondContact O-N 3.22Å; G351-L353 VanDerWaalsContact C-N 3.35Å
352	D	77.3	Confident	85.2	Confident	77 Å²	77	35.6 Å²	35.6	41%	0.412	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-7.1	-173.6	-52.4	-46.8	0	0	0	112.2	K125 F126 I349	K125-D352 CarbonylContact C-O 3.58Å; K125-D352 VanDerWaalsContact CA-O 3.23Å; K125-D352 WeakPolarHBondContact CA-O 3.38Å; K125-D352 WeakPolarHBondContact CB-O 3.49Å; F126-D352 HydrophobicContact CD2-CB 4Å; F126-D352 HydrophobicContact CE2-CB 4.33Å; F126-D352 PolarHBondContact N-O 3.11Å; I349-D352 HydrophobicContact CB-CB 4.37Å; I349-D352 PolarHBondContact O-N 3.08Å
353	L	82.3	Confident	85.4	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-77.1	146	175	-60.2	175.4	0	0	0	111.4	K125 F126 V132 G351 A356 A359 I360	K125-L353 WeakPolarHBondContact CD-O 3.19Å; K125-L353 PolarHBondContact NZ-O 3.12Å; F126-L353 HydrophobicContact CB-CD2 4.39Å; F126-L353 WeakPolarHBondContact O-CA 3.45Å; V132-L353 HydrophobicContact CG2-CD1 3.66Å; V132-L353 HydrophobicContact CG2-CD2 3.88Å; V132-L353 HydrophobicContact CG2-CG 4.46Å; G351-L353 VanDerWaalsContact C-N 3.35Å; L353-A356 HydrophobicContact CB-CB 4.28Å; L353-A356 HydrophobicContact CD1-CB 4Å; L353-A359 HydrophobicContact CD1-CB 4.21Å; L353-I360 HydrophobicContact CD1-CD1 4.18Å; L353-I360 HydrophobicContact CD1-CG1 3.82Å
354	R	80.3	Confident	85.5	Confident	212 Å²	212	35 Å²	35	80%	0.8	18%	0.176	S	C	*	.	S	Bend	trans	-63.4	-42.7	172.8	-180	176.5	174.2	178.8	-1.7	111.6	K125 F126	K125-R354 HydrophobicContact CB-CB 4.33Å; F126-R354 PolarHBondContact O-N 3.38Å
355	D	83.7	Confident	85.9	Confident	79 Å²	79	36.4 Å²	36.4	42%	0.422	18%	0.184	S	C	.	.			trans	-143.7	119	172.9	161.1	11	0	0	0	105.6	Q357 A358 A359	D355-Q357 PolarHBondContact OD1-N 3.22Å; D355-A358 PolarHBondContact OD1-N 3.49Å; D355-A358 WeakPolarHBondContact OD2-CB 3.32Å; D355-A359 WeakPolarHBondContact O-CB 3.36Å
356	A	85.3	Confident	86.3	Confident	7 Å²	7	39 Å²	39	6%	0.058	20%	0.195	C	C	.	.	H	α-helix	trans	-89.3	-27.1	179.4	0	0	0	0	0	113	V188 L353 I360	V188-A356 HydrophobicContact CB-CB 3.98Å; V188-A356 HydrophobicContact CG1-CB 3.55Å; V188-A356 HydrophobicContact CG2-CB 4.42Å; L353-A356 HydrophobicContact CB-CB 4.28Å; L353-A356 HydrophobicContact CD1-CB 4Å; A356-I360 HydrophobicContact CB-CD1 4.05Å; A356-I360 WeakPolarHBondContact O-CG1 3.43Å; A356-I360 PolarHBondContact O-N 3.18Å; A356-I360 VanDerWaalsContact O-N 3.16Å
357	Q	87	Confident	86.9	Confident	79 Å²	79	39 Å²	39	37%	0.369	20%	0.195	S	C	.	.	H	α-helix	trans	-67	-45.2	-176.5	-68.7	-179.4	-28	0	0	111	C183 G186 V188 D355 P361	C183-Q357 WeakPolarHBondContact O-CG 3.43Å; G186-Q357 PolarHBondContact O-NE2 3.31Å; V188-Q357 HydrophobicContact CG2-CG 3.83Å; D355-Q357 PolarHBondContact OD1-N 3.22Å; Q357-P361 WeakPolarHBondContact O-CD 3.34Å; Q357-P361 WeakPolarHBondContact O-CG 3.17Å
358	A	86.9	Confident	87.3	Confident	35 Å²	35	39.2 Å²	39.2	29%	0.289	20%	0.196	S	C	.	.	H	α-helix	trans	-86.8	-26.3	176.6	0	0	0	0	0	113.4	D355 K362	D355-A358 PolarHBondContact OD1-N 3.49Å; D355-A358 WeakPolarHBondContact OD2-CB 3.32Å; A358-K362 WeakPolarHBondContact O-CD 3.22Å; A358-K362 VanDerWaalsContact O-CG 3.27Å; A358-K362 WeakPolarHBondContact O-CG 3.48Å
359	A	90.3	Very high	87.9	Confident	5 Å²	5	42.2 Å²	42.2	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-74.7	-44.4	-176.5	0	0	0	0	0	113.7	W128 V132 L353 D355 G363	W128-A359 HydrophobicContact CB-CB 3.46Å; W128-A359 VanDerWaalsContact CB-CB 3.46Å; V132-A359 HydrophobicContact CG2-CB 3.96Å; L353-A359 HydrophobicContact CD1-CB 4.21Å; D355-A359 WeakPolarHBondContact O-CB 3.36Å; A359-G363 PolarHBondContact O-N 2.93Å
360	I	91.4	Very high	88.7	Confident	2 Å²	2	44 Å²	44	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-65	-49.7	-173.3	-63.3	166.7	0	0	0	111.4	V132 C183 L196 A347 L353 A356 K362 G363 T364	V132-I360 HydrophobicContact CG2-CG1 4.19Å; C183-I360 HydrophobicContact CB-CB 4.45Å; L196-I360 HydrophobicContact CD1-CD1 4.18Å; A347-I360 HydrophobicContact CB-CD1 4.31Å; A347-I360 HydrophobicContact CB-CG2 4.35Å; L353-I360 HydrophobicContact CD1-CD1 4.18Å; L353-I360 HydrophobicContact CD1-CG1 3.82Å; A356-I360 HydrophobicContact CB-CD1 4.05Å; A356-I360 WeakPolarHBondContact O-CG1 3.43Å; A356-I360 PolarHBondContact O-N 3.18Å; A356-I360 VanDerWaalsContact O-N 3.16Å; I360-K362 PolarHBondContact O-N 3.11Å; I360-G363 PolarHBondContact O-N 3.43Å; I360-T364 WeakPolarHBondContact O-CB 3.5Å; I360-T364 PolarHBondContact O-N 3.27Å
361	P	93.1	Very high	89.4	Confident	6 Å²	6	44.1 Å²	44.1	4%	0.039	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-43.6	178.1	-24.7	35.6	0	0	0	113.1	S180 Q357 L365 Y552	S180-P361 WeakPolarHBondContact OG-CA 3.31Å; S180-P361 WeakPolarHBondContact OG-CB 3.45Å; Q357-P361 WeakPolarHBondContact O-CD 3.34Å; Q357-P361 WeakPolarHBondContact O-CG 3.17Å; P361-L365 WeakPolarHBondContact O-CB 3.34Å; P361-L365 WeakPolarHBondContact O-CG 3.38Å; P361-L365 PolarHBondContact O-N 2.69Å; P361-Y552 HydrophobicContact CB-CD2 4.1Å; P361-Y552 HydrophobicContact CB-CE2 3.6Å; P361-Y552 HydrophobicContact CG-CD2 4.27Å; P361-Y552 HydrophobicContact CG-CE2 4.27Å
362	K	92.4	Very high	90.3	Very high	128 Å²	128	43.5 Å²	43.5	56%	0.557	22%	0.216	S	C	*	.	H	α-helix	trans	-65.9	-48.2	-179.7	-69.8	178.2	-175.6	176.9	0	111.8	W128 A358 I360 L366	W128-K362 HydrophobicContact CE3-CB 4.3Å; A358-K362 WeakPolarHBondContact O-CD 3.22Å; A358-K362 VanDerWaalsContact O-CG 3.27Å; A358-K362 WeakPolarHBondContact O-CG 3.48Å; I360-K362 PolarHBondContact O-N 3.11Å; K362-L366 WeakPolarHBondContact O-CB 3.39Å; K362-L366 PolarHBondContact O-N 3.39Å
363	G	93.7	Very high	91.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-72.5	-41.7	-176.6	0	0	0	0	0	113.5	L133 A359 I360 A367	L133-G363 WeakPolarHBondContact CD1-O 3.26Å; A359-G363 PolarHBondContact O-N 2.93Å; I360-G363 PolarHBondContact O-N 3.43Å; G363-A367 WeakPolarHBondContact O-CB 3.45Å; G363-A367 PolarHBondContact O-N 2.95Å
364	T	94.6	Very high	91.7	Very high	5 Å²	5	45.7 Å²	45.7	3%	0.031	23%	0.227	C	C	.	.	H	α-helix	trans	-71.9	-45.2	-178.7	-71.2	0	0	0	0	112.3	C136 I343 I360 A367 I368	C136-T364 PolarHBondContact SG-OG1 3.49Å; C136-T364 VanDerWaalsContact SG-OG1 3.36Å; I343-T364 HydrophobicContact CB-CG2 4.04Å; I343-T364 VanDerWaalsContact O-CG2 3.31Å; I343-T364 WeakPolarHBondContact O-CG2 3.49Å; I343-T364 PolarHBondContact O-OG1 3.43Å; I360-T364 WeakPolarHBondContact O-CB 3.5Å; I360-T364 PolarHBondContact O-N 3.27Å; T364-A367 PolarHBondContact O-N 2.88Å; T364-I368 HydrophobicContact CG2-CD1 3.93Å; T364-I368 WeakPolarHBondContact O-CG1 3.17Å; T364-I368 PolarHBondContact O-N 3.47Å
365	L	94.7	Very high	92.4	Very high	34 Å²	34	35.9 Å²	35.9	18%	0.178	19%	0.19	C	C	.	.	H	α-helix	trans	-69.5	-37.8	-179.5	-64.6	171.3	0	0	0	112	T173 L177 P361 I368 L369 Y552	T173-L365 HydrophobicContact CG2-CD2 4.44Å; L177-L365 HydrophobicContact CD2-CD1 4.06Å; L177-L365 HydrophobicContact CD2-CD2 4.4Å; P361-L365 WeakPolarHBondContact O-CB 3.34Å; P361-L365 WeakPolarHBondContact O-CG 3.38Å; P361-L365 PolarHBondContact O-N 2.69Å; L365-I368 PolarHBondContact O-N 3.31Å; L365-L369 PolarHBondContact O-N 2.93Å; L365-L369 VanDerWaalsContact O-N 3.13Å; L365-Y552 WeakPolarHBondContact CD1-OH 3.38Å
366	L	95.4	Very high	92.9	Very high	65 Å²	65	35 Å²	35	34%	0.34	19%	0.185	S	C	.	.	H	α-helix	trans	-68.7	-35	173.9	-175.3	62.4	0	0	0	112	W128 L133 K362 L369 I370	W128-L366 HydrophobicContact CH2-CD2 4.12Å; W128-L366 HydrophobicContact CZ3-CD2 4.05Å; L133-L366 HydrophobicContact CD1-CB 3.98Å; L133-L366 HydrophobicContact CD1-CD2 4.09Å; L133-L366 HydrophobicContact CD1-CG 3.95Å; L133-L366 HydrophobicContact CD2-CD2 4.17Å; K362-L366 WeakPolarHBondContact O-CB 3.39Å; K362-L366 PolarHBondContact O-N 3.39Å; L366-L369 PolarHBondContact O-N 3.38Å; L366-I370 HydrophobicContact CD1-CD1 4.06Å; L366-I370 HydrophobicContact CD1-CG1 4.21Å; L366-I370 HydrophobicContact CD2-CD1 4.42Å; L366-I370 HydrophobicContact CG-CD1 3.82Å; L366-I370 HydrophobicContact CG-CG1 4.38Å; L366-I370 WeakPolarHBondContact O-CB 3.38Å; L366-I370 VanDerWaalsContact O-CG1 3.31Å; L366-I370 WeakPolarHBondContact O-CG1 3.35Å; L366-I370 PolarHBondContact O-N 3.19Å
367	A	94.7	Very high	93.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.7	-52.6	172.7	0	0	0	0	0	111.1	L133 C136 M137 I140 G363 T364 L369 I370 T371	L133-A367 HydrophobicContact CD1-CB 4.05Å; C136-A367 HydrophobicContact CB-CB 3.49Å; C136-A367 VanDerWaalsContact CB-CB 3.49Å; M137-A367 HydrophobicContact CG-CB 3.88Å; I140-A367 HydrophobicContact CD1-CB 4.02Å; G363-A367 WeakPolarHBondContact O-CB 3.45Å; G363-A367 PolarHBondContact O-N 2.95Å; T364-A367 PolarHBondContact O-N 2.88Å; A367-L369 VanDerWaalsContact C-N 3.27Å; A367-L369 PolarHBondContact O-N 2.96Å; A367-I370 PolarHBondContact O-N 3.08Å; A367-T371 WeakPolarHBondContact O-CG2 3.39Å; A367-T371 PolarHBondContact O-N 2.67Å; A367-T371 PolarHBondContact O-OG1 3.28Å
368	I	95.4	Very high	93.5	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-55.8	-42.5	179.4	-65.9	161.4	0	0	0	111.3	I343 T364 L365 T371 G372	I343-I368 HydrophobicContact CB-CD1 4.25Å; I343-I368 HydrophobicContact CG2-CD1 3.79Å; I343-I368 HydrophobicContact CG2-CG1 3.67Å; T364-I368 HydrophobicContact CG2-CD1 3.93Å; T364-I368 WeakPolarHBondContact O-CG1 3.17Å; T364-I368 PolarHBondContact O-N 3.47Å; L365-I368 PolarHBondContact O-N 3.31Å; I368-T371 PolarHBondContact O-OG1 2.92Å; I368-G372 PolarHBondContact O-N 2.65Å
369	L	95.5	Very high	93.8	Very high	104 Å²	104	31 Å²	31	55%	0.545	17%	0.165	S	C	.	.	H	α-helix	trans	-65.2	-49.3	177.9	-178.3	62.3	0	0	0	112.1	L365 L366 A367 I373	L365-L369 PolarHBondContact O-N 2.93Å; L365-L369 VanDerWaalsContact O-N 3.13Å; L366-L369 PolarHBondContact O-N 3.38Å; A367-L369 VanDerWaalsContact C-N 3.27Å; A367-L369 PolarHBondContact O-N 2.96Å; L369-I373 HydrophobicContact CD1-CD1 3.84Å; L369-I373 HydrophobicContact CD1-CG1 4.4Å; L369-I373 HydrophobicContact CG-CD1 3.99Å; L369-I373 WeakPolarHBondContact O-CB 3Å; L369-I373 VanDerWaalsContact O-CG1 3.27Å; L369-I373 WeakPolarHBondContact O-CG1 3.3Å; L369-I373 PolarHBondContact O-N 3.36Å
370	I	95	Very high	93.9	Very high	54 Å²	54	33 Å²	33	28%	0.277	18%	0.175	S	C	.	.	H	α-helix	trans	-62.3	-48	179.1	-69.7	170.7	0	0	0	110.3	L133 M137 W141 L366 A367 I373 T374	L133-I370 HydrophobicContact CD1-CD1 4.44Å; M137-I370 HydrophobicContact CE-CG2 3.81Å; M137-I370 HydrophobicContact SD-CD1 4.39Å; W141-I370 HydrophobicContact CZ2-CG2 4.3Å; L366-I370 HydrophobicContact CD1-CD1 4.06Å; L366-I370 HydrophobicContact CD1-CG1 4.21Å; L366-I370 HydrophobicContact CD2-CD1 4.42Å; L366-I370 HydrophobicContact CG-CD1 3.82Å; L366-I370 HydrophobicContact CG-CG1 4.38Å; L366-I370 WeakPolarHBondContact O-CB 3.38Å; L366-I370 VanDerWaalsContact O-CG1 3.31Å; L366-I370 WeakPolarHBondContact O-CG1 3.35Å; L366-I370 PolarHBondContact O-N 3.19Å; A367-I370 PolarHBondContact O-N 3.08Å; I370-I373 PolarHBondContact O-N 2.96Å; I370-T374 PolarHBondContact O-N 2.72Å; I370-T374 PolarHBondContact O-OG1 3.37Å
371	T	94.2	Very high	93.9	Very high	6 Å²	6	34 Å²	34	4%	0.037	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-44.4	-178.3	56.8	0	0	0	0	111.4	M137 I140 W141 A367 I368 I373 T374 Y375	M137-T371 HydrophobicContact CG-CG2 4.24Å; I140-T371 HydrophobicContact CB-CG2 3.89Å; I140-T371 HydrophobicContact CD1-CG2 4.01Å; I140-T371 HydrophobicContact CG2-CG2 3.7Å; I140-T371 WeakPolarHBondContact CG2-OG1 3.34Å; W141-T371 HydrophobicContact CD2-CG2 4.28Å; W141-T371 HydrophobicContact CG-CG2 4.28Å; W141-T371 HydrophobicContact CZ2-CG2 4.4Å; A367-T371 WeakPolarHBondContact O-CG2 3.39Å; A367-T371 PolarHBondContact O-N 2.67Å; A367-T371 PolarHBondContact O-OG1 3.28Å; I368-T371 PolarHBondContact O-OG1 2.92Å; T371-I373 PolarHBondContact O-N 3.01Å; T371-T374 WeakPolarHBondContact CA-OG1 3.3Å; T371-T374 PolarHBondContact O-N 3.13Å; T371-T374 VanDerWaalsContact O-N 3.14Å; T371-T374 PolarHBondContact O-OG1 3.49Å; T371-Y375 WeakPolarHBondContact O-CD2 3.3Å; T371-Y375 PolarHBondContact O-N 3.45Å
372	G	94.3	Very high	93.7	Very high	8 Å²	8	33.8 Å²	33.8	8%	0.082	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-43.9	176	0	0	0	0	0	112.9	I368 Y375 L376	I368-G372 PolarHBondContact O-N 2.65Å; G372-Y375 PolarHBondContact O-N 3.3Å; G372-L376 WeakPolarHBondContact O-CB 3.4Å; G372-L376 PolarHBondContact O-N 3.21Å
373	I	95.1	Very high	93.6	Very high	98 Å²	98	27.8 Å²	27.8	50%	0.503	16%	0.155	S	C	.	.	H	α-helix	trans	-63.4	-42.7	174.3	-68.8	168.1	0	0	0	111.1	L369 I370 T371 L376 A377	L369-I373 HydrophobicContact CD1-CD1 3.84Å; L369-I373 HydrophobicContact CD1-CG1 4.4Å; L369-I373 HydrophobicContact CG-CD1 3.99Å; L369-I373 WeakPolarHBondContact O-CB 3Å; L369-I373 VanDerWaalsContact O-CG1 3.27Å; L369-I373 WeakPolarHBondContact O-CG1 3.3Å; L369-I373 PolarHBondContact O-N 3.36Å; I370-I373 PolarHBondContact O-N 2.96Å; T371-I373 PolarHBondContact O-N 3.01Å; I373-L376 PolarHBondContact O-N 3.46Å; I373-A377 VanDerWaalsContact O-CB 3.31Å; I373-A377 WeakPolarHBondContact O-CB 3.29Å; I373-A377 PolarHBondContact O-N 2.88Å
374	T	93.5	Very high	93.4	Very high	27 Å²	27	28 Å²	28	17%	0.166	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-39.4	177.5	53.7	0	0	0	0	113.4	W141 I370 T371 A377 V378	W141-T374 HydrophobicContact CZ2-CG2 3.96Å; W141-T374 PolarHBondContact NE1-OG1 3.12Å; I370-T374 PolarHBondContact O-N 2.72Å; I370-T374 PolarHBondContact O-OG1 3.37Å; T371-T374 WeakPolarHBondContact CA-OG1 3.3Å; T371-T374 PolarHBondContact O-N 3.13Å; T371-T374 VanDerWaalsContact O-N 3.14Å; T371-T374 PolarHBondContact O-OG1 3.49Å; T374-A377 PolarHBondContact O-N 3.09Å; T374-V378 WeakPolarHBondContact O-CB 3.3Å; T374-V378 VanDerWaalsContact O-CG2 3.31Å; T374-V378 WeakPolarHBondContact O-CG2 3.3Å; T374-V378 PolarHBondContact O-N 3.2Å
375	Y	94.3	Very high	93.2	Very high	5 Å²	5	27.7 Å²	27.7	2%	0.02	16%	0.155	C	C	.	.	H	α-helix	trans	-61.3	-47.6	174.2	-78.1	-63.6	0	0	0	111.1	I140 L145 L149 F336 A339 T371 G372 A379	I140-Y375 HydrophobicContact CG2-CE2 4.09Å; I140-Y375 PolarHBondContact O-OH 2.97Å; I140-Y375 VanDerWaalsContact O-OH 3.05Å; L145-Y375 HydrophobicContact CB-CE1 3.68Å; L145-Y375 HydrophobicContact CD1-CD1 4.36Å; L145-Y375 HydrophobicContact CD1-CE1 3.84Å; L145-Y375 HydrophobicContact CG-CD1 4.31Å; L145-Y375 HydrophobicContact CG-CE1 3.81Å; L149-Y375 HydrophobicContact CD1-CD1 4.01Å; L149-Y375 HydrophobicContact CD2-CD1 3.96Å; F336-Y375 HydrophobicContact CE2-CD1 4.27Å; F336-Y375 HydrophobicContact CZ-CG 4.37Å; A339-Y375 HydrophobicContact CB-CE1 4.3Å; A339-Y375 WeakPolarHBondContact O-CE2 3.36Å; A339-Y375 PolarHBondContact O-OH 2.94Å; T371-Y375 WeakPolarHBondContact O-CD2 3.3Å; T371-Y375 PolarHBondContact O-N 3.45Å; G372-Y375 PolarHBondContact O-N 3.3Å; Y375-A379 WeakPolarHBondContact O-CB 3.46Å; Y375-A379 PolarHBondContact O-N 2.97Å
376	L	93.9	Very high	93	Very high	61 Å²	61	26.1 Å²	26.1	32%	0.319	15%	0.147	S	C	.	.	H	α-helix	trans	-59.9	-47.5	177.8	178.5	61.1	0	0	0	112	I162 G372 I373 L380	I162-L376 HydrophobicContact CD1-CD1 4.3Å; I162-L376 HydrophobicContact CG1-CD1 3.69Å; G372-L376 WeakPolarHBondContact O-CB 3.4Å; G372-L376 PolarHBondContact O-N 3.21Å; I373-L376 PolarHBondContact O-N 3.46Å; L376-L380 HydrophobicContact CD1-CD1 3.74Å; L376-L380 HydrophobicContact CD1-CG 4.19Å; L376-L380 HydrophobicContact CG-CD1 4.05Å; L376-L380 WeakPolarHBondContact O-CB 3.21Å; L376-L380 VanDerWaalsContact O-CG 3.32Å; L376-L380 WeakPolarHBondContact O-CG 3.26Å; L376-L380 PolarHBondContact O-N 3.3Å
377	A	93.5	Very high	92.7	Very high	34 Å²	34	23.2 Å²	23.2	28%	0.281	13%	0.132	S	C	.	.	H	α-helix	trans	-65.5	-47.9	-178.4	0	0	0	0	0	112.4	F291 I373 T374 C381	F291-A377 HydrophobicContact CE1-CB 4.08Å; F291-A377 HydrophobicContact CZ-CB 3.83Å; I373-A377 VanDerWaalsContact O-CB 3.31Å; I373-A377 WeakPolarHBondContact O-CB 3.29Å; I373-A377 PolarHBondContact O-N 2.88Å; T374-A377 PolarHBondContact O-N 3.09Å; A377-C381 WeakPolarHBondContact O-CB 3.39Å; A377-C381 PolarHBondContact O-N 3.05Å; A377-C381 PolarHBondContact O-SG 2.81Å; A377-C381 VanDerWaalsContact O-SG 3.32Å
378	V	92.5	Very high	92.3	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.006	14%	0.135	C	C	.	.	H	α-helix	trans	-63.3	-45.3	178.2	174.7	0	0	0	0	110.6	L149 I287 V290 F291 T374 L380 C381 V382 M437	L149-V378 HydrophobicContact CD2-CB 4.16Å; L149-V378 HydrophobicContact CD2-CG1 4.05Å; I287-V378 HydrophobicContact CG2-CG2 4.49Å; V290-V378 HydrophobicContact CG1-CG1 4.37Å; F291-V378 HydrophobicContact CE1-CG2 4.39Å; F291-V378 HydrophobicContact CE2-CG2 3.79Å; F291-V378 HydrophobicContact CZ-CB 4.47Å; F291-V378 HydrophobicContact CZ-CG2 3.54Å; T374-V378 WeakPolarHBondContact O-CB 3.3Å; T374-V378 VanDerWaalsContact O-CG2 3.31Å; T374-V378 WeakPolarHBondContact O-CG2 3.3Å; T374-V378 PolarHBondContact O-N 3.2Å; V378-L380 PolarHBondContact O-N 3.45Å; V378-C381 PolarHBondContact O-N 2.96Å; V378-V382 HydrophobicContact CG1-CG2 4.43Å; V378-V382 WeakPolarHBondContact O-CG2 3.27Å; V378-V382 PolarHBondContact O-N 2.97Å; V378-M437 HydrophobicContact CG1-CE 3.5Å; V378-M437 HydrophobicContact CG1-SD 3.79Å
379	A	92.1	Very high	91.8	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.008	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-42.5	-178.6	0	0	0	0	0	112.8	L149 F153 Y375 S383	L149-A379 HydrophobicContact CD1-CB 4.17Å; L149-A379 HydrophobicContact CD2-CB 3.99Å; L149-A379 HydrophobicContact CG-CB 3.95Å; F153-A379 HydrophobicContact CD1-CB 3.76Å; F153-A379 HydrophobicContact CD2-CB 3.71Å; F153-A379 HydrophobicContact CE1-CB 3.59Å; F153-A379 HydrophobicContact CE2-CB 3.55Å; F153-A379 HydrophobicContact CG-CB 3.83Å; F153-A379 HydrophobicContact CZ-CB 3.49Å; F153-A379 VanDerWaalsContact CZ-CB 3.49Å; Y375-A379 WeakPolarHBondContact O-CB 3.46Å; Y375-A379 PolarHBondContact O-N 2.97Å; A379-S383 VanDerWaalsContact O-CB 3.31Å; A379-S383 WeakPolarHBondContact O-CB 3.46Å; A379-S383 PolarHBondContact O-N 3.28Å; A379-S383 PolarHBondContact O-OG 2.95Å
380	L	92.1	Very high	91.4	Very high	49 Å²	49	19.3 Å²	19.3	26%	0.257	11%	0.11	S	C	.	.	H	α-helix	trans	-66.5	-40.9	175.9	-72.4	171.9	0	0	0	112.3	W158 I162 F315 L376 V378 V382 S383 G384	W158-L380 HydrophobicContact CB-CD2 4.08Å; W158-L380 HydrophobicContact CD2-CD2 4.22Å; W158-L380 HydrophobicContact CE3-CD2 4.03Å; W158-L380 HydrophobicContact CG-CD2 4.29Å; I162-L380 HydrophobicContact CD1-CD2 4.4Å; F315-L380 HydrophobicContact CE2-CD2 4.25Å; L376-L380 HydrophobicContact CD1-CD1 3.74Å; L376-L380 HydrophobicContact CD1-CG 4.19Å; L376-L380 HydrophobicContact CG-CD1 4.05Å; L376-L380 WeakPolarHBondContact O-CB 3.21Å; L376-L380 VanDerWaalsContact O-CG 3.32Å; L376-L380 WeakPolarHBondContact O-CG 3.26Å; L376-L380 PolarHBondContact O-N 3.3Å; V378-L380 PolarHBondContact O-N 3.45Å; L380-V382 PolarHBondContact O-N 3.44Å; L380-S383 PolarHBondContact O-N 3.22Å; L380-G384 PolarHBondContact O-N 3.07Å
381	C	91.4	Very high	90.7	Very high	23 Å²	23	18.1 Å²	18.1	16%	0.155	11%	0.105	C	C	.	.	H	α-helix	trans	-61.6	-42.4	176.3	-76.4	0	0	0	0	112.6	F291 T294 Y310 A377 V378 T385	F291-C381 HydrophobicContact CD1-CB 4.49Å; F291-C381 HydrophobicContact CE1-CB 4.36Å; T294-C381 HydrophobicContact CG2-CB 4.33Å; Y310-C381 PolarHBondContact OH-SG 3.18Å; A377-C381 WeakPolarHBondContact O-CB 3.39Å; A377-C381 PolarHBondContact O-N 3.05Å; A377-C381 PolarHBondContact O-SG 2.81Å; A377-C381 VanDerWaalsContact O-SG 3.32Å; V378-C381 PolarHBondContact O-N 2.96Å; C381-T385 VanDerWaalsContact O-CG2 3.27Å; C381-T385 WeakPolarHBondContact O-CG2 3.44Å; C381-T385 PolarHBondContact O-OG1 3.42Å
382	V	90.2	Very high	90.1	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-70.8	-40.5	176.1	-175.6	0	0	0	0	111	V378 L380 G384 T385 V386 L430 V436 M437	V378-V382 HydrophobicContact CG1-CG2 4.43Å; V378-V382 WeakPolarHBondContact O-CG2 3.27Å; V378-V382 PolarHBondContact O-N 2.97Å; L380-V382 PolarHBondContact O-N 3.44Å; V382-G384 VanDerWaalsContact C-N 3.26Å; V382-G384 PolarHBondContact O-N 3.33Å; V382-T385 PolarHBondContact O-N 3.18Å; V382-T385 VanDerWaalsContact O-N 3.12Å; V382-T385 PolarHBondContact O-OG1 2.9Å; V382-V386 HydrophobicContact CG1-CG2 3.99Å; V382-V386 PolarHBondContact O-N 2.76Å; V382-V386 VanDerWaalsContact O-N 3.12Å; V382-L430 HydrophobicContact CG1-CD2 3.73Å; V382-V436 HydrophobicContact CG1-CG1 3.67Å; V382-M437 HydrophobicContact CG2-CE 4.43Å
383	S	89.7	Confident	89.4	Confident	1 Å²	1	21.5 Å²	21.5	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-64.3	-26.1	177.8	-55.7	0	0	0	0	114	F153 N318 A379 L380	F153-S383 WeakPolarHBondContact CD1-OG 3.16Å; N318-S383 PolarHBondContact ND2-O 2.96Å; A379-S383 VanDerWaalsContact O-CB 3.31Å; A379-S383 WeakPolarHBondContact O-CB 3.46Å; A379-S383 PolarHBondContact O-N 3.28Å; A379-S383 PolarHBondContact O-OG 2.95Å; L380-S383 PolarHBondContact O-N 3.22Å
384	G	89.6	Confident	88.5	Confident	4 Å²	4	20.5 Å²	20.5	4%	0.041	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	0.2	175.6	0	0	0	0	0	115.3	Y310 N311 L380 V382	Y310-G384 WeakPolarHBondContact CA-O 3.41Å; N311-G384 PolarHBondContact N-O 3.28Å; N311-G384 VanDerWaalsContact N-O 3.17Å; L380-G384 PolarHBondContact O-N 3.07Å; V382-G384 VanDerWaalsContact C-N 3.26Å; V382-G384 PolarHBondContact O-N 3.33Å
385	T	89.7	Confident	87.5	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132	-12.5	-171.7	56.5	0	0	0	0	115.7	T294 F307 F308 G309 Y310 C381 V382	T294-T385 HydrophobicContact CG2-CG2 4.3Å; F307-T385 WeakPolarHBondContact CD2-O 3.25Å; F307-T385 HydrophobicContact CE2-CG2 4.34Å; F308-T385 PolarHBondContact N-O 3.08Å; G309-T385 WeakPolarHBondContact O-CA 3.49Å; Y310-T385 HydrophobicContact CD1-CG2 3.67Å; Y310-T385 HydrophobicContact CD2-CG2 3.98Å; Y310-T385 HydrophobicContact CE1-CG2 3.74Å; Y310-T385 HydrophobicContact CE2-CG2 4.04Å; Y310-T385 HydrophobicContact CG-CG2 3.79Å; C381-T385 VanDerWaalsContact O-CG2 3.27Å; C381-T385 WeakPolarHBondContact O-CG2 3.44Å; C381-T385 PolarHBondContact O-OG1 3.42Å; V382-T385 PolarHBondContact O-N 3.18Å; V382-T385 VanDerWaalsContact O-N 3.12Å; V382-T385 PolarHBondContact O-OG1 2.9Å
386	V	89.9	Confident	86.3	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-129.9	136.4	-176.3	-169.2	0	0	0	0	111.1	G306 F307 I314 N318 V382 L430 V436 V440	G306-V386 WeakPolarHBondContact O-CA 3.49Å; F307-V386 HydrophobicContact CD2-CG2 4.12Å; I314-V386 WeakPolarHBondContact CG2-O 3.46Å; N318-V386 PolarHBondContact ND2-O 2.72Å; V382-V386 HydrophobicContact CG1-CG2 3.99Å; V382-V386 PolarHBondContact O-N 2.76Å; V382-V386 VanDerWaalsContact O-N 3.12Å; V386-L430 HydrophobicContact CB-CD2 4.13Å; V386-L430 HydrophobicContact CB-CG 4.11Å; V386-L430 HydrophobicContact CG1-CD2 4.38Å; V386-L430 HydrophobicContact CG1-CG 4.11Å; V386-L430 WeakPolarHBondContact O-CD1 3.43Å; V386-V436 HydrophobicContact CG1-CG1 4.24Å; V386-V436 HydrophobicContact CG2-CG1 4.08Å; V386-V440 HydrophobicContact CG2-CG2 3.43Å; V386-V440 VanDerWaalsContact CG2-CG2 3.43Å
387	V	89.3	Confident	85.1	Confident	4 Å²	4	27.5 Å²	27.5	2%	0.024	16%	0.164	C	C	.	.			trans	-78.7	164.8	173.6	-64.6	0	0	0	0	112.6	G306 F308 I314 D389 A390 F418 G429 L430	G306-V387 PolarHBondContact O-N 3.39Å; G306-V387 VanDerWaalsContact O-N 3.1Å; F308-V387 HydrophobicContact CD2-CG1 4.12Å; F308-V387 HydrophobicContact CE2-CG1 4.1Å; F308-V387 HydrophobicContact CE2-CG2 4.14Å; I314-V387 HydrophobicContact CD1-CG1 3.89Å; I314-V387 HydrophobicContact CG1-CG1 4Å; I314-V387 HydrophobicContact CG2-CG1 4.32Å; V387-D389 WeakPolarHBondContact CG2-O 3.26Å; V387-A390 HydrophobicContact CG2-CB 4.4Å; V387-F418 HydrophobicContact CG2-CD2 4.3Å; V387-F418 HydrophobicContact CG2-CE2 4.08Å; V387-G429 WeakPolarHBondContact O-CA 3.26Å; V387-L430 PolarHBondContact O-N 3.31Å
388	R	86.8	Confident	83.9	Confident	19 Å²	19	27.8 Å²	27.8	7%	0.072	16%	0.162	C	C	.	.	S	Bend	trans	-66	-46.5	-175.8	-69.7	-170.1	171.2	-172.4	-10.6	114	N318 T320 D322 G429 L430 M431	N318-R388 PolarHBondContact O-NH2 3.31Å; N318-R388 VanDerWaalsContact OD1-CG 3.22Å; N318-R388 WeakPolarHBondContact OD1-CG 3.33Å; N318-R388 PolarHBondContact OD1-NE 2.98Å; T320-R388 VanDerWaalsContact O-CZ 3.31Å; T320-R388 PolarHBondContact O-NH1 3.08Å; T320-R388 PolarHBondContact O-NH2 2.97Å; D322-R388 VanDerWaalsContact CB-NH1 3.26Å; R388-G429 CarbonylContact O-C 3.32Å; R388-G429 VanDerWaalsContact O-C 3.23Å; R388-G429 WeakPolarHBondContact O-CA 3.33Å; R388-L430 PolarHBondContact O-N 3.34Å; R388-M431 HydrophobicContact CB-CG 4.27Å; R388-M431 HydrophobicContact CB-SD 3.83Å; R388-M431 HydrophobicContact CG-SD 4.26Å; R388-M431 PolarHBondContact O-N 3.22Å
389	D	86.3	Confident	82.4	Confident	10 Å²	10	33.3 Å²	33.3	5%	0.053	20%	0.196	C	C	.	.			trans	-128.9	141.3	-177.2	-60.1	-75.5	0	0	0	109.8	R324 V387 F418 C421 N432	R324-D389 IonicContact CZ-OD1 2.62Å; R324-D389 IonicContact CZ-OD2 2.82Å; R324-D389 VanDerWaalsContact CZ-OD2 3.28Å; R324-D389 IonicContact NH1-OD1 3.76Å; R324-D389 PolarHBondContact NH1-OD1 2.96Å; R324-D389 IonicContact NH1-OD2 2.69Å; R324-D389 PolarHBondContact NH1-OD2 3.39Å; R324-D389 IonicContact NH2-OD2 3.26Å; R324-D389 PolarHBondContact NH2-OD2 3.24Å; V387-D389 WeakPolarHBondContact CG2-O 3.26Å; D389-F418 WeakPolarHBondContact O-CD2 3.3Å; D389-C421 HydrophobicContact CB-CB 3.69Å; D389-N432 PolarHBondContact OD1-ND2 3.43Å
390	A	85.1	Confident	80.7	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-150.6	145.8	172.3	0	0	0	0	0	111	V387 F418 F428	V387-A390 HydrophobicContact CG2-CB 4.4Å; A390-F418 HydrophobicContact CB-CD2 4.13Å; A390-F418 HydrophobicContact CB-CE1 4.32Å; A390-F418 HydrophobicContact CB-CE2 3.8Å; A390-F418 HydrophobicContact CB-CZ 3.9Å; A390-F428 HydrophobicContact CB-CB 4.01Å; A390-F428 PolarHBondContact N-O 3.2Å; A390-F428 CarbonylContact O-C 3.23Å; A390-F428 WeakPolarHBondContact O-CA 3.48Å; A390-F428 WeakPolarHBondContact O-CB 3.3Å; A390-F428 PolarHBondContact O-N 3.03Å
391	T	81.9	Confident	78.9	Confident	28 Å²	28	39 Å²	39	17%	0.172	25%	0.251	C	S	.	.			trans	-77.7	-30.1	-177.7	57	0	0	0	0	112.7	N393 D396 F418 S420	T391-N393 PolarHBondContact OG1-N 3.42Å; T391-D396 VanDerWaalsContact CB-OD2 3.24Å; T391-D396 WeakPolarHBondContact CB-OD2 3.14Å; T391-D396 WeakPolarHBondContact CG2-OD2 3.43Å; T391-D396 PolarHBondContact OG1-OD2 3.15Å; T391-F418 HydrophobicContact CG2-CD1 3.94Å; T391-S420 WeakPolarHBondContact CG2-OG 3.49Å
392	G	81.6	Confident	77.5	Confident	16 Å²	16	42.8 Å²	42.8	17%	0.165	27%	0.269	C	S	.	.			trans	82.9	-8.5	-170.1	0	0	0	0	0	114.2	S304 F428	S304-G392 WeakPolarHBondContact CB-O 3.46Å; S304-G392 WeakPolarHBondContact O-CA 3.05Å; S304-G392 PolarHBondContact O-N 2.97Å; S304-G392 PolarHBondContact OG-O 2.97Å; G392-F428 VanDerWaalsContact CA-CD2 3.48Å
393	N	79.8	Confident	75.9	Confident	69 Å²	69	48.2 Å²	48.2	37%	0.369	31%	0.305	S	S	.	.			trans	-86.2	133.6	-172.6	-176	23.3	0	0	0	111.9	S304 T391 T395 D396	S304-N393 WeakPolarHBondContact CB-O 3.36Å; T391-N393 PolarHBondContact OG1-N 3.42Å; N393-T395 PolarHBondContact ND2-OG1 2.7Å; N393-T395 PolarHBondContact OD1-N 3.47Å; N393-T395 PolarHBondContact OD1-OG1 3.34Å; N393-D396 PolarHBondContact ND2-OD1 3.17Å
394	T	75.3	Confident	74.6	Confident	77 Å²	77	49.3 Å²	49.3	47%	0.472	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-13.9	-177.8	51	0	0	0	0	113.6	D396	T394-D396 VanDerWaalsContact C-N 3.3Å
395	T	72.4	Confident	73.1	Confident	107 Å²	107	55.7 Å²	55.7	66%	0.656	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-6.9	175.9	67.2	0	0	0	0	114	N393 L397	N393-T395 PolarHBondContact ND2-OG1 2.7Å; N393-T395 PolarHBondContact OD1-N 3.47Å; N393-T395 PolarHBondContact OD1-OG1 3.34Å; T395-L397 PolarHBondContact O-N 3.44Å
396	D	69.9	Low	71.7	Confident	33 Å²	33	57.6 Å²	57.6	18%	0.176	37%	0.365	C	S	.	.			trans	-80.4	20.7	-176	-58.6	-2.3	0	0	0	112.6	T391 N393 T394 Y416 N417	T391-D396 VanDerWaalsContact CB-OD2 3.24Å; T391-D396 WeakPolarHBondContact CB-OD2 3.14Å; T391-D396 WeakPolarHBondContact CG2-OD2 3.43Å; T391-D396 PolarHBondContact OG1-OD2 3.15Å; N393-D396 PolarHBondContact ND2-OD1 3.17Å; T394-D396 VanDerWaalsContact C-N 3.3Å; D396-Y416 WeakPolarHBondContact O-CA 3.21Å; D396-N417 PolarHBondContact O-N 3.01Å
397	L	68.8	Low	70.2	Confident	101 Å²	101	60.1 Å²	60.1	53%	0.529	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-78.7	122.7	-179	-112.9	157.6	0	0	0	110.2	T395 G415 Y416	T395-L397 PolarHBondContact O-N 3.44Å; L397-G415 WeakPolarHBondContact CA-O 3.18Å; L397-Y416 HydrophobicContact CD1-CE1 4.49Å; L397-Y416 HydrophobicContact CD2-CE2 4.4Å; L397-Y416 HydrophobicContact CG-CE1 4.07Å; L397-Y416 HydrophobicContact CG-CE2 4.45Å
398	V	68.6	Low	69	Low	39 Å²	39	60.3 Å²	60.3	24%	0.236	38%	0.384	C	S	.	.			trans	-124.7	140	-173.7	178.3	0	0	0	0	110.6	S400 I402 G415 N417	V398-S400 PolarHBondContact O-N 3.29Å; V398-I402 HydrophobicContact CG1-CB 4.14Å; V398-I402 HydrophobicContact CG1-CD1 3.72Å; V398-I402 HydrophobicContact CG1-CG1 4.06Å; V398-G415 PolarHBondContact N-O 3.12Å; V398-G415 WeakPolarHBondContact O-CA 3.48Å; V398-N417 HydrophobicContact CG2-CB 3.72Å
399	T	59.6	Low	68.2	Low	117 Å²	117	62.4 Å²	62.4	72%	0.718	40%	0.399	S	S	*	.			trans	-58.9	126.3	175.2	-44	0	0	0	0	110.3	G401	T399-G401 PolarHBondContact O-N 2.94Å
400	S	55.8	Low	67.5	Low	98 Å²	98	62.8 Å²	62.8	69%	0.685	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	123.2	-175.8	40.4	0	0	0	0	112.1	V398	V398-S400 PolarHBondContact O-N 3.29Å
401	G	55.5	Low	66.9	Low	72 Å²	72	62.9 Å²	62.9	74%	0.742	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	120.8	-2.7	178.7	0	0	0	0	0	116.1	T399	T399-G401 PolarHBondContact O-N 2.94Å
402	I	60.9	Low	66.4	Low	102 Å²	102	61.8 Å²	61.8	52%	0.523	40%	0.396	S	S	.	.			trans	-73.7	130.4	168.8	-58.4	-168.5	0	0	0	109.4	V398 C404 C412	V398-I402 HydrophobicContact CG1-CB 4.14Å; V398-I402 HydrophobicContact CG1-CD1 3.72Å; V398-I402 HydrophobicContact CG1-CG1 4.06Å; I402-C404 PolarHBondContact O-N 3.48Å; I402-C412 PolarHBondContact O-SG 3.36Å
403	P	56.5	Low	66	Low	116 Å²	116	65.9 Å²	65.9	75%	0.753	41%	0.41	S	S	*	.			trans	-77.2	101.6	177.8	30.3	-33.8	0	0	0	111.3
404	C	62.4	Low	65.8	Low	23 Å²	23	65.3 Å²	65.3	16%	0.155	41%	0.407	C	S	.	.			trans	-78.3	143.9	162.5	-58.2	0	0	0	0	110.4	I402 C412 N417	I402-C404 PolarHBondContact O-N 3.48Å; C404-C412 HydrophobicContact CB-CB 3.48Å; C404-C412 VanDerWaalsContact CB-CB 3.48Å; C404-C412 WeakPolarHBondContact CB-SG 3.29Å; C404-C412 WeakPolarHBondContact SG-CB 3.2Å; C404-C412 CovalentContact SG-SG 2.04Å; C404-C412 PolarHBondContact SG-SG 3.42Å; C404-N417 PolarHBondContact SG-OD1 3.49Å
405	N	58.1	Low	65.8	Low	139 Å²	139	62 Å²	62	74%	0.743	39%	0.388	S	S	*	.			trans	-101	162.4	166.8	-70.5	-31	0	0	0	109.7
406	G	62.2	Low	66.1	Low	40 Å²	40	57.3 Å²	57.3	41%	0.412	36%	0.359	S	S	.	.	S	Bend	trans	99.6	-163.2	170.4	0	0	0	0	0	115.4	S408 V409 E422	G406-S408 PolarHBondContact O-N 2.93Å; G406-V409 WeakPolarHBondContact O-CG2 3.22Å; G406-E422 WeakPolarHBondContact CA-OE1 3.5Å
407	S	58.5	Low	66.6	Low	53 Å²	53	58 Å²	58	37%	0.371	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	18	-177.6	72.4	0	0	0	0	114.9	E422	S407-E422 PolarHBondContact N-OE1 3.22Å
408	S	63.9	Low	67.1	Low	8 Å²	8	53.3 Å²	53.3	6%	0.056	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.2	14.6	-176.5	64.5	0	0	0	0	114.1	G406 V410 A411 C412 S419	G406-S408 PolarHBondContact O-N 2.93Å; S408-V410 VanDerWaalsContact C-N 3.33Å; S408-V410 PolarHBondContact O-N 3.37Å; S408-A411 PolarHBondContact O-N 2.83Å; S408-C412 PolarHBondContact O-N 3.43Å; S408-C412 VanDerWaalsContact O-N 3.08Å; S408-S419 PolarHBondContact OG-N 3.49Å
409	V	68.9	Low	67.3	Low	63 Å²	63	53.6 Å²	53.6	38%	0.382	34%	0.341	S	S	.	.	H	α-helix	trans	-54.3	-45.9	-178.9	172.1	0	0	0	0	111.9	G406 A411 C412 E413	G406-V409 WeakPolarHBondContact O-CG2 3.22Å; V409-A411 PolarHBondContact O-N 3.22Å; V409-C412 WeakPolarHBondContact O-CB 3.46Å; V409-C412 PolarHBondContact O-N 3.07Å; V409-E413 PolarHBondContact O-N 3Å
410	V	72.2	Confident	68.1	Low	17 Å²	17	50.3 Å²	50.3	10%	0.103	32%	0.323	C	S	.	.	H	α-helix	trans	-68.4	-37.1	-177.1	176.8	0	0	0	0	112	K313 I314 E317 S408 C412 E413 L414	K313-V410 HydrophobicContact CB-CB 4.5Å; K313-V410 HydrophobicContact CB-CG1 3.52Å; K313-V410 HydrophobicContact CB-CG2 4.13Å; I314-V410 HydrophobicContact CG1-CG1 3.72Å; E317-V410 HydrophobicContact CB-CG2 4.15Å; E317-V410 HydrophobicContact CG-CG2 4.38Å; E317-V410 WeakPolarHBondContact OE1-CB 3.41Å; E317-V410 VanDerWaalsContact OE1-CG2 3.31Å; E317-V410 WeakPolarHBondContact OE1-CG2 3.32Å; S408-V410 VanDerWaalsContact C-N 3.33Å; S408-V410 PolarHBondContact O-N 3.37Å; V410-C412 VanDerWaalsContact C-N 3.32Å; V410-C412 PolarHBondContact O-N 3.37Å; V410-E413 PolarHBondContact O-N 2.98Å; V410-L414 HydrophobicContact CG1-CD1 4.21Å; V410-L414 VanDerWaalsContact O-CG 3.29Å; V410-L414 WeakPolarHBondContact O-CG 3.45Å; V410-L414 PolarHBondContact O-N 3.45Å
411	A	71.5	Confident	69.1	Low	2 Å²	2	46.2 Å²	46.2	2%	0.017	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-39.5	174	0	0	0	0	0	111.7	S408 V409 L414 G415 Y416 F418	S408-A411 PolarHBondContact O-N 2.83Å; V409-A411 PolarHBondContact O-N 3.22Å; A411-L414 CarbonylContact O-C 3.35Å; A411-L414 WeakPolarHBondContact O-CA 3.26Å; A411-L414 WeakPolarHBondContact O-CB 3.43Å; A411-L414 PolarHBondContact O-N 2.99Å; A411-G415 PolarHBondContact O-N 2.91Å; A411-G415 VanDerWaalsContact O-N 3.17Å; A411-Y416 CarbonylContact C-O 3.02Å; A411-Y416 PolarHBondContact O-N 2.79Å; A411-Y416 VanDerWaalsContact O-O 3.05Å; A411-F418 HydrophobicContact CB-CD2 3.57Å; A411-F418 HydrophobicContact CB-CE2 3.94Å; A411-F418 HydrophobicContact CB-CG 4.45Å
412	C	72.6	Confident	69.9	Low	6 Å²	6	48.2 Å²	48.2	4%	0.041	28%	0.284	C	S	.	.	H	α-helix	trans	-67.4	-39	179	-173.1	0	0	0	0	112.3	I402 C404 S408 V409 V410 L414 G415 Y416	I402-C412 PolarHBondContact O-SG 3.36Å; C404-C412 HydrophobicContact CB-CB 3.48Å; C404-C412 VanDerWaalsContact CB-CB 3.48Å; C404-C412 WeakPolarHBondContact CB-SG 3.29Å; C404-C412 WeakPolarHBondContact SG-CB 3.2Å; C404-C412 CovalentContact SG-SG 2.04Å; C404-C412 PolarHBondContact SG-SG 3.42Å; S408-C412 PolarHBondContact O-N 3.43Å; S408-C412 VanDerWaalsContact O-N 3.08Å; V409-C412 WeakPolarHBondContact O-CB 3.46Å; V409-C412 PolarHBondContact O-N 3.07Å; V410-C412 VanDerWaalsContact C-N 3.32Å; V410-C412 PolarHBondContact O-N 3.37Å; C412-L414 PolarHBondContact O-N 3.14Å; C412-G415 PolarHBondContact O-N 3Å; C412-Y416 VanDerWaalsContact CA-O 3.32Å; C412-Y416 WeakPolarHBondContact CA-O 3.37Å; C412-Y416 PolarHBondContact N-O 3.26Å; C412-Y416 VanDerWaalsContact N-O 3.14Å
413	E	72.2	Confident	70.4	Confident	101 Å²	101	49 Å²	49	47%	0.472	29%	0.294	S	S	.	.	H	α-helix	trans	-63	-22.9	169	-70.5	-168.7	108.2	0	0	113.5	K313 V409 V410	K313-E413 VanDerWaalsContact CD-OE2 3.27Å; K313-E413 WeakPolarHBondContact CD-OE2 3.31Å; K313-E413 WeakPolarHBondContact CE-OE2 3.48Å; K313-E413 IonicContact NZ-OE1 3.93Å; K313-E413 PolarHBondContact NZ-OE1 3.04Å; K313-E413 IonicContact NZ-OE2 2.71Å; K313-E413 PolarHBondContact NZ-OE2 2.98Å; V409-E413 PolarHBondContact O-N 3Å; V410-E413 PolarHBondContact O-N 2.98Å
414	L	75.9	Confident	71.4	Confident	57 Å²	57	50.2 Å²	50.2	30%	0.298	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	7.5	175.3	-63.2	171.7	0	0	0	113.3	F308 N311 I314 V410 A411 C412	F308-L414 HydrophobicContact CB-CD1 4.32Å; F308-L414 HydrophobicContact CD1-CB 4.21Å; F308-L414 HydrophobicContact CD1-CD1 4.11Å; F308-L414 HydrophobicContact CD2-CD1 4.45Å; F308-L414 HydrophobicContact CE1-CB 4.1Å; F308-L414 HydrophobicContact CG-CD1 4.04Å; N311-L414 WeakPolarHBondContact ND2-CD2 3.43Å; I314-L414 HydrophobicContact CD1-CD1 3.89Å; I314-L414 HydrophobicContact CG1-CD1 4.22Å; V410-L414 HydrophobicContact CG1-CD1 4.21Å; V410-L414 VanDerWaalsContact O-CG 3.29Å; V410-L414 WeakPolarHBondContact O-CG 3.45Å; V410-L414 PolarHBondContact O-N 3.45Å; A411-L414 CarbonylContact O-C 3.35Å; A411-L414 WeakPolarHBondContact O-CA 3.26Å; A411-L414 WeakPolarHBondContact O-CB 3.43Å; A411-L414 PolarHBondContact O-N 2.99Å; C412-L414 PolarHBondContact O-N 3.14Å
415	G	74.7	Confident	72	Confident	8 Å²	8	55.1 Å²	55.1	8%	0.082	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	14.6	173	0	0	0	0	0	115.8	L397 V398 A411 C412	L397-G415 WeakPolarHBondContact CA-O 3.18Å; V398-G415 PolarHBondContact N-O 3.12Å; V398-G415 WeakPolarHBondContact O-CA 3.48Å; A411-G415 PolarHBondContact O-N 2.91Å; A411-G415 VanDerWaalsContact O-N 3.17Å; C412-G415 PolarHBondContact O-N 3Å
416	Y	78.8	Confident	73.1	Confident	9 Å²	9	49.3 Å²	49.3	4%	0.035	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-126.4	124.3	177.2	-74.6	-99.5	0	0	0	110.9	K303 F308 D396 L397 A411 C412 F418	K303-Y416 HydrophobicContact CB-CE1 4.34Å; K303-Y416 HydrophobicContact CB-CE2 3.81Å; K303-Y416 WeakPolarHBondContact CB-OH 3.37Å; K303-Y416 HydrophobicContact CD-CE2 4.08Å; F308-Y416 AromaticContact CE1-CD2 3.61Å; F308-Y416 HydrophobicContact CE1-CD2 3.61Å; F308-Y416 AromaticContact CE1-CE2 3.97Å; F308-Y416 HydrophobicContact CE1-CE2 3.97Å; F308-Y416 HydrophobicContact CE1-CG 4.33Å; F308-Y416 AromaticContact CZ-CD2 3.9Å; F308-Y416 HydrophobicContact CZ-CD2 3.9Å; F308-Y416 HydrophobicContact CZ-CG 4.16Å; D396-Y416 WeakPolarHBondContact O-CA 3.21Å; L397-Y416 HydrophobicContact CD1-CE1 4.49Å; L397-Y416 HydrophobicContact CD2-CE2 4.4Å; L397-Y416 HydrophobicContact CG-CE1 4.07Å; L397-Y416 HydrophobicContact CG-CE2 4.45Å; A411-Y416 CarbonylContact C-O 3.02Å; A411-Y416 PolarHBondContact O-N 2.79Å; A411-Y416 VanDerWaalsContact O-O 3.05Å; C412-Y416 VanDerWaalsContact CA-O 3.32Å; C412-Y416 WeakPolarHBondContact CA-O 3.37Å; C412-Y416 PolarHBondContact N-O 3.26Å; C412-Y416 VanDerWaalsContact N-O 3.14Å; Y416-F418 HydrophobicContact CD1-CE1 4.24Å; Y416-F418 HydrophobicContact CD1-CZ 4.12Å; Y416-F418 HydrophobicContact CG-CZ 4.19Å
417	N	80.4	Confident	74.1	Confident	46 Å²	46	55.1 Å²	55.1	25%	0.246	31%	0.305	C	S	.	.			trans	-94	107.8	176.4	-177	26.6	0	0	0	112.1	D396 V398 C404 S419	D396-N417 PolarHBondContact O-N 3.01Å; V398-N417 HydrophobicContact CG2-CB 3.72Å; C404-N417 PolarHBondContact SG-OD1 3.49Å; N417-S419 PolarHBondContact ND2-OG 3.49Å; N417-S419 VanDerWaalsContact ND2-OG 3.09Å; N417-S419 WeakPolarHBondContact OD1-CB 3.34Å; N417-S419 PolarHBondContact OD1-N 2.83Å; N417-S419 PolarHBondContact OD1-OG 3.07Å
418	F	79.9	Confident	75.3	Confident	3 Å²	3	55.2 Å²	55.2	1%	0.013	30%	0.299	C	S	.	.			trans	-103.1	20.4	173.8	-56.5	-38.8	0	0	0	113.5	F308 V387 D389 A390 T391 A411 Y416 S420 C421	F308-F418 HydrophobicContact CE2-CE2 4.19Å; F308-F418 HydrophobicContact CZ-CE2 4.17Å; F308-F418 HydrophobicContact CZ-CZ 4.44Å; V387-F418 HydrophobicContact CG2-CD2 4.3Å; V387-F418 HydrophobicContact CG2-CE2 4.08Å; D389-F418 WeakPolarHBondContact O-CD2 3.3Å; A390-F418 HydrophobicContact CB-CD2 4.13Å; A390-F418 HydrophobicContact CB-CE1 4.32Å; A390-F418 HydrophobicContact CB-CE2 3.8Å; A390-F418 HydrophobicContact CB-CZ 3.9Å; T391-F418 HydrophobicContact CG2-CD1 3.94Å; A411-F418 HydrophobicContact CB-CD2 3.57Å; A411-F418 HydrophobicContact CB-CE2 3.94Å; A411-F418 HydrophobicContact CB-CG 4.45Å; Y416-F418 HydrophobicContact CD1-CE1 4.24Å; Y416-F418 HydrophobicContact CD1-CZ 4.12Å; Y416-F418 HydrophobicContact CG-CZ 4.19Å; F418-S420 PolarHBondContact O-N 3.36Å; F418-S420 VanDerWaalsContact O-N 3.09Å; F418-C421 VanDerWaalsContact O-CB 3.3Å; F418-C421 WeakPolarHBondContact O-CB 3.44Å; F418-C421 PolarHBondContact O-N 2.9Å; F418-C421 PolarHBondContact O-SG 2.72Å
419	S	73.4	Confident	76.4	Confident	46 Å²	46	54.8 Å²	54.8	32%	0.322	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-61.1	-20.1	-177.9	70	0	0	0	0	114.4	S408 N417 C421 E422	S408-S419 PolarHBondContact OG-N 3.49Å; N417-S419 PolarHBondContact ND2-OG 3.49Å; N417-S419 VanDerWaalsContact ND2-OG 3.09Å; N417-S419 WeakPolarHBondContact OD1-CB 3.34Å; N417-S419 PolarHBondContact OD1-N 2.83Å; N417-S419 PolarHBondContact OD1-OG 3.07Å; S419-C421 PolarHBondContact O-N 3.29Å; S419-E422 PolarHBondContact O-N 3.35Å
420	S	74.9	Confident	77.1	Confident	47 Å²	47	51.9 Å²	51.9	33%	0.329	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-62.3	-23.6	172.7	45.5	0	0	0	0	113.2	T391 F418 E422 T423 E424	T391-S420 WeakPolarHBondContact CG2-OG 3.49Å; F418-S420 PolarHBondContact O-N 3.36Å; F418-S420 VanDerWaalsContact O-N 3.09Å; S420-E422 PolarHBondContact O-N 2.9Å; S420-T423 PolarHBondContact O-N 3.42Å; S420-T423 VanDerWaalsContact O-N 3.08Å; S420-T423 PolarHBondContact O-OG1 3.02Å; S420-E424 PolarHBondContact O-N 3.1Å
421	C	76.6	Confident	77.7	Confident	13 Å²	13	51.4 Å²	51.4	9%	0.088	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-68.1	-13.1	178.4	-56.6	0	0	0	0	114.2	D389 F418 S419 E424 C426	D389-C421 HydrophobicContact CB-CB 3.69Å; F418-C421 VanDerWaalsContact O-CB 3.3Å; F418-C421 WeakPolarHBondContact O-CB 3.44Å; F418-C421 PolarHBondContact O-N 2.9Å; F418-C421 PolarHBondContact O-SG 2.72Å; S419-C421 PolarHBondContact O-N 3.29Å; C421-E424 WeakPolarHBondContact CA-O 3.35Å; C421-C426 WeakPolarHBondContact CA-SG 3.27Å; C421-C426 HydrophobicContact CB-CB 3.76Å; C421-C426 WeakPolarHBondContact CB-SG 3.38Å; C421-C426 WeakPolarHBondContact SG-CB 3.39Å; C421-C426 CovalentContact SG-SG 2.03Å; C421-C426 PolarHBondContact SG-SG 3.5Å
422	E	72.8	Confident	78.4	Confident	113 Å²	113	54.1 Å²	54.1	53%	0.528	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-78.7	-22	171.4	-62.7	-164.8	142.6	0	0	112.6	G406 S407 S419 S420	G406-E422 WeakPolarHBondContact CA-OE1 3.5Å; S407-E422 PolarHBondContact N-OE1 3.22Å; S419-E422 PolarHBondContact O-N 3.35Å; S420-E422 PolarHBondContact O-N 2.9Å
423	T	72.6	Confident	78.9	Confident	120 Å²	120	55.1 Å²	55.1	74%	0.736	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	-28.7	-176.1	49.2	0	0	0	0	114.1	S420	S420-T423 PolarHBondContact O-N 3.42Å; S420-T423 VanDerWaalsContact O-N 3.08Å; S420-T423 PolarHBondContact O-OG1 3.02Å
424	E	76.1	Confident	79.5	Confident	141 Å²	141	52.8 Å²	52.8	66%	0.659	28%	0.283	S	S	*	.	S	Bend	trans	-127.5	145.2	178.6	-66.3	-168.6	169.2	0	0	110.9	S420 C421 C426	S420-E424 PolarHBondContact O-N 3.1Å; C421-E424 WeakPolarHBondContact CA-O 3.35Å; E424-C426 PolarHBondContact O-N 3.31Å
425	P	75.4	Confident	80	Confident	126 Å²	126	51.2 Å²	51.2	82%	0.818	27%	0.274	S	S	*	.			trans	-68.2	104.7	179.3	27.9	-34.2	0	0	0	111.2
426	C	82.1	Confident	80.6	Confident	17 Å²	17	50.9 Å²	50.9	12%	0.115	27%	0.27	C	S	.	.			trans	-66.8	154	177.7	-87.2	0	0	0	0	113.1	C421 E424 N432	C421-C426 WeakPolarHBondContact CA-SG 3.27Å; C421-C426 HydrophobicContact CB-CB 3.76Å; C421-C426 WeakPolarHBondContact CB-SG 3.38Å; C421-C426 WeakPolarHBondContact SG-CB 3.39Å; C421-C426 CovalentContact SG-SG 2.03Å; C421-C426 PolarHBondContact SG-SG 3.5Å; E424-C426 PolarHBondContact O-N 3.31Å; C426-N432 WeakPolarHBondContact O-CB 3.27Å
427	K	81.7	Confident	81	Confident	161 Å²	161	50.5 Å²	50.5	70%	0.7	27%	0.269	S	S	*	.	S	Bend	trans	-95.3	-16.2	-172.2	-64.7	-177.7	-175.8	178.2	0	114.4
428	F	85.7	Confident	81.4	Confident	55 Å²	55	49.9 Å²	49.9	24%	0.241	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-130.2	-176	-176.1	-58.7	-83.3	0	0	0	111.4	K305 A390 G392 N432 N433 M439	K305-F428 HydrophobicContact CB-CB 4.28Å; K305-F428 HydrophobicContact CB-CD1 4.1Å; K305-F428 HydrophobicContact CB-CG 4.13Å; K305-F428 HydrophobicContact CD-CD1 4.41Å; K305-F428 HydrophobicContact CD-CE1 4.16Å; K305-F428 HydrophobicContact CD-CZ 4.45Å; K305-F428 HydrophobicContact CG-CD1 3.99Å; K305-F428 HydrophobicContact CG-CD2 4.27Å; K305-F428 HydrophobicContact CG-CE1 4.11Å; K305-F428 HydrophobicContact CG-CE2 4.38Å; K305-F428 HydrophobicContact CG-CG 4.08Å; K305-F428 HydrophobicContact CG-CZ 4.3Å; K305-F428 WeakPolarHBondContact O-CB 3.47Å; A390-F428 HydrophobicContact CB-CB 4.01Å; A390-F428 PolarHBondContact N-O 3.2Å; A390-F428 CarbonylContact O-C 3.23Å; A390-F428 WeakPolarHBondContact O-CA 3.48Å; A390-F428 WeakPolarHBondContact O-CB 3.3Å; A390-F428 PolarHBondContact O-N 3.03Å; G392-F428 VanDerWaalsContact CA-CD2 3.48Å; F428-N432 PolarHBondContact O-ND2 3.45Å; F428-N433 HydrophobicContact CD1-CB 4.44Å; F428-M439 HydrophobicContact CD1-CE 4.07Å
429	G	85.4	Confident	81.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.272	C	S	.	.	S	Bend	trans	85.7	169.6	-166.2	0	0	0	0	0	113.7	V387 R388 M431 N432 N433	V387-G429 WeakPolarHBondContact O-CA 3.26Å; R388-G429 CarbonylContact O-C 3.32Å; R388-G429 VanDerWaalsContact O-C 3.23Å; R388-G429 WeakPolarHBondContact O-CA 3.33Å; G429-M431 PolarHBondContact O-N 2.84Å; G429-N432 PolarHBondContact O-N 3.22Å; G429-N433 PolarHBondContact O-N 2.99Å
430	L	84.9	Confident	82.4	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-34	-177.2	-71.3	166.3	0	0	0	114.6	N318 V382 V386 V387 R388 V436	N318-L430 WeakPolarHBondContact ND2-CD1 3.37Å; N318-L430 WeakPolarHBondContact OD1-CD1 3.48Å; V382-L430 HydrophobicContact CG1-CD2 3.73Å; V386-L430 HydrophobicContact CB-CD2 4.13Å; V386-L430 HydrophobicContact CB-CG 4.11Å; V386-L430 HydrophobicContact CG1-CD2 4.38Å; V386-L430 HydrophobicContact CG1-CG 4.11Å; V386-L430 WeakPolarHBondContact O-CD1 3.43Å; V387-L430 PolarHBondContact O-N 3.31Å; R388-L430 PolarHBondContact O-N 3.34Å; L430-V436 HydrophobicContact CD2-CG1 4.47Å
431	M	84.4	Confident	83.1	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.039	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-27.3	-170	-65	177.8	110.3	0	0	113.4	W151 D322 R324 R388 G429	W151-M431 VanDerWaalsContact CD1-O 3.29Å; D322-M431 HydrophobicContact CB-CE 3.94Å; D322-M431 WeakPolarHBondContact O-CE 3.33Å; R324-M431 HydrophobicContact CG-CE 3.87Å; R324-M431 PolarHBondContact NH2-SD 3.21Å; R388-M431 HydrophobicContact CB-CG 4.27Å; R388-M431 HydrophobicContact CB-SD 3.83Å; R388-M431 HydrophobicContact CG-SD 4.26Å; R388-M431 PolarHBondContact O-N 3.22Å; G429-M431 PolarHBondContact O-N 2.84Å
432	N	84.9	Confident	83.5	Confident	58 Å²	58	47.7 Å²	47.7	31%	0.31	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-27.3	-169.8	-49.2	-58.4	0	0	0	113.4	D389 C426 F428 G429	D389-N432 PolarHBondContact OD1-ND2 3.43Å; C426-N432 WeakPolarHBondContact O-CB 3.27Å; F428-N432 PolarHBondContact O-ND2 3.45Å; G429-N432 PolarHBondContact O-N 3.22Å
433	N	84.5	Confident	84.3	Confident	27 Å²	27	48.3 Å²	48.3	14%	0.144	26%	0.257	C	S	.	.			trans	-110.2	112	-179.3	178.9	14.9	0	0	0	111.9	F428 G429 Q435 V436	F428-N433 HydrophobicContact CD1-CB 4.44Å; G429-N433 PolarHBondContact O-N 2.99Å; N433-Q435 VanDerWaalsContact C-N 3.28Å; N433-Q435 PolarHBondContact O-N 2.81Å; N433-Q435 WeakPolarHBondContact OD1-CA 3.25Å; N433-Q435 WeakPolarHBondContact OD1-CB 3.36Å; N433-Q435 PolarHBondContact OD1-N 3.02Å; N433-V436 HydrophobicContact CB-CG2 4.03Å; N433-V436 WeakPolarHBondContact O-CG2 3.42Å; N433-V436 PolarHBondContact O-N 3.02Å
434	F	84.4	Confident	84.9	Confident	52 Å²	52	43.5 Å²	43.5	23%	0.228	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-24.9	175.2	-60.8	-53.2	0	0	0	113.6	I147 R148 W151 V436	I147-F434 HydrophobicContact CG2-CB 3.81Å; I147-F434 WeakPolarHBondContact O-CB 3.49Å; R148-F434 VanDerWaalsContact NH1-CD1 3.28Å; R148-F434 VanDerWaalsContact NH1-CD2 3.3Å; W151-F434 HydrophobicContact CB-CD1 4.14Å; W151-F434 HydrophobicContact CB-CE1 4.11Å; W151-F434 AromaticContact CD1-CE1 3.59Å; W151-F434 HydrophobicContact CD2-CE1 4.41Å; W151-F434 HydrophobicContact CG-CD1 4.32Å; W151-F434 AromaticContact CG-CE1 3.79Å; W151-F434 HydrophobicContact CG-CE1 3.79Å; F434-V436 VanDerWaalsContact C-N 3.28Å; F434-V436 PolarHBondContact O-N 3.22Å
435	Q	85.9	Confident	85.6	Confident	25 Å²	25	40.4 Å²	40.4	12%	0.117	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	19.6	179.4	-56	-63.4	-18.3	0	0	113.7	D234 N433 M437 T438 M439	D234-Q435 HydrophobicContact CB-CG 4.35Å; D234-Q435 WeakPolarHBondContact OD2-CG 3.37Å; D234-Q435 PolarHBondContact OD2-NE2 3.09Å; N433-Q435 VanDerWaalsContact C-N 3.28Å; N433-Q435 PolarHBondContact O-N 2.81Å; N433-Q435 WeakPolarHBondContact OD1-CA 3.25Å; N433-Q435 WeakPolarHBondContact OD1-CB 3.36Å; N433-Q435 PolarHBondContact OD1-N 3.02Å; Q435-M437 PolarHBondContact O-N 3.25Å; Q435-M437 VanDerWaalsContact O-N 3.17Å; Q435-T438 WeakPolarHBondContact O-CB 3.42Å; Q435-T438 PolarHBondContact O-N 3.45Å; Q435-M439 PolarHBondContact O-N 3.41Å
436	V	87.6	Confident	86.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-54.5	-34	178.4	158.7	0	0	0	0	112.8	V382 V386 L430 N433 F434 T438 M439 V440	V382-V436 HydrophobicContact CG1-CG1 3.67Å; V386-V436 HydrophobicContact CG1-CG1 4.24Å; V386-V436 HydrophobicContact CG2-CG1 4.08Å; L430-V436 HydrophobicContact CD2-CG1 4.47Å; N433-V436 HydrophobicContact CB-CG2 4.03Å; N433-V436 WeakPolarHBondContact O-CG2 3.42Å; N433-V436 PolarHBondContact O-N 3.02Å; F434-V436 VanDerWaalsContact C-N 3.28Å; F434-V436 PolarHBondContact O-N 3.22Å; V436-T438 VanDerWaalsContact C-N 3.32Å; V436-T438 PolarHBondContact O-N 3.23Å; V436-M439 HydrophobicContact CG2-CE 4.17Å; V436-M439 WeakPolarHBondContact O-CB 3.27Å; V436-M439 PolarHBondContact O-N 2.84Å; V436-V440 HydrophobicContact CG1-CG2 3.97Å; V436-V440 WeakPolarHBondContact O-CB 3.11Å; V436-V440 VanDerWaalsContact O-CG2 3.3Å; V436-V440 WeakPolarHBondContact O-CG2 3.49Å; V436-V440 PolarHBondContact O-N 3.39Å
437	M	87.9	Confident	86.8	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-64.8	-36	176.9	-64.1	-146	-176.5	0	0	113.3	L145 F146 L149 V378 V382 Q435 M439 V440 S441 I447	L145-M437 WeakPolarHBondContact O-CE 3.19Å; L145-M437 VanDerWaalsContact O-SD 3.4Å; F146-M437 HydrophobicContact CD1-CB 4.46Å; F146-M437 HydrophobicContact CD1-SD 4Å; F146-M437 WeakPolarHBondContact O-CG 3.31Å; L149-M437 HydrophobicContact CB-CE 3.81Å; L149-M437 HydrophobicContact CD2-CE 3.87Å; L149-M437 HydrophobicContact CG-CE 4.27Å; V378-M437 HydrophobicContact CG1-CE 3.5Å; V378-M437 HydrophobicContact CG1-SD 3.79Å; V382-M437 HydrophobicContact CG2-CE 4.43Å; Q435-M437 PolarHBondContact O-N 3.25Å; Q435-M437 VanDerWaalsContact O-N 3.17Å; M437-M439 VanDerWaalsContact C-N 3.35Å; M437-V440 PolarHBondContact O-N 3.41Å; M437-S441 WeakPolarHBondContact O-CB 3.29Å; M437-S441 PolarHBondContact O-N 3.18Å; M437-S441 VanDerWaalsContact O-N 3.07Å; M437-I447 HydrophobicContact CB-CG2 4.26Å
438	T	88.3	Confident	87.2	Confident	34 Å²	34	28.9 Å²	28.9	21%	0.209	16%	0.161	C	C	.	.	H	α-helix	trans	-62.6	-44.2	174.2	-54.3	0	0	0	0	110.2	Q435 V436 S441 T448	Q435-T438 WeakPolarHBondContact O-CB 3.42Å; Q435-T438 PolarHBondContact O-N 3.45Å; V436-T438 VanDerWaalsContact C-N 3.32Å; V436-T438 PolarHBondContact O-N 3.23Å; T438-S441 PolarHBondContact O-OG 2.83Å; T438-T448 HydrophobicContact CG2-CG2 4.12Å
439	M	87	Confident	87.5	Confident	24 Å²	24	28 Å²	28	12%	0.118	16%	0.164	C	C	.	.	H	α-helix	trans	-63.7	-44.9	176.3	-172.1	-151.7	-54.2	0	0	113.1	K302 K305 F307 F428 Q435 V436 M437	K302-M439 WeakPolarHBondContact CE-O 3.48Å; K302-M439 PolarHBondContact NZ-O 3.18Å; K305-M439 HydrophobicContact CB-CE 3.73Å; K305-M439 HydrophobicContact CB-SD 3.66Å; K305-M439 WeakPolarHBondContact O-CE 3.19Å; F307-M439 HydrophobicContact CB-SD 4.22Å; F428-M439 HydrophobicContact CD1-CE 4.07Å; Q435-M439 PolarHBondContact O-N 3.41Å; V436-M439 HydrophobicContact CG2-CE 4.17Å; V436-M439 WeakPolarHBondContact O-CB 3.27Å; V436-M439 PolarHBondContact O-N 2.84Å; M437-M439 VanDerWaalsContact C-N 3.35Å
440	V	87.9	Confident	87.8	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-70.4	-31.4	-177.2	169.7	0	0	0	0	112.2	G293 T294 F307 V386 V436 M437	G293-V440 CarbonylContact C-O 3.5Å; G293-V440 VanDerWaalsContact C-O 3.32Å; G293-V440 WeakPolarHBondContact CA-O 3.36Å; T294-V440 HydrophobicContact CG2-CG1 3.4Å; T294-V440 VanDerWaalsContact CG2-CG1 3.4Å; F307-V440 HydrophobicContact CD2-CB 4.48Å; F307-V440 HydrophobicContact CD2-CG1 4.36Å; F307-V440 HydrophobicContact CD2-CG2 3.89Å; F307-V440 HydrophobicContact CE2-CG1 4.02Å; F307-V440 HydrophobicContact CE2-CG2 4.38Å; V386-V440 HydrophobicContact CG2-CG2 3.43Å; V386-V440 VanDerWaalsContact CG2-CG2 3.43Å; V436-V440 HydrophobicContact CG1-CG2 3.97Å; V436-V440 WeakPolarHBondContact O-CB 3.11Å; V436-V440 VanDerWaalsContact O-CG2 3.3Å; V436-V440 WeakPolarHBondContact O-CG2 3.49Å; V436-V440 PolarHBondContact O-N 3.39Å; M437-V440 PolarHBondContact O-N 3.41Å
441	S	89.1	Confident	88	Confident	1 Å²	1	28 Å²	28	1%	0.007	16%	0.164	C	C	.	.	S	Bend	trans	-62.2	160.5	-176.2	75.5	0	0	0	0	115.1	K302 M437 T438 F443 G444 I447	K302-S441 PolarHBondContact NZ-O 3.16Å; M437-S441 WeakPolarHBondContact O-CB 3.29Å; M437-S441 PolarHBondContact O-N 3.18Å; M437-S441 VanDerWaalsContact O-N 3.07Å; T438-S441 PolarHBondContact O-OG 2.83Å; S441-F443 PolarHBondContact OG-O 3.5Å; S441-G444 WeakPolarHBondContact OG-CA 3.42Å; S441-G444 PolarHBondContact OG-N 2.84Å; S441-I447 WeakPolarHBondContact OG-CG1 3.48Å
442	G	85.4	Confident	88.4	Confident	37 Å²	37	30.3 Å²	30.3	38%	0.381	17%	0.174	S	C	.	.	S	Bend	trans	-67.7	-42	175.3	0	0	0	0	0	112.1	N289	N289-G442 PolarHBondContact O-N 2.9Å; N289-G442 PolarHBondContact OD1-N 3.41Å
443	F	89.6	Confident	88.7	Confident	127 Å²	127	27.7 Å²	27.7	56%	0.557	16%	0.16	S	C	*	.	S	Bend	trans	-132.7	105.5	176.2	-175.8	-124.3	0	0	0	111.2	N289 S441 P445 L446	N289-F443 PolarHBondContact ND2-O 2.97Å; N289-F443 PolarHBondContact OD1-N 2.7Å; S441-F443 PolarHBondContact OG-O 3.5Å; F443-P445 HydrophobicContact CE1-CB 4.01Å; F443-P445 HydrophobicContact CE1-CG 4.32Å; F443-P445 HydrophobicContact CE2-CG 3.95Å; F443-P445 HydrophobicContact CZ-CB 3.94Å; F443-P445 HydrophobicContact CZ-CG 3.82Å; F443-L446 HydrophobicContact CD1-CB 3.75Å; F443-L446 HydrophobicContact CE1-CB 4.45Å; F443-L446 WeakPolarHBondContact O-CB 3.26Å; F443-L446 PolarHBondContact O-N 3.26Å
444	G	85.7	Confident	89	Confident	18 Å²	18	26.4 Å²	26.4	19%	0.186	15%	0.154	C	C	.	.	H	α-helix	trans	-55.1	-48.2	-174.1	0	0	0	0	0	115.8	S441 L446 I447 T448	S441-G444 WeakPolarHBondContact OG-CA 3.42Å; S441-G444 PolarHBondContact OG-N 2.84Å; G444-L446 PolarHBondContact O-N 2.89Å; G444-I447 WeakPolarHBondContact O-CB 3.49Å; G444-I447 PolarHBondContact O-N 3.32Å; G444-T448 PolarHBondContact O-N 2.94Å
445	P	90.5	Very high	89.3	Confident	76 Å²	76	24 Å²	24	49%	0.494	14%	0.143	S	C	.	.	H	α-helix	trans	-59.7	-17.8	-179.3	-27.6	36.5	0	0	0	115.2	F443 T448 A449	F443-P445 HydrophobicContact CE1-CB 4.01Å; F443-P445 HydrophobicContact CE1-CG 4.32Å; F443-P445 HydrophobicContact CE2-CG 3.95Å; F443-P445 HydrophobicContact CZ-CB 3.94Å; F443-P445 HydrophobicContact CZ-CG 3.82Å; P445-T448 WeakPolarHBondContact CA-OG1 3.49Å; P445-T448 PolarHBondContact O-OG1 2.97Å; P445-T448 VanDerWaalsContact O-OG1 3.08Å; P445-A449 WeakPolarHBondContact O-CB 3.23Å; P445-A449 PolarHBondContact O-N 2.96Å; P445-A449 VanDerWaalsContact O-N 3.13Å
446	L	91.1	Very high	89.5	Confident	45 Å²	45	25.1 Å²	25.1	24%	0.236	15%	0.149	C	C	.	.	H	α-helix	trans	-81.2	-25.1	174.3	176.4	60.3	0	0	0	112.4	V285 A286 N289 F443 G444 G450	V285-L446 HydrophobicContact CG1-CD1 4.05Å; V285-L446 HydrophobicContact CG1-CD2 3.93Å; V285-L446 HydrophobicContact CG1-CG 4.44Å; A286-L446 WeakPolarHBondContact CB-O 3.3Å; N289-L446 HydrophobicContact CB-CD2 3.84Å; N289-L446 HydrophobicContact CB-CG 4.36Å; F443-L446 HydrophobicContact CD1-CB 3.75Å; F443-L446 HydrophobicContact CE1-CB 4.45Å; F443-L446 WeakPolarHBondContact O-CB 3.26Å; F443-L446 PolarHBondContact O-N 3.26Å; G444-L446 PolarHBondContact O-N 2.89Å; L446-G450 PolarHBondContact O-N 3.49Å
447	I	90.9	Very high	89.5	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-74.2	-40.5	169.5	-57.2	-54.6	0	0	0	111.1	F146 A286 N289 V290 M437 S441 G444 G450 T451	F146-I447 HydrophobicContact CD1-CG2 3.77Å; F146-I447 HydrophobicContact CE1-CD1 4.38Å; F146-I447 HydrophobicContact CE1-CG2 4.19Å; F146-I447 HydrophobicContact CG-CG2 4.32Å; A286-I447 HydrophobicContact CB-CD1 4.3Å; A286-I447 WeakPolarHBondContact O-CD1 3.37Å; N289-I447 HydrophobicContact CB-CD1 4.31Å; N289-I447 WeakPolarHBondContact ND2-CD1 3.38Å; V290-I447 HydrophobicContact CG2-CD1 3.57Å; M437-I447 HydrophobicContact CB-CG2 4.26Å; S441-I447 WeakPolarHBondContact OG-CG1 3.48Å; G444-I447 WeakPolarHBondContact O-CB 3.49Å; G444-I447 PolarHBondContact O-N 3.32Å; I447-G450 CarbonylContact O-C 3.38Å; I447-G450 PolarHBondContact O-N 2.86Å; I447-T451 WeakPolarHBondContact O-CB 3.32Å; I447-T451 PolarHBondContact O-N 3.08Å; I447-T451 PolarHBondContact O-OG1 3.41Å
448	T	90.6	Very high	89.6	Confident	17 Å²	17	25.1 Å²	25.1	10%	0.104	15%	0.15	C	C	.	.	H	α-helix	trans	-66.7	-40.3	176.3	59.6	0	0	0	0	111	L235 T438 G444 P445 G450 T451 F452	L235-T448 HydrophobicContact CD1-CG2 4.25Å; L235-T448 HydrophobicContact CD2-CG2 4.37Å; T438-T448 HydrophobicContact CG2-CG2 4.12Å; G444-T448 PolarHBondContact O-N 2.94Å; P445-T448 WeakPolarHBondContact CA-OG1 3.49Å; P445-T448 PolarHBondContact O-OG1 2.97Å; P445-T448 VanDerWaalsContact O-OG1 3.08Å; T448-G450 PolarHBondContact O-N 3.46Å; T448-T451 PolarHBondContact O-N 2.94Å; T448-F452 VanDerWaalsContact O-CG 3.27Å; T448-F452 WeakPolarHBondContact O-CG 3.38Å; T448-F452 PolarHBondContact O-N 2.86Å
449	A	90.8	Very high	89.8	Confident	37 Å²	37	23.5 Å²	23.5	31%	0.306	14%	0.14	S	C	.	.	H	α-helix	trans	-60.6	-40.4	168.6	0	0	0	0	0	113.1	I282 P445 S453	I282-A449 HydrophobicContact CG2-CB 4.28Å; P445-A449 WeakPolarHBondContact O-CB 3.23Å; P445-A449 PolarHBondContact O-N 2.96Å; P445-A449 VanDerWaalsContact O-N 3.13Å; A449-S453 VanDerWaalsContact O-CB 3.3Å; A449-S453 WeakPolarHBondContact O-CB 3.43Å; A449-S453 PolarHBondContact O-N 3.39Å
450	G	91.4	Very high	89.8	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.2	-38.7	173	0	0	0	0	0	113.5	L446 I447 T448 S453 A454	L446-G450 PolarHBondContact O-N 3.49Å; I447-G450 CarbonylContact O-C 3.38Å; I447-G450 PolarHBondContact O-N 2.86Å; T448-G450 PolarHBondContact O-N 3.46Å; G450-S453 WeakPolarHBondContact O-CB 3.48Å; G450-S453 PolarHBondContact O-N 3.34Å; G450-A454 PolarHBondContact O-N 2.86Å
451	T	90.9	Very high	89.8	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67	-51.9	176.9	-57.6	0	0	0	0	110.2	F146 I147 T231 I447 T448 S453 A454 T455	F146-T451 HydrophobicContact CB-CG2 4.48Å; F146-T451 WeakPolarHBondContact CB-OG1 3.43Å; F146-T451 WeakPolarHBondContact CD2-OG1 3.35Å; F146-T451 WeakPolarHBondContact CG-OG1 3.22Å; I147-T451 HydrophobicContact CD1-CG2 3.81Å; I147-T451 HydrophobicContact CG1-CG2 3.99Å; T231-T451 HydrophobicContact CG2-CG2 4.09Å; T231-T451 WeakPolarHBondContact OG1-CG2 3.45Å; I447-T451 WeakPolarHBondContact O-CB 3.32Å; I447-T451 PolarHBondContact O-N 3.08Å; I447-T451 PolarHBondContact O-OG1 3.41Å; T448-T451 PolarHBondContact O-N 2.94Å; T451-S453 PolarHBondContact O-N 3.17Å; T451-A454 PolarHBondContact O-N 3.37Å; T451-A454 VanDerWaalsContact O-N 3.16Å; T451-T455 HydrophobicContact CG2-CG2 4.25Å; T451-T455 VanDerWaalsContact O-CG2 3.3Å; T451-T455 WeakPolarHBondContact O-CG2 3.32Å; T451-T455 PolarHBondContact O-N 2.9Å; T451-T455 PolarHBondContact O-OG1 3.36Å; T451-T455 VanDerWaalsContact O-OG1 3.1Å
452	F	91.9	Very high	89.8	Confident	57 Å²	57	23.7 Å²	23.7	25%	0.25	14%	0.143	C	C	.	.	H	α-helix	trans	-54.9	-37.4	172.7	-64.3	-13.8	0	0	0	112.2	F228 T231 V232 L235 T448 T455 L456	F228-F452 HydrophobicContact CD2-CB 4.35Å; F228-F452 AromaticContact CD2-CD1 3.58Å; F228-F452 HydrophobicContact CD2-CD1 3.58Å; F228-F452 HydrophobicContact CD2-CE1 4.16Å; F228-F452 HydrophobicContact CD2-CG 4.15Å; F228-F452 HydrophobicContact CE2-CB 4.09Å; F228-F452 AromaticContact CE2-CD1 3.45Å; F228-F452 HydrophobicContact CE2-CD1 3.45Å; F228-F452 VanDerWaalsContact CE2-CD1 3.45Å; F228-F452 HydrophobicContact CE2-CD2 4.37Å; F228-F452 AromaticContact CE2-CE1 3.89Å; F228-F452 HydrophobicContact CE2-CE1 3.89Å; F228-F452 AromaticContact CE2-CG 3.73Å; F228-F452 HydrophobicContact CE2-CG 3.73Å; T231-F452 HydrophobicContact CG2-CD1 4.27Å; T231-F452 HydrophobicContact CG2-CE1 3.7Å; V232-F452 HydrophobicContact CG2-CE1 3.67Å; V232-F452 HydrophobicContact CG2-CZ 3.81Å; L235-F452 HydrophobicContact CD1-CZ 3.79Å; T448-F452 VanDerWaalsContact O-CG 3.27Å; T448-F452 WeakPolarHBondContact O-CG 3.38Å; T448-F452 PolarHBondContact O-N 2.86Å; F452-T455 PolarHBondContact O-OG1 3.1Å; F452-L456 VanDerWaalsContact O-CB 3.26Å; F452-L456 WeakPolarHBondContact O-CB 3.36Å; F452-L456 WeakPolarHBondContact O-CG 3.38Å; F452-L456 PolarHBondContact O-N 3.27Å; F452-L456 VanDerWaalsContact O-N 3.08Å
453	S	90.6	Very high	90	Very high	3 Å²	3	21.9 Å²	21.9	2%	0.021	13%	0.125	C	C	.	.	H	α-helix	trans	-62.9	-52.2	176.1	-169	0	0	0	0	112.2	L279 A449 G450 T451 S457	L279-S453 WeakPolarHBondContact CA-OG 3.24Å; L279-S453 WeakPolarHBondContact CB-OG 3.41Å; L279-S453 WeakPolarHBondContact CD2-OG 3.43Å; L279-S453 PolarHBondContact O-OG 3.23Å; A449-S453 VanDerWaalsContact O-CB 3.3Å; A449-S453 WeakPolarHBondContact O-CB 3.43Å; A449-S453 PolarHBondContact O-N 3.39Å; G450-S453 WeakPolarHBondContact O-CB 3.48Å; G450-S453 PolarHBondContact O-N 3.34Å; T451-S453 PolarHBondContact O-N 3.17Å; S453-S457 VanDerWaalsContact O-CB 3.27Å; S453-S457 WeakPolarHBondContact O-CB 3.35Å; S453-S457 PolarHBondContact O-N 2.79Å; S453-S457 PolarHBondContact O-OG 2.9Å
454	A	90.6	Very high	89.9	Confident	1 Å²	1	16.4 Å²	16.4	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-63.3	-42.3	179.6	0	0	0	0	0	113.4	W141 L283 G450 T451 S457 S458	W141-A454 WeakPolarHBondContact O-CB 3.46Å; L283-A454 HydrophobicContact CD1-CB 4.06Å; L283-A454 HydrophobicContact CD2-CB 4.35Å; G450-A454 PolarHBondContact O-N 2.86Å; T451-A454 PolarHBondContact O-N 3.37Å; T451-A454 VanDerWaalsContact O-N 3.16Å; A454-S457 PolarHBondContact O-OG 3.18Å; A454-S458 VanDerWaalsContact O-CB 3.3Å; A454-S458 WeakPolarHBondContact O-CB 3.14Å; A454-S458 PolarHBondContact O-N 3.44Å; A454-S458 PolarHBondContact O-OG 2.95Å
455	T	92.1	Very high	90	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.006	10%	0.097	C	C	.	.	H	α-helix	trans	-70	-50.6	-178.7	58.5	0	0	0	0	111.5	V143 Y224 F228 T451 F452 S458 A459	V143-T455 HydrophobicContact CB-CG2 4.26Å; V143-T455 HydrophobicContact CG2-CG2 3.44Å; V143-T455 VanDerWaalsContact CG2-CG2 3.44Å; Y224-T455 WeakPolarHBondContact O-CB 3.32Å; F228-T455 HydrophobicContact CB-CG2 4.38Å; T451-T455 HydrophobicContact CG2-CG2 4.25Å; T451-T455 VanDerWaalsContact O-CG2 3.3Å; T451-T455 WeakPolarHBondContact O-CG2 3.32Å; T451-T455 PolarHBondContact O-N 2.9Å; T451-T455 PolarHBondContact O-OG1 3.36Å; T451-T455 VanDerWaalsContact O-OG1 3.1Å; F452-T455 PolarHBondContact O-OG1 3.1Å; T455-S458 PolarHBondContact O-N 3.34Å; T455-A459 VanDerWaalsContact O-CB 3.27Å; T455-A459 WeakPolarHBondContact O-CB 3.37Å; T455-A459 PolarHBondContact O-N 2.89Å
456	L	89.8	Confident	90	Very high	48 Å²	48	12.6 Å²	12.6	25%	0.251	7%	0.074	S	C	.	.	H	α-helix	trans	-69.9	-34.4	-177.6	-61.9	173.7	0	0	0	112.2	F228 T257 L261 F452 L460	F228-L456 HydrophobicContact CD1-CD2 4.43Å; F228-L456 HydrophobicContact CD2-CD1 4.23Å; F228-L456 HydrophobicContact CD2-CD2 3.95Å; F228-L456 HydrophobicContact CD2-CG 3.94Å; F228-L456 HydrophobicContact CE2-CD1 3.86Å; F228-L456 HydrophobicContact CE2-CD2 4.15Å; F228-L456 HydrophobicContact CE2-CG 4.09Å; F228-L456 HydrophobicContact CG-CD2 4.11Å; F228-L456 HydrophobicContact CZ-CD1 4.46Å; F228-L456 HydrophobicContact CZ-CD2 4.47Å; T257-L456 HydrophobicContact CG2-CD2 3.8Å; L261-L456 HydrophobicContact CD1-CD2 4.27Å; L261-L456 HydrophobicContact CD2-CD2 4.32Å; F452-L456 VanDerWaalsContact O-CB 3.26Å; F452-L456 WeakPolarHBondContact O-CB 3.36Å; F452-L456 WeakPolarHBondContact O-CG 3.38Å; F452-L456 PolarHBondContact O-N 3.27Å; F452-L456 VanDerWaalsContact O-N 3.08Å; L456-L460 VanDerWaalsContact O-CB 3.26Å; L456-L460 WeakPolarHBondContact O-CB 3.49Å; L456-L460 PolarHBondContact O-N 3.13Å
457	S	88.4	Confident	90	Very high	2 Å²	2	10.4 Å²	10.4	1%	0.014	6%	0.063	C	C	.	.	H	α-helix	trans	-64.8	-45.5	174.5	65.4	0	0	0	0	112.1	S453 A454 A461	S453-S457 VanDerWaalsContact O-CB 3.27Å; S453-S457 WeakPolarHBondContact O-CB 3.35Å; S453-S457 PolarHBondContact O-N 2.79Å; S453-S457 PolarHBondContact O-OG 2.9Å; A454-S457 PolarHBondContact O-OG 3.18Å; S457-A461 VanDerWaalsContact O-CB 3.31Å; S457-A461 WeakPolarHBondContact O-CB 3.15Å; S457-A461 PolarHBondContact O-N 3.25Å
458	S	89.6	Confident	89.8	Confident	0 Å²	0	13 Å²	13	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-69.4	-40.3	-179	-55.9	0	0	0	0	111.8	L138 A454 T455 S462	L138-S458 PolarHBondContact O-OG 2.93Å; A454-S458 VanDerWaalsContact O-CB 3.3Å; A454-S458 WeakPolarHBondContact O-CB 3.14Å; A454-S458 PolarHBondContact O-N 3.44Å; A454-S458 PolarHBondContact O-OG 2.95Å; T455-S458 PolarHBondContact O-N 3.34Å; S458-S462 VanDerWaalsContact O-CB 3.29Å; S458-S462 WeakPolarHBondContact O-CB 3.46Å; S458-S462 PolarHBondContact O-N 2.94Å; S458-S462 PolarHBondContact O-OG 3.39Å
459	A	91.5	Very high	89.7	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.1	-50.2	173.8	0	0	0	0	0	111.5	V225 L261 T455 S462 L463	V225-A459 HydrophobicContact CG2-CB 3.98Å; L261-A459 HydrophobicContact CD1-CB 3.68Å; T455-A459 VanDerWaalsContact O-CB 3.27Å; T455-A459 WeakPolarHBondContact O-CB 3.37Å; T455-A459 PolarHBondContact O-N 2.89Å; A459-S462 PolarHBondContact O-N 3.26Å; A459-L463 VanDerWaalsContact O-CB 3.23Å; A459-L463 WeakPolarHBondContact O-CB 3.48Å; A459-L463 PolarHBondContact O-N 2.88Å
460	L	88.3	Confident	89.7	Confident	12 Å²	12	11.9 Å²	11.9	6%	0.063	6%	0.061	C	C	.	.	H	α-helix	trans	-63.4	-43.9	-179.3	-174.5	64.8	0	0	0	111.9	L261 I264 E272 L456 L463 V464	L261-L460 HydrophobicContact CD2-CB 4.3Å; L261-L460 HydrophobicContact CD2-CD1 4.39Å; I264-L460 HydrophobicContact CB-CD1 4.4Å; I264-L460 HydrophobicContact CG2-CD1 4Å; I264-L460 HydrophobicContact CG2-CD2 4.15Å; E272-L460 HydrophobicContact CB-CD2 4.37Å; E272-L460 HydrophobicContact CG-CD2 3.92Å; E272-L460 HydrophobicContact CG-CG 4.2Å; L456-L460 VanDerWaalsContact O-CB 3.26Å; L456-L460 WeakPolarHBondContact O-CB 3.49Å; L456-L460 PolarHBondContact O-N 3.13Å; L460-L463 PolarHBondContact O-N 3.32Å; L460-V464 WeakPolarHBondContact O-CG2 3.4Å; L460-V464 PolarHBondContact O-N 3.42Å
461	A	87	Confident	89.6	Confident	12 Å²	12	12.7 Å²	12.7	10%	0.099	7%	0.065	C	C	.	.	H	α-helix	trans	-63.7	-40.9	177.7	0	0	0	0	0	112.2	N139 S457 V464 S465	N139-A461 WeakPolarHBondContact OD1-CB 3.37Å; S457-A461 VanDerWaalsContact O-CB 3.31Å; S457-A461 WeakPolarHBondContact O-CB 3.15Å; S457-A461 PolarHBondContact O-N 3.25Å; A461-V464 PolarHBondContact O-N 3.26Å; A461-S465 WeakPolarHBondContact O-CB 3.44Å; A461-S465 PolarHBondContact O-N 3.42Å
462	S	89.8	Confident	89.3	Confident	4 Å²	4	13.8 Å²	13.8	3%	0.028	7%	0.074	C	C	.	.	H	α-helix	trans	-67	-40.3	176.1	-59.4	0	0	0	0	112.3	Y224 S458 A459 V464 S465 A466	Y224-S462 WeakPolarHBondContact CE2-OG 3.31Å; S458-S462 VanDerWaalsContact O-CB 3.29Å; S458-S462 WeakPolarHBondContact O-CB 3.46Å; S458-S462 PolarHBondContact O-N 2.94Å; S458-S462 PolarHBondContact O-OG 3.39Å; A459-S462 PolarHBondContact O-N 3.26Å; S462-V464 VanDerWaalsContact C-N 3.29Å; S462-V464 PolarHBondContact O-N 2.94Å; S462-S465 WeakPolarHBondContact O-CB 3.46Å; S462-S465 PolarHBondContact O-N 2.87Å; S462-A466 PolarHBondContact O-N 3.46Å
463	L	89.9	Confident	89.1	Confident	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-66.2	-28.7	177.7	-176.9	59.6	0	0	0	112.7	V221 L261 A459 L460 P467 T502	V221-L463 HydrophobicContact CG1-CB 4.5Å; V221-L463 HydrophobicContact CG2-CB 3.84Å; V221-L463 HydrophobicContact CG2-CD1 4.49Å; L261-L463 HydrophobicContact CB-CD2 3.91Å; A459-L463 VanDerWaalsContact O-CB 3.23Å; A459-L463 WeakPolarHBondContact O-CB 3.48Å; A459-L463 PolarHBondContact O-N 2.88Å; L460-L463 PolarHBondContact O-N 3.32Å; L463-P467 WeakPolarHBondContact O-CD 3.21Å; L463-P467 WeakPolarHBondContact O-CG 3.37Å; L463-T502 HydrophobicContact CD1-CG2 3.73Å
464	V	87.4	Confident	89	Confident	12 Å²	12	11.1 Å²	11.1	7%	0.073	6%	0.062	C	C	.	.	H	α-helix	trans	-85.2	-32.6	172	175.9	0	0	0	0	112.1	L460 A461 S462 K468 Y499	L460-V464 WeakPolarHBondContact O-CG2 3.4Å; L460-V464 PolarHBondContact O-N 3.42Å; A461-V464 PolarHBondContact O-N 3.26Å; S462-V464 VanDerWaalsContact C-N 3.29Å; S462-V464 PolarHBondContact O-N 2.94Å; V464-K468 HydrophobicContact CG1-CD 3.89Å; V464-K468 WeakPolarHBondContact O-CD 3.49Å; V464-K468 WeakPolarHBondContact O-CG 3.29Å; V464-Y499 HydrophobicContact CG2-CE1 4.4Å
465	S	86.6	Confident	88.8	Confident	12 Å²	12	15.6 Å²	15.6	8%	0.084	8%	0.082	C	C	.	.	H	α-helix	trans	-63.2	-58.3	178.1	175.4	0	0	0	0	112.6	N217 N348 A461 S462 K468 V469	N217-S465 PolarHBondContact OD1-OG 3.07Å; N348-S465 PolarHBondContact ND2-OG 3.4Å; A461-S465 WeakPolarHBondContact O-CB 3.44Å; A461-S465 PolarHBondContact O-N 3.42Å; S462-S465 WeakPolarHBondContact O-CB 3.46Å; S462-S465 PolarHBondContact O-N 2.87Å; S465-K468 PolarHBondContact O-N 2.74Å; S465-V469 WeakPolarHBondContact O-CG2 3.31Å; S465-V469 PolarHBondContact O-N 3.42Å; S465-V469 VanDerWaalsContact O-N 3.11Å
466	A	91	Very high	88.3	Confident	1 Å²	1	17 Å²	17	1%	0.008	9%	0.089	C	C	.	.	H	α-helix	trans	-57.4	-48.5	-172	0	0	0	0	0	113.8	A214 N217 A218 S462 K468 F470 T502	A214-A466 VanDerWaalsContact O-CB 3.29Å; A214-A466 WeakPolarHBondContact O-CB 3.45Å; N217-A466 HydrophobicContact CB-CB 3.76Å; A218-A466 HydrophobicContact CB-CB 4.17Å; S462-A466 PolarHBondContact O-N 3.46Å; A466-K468 VanDerWaalsContact C-N 3.29Å; A466-K468 PolarHBondContact O-N 2.97Å; A466-F470 VanDerWaalsContact O-CB 3.28Å; A466-F470 WeakPolarHBondContact O-CB 3.46Å; A466-F470 PolarHBondContact O-N 3.42Å; A466-T502 HydrophobicContact CB-CG2 4.06Å
467	P	90.9	Very high	88.1	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.4	-32.7	179.2	-27.1	38.8	0	0	0	113.9	L463 Q471 P495 Y499	L463-P467 WeakPolarHBondContact O-CD 3.21Å; L463-P467 WeakPolarHBondContact O-CG 3.37Å; P467-Q471 VanDerWaalsContact O-CB 3.24Å; P467-Q471 WeakPolarHBondContact O-CB 3.27Å; P467-Q471 PolarHBondContact O-N 3.22Å; P467-P495 HydrophobicContact CB-CB 4.22Å; P467-P495 HydrophobicContact CB-CG 3.56Å; P467-Y499 HydrophobicContact CB-CD1 4.16Å; P467-Y499 HydrophobicContact CB-CD2 4.44Å; P467-Y499 HydrophobicContact CB-CE1 4.33Å; P467-Y499 HydrophobicContact CB-CG 4.19Å; P467-Y499 HydrophobicContact CG-CD1 3.59Å; P467-Y499 HydrophobicContact CG-CE1 3.95Å; P467-Y499 HydrophobicContact CG-CG 3.96Å
468	K	87.1	Confident	87.9	Confident	54 Å²	54	17.2 Å²	17.2	24%	0.235	9%	0.09	C	C	.	.	H	α-helix	trans	-78.2	-42.4	-176.2	-72.2	176.5	177.8	173	0	111.5	M269 V464 S465 A466 F470 Q471 A472 E494 P495 Y499	M269-K468 VanDerWaalsContact CG-NZ 3.32Å; M269-K468 PolarHBondContact SD-NZ 3.02Å; V464-K468 HydrophobicContact CG1-CD 3.89Å; V464-K468 WeakPolarHBondContact O-CD 3.49Å; V464-K468 WeakPolarHBondContact O-CG 3.29Å; S465-K468 PolarHBondContact O-N 2.74Å; A466-K468 VanDerWaalsContact C-N 3.29Å; A466-K468 PolarHBondContact O-N 2.97Å; K468-F470 VanDerWaalsContact C-N 3.34Å; K468-Q471 PolarHBondContact O-N 3.04Å; K468-A472 WeakPolarHBondContact O-CB 3.41Å; K468-A472 PolarHBondContact O-N 3.41Å; K468-E494 WeakPolarHBondContact CE-OE2 3.43Å; K468-E494 IonicContact NZ-OE1 2.66Å; K468-E494 PolarHBondContact NZ-OE1 3.46Å; K468-E494 VanDerWaalsContact NZ-OE1 3.08Å; K468-E494 IonicContact NZ-OE2 3.28Å; K468-E494 PolarHBondContact NZ-OE2 3.35Å; K468-P495 HydrophobicContact CG-CG 4.13Å; K468-Y499 WeakPolarHBondContact CE-OH 3.4Å; K468-Y499 PolarHBondContact NZ-OH 2.89Å
469	V	88.6	Confident	87.7	Confident	8 Å²	8	17.9 Å²	17.9	5%	0.048	9%	0.093	C	C	.	.	H	α-helix	trans	-57	-49.6	168.5	174.4	0	0	0	0	110.2	G210 F213 A214 S465 Q471 A472 L473	G210-V469 VanDerWaalsContact O-CG1 3.26Å; G210-V469 WeakPolarHBondContact O-CG1 3.43Å; F213-V469 HydrophobicContact CD1-CG1 4.15Å; F213-V469 HydrophobicContact CD1-CG2 3.93Å; F213-V469 HydrophobicContact CE1-CG2 3.95Å; A214-V469 HydrophobicContact CB-CB 4.27Å; A214-V469 HydrophobicContact CB-CG1 3.92Å; S465-V469 WeakPolarHBondContact O-CG2 3.31Å; S465-V469 PolarHBondContact O-N 3.42Å; S465-V469 VanDerWaalsContact O-N 3.11Å; V469-Q471 PolarHBondContact O-N 3.03Å; V469-A472 PolarHBondContact O-N 2.81Å; V469-L473 PolarHBondContact O-N 3.02Å
470	F	89.8	Confident	87.3	Confident	23 Å²	23	22.8 Å²	22.8	10%	0.101	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-41.5	-178.5	-163	-105.8	0	0	0	112.7	L211 A214 A466 K468 L473 C474 L482 F485 L501	L211-F470 HydrophobicContact CD1-CD2 4.18Å; L211-F470 HydrophobicContact CD1-CE2 3.65Å; A214-F470 HydrophobicContact CB-CB 4.15Å; A214-F470 HydrophobicContact CB-CD2 4.14Å; A466-F470 VanDerWaalsContact O-CB 3.28Å; A466-F470 WeakPolarHBondContact O-CB 3.46Å; A466-F470 PolarHBondContact O-N 3.42Å; K468-F470 VanDerWaalsContact C-N 3.34Å; F470-L473 PolarHBondContact O-N 2.95Å; F470-C474 WeakPolarHBondContact O-CB 3.25Å; F470-C474 PolarHBondContact O-N 3.01Å; F470-C474 PolarHBondContact O-SG 3.05Å; F470-L482 HydrophobicContact CE2-CD1 4.29Å; F470-L482 HydrophobicContact CZ-CD1 4.23Å; F470-L482 HydrophobicContact CZ-CD2 4.37Å; F470-F485 HydrophobicContact CD1-CB 3.98Å; F470-F485 HydrophobicContact CD1-CG 4.25Å; F470-F485 HydrophobicContact CE1-CB 3.69Å; F470-F485 AromaticContact CE1-CD1 3.97Å; F470-F485 HydrophobicContact CE1-CD1 3.97Å; F470-F485 AromaticContact CE1-CD2 3.8Å; F470-F485 HydrophobicContact CE1-CD2 3.8Å; F470-F485 HydrophobicContact CE1-CE2 4.41Å; F470-F485 AromaticContact CE1-CG 3.56Å; F470-F485 HydrophobicContact CE1-CG 3.56Å; F470-F485 HydrophobicContact CZ-CD2 4.43Å; F470-L501 HydrophobicContact CD1-CD2 4.19Å; F470-L501 HydrophobicContact CE1-CD2 3.5Å; F470-L501 HydrophobicContact CE2-CD2 4.36Å; F470-L501 HydrophobicContact CZ-CD2 3.61Å
471	Q	89.8	Confident	87.1	Confident	16 Å²	16	26.4 Å²	26.4	8%	0.075	15%	0.146	C	C	.	.	H	α-helix	trans	-65.2	-41	176.8	-168.2	-156	58.7	0	0	112.2	P467 K468 V469 C474 K475 G488 N493 P495	P467-Q471 VanDerWaalsContact O-CB 3.24Å; P467-Q471 WeakPolarHBondContact O-CB 3.27Å; P467-Q471 PolarHBondContact O-N 3.22Å; K468-Q471 PolarHBondContact O-N 3.04Å; V469-Q471 PolarHBondContact O-N 3.03Å; Q471-C474 PolarHBondContact O-N 3.37Å; Q471-K475 VanDerWaalsContact CD-NZ 3.33Å; Q471-K475 HydrophobicContact CG-CD 4.35Å; Q471-K475 WeakPolarHBondContact O-CG 3.23Å; Q471-K475 PolarHBondContact O-N 3.08Å; Q471-G488 VanDerWaalsContact NE2-CA 3.29Å; Q471-N493 PolarHBondContact NE2-O 3.22Å; Q471-P495 HydrophobicContact CB-CB 3.74Å; Q471-P495 HydrophobicContact CB-CG 4.44Å; Q471-P495 HydrophobicContact CG-CB 3.92Å
472	A	84.9	Confident	87.1	Confident	23 Å²	23	27.9 Å²	27.9	19%	0.19	15%	0.152	C	C	.	.	H	α-helix	trans	-62	-47.3	177	0	0	0	0	0	111.1	Y194 K468 V469 C474 K475 D476	Y194-A472 HydrophobicContact CD1-CB 3.52Å; Y194-A472 HydrophobicContact CE1-CB 3.86Å; K468-A472 WeakPolarHBondContact O-CB 3.41Å; K468-A472 PolarHBondContact O-N 3.41Å; V469-A472 PolarHBondContact O-N 2.81Å; A472-C474 VanDerWaalsContact C-N 3.29Å; A472-C474 PolarHBondContact O-N 3.41Å; A472-K475 PolarHBondContact O-N 2.87Å; A472-D476 PolarHBondContact O-N 3.05Å
473	L	88.1	Confident	86.9	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-55.2	-41.6	172.7	176.3	65	0	0	0	112.8	Y194 L211 V469 F470 I478 Y479	Y194-L473 HydrophobicContact CE1-CB 4.49Å; Y194-L473 HydrophobicContact CE2-CB 4.17Å; Y194-L473 HydrophobicContact CE2-CD1 3.73Å; L211-L473 HydrophobicContact CB-CD2 3.89Å; L211-L473 HydrophobicContact CD1-CD2 3.7Å; L211-L473 HydrophobicContact CG-CD2 4.43Å; V469-L473 PolarHBondContact O-N 3.02Å; F470-L473 PolarHBondContact O-N 2.95Å; L473-I478 HydrophobicContact CD1-CD1 4.15Å; L473-Y479 HydrophobicContact CD1-CD2 4.21Å; L473-Y479 HydrophobicContact CD1-CE2 4.01Å; L473-Y479 HydrophobicContact CD2-CD2 4.3Å; L473-Y479 HydrophobicContact CD2-CE2 4.18Å; L473-Y479 HydrophobicContact CG-CD2 4.33Å; L473-Y479 HydrophobicContact CG-CE2 4.43Å
474	C	88.6	Confident	86.8	Confident	3 Å²	3	38 Å²	38	2%	0.02	20%	0.197	C	C	.	.	H	α-helix	trans	-73.3	-31.8	-180	-65.3	0	0	0	0	113.2	F470 Q471 A472 N477 L482 F485 A486	F470-C474 WeakPolarHBondContact O-CB 3.25Å; F470-C474 PolarHBondContact O-N 3.01Å; F470-C474 PolarHBondContact O-SG 3.05Å; Q471-C474 PolarHBondContact O-N 3.37Å; A472-C474 VanDerWaalsContact C-N 3.29Å; A472-C474 PolarHBondContact O-N 3.41Å; C474-N477 PolarHBondContact O-N 3.49Å; C474-L482 PolarHBondContact SG-O 2.87Å; C474-L482 VanDerWaalsContact SG-O 3.35Å; C474-F485 HydrophobicContact CB-CB 4.4Å; C474-A486 HydrophobicContact CB-CB 3.86Å
475	K	85.5	Confident	86.9	Confident	96 Å²	96	39.5 Å²	39.5	42%	0.417	20%	0.203	S	C	.	.	H	α-helix	trans	-64.8	-40.2	175.5	-78.1	166.7	171.5	170.7	0	111.9	Q471 A472 N477 A486	Q471-K475 VanDerWaalsContact CD-NZ 3.33Å; Q471-K475 HydrophobicContact CG-CD 4.35Å; Q471-K475 WeakPolarHBondContact O-CG 3.23Å; Q471-K475 PolarHBondContact O-N 3.08Å; A472-K475 PolarHBondContact O-N 2.87Å; K475-N477 PolarHBondContact O-N 2.74Å; K475-N477 VanDerWaalsContact O-N 3.13Å; K475-N477 PolarHBondContact O-ND2 3.41Å; K475-N477 VanDerWaalsContact O-ND2 3.15Å; K475-A486 WeakPolarHBondContact CE-O 3.21Å; K475-A486 HydrophobicContact CG-CB 4.03Å
476	D	82.5	Confident	86.8	Confident	30 Å²	30	39.4 Å²	39.4	16%	0.16	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-2.1	177	-71.2	-38.5	0	0	0	113.8	Y194 R199 A472 I478 W602	Y194-D476 WeakPolarHBondContact CE1-OD2 3.38Å; Y194-D476 PolarHBondContact OH-OD2 3.39Å; R199-D476 IonicContact NH2-OD1 3.84Å; R199-D476 PolarHBondContact NH2-OD1 3.19Å; A472-D476 PolarHBondContact O-N 3.05Å; D476-I478 HydrophobicContact CB-CD1 4.49Å; D476-I478 HydrophobicContact CB-CG1 4.23Å; D476-I478 PolarHBondContact O-N 2.95Å; D476-W602 HydrophobicContact CB-CH2 3.67Å; D476-W602 HydrophobicContact CB-CZ2 3.77Å; D476-W602 VanDerWaalsContact CG-CH2 3.43Å; D476-W602 WeakPolarHBondContact OD1-CZ2 3.38Å; D476-W602 VanDerWaalsContact OD2-CH2 3.31Å; D476-W602 WeakPolarHBondContact OD2-CH2 3.36Å
477	N	83.9	Confident	86.6	Confident	52 Å²	52	45.4 Å²	45.4	28%	0.278	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	16.8	170.9	-90.6	-79.8	0	0	0	116.8	C474 K475 Y479 H483	C474-N477 PolarHBondContact O-N 3.49Å; K475-N477 PolarHBondContact O-N 2.74Å; K475-N477 VanDerWaalsContact O-N 3.13Å; K475-N477 PolarHBondContact O-ND2 3.41Å; K475-N477 VanDerWaalsContact O-ND2 3.15Å; N477-Y479 PolarHBondContact O-N 3.46Å; N477-H483 PolarHBondContact ND2-CD2 3.01Å; N477-H483 PolarHBondContact ND2-NE2 2.57Å; N477-H483 PolarHBondContact OD1-CD2 3.39Å
478	I	84.6	Confident	86.3	Confident	2 Å²	2	46 Å²	46	1%	0.01	24%	0.235	C	C	.	.	S	Bend	trans	-53.9	-52.1	177.1	-60.7	179.8	0	0	0	110.6	P203 L473 D476 V593 W602	P203-I478 HydrophobicContact CB-CD1 4.11Å; L473-I478 HydrophobicContact CD1-CD1 4.15Å; D476-I478 HydrophobicContact CB-CD1 4.49Å; D476-I478 HydrophobicContact CB-CG1 4.23Å; D476-I478 PolarHBondContact O-N 2.95Å; I478-V593 HydrophobicContact CG2-CB 4.46Å; I478-V593 HydrophobicContact CG2-CG1 4.13Å; I478-V593 HydrophobicContact CG2-CG2 3.47Å; I478-V593 VanDerWaalsContact CG2-CG2 3.47Å; I478-W602 HydrophobicContact CD1-CH2 3.96Å; I478-W602 HydrophobicContact CD1-CZ3 4.08Å; I478-W602 HydrophobicContact CG1-CH2 4.5Å
479	Y	86.3	Confident	86.1	Confident	15 Å²	15	46.3 Å²	46.3	6%	0.059	24%	0.237	C	C	.	.	S	Bend	trans	-100.9	95	175.1	-54.5	-67.6	0	0	0	109.9	G207 L473 N477 A481 L482 L589 Y592 V593	G207-Y479 VanDerWaalsContact C-OH 3.23Å; G207-Y479 VanDerWaalsContact O-CE2 3.31Å; G207-Y479 WeakPolarHBondContact O-CE2 3.21Å; G207-Y479 PolarHBondContact O-OH 2.91Å; L473-Y479 HydrophobicContact CD1-CD2 4.21Å; L473-Y479 HydrophobicContact CD1-CE2 4.01Å; L473-Y479 HydrophobicContact CD2-CD2 4.3Å; L473-Y479 HydrophobicContact CD2-CE2 4.18Å; L473-Y479 HydrophobicContact CG-CD2 4.33Å; L473-Y479 HydrophobicContact CG-CE2 4.43Å; N477-Y479 PolarHBondContact O-N 3.46Å; Y479-A481 PolarHBondContact O-N 3.36Å; Y479-L482 HydrophobicContact CD2-CD1 4.02Å; Y479-L482 HydrophobicContact CG-CD1 4.25Å; Y479-L482 PolarHBondContact O-N 3.17Å; Y479-L589 HydrophobicContact CE1-CD2 3.79Å; Y479-Y592 AromaticContact CD1-CD1 3.72Å; Y479-Y592 HydrophobicContact CD1-CD1 3.72Å; Y479-Y592 AromaticContact CD1-CE1 3.81Å; Y479-Y592 HydrophobicContact CD1-CE1 3.81Å; Y479-Y592 AromaticContact CE1-CD1 3.96Å; Y479-Y592 HydrophobicContact CE1-CD1 3.96Å; Y479-Y592 HydrophobicContact CE1-CE1 4.5Å; Y479-V593 HydrophobicContact CE1-CG2 3.84Å
480	K	81.8	Confident	85.7	Confident	103 Å²	103	49.1 Å²	49.1	45%	0.448	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.1	-174.2	-59.5	-164.1	178.3	-168.1	0	114.2	D599	K480-D599 IonicContact NZ-OD2 4Å; K480-D599 PolarHBondContact NZ-OD2 3.29Å
481	A	84.3	Confident	84.9	Confident	87 Å²	87	58 Å²	58	72%	0.719	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-30.4	171.2	0	0	0	0	0	114	Y479	Y479-A481 PolarHBondContact O-N 3.36Å
482	L	87.1	Confident	84	Confident	44 Å²	44	62.4 Å²	62.4	23%	0.23	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-87.9	-6	-175.6	-57.4	-176.9	0	0	0	113.6	L211 F470 C474 Y479 F484 F485	L211-L482 HydrophobicContact CD1-CD1 3.81Å; F470-L482 HydrophobicContact CE2-CD1 4.29Å; F470-L482 HydrophobicContact CZ-CD1 4.23Å; F470-L482 HydrophobicContact CZ-CD2 4.37Å; C474-L482 PolarHBondContact SG-O 2.87Å; C474-L482 VanDerWaalsContact SG-O 3.35Å; Y479-L482 HydrophobicContact CD2-CD1 4.02Å; Y479-L482 HydrophobicContact CG-CD1 4.25Å; Y479-L482 PolarHBondContact O-N 3.17Å; L482-F484 PolarHBondContact O-N 3.04Å; L482-F485 PolarHBondContact O-N 3.05Å
483	H	85.8	Confident	83.9	Confident	97 Å²	97	66 Å²	66	45%	0.449	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-53	-25	-178.8	-176.2	-122.5	0	0	0	114	N477 F485 A486	N477-H483 PolarHBondContact ND2-CD2 3.01Å; N477-H483 PolarHBondContact ND2-NE2 2.57Å; N477-H483 PolarHBondContact OD1-CD2 3.39Å; H483-F485 PolarHBondContact O-N 3.17Å; H483-F485 VanDerWaalsContact O-N 3.12Å; H483-A486 VanDerWaalsContact O-CB 3.25Å; H483-A486 WeakPolarHBondContact O-CB 3.35Å; H483-A486 PolarHBondContact O-N 3.41Å
484	F	88.1	Confident	83.6	Confident	119 Å²	119	67.5 Å²	67.5	52%	0.522	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-51.4	-32	170.9	-179.6	-95.4	0	0	0	113.9	L482 R497	L482-F484 PolarHBondContact O-N 3.04Å; F484-R497 VanDerWaalsContact CD2-NH1 3.34Å; F484-R497 HydrophobicContact CE1-CG 4.42Å; F484-R497 VanDerWaalsContact CE2-NH1 3.29Å; F484-R497 VanDerWaalsContact CZ-CZ 3.48Å; F484-R497 VanDerWaalsContact O-CD 3.31Å; F484-R497 WeakPolarHBondContact O-CD 3.21Å; F484-R497 PolarHBondContact O-NH1 2.79Å
485	F	89.8	Confident	83.7	Confident	44 Å²	44	67.4 Å²	67.4	19%	0.193	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-89.3	-7.4	-179	-63.4	-88.3	0	0	0	114	F470 C474 L482 H483 K487 R497 L501	F470-F485 HydrophobicContact CD1-CB 3.98Å; F470-F485 HydrophobicContact CD1-CG 4.25Å; F470-F485 HydrophobicContact CE1-CB 3.69Å; F470-F485 AromaticContact CE1-CD1 3.97Å; F470-F485 HydrophobicContact CE1-CD1 3.97Å; F470-F485 AromaticContact CE1-CD2 3.8Å; F470-F485 HydrophobicContact CE1-CD2 3.8Å; F470-F485 HydrophobicContact CE1-CE2 4.41Å; F470-F485 AromaticContact CE1-CG 3.56Å; F470-F485 HydrophobicContact CE1-CG 3.56Å; F470-F485 HydrophobicContact CZ-CD2 4.43Å; C474-F485 HydrophobicContact CB-CB 4.4Å; L482-F485 PolarHBondContact O-N 3.05Å; H483-F485 PolarHBondContact O-N 3.17Å; H483-F485 VanDerWaalsContact O-N 3.12Å; F485-K487 VanDerWaalsContact C-N 3.25Å; F485-K487 PolarHBondContact O-N 3.33Å; F485-R497 HydrophobicContact CD1-CB 3.74Å; F485-R497 HydrophobicContact CE1-CB 4.26Å; F485-L501 HydrophobicContact CD1-CD2 4.45Å; F485-L501 HydrophobicContact CE1-CB 4.1Å; F485-L501 HydrophobicContact CE1-CD2 4Å; F485-L501 HydrophobicContact CZ-CD2 4.15Å
486	A	83.5	Confident	83.8	Confident	10 Å²	10	66.3 Å²	66.3	8%	0.083	35%	0.351	C	S	.	.			trans	-65.5	-26.5	178.8	0	0	0	0	0	113.6	C474 K475 H483 G488	C474-A486 HydrophobicContact CB-CB 3.86Å; K475-A486 WeakPolarHBondContact CE-O 3.21Å; K475-A486 HydrophobicContact CG-CB 4.03Å; H483-A486 VanDerWaalsContact O-CB 3.25Å; H483-A486 WeakPolarHBondContact O-CB 3.35Å; H483-A486 PolarHBondContact O-N 3.41Å; A486-G488 PolarHBondContact O-N 3.05Å; A486-G488 VanDerWaalsContact O-N 3.15Å
487	K	86.8	Confident	84.2	Confident	126 Å²	126	68.5 Å²	68.5	55%	0.548	36%	0.357	S	S	.	.			trans	-72	106	-173	-173.2	175.8	179.1	178.3	0	112.3	F485 H489	F485-K487 VanDerWaalsContact C-N 3.25Å; F485-K487 PolarHBondContact O-N 3.33Å; K487-H489 PolarHBondContact O-CE1 3.48Å; K487-H489 VanDerWaalsContact O-CE1 3.25Å; K487-H489 PolarHBondContact O-ND1 2.9Å
488	G	86.2	Confident	84.6	Confident	14 Å²	14	66.1 Å²	66.1	14%	0.144	34%	0.344	C	S	.	.			trans	-68.4	158	164.9	0	0	0	0	0	112.9	Q471 A486 N493	Q471-G488 VanDerWaalsContact NE2-CA 3.29Å; A486-G488 PolarHBondContact O-N 3.05Å; A486-G488 VanDerWaalsContact O-N 3.15Å; G488-N493 VanDerWaalsContact CA-O 3.31Å; G488-N493 WeakPolarHBondContact CA-O 3.47Å
489	H	81.8	Confident	85	Confident	60 Å²	60	66.1 Å²	66.1	28%	0.278	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-134.6	155.2	178.8	-63.7	73.7	0	0	0	110.4	K487 N493 E494 I496	K487-H489 PolarHBondContact O-CE1 3.48Å; K487-H489 VanDerWaalsContact O-CE1 3.25Å; K487-H489 PolarHBondContact O-ND1 2.9Å; H489-N493 CarbonylContact O-C 3.52Å; H489-E494 PolarHBondContact N-O 3.11Å; H489-E494 PolarHBondContact O-N 3.46Å; H489-I496 HydrophobicContact CB-CD1 3.63Å; H489-I496 HydrophobicContact CB-CG1 4.1Å
490	G	79.6	Confident	85.3	Confident	67 Å²	67	69.5 Å²	69.5	69%	0.691	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	178.2	-175.8	0	0	0	0	0	114	N492 N493	G490-N492 PolarHBondContact O-N 3.21Å; G490-N493 PolarHBondContact O-N 3.08Å
491	K	73.9	Confident	85.8	Confident	208 Å²	208	67 Å²	67	90%	0.904	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.1	-176.3	-66.6	-177.8	178.7	179.3	0	113.4
492	N	71.4	Confident	86.3	Confident	110 Å²	110	63.2 Å²	63.2	59%	0.588	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	9.2	-175.1	-61.5	10.6	0	0	0	113.2	G490 E494	G490-N492 PolarHBondContact O-N 3.21Å; N492-E494 VanDerWaalsContact C-N 3.27Å; N492-E494 HydrophobicContact CB-CG 4.19Å; N492-E494 PolarHBondContact O-N 3.41Å
493	N	81.4	Confident	86.7	Confident	99 Å²	99	63.1 Å²	63.1	53%	0.529	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.8	31	-177.6	-75.5	-62.2	0	0	0	115	Q471 G488 H489 G490	Q471-N493 PolarHBondContact NE2-O 3.22Å; G488-N493 VanDerWaalsContact CA-O 3.31Å; G488-N493 WeakPolarHBondContact CA-O 3.47Å; H489-N493 CarbonylContact O-C 3.52Å; G490-N493 PolarHBondContact O-N 3.08Å
494	E	83.6	Confident	87.1	Confident	31 Å²	31	63.4 Å²	63.4	15%	0.145	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-63.1	137.9	-174	-74.6	-69.9	161.6	0	0	112.5	K468 H489 N492 I496 Y499	K468-E494 WeakPolarHBondContact CE-OE2 3.43Å; K468-E494 IonicContact NZ-OE1 2.66Å; K468-E494 PolarHBondContact NZ-OE1 3.46Å; K468-E494 VanDerWaalsContact NZ-OE1 3.08Å; K468-E494 IonicContact NZ-OE2 3.28Å; K468-E494 PolarHBondContact NZ-OE2 3.35Å; H489-E494 PolarHBondContact N-O 3.11Å; H489-E494 PolarHBondContact O-N 3.46Å; N492-E494 VanDerWaalsContact C-N 3.27Å; N492-E494 HydrophobicContact CB-CG 4.19Å; N492-E494 PolarHBondContact O-N 3.41Å; E494-I496 PolarHBondContact O-N 3.48Å; E494-Y499 HydrophobicContact CB-CE2 4.4Å; E494-Y499 WeakPolarHBondContact OE2-CE2 3.48Å; E494-Y499 PolarHBondContact OE2-OH 3.24Å
495	P	89.1	Confident	87.5	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.013	31%	0.306	C	S	.	.			trans	-82.8	65	-174.3	34.5	-38.8	0	0	0	113.4	P467 K468 Q471 R497 G498 Y499	P467-P495 HydrophobicContact CB-CB 4.22Å; P467-P495 HydrophobicContact CB-CG 3.56Å; K468-P495 HydrophobicContact CG-CG 4.13Å; Q471-P495 HydrophobicContact CB-CB 3.74Å; Q471-P495 HydrophobicContact CB-CG 4.44Å; Q471-P495 HydrophobicContact CG-CB 3.92Å; P495-R497 PolarHBondContact O-N 2.85Å; P495-G498 CarbonylContact O-C 3.53Å; P495-G498 WeakPolarHBondContact O-CA 3.34Å; P495-G498 PolarHBondContact O-N 3.4Å; P495-Y499 HydrophobicContact CG-CD2 4.15Å; P495-Y499 HydrophobicContact CG-CE2 3.81Å; P495-Y499 VanDerWaalsContact O-CD2 3.28Å; P495-Y499 WeakPolarHBondContact O-CD2 3.5Å; P495-Y499 PolarHBondContact O-N 3.2Å
496	I	88.9	Confident	87.7	Confident	72 Å²	72	57.2 Å²	57.2	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-48.3	-41.4	-179.8	-59.7	-178.6	0	0	0	112.6	H489 E494 G498 Y499 I500	H489-I496 HydrophobicContact CB-CD1 3.63Å; H489-I496 HydrophobicContact CB-CG1 4.1Å; E494-I496 PolarHBondContact O-N 3.48Å; I496-G498 VanDerWaalsContact C-N 3.33Å; I496-G498 PolarHBondContact O-N 3.37Å; I496-Y499 PolarHBondContact O-N 3.1Å; I496-I500 HydrophobicContact CG2-CD1 4.02Å; I496-I500 WeakPolarHBondContact O-CG1 3.36Å; I496-I500 PolarHBondContact O-N 3.21Å
497	R	91.1	Very high	88.3	Confident	77 Å²	77	58.8 Å²	58.8	29%	0.291	30%	0.303	S	S	.	.	H	α-helix	trans	-66	-33	176.9	-65.2	177.1	173	-171.7	-8.7	113.4	F484 F485 P495 L501	F484-R497 VanDerWaalsContact CD2-NH1 3.34Å; F484-R497 HydrophobicContact CE1-CG 4.42Å; F484-R497 VanDerWaalsContact CE2-NH1 3.29Å; F484-R497 VanDerWaalsContact CZ-CZ 3.48Å; F484-R497 VanDerWaalsContact O-CD 3.31Å; F484-R497 WeakPolarHBondContact O-CD 3.21Å; F484-R497 PolarHBondContact O-NH1 2.79Å; F485-R497 HydrophobicContact CD1-CB 3.74Å; F485-R497 HydrophobicContact CE1-CB 4.26Å; P495-R497 PolarHBondContact O-N 2.85Å; R497-L501 PolarHBondContact O-N 3.44Å; R497-L501 VanDerWaalsContact O-N 3.17Å
498	G	91.8	Very high	88.7	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-72.3	-44	174.1	0	0	0	0	0	111.7	P495 I496 I500 L501 T502	P495-G498 CarbonylContact O-C 3.53Å; P495-G498 WeakPolarHBondContact O-CA 3.34Å; P495-G498 PolarHBondContact O-N 3.4Å; I496-G498 VanDerWaalsContact C-N 3.33Å; I496-G498 PolarHBondContact O-N 3.37Å; G498-I500 VanDerWaalsContact C-N 3.32Å; G498-I500 PolarHBondContact O-N 3.11Å; G498-L501 PolarHBondContact O-N 2.9Å; G498-T502 WeakPolarHBondContact O-CB 3.21Å; G498-T502 PolarHBondContact O-N 2.86Å; G498-T502 PolarHBondContact O-OG1 2.91Å; G498-T502 VanDerWaalsContact O-OG1 3.08Å
499	Y	92.1	Very high	89.1	Confident	3 Å²	3	56.8 Å²	56.8	1%	0.012	30%	0.302	C	S	.	.	H	α-helix	trans	-57.3	-44.2	173.9	-71.3	-72.5	0	0	0	111.5	V464 P467 K468 E494 P495 I496 T502 F503	V464-Y499 HydrophobicContact CG2-CE1 4.4Å; P467-Y499 HydrophobicContact CB-CD1 4.16Å; P467-Y499 HydrophobicContact CB-CD2 4.44Å; P467-Y499 HydrophobicContact CB-CE1 4.33Å; P467-Y499 HydrophobicContact CB-CG 4.19Å; P467-Y499 HydrophobicContact CG-CD1 3.59Å; P467-Y499 HydrophobicContact CG-CE1 3.95Å; P467-Y499 HydrophobicContact CG-CG 3.96Å; K468-Y499 WeakPolarHBondContact CE-OH 3.4Å; K468-Y499 PolarHBondContact NZ-OH 2.89Å; E494-Y499 HydrophobicContact CB-CE2 4.4Å; E494-Y499 WeakPolarHBondContact OE2-CE2 3.48Å; E494-Y499 PolarHBondContact OE2-OH 3.24Å; P495-Y499 HydrophobicContact CG-CD2 4.15Å; P495-Y499 HydrophobicContact CG-CE2 3.81Å; P495-Y499 VanDerWaalsContact O-CD2 3.28Å; P495-Y499 WeakPolarHBondContact O-CD2 3.5Å; P495-Y499 PolarHBondContact O-N 3.2Å; I496-Y499 PolarHBondContact O-N 3.1Å; Y499-T502 PolarHBondContact O-N 3.45Å; Y499-F503 VanDerWaalsContact O-CB 3.23Å; Y499-F503 WeakPolarHBondContact O-CB 3.41Å; Y499-F503 PolarHBondContact O-N 3.2Å
500	I	92.8	Very high	89.8	Confident	86 Å²	86	53.9 Å²	53.9	44%	0.441	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-43.9	176	-67.4	165.3	0	0	0	111.7	I496 G498 F503 I504	I496-I500 HydrophobicContact CG2-CD1 4.02Å; I496-I500 WeakPolarHBondContact O-CG1 3.36Å; I496-I500 PolarHBondContact O-N 3.21Å; G498-I500 VanDerWaalsContact C-N 3.32Å; G498-I500 PolarHBondContact O-N 3.11Å; I500-F503 PolarHBondContact O-N 2.97Å; I500-I504 HydrophobicContact CG2-CD1 3.92Å; I500-I504 VanDerWaalsContact O-CG1 3.32Å; I500-I504 WeakPolarHBondContact O-CG1 3.31Å; I500-I504 PolarHBondContact O-N 3.02Å
501	L	93.6	Very high	90.5	Very high	51 Å²	51	55 Å²	55	27%	0.267	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-46.2	177	178.6	62.2	0	0	0	111.7	F470 F485 R497 G498 F503 I504 I505	F470-L501 HydrophobicContact CD1-CD2 4.19Å; F470-L501 HydrophobicContact CE1-CD2 3.5Å; F470-L501 HydrophobicContact CE2-CD2 4.36Å; F470-L501 HydrophobicContact CZ-CD2 3.61Å; F485-L501 HydrophobicContact CD1-CD2 4.45Å; F485-L501 HydrophobicContact CE1-CB 4.1Å; F485-L501 HydrophobicContact CE1-CD2 4Å; F485-L501 HydrophobicContact CZ-CD2 4.15Å; R497-L501 PolarHBondContact O-N 3.44Å; R497-L501 VanDerWaalsContact O-N 3.17Å; G498-L501 PolarHBondContact O-N 2.9Å; L501-F503 PolarHBondContact O-N 3.45Å; L501-I504 PolarHBondContact O-N 3.13Å; L501-I505 HydrophobicContact CD1-CD1 4.19Å; L501-I505 HydrophobicContact CG-CD1 4.1Å; L501-I505 WeakPolarHBondContact O-CG1 3.2Å; L501-I505 PolarHBondContact O-N 3.37Å
502	T	94.2	Very high	91.4	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.043	25%	0.249	C	C	.	.	H	α-helix	trans	-60.8	-43.3	176.6	-62	0	0	0	0	111.4	A218 L463 A466 G498 Y499 I505 S506	A218-T502 HydrophobicContact CB-CG2 3.87Å; L463-T502 HydrophobicContact CD1-CG2 3.73Å; A466-T502 HydrophobicContact CB-CG2 4.06Å; G498-T502 WeakPolarHBondContact O-CB 3.21Å; G498-T502 PolarHBondContact O-N 2.86Å; G498-T502 PolarHBondContact O-OG1 2.91Å; G498-T502 VanDerWaalsContact O-OG1 3.08Å; Y499-T502 PolarHBondContact O-N 3.45Å; T502-I505 PolarHBondContact O-N 3.16Å; T502-S506 WeakPolarHBondContact O-CB 3.26Å; T502-S506 PolarHBondContact O-N 2.88Å; T502-S506 PolarHBondContact O-OG 3.27Å
503	F	94.6	Very high	92.2	Very high	41 Å²	41	42.6 Å²	42.6	18%	0.18	22%	0.222	C	C	.	.	H	α-helix	trans	-61.1	-44.2	176.5	171.4	-99.9	0	0	0	112.7	V258 V259 L262 Y499 I500 L501 S506 I507	V258-F503 HydrophobicContact CG1-CD2 4.35Å; V258-F503 HydrophobicContact CG1-CE2 4.04Å; V258-F503 HydrophobicContact CG2-CD2 4.23Å; V259-F503 HydrophobicContact CB-CE2 4.5Å; V259-F503 HydrophobicContact CG2-CE2 3.69Å; V259-F503 HydrophobicContact CG2-CZ 3.74Å; L262-F503 HydrophobicContact CB-CD2 4.22Å; L262-F503 HydrophobicContact CD2-CB 4.23Å; L262-F503 HydrophobicContact CD2-CD1 4.32Å; L262-F503 HydrophobicContact CD2-CD2 3.64Å; L262-F503 HydrophobicContact CD2-CE2 3.96Å; L262-F503 HydrophobicContact CD2-CG 3.83Å; L262-F503 HydrophobicContact CD2-CZ 4.42Å; L262-F503 HydrophobicContact CG-CD2 4.46Å; Y499-F503 VanDerWaalsContact O-CB 3.23Å; Y499-F503 WeakPolarHBondContact O-CB 3.41Å; Y499-F503 PolarHBondContact O-N 3.2Å; I500-F503 PolarHBondContact O-N 2.97Å; L501-F503 PolarHBondContact O-N 3.45Å; F503-S506 PolarHBondContact O-N 3.27Å; F503-I507 HydrophobicContact CD1-CD1 4.19Å; F503-I507 HydrophobicContact CD2-CD1 4.28Å; F503-I507 HydrophobicContact CE1-CD1 3.61Å; F503-I507 HydrophobicContact CE2-CD1 3.71Å; F503-I507 HydrophobicContact CE2-CG1 4.44Å; F503-I507 HydrophobicContact CZ-CD1 3.34Å; F503-I507 HydrophobicContact CZ-CG1 4.48Å; F503-I507 PolarHBondContact O-N 2.84Å
504	I	95.6	Very high	92.6	Very high	103 Å²	103	40.2 Å²	40.2	53%	0.528	21%	0.209	S	C	.	.	H	α-helix	trans	-62.7	-44.2	176.2	-68.9	165.6	0	0	0	111.1	I500 L501 A508	I500-I504 HydrophobicContact CG2-CD1 3.92Å; I500-I504 VanDerWaalsContact O-CG1 3.32Å; I500-I504 WeakPolarHBondContact O-CG1 3.31Å; I500-I504 PolarHBondContact O-N 3.02Å; L501-I504 PolarHBondContact O-N 3.13Å; I504-A508 PolarHBondContact O-N 3.31Å; I504-A508 VanDerWaalsContact O-N 3.11Å
505	I	95.5	Very high	92.7	Very high	34 Å²	34	38.8 Å²	38.8	17%	0.174	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-46.7	175.1	-66.9	165.1	0	0	0	110.1	F215 A218 V219 L501 T502 I507 A508 F509	F215-I505 HydrophobicContact CD2-CD1 4.22Å; F215-I505 HydrophobicContact CE2-CD1 4.2Å; F215-I505 HydrophobicContact CE2-CG2 4.15Å; A218-I505 HydrophobicContact CB-CB 4.36Å; A218-I505 HydrophobicContact CB-CD1 4.34Å; A218-I505 HydrophobicContact CB-CG2 3.99Å; V219-I505 HydrophobicContact CG2-CG2 4.23Å; L501-I505 HydrophobicContact CD1-CD1 4.19Å; L501-I505 HydrophobicContact CG-CD1 4.1Å; L501-I505 WeakPolarHBondContact O-CG1 3.2Å; L501-I505 PolarHBondContact O-N 3.37Å; T502-I505 PolarHBondContact O-N 3.16Å; I505-I507 PolarHBondContact O-N 3.39Å; I505-A508 WeakPolarHBondContact O-CB 3.44Å; I505-A508 PolarHBondContact O-N 2.95Å; I505-F509 HydrophobicContact CG2-CD2 4.13Å; I505-F509 HydrophobicContact CG2-CE2 4.21Å; I505-F509 WeakPolarHBondContact O-CD2 3.01Å; I505-F509 PolarHBondContact O-N 2.91Å
506	S	94.6	Very high	92.7	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.6	-44.6	-178.5	-55.2	0	0	0	0	111.6	A218 V221 A222 T502 F503 A508 F509 I510	A218-S506 PolarHBondContact O-OG 3.38Å; V221-S506 WeakPolarHBondContact CB-OG 3.25Å; A222-S506 WeakPolarHBondContact CB-O 3.45Å; T502-S506 WeakPolarHBondContact O-CB 3.26Å; T502-S506 PolarHBondContact O-N 2.88Å; T502-S506 PolarHBondContact O-OG 3.27Å; F503-S506 PolarHBondContact O-N 3.27Å; S506-A508 PolarHBondContact O-N 2.78Å; S506-F509 PolarHBondContact O-N 2.99Å; S506-I510 WeakPolarHBondContact O-CD1 3.29Å; S506-I510 VanDerWaalsContact O-CG1 3.25Å; S506-I510 WeakPolarHBondContact O-CG1 3.37Å; S506-I510 PolarHBondContact O-N 3.42Å
507	I	95.6	Very high	92.8	Very high	42 Å²	42	40.4 Å²	40.4	22%	0.215	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-43.4	175.5	-75.5	178.9	0	0	0	111.4	V258 F503 I505 F509 I510 L511	V258-I507 HydrophobicContact CG1-CD1 4.29Å; V258-I507 HydrophobicContact CG1-CG1 3.83Å; F503-I507 HydrophobicContact CD1-CD1 4.19Å; F503-I507 HydrophobicContact CD2-CD1 4.28Å; F503-I507 HydrophobicContact CE1-CD1 3.61Å; F503-I507 HydrophobicContact CE2-CD1 3.71Å; F503-I507 HydrophobicContact CE2-CG1 4.44Å; F503-I507 HydrophobicContact CZ-CD1 3.34Å; F503-I507 HydrophobicContact CZ-CG1 4.48Å; F503-I507 PolarHBondContact O-N 2.84Å; I505-I507 PolarHBondContact O-N 3.39Å; I507-F509 PolarHBondContact O-N 3.36Å; I507-I510 PolarHBondContact O-N 3.12Å; I507-L511 HydrophobicContact CG2-CD1 3.97Å; I507-L511 HydrophobicContact CG2-CG 4.29Å; I507-L511 VanDerWaalsContact O-CG 3.32Å; I507-L511 WeakPolarHBondContact O-CG 3.22Å; I507-L511 PolarHBondContact O-N 3.21Å
508	A	95.6	Very high	92.8	Very high	61 Å²	61	36.7 Å²	36.7	50%	0.504	20%	0.201	S	C	.	.	H	α-helix	trans	-58.8	-33.2	179.4	0	0	0	0	0	113	I504 I505 S506	I504-A508 PolarHBondContact O-N 3.31Å; I504-A508 VanDerWaalsContact O-N 3.11Å; I505-A508 WeakPolarHBondContact O-CB 3.44Å; I505-A508 PolarHBondContact O-N 2.95Å; S506-A508 PolarHBondContact O-N 2.78Å
509	F	95	Very high	92.8	Very high	37 Å²	37	36.7 Å²	36.7	16%	0.162	20%	0.2	C	C	.	.	H	α-helix	trans	-84.8	-34.4	173.9	-78.1	-85	0	0	0	113.6	F215 V219 A222 I505 S506 I507 L511 I512 I518 I521	F215-F509 HydrophobicContact CZ-CE2 4.25Å; V219-F509 HydrophobicContact CB-CD2 4.46Å; V219-F509 HydrophobicContact CG1-CB 4.5Å; V219-F509 HydrophobicContact CG1-CD1 3.8Å; V219-F509 HydrophobicContact CG1-CD2 4.01Å; V219-F509 HydrophobicContact CG1-CE1 3.96Å; V219-F509 HydrophobicContact CG1-CE2 4.16Å; V219-F509 HydrophobicContact CG1-CG 3.84Å; V219-F509 HydrophobicContact CG1-CZ 4.14Å; V219-F509 HydrophobicContact CG2-CD2 3.94Å; V219-F509 HydrophobicContact CG2-CE2 3.6Å; V219-F509 HydrophobicContact CG2-CZ 3.99Å; A222-F509 HydrophobicContact CB-CB 3.43Å; A222-F509 VanDerWaalsContact CB-CB 3.43Å; I505-F509 HydrophobicContact CG2-CD2 4.13Å; I505-F509 HydrophobicContact CG2-CE2 4.21Å; I505-F509 WeakPolarHBondContact O-CD2 3.01Å; I505-F509 PolarHBondContact O-N 2.91Å; S506-F509 PolarHBondContact O-N 2.99Å; I507-F509 PolarHBondContact O-N 3.36Å; F509-L511 PolarHBondContact O-N 3.14Å; F509-I512 HydrophobicContact CD1-CD1 3.76Å; F509-I512 HydrophobicContact CE1-CD1 4.36Å; F509-I512 WeakPolarHBondContact O-CB 3.39Å; F509-I512 WeakPolarHBondContact O-CG1 3.4Å; F509-I512 PolarHBondContact O-N 3.31Å; F509-I512 VanDerWaalsContact O-N 3.1Å; F509-I518 WeakPolarHBondContact O-CD1 3.4Å; F509-I521 HydrophobicContact CE1-CD1 3.98Å; F509-I521 HydrophobicContact CE1-CG2 4.07Å; F509-I521 HydrophobicContact CZ-CG2 4.44Å
510	I	95	Very high	92.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-36.2	172.8	-72	161.7	0	0	0	111	A222 V225 V226 V258 S506 I507 I512 G513	A222-I510 HydrophobicContact CB-CG1 3.88Å; V225-I510 HydrophobicContact CB-CD1 4.11Å; V225-I510 HydrophobicContact CB-CG1 4.46Å; V225-I510 HydrophobicContact CG1-CD1 3.72Å; V225-I510 HydrophobicContact CG1-CG1 4.22Å; V226-I510 HydrophobicContact CG2-CB 4.42Å; V226-I510 HydrophobicContact CG2-CG1 4.22Å; V226-I510 HydrophobicContact CG2-CG2 4.48Å; V258-I510 HydrophobicContact CB-CD1 3.85Å; V258-I510 HydrophobicContact CG1-CD1 3.76Å; V258-I510 HydrophobicContact CG2-CD1 4.24Å; S506-I510 WeakPolarHBondContact O-CD1 3.29Å; S506-I510 VanDerWaalsContact O-CG1 3.25Å; S506-I510 WeakPolarHBondContact O-CG1 3.37Å; S506-I510 PolarHBondContact O-N 3.42Å; I507-I510 PolarHBondContact O-N 3.12Å; I510-I512 PolarHBondContact O-N 3.43Å; I510-I512 VanDerWaalsContact O-N 3.15Å; I510-G513 PolarHBondContact O-N 3.43Å
511	L	94.8	Very high	92.7	Very high	90 Å²	90	36.7 Å²	36.7	47%	0.471	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-14.1	177.5	-72.6	171.1	0	0	0	114.3	R251 I507 F509	R251-L511 PolarHBondContact NE-O 3.24Å; I507-L511 HydrophobicContact CG2-CD1 3.97Å; I507-L511 HydrophobicContact CG2-CG 4.29Å; I507-L511 VanDerWaalsContact O-CG 3.32Å; I507-L511 WeakPolarHBondContact O-CG 3.22Å; I507-L511 PolarHBondContact O-N 3.21Å; F509-L511 PolarHBondContact O-N 3.14Å
512	I	94.1	Very high	92.6	Very high	56 Å²	56	34.3 Å²	34.3	29%	0.287	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-46	169.8	-60.4	174.5	0	0	0	109.4	R251 F509 I510 D514 T517 I518	R251-I512 PolarHBondContact NH2-O 2.91Å; F509-I512 HydrophobicContact CD1-CD1 3.76Å; F509-I512 HydrophobicContact CE1-CD1 4.36Å; F509-I512 WeakPolarHBondContact O-CB 3.39Å; F509-I512 WeakPolarHBondContact O-CG1 3.4Å; F509-I512 PolarHBondContact O-N 3.31Å; F509-I512 VanDerWaalsContact O-N 3.1Å; I510-I512 PolarHBondContact O-N 3.43Å; I510-I512 VanDerWaalsContact O-N 3.15Å; I512-D514 VanDerWaalsContact C-N 3.32Å; I512-D514 PolarHBondContact O-N 3.34Å; I512-T517 HydrophobicContact CG2-CG2 4.02Å; I512-I518 HydrophobicContact CB-CD1 4.29Å; I512-I518 HydrophobicContact CB-CG1 4.26Å; I512-I518 HydrophobicContact CD1-CG1 4.13Å; I512-I518 HydrophobicContact CG2-CG1 4.33Å
513	G	87.1	Confident	92.5	Very high	2 Å²	2	34 Å²	34	2%	0.021	19%	0.188	C	C	.	.			trans	87.6	-27.3	176	0	0	0	0	0	115.3	V226 I250 I510	V226-G513 WeakPolarHBondContact CG1-O 3.46Å; I250-G513 WeakPolarHBondContact CG2-O 3.46Å; I510-G513 PolarHBondContact O-N 3.43Å
514	D	89.3	Confident	92.4	Very high	48 Å²	48	32.4 Å²	32.4	26%	0.257	18%	0.182	S	C	.	.			trans	-95.9	125.9	178.1	166.6	40.6	0	0	0	112.6	M247 I512 N516 T517 I518	M247-D514 HydrophobicContact CE-CB 4.2Å; I512-D514 VanDerWaalsContact C-N 3.32Å; I512-D514 PolarHBondContact O-N 3.34Å; D514-N516 WeakPolarHBondContact OD1-CB 3.23Å; D514-N516 PolarHBondContact OD1-N 3.42Å; D514-T517 WeakPolarHBondContact OD2-CB 3.26Å; D514-T517 PolarHBondContact OD2-N 2.87Å; D514-T517 PolarHBondContact OD2-OG1 3Å; D514-I518 VanDerWaalsContact O-CD1 3.29Å; D514-I518 WeakPolarHBondContact O-CD1 3.23Å; D514-I518 VanDerWaalsContact O-CG1 3.23Å; D514-I518 WeakPolarHBondContact O-CG1 3.43Å; D514-I518 PolarHBondContact O-N 3.47Å
515	L	87.3	Confident	92.3	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-36.7	175.8	-168.6	73.8	0	0	0	112.9	V143 M144 R148 M223 V226 I518 A519	V143-L515 HydrophobicContact CG1-CD1 4.4Å; V143-L515 HydrophobicContact CG1-CD2 3.72Å; M144-L515 HydrophobicContact CE-CD2 4.17Å; M144-L515 HydrophobicContact CE-CG 4.21Å; M144-L515 HydrophobicContact SD-CD2 4.14Å; R148-L515 HydrophobicContact CG-CD2 4.1Å; M223-L515 HydrophobicContact CB-CD1 4.37Å; M223-L515 HydrophobicContact CG-CD1 3.53Å; M223-L515 WeakPolarHBondContact O-CD1 3.41Å; V226-L515 HydrophobicContact CB-CD1 4.48Å; V226-L515 HydrophobicContact CG1-CB 4.2Å; V226-L515 HydrophobicContact CG1-CD1 4.26Å; L515-I518 PolarHBondContact O-N 2.65Å; L515-A519 WeakPolarHBondContact O-CB 3.38Å; L515-A519 PolarHBondContact O-N 3.07Å
516	N	89	Confident	92.2	Very high	34 Å²	34	27.9 Å²	27.9	18%	0.182	16%	0.157	C	C	.	.	H	α-helix	trans	-72.3	-32.7	-173.2	-66.1	-5.3	0	0	0	111.7	R148 I335 D514 P520	R148-N516 PolarHBondContact NE-OD1 3.02Å; R148-N516 PolarHBondContact NH2-OD1 3.15Å; I335-N516 HydrophobicContact CD1-CB 4.23Å; D514-N516 WeakPolarHBondContact OD1-CB 3.23Å; D514-N516 PolarHBondContact OD1-N 3.42Å; N516-P520 WeakPolarHBondContact O-CD 3.38Å; N516-P520 WeakPolarHBondContact O-CG 3.33Å
517	T	90.1	Very high	92.2	Very high	74 Å²	74	27.9 Å²	27.9	45%	0.454	16%	0.157	S	C	.	.	H	α-helix	trans	-71.9	-35.2	170.9	-62.6	0	0	0	0	112.2	I512 D514	I512-T517 HydrophobicContact CG2-CG2 4.02Å; D514-T517 WeakPolarHBondContact OD2-CB 3.26Å; D514-T517 PolarHBondContact OD2-N 2.87Å; D514-T517 PolarHBondContact OD2-OG1 3Å
518	I	91.4	Very high	92.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-75.7	-38.7	-177.8	-64.5	165.2	0	0	0	111.8	M223 V226 F509 I512 D514 L515 I521 I522	M223-I518 HydrophobicContact CB-CG2 3.93Å; V226-I518 HydrophobicContact CB-CD1 4.44Å; V226-I518 HydrophobicContact CG1-CD1 4.47Å; V226-I518 HydrophobicContact CG2-CD1 3.94Å; F509-I518 WeakPolarHBondContact O-CD1 3.4Å; I512-I518 HydrophobicContact CB-CD1 4.29Å; I512-I518 HydrophobicContact CB-CG1 4.26Å; I512-I518 HydrophobicContact CD1-CG1 4.13Å; I512-I518 HydrophobicContact CG2-CG1 4.33Å; D514-I518 VanDerWaalsContact O-CD1 3.29Å; D514-I518 WeakPolarHBondContact O-CD1 3.23Å; D514-I518 VanDerWaalsContact O-CG1 3.23Å; D514-I518 WeakPolarHBondContact O-CG1 3.43Å; D514-I518 PolarHBondContact O-N 3.47Å; L515-I518 PolarHBondContact O-N 2.65Å; I518-I521 WeakPolarHBondContact O-CB 3.35Å; I518-I521 PolarHBondContact O-N 3.42Å; I518-I522 HydrophobicContact CG2-CD1 3.75Å; I518-I522 HydrophobicContact CG2-CG1 4.45Å; I518-I522 PolarHBondContact O-N 3.27Å
519	A	90.8	Very high	91.9	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.3	-45.2	-172.8	0	0	0	0	0	114.9	M144 M223 P338 L515 I521 I522 S523	M144-A519 HydrophobicContact CE-CB 3.72Å; M223-A519 HydrophobicContact SD-CB 4.48Å; P338-A519 HydrophobicContact CG-CB 4.14Å; L515-A519 WeakPolarHBondContact O-CB 3.38Å; L515-A519 PolarHBondContact O-N 3.07Å; A519-I521 VanDerWaalsContact C-N 3.27Å; A519-I521 PolarHBondContact O-N 3.33Å; A519-I522 WeakPolarHBondContact O-CB 3.42Å; A519-I522 PolarHBondContact O-N 2.89Å; A519-S523 PolarHBondContact O-N 3.17Å; A519-S523 PolarHBondContact O-OG 2.88Å
520	P	91.1	Very high	91.9	Very high	36 Å²	36	21.2 Å²	21.2	23%	0.234	12%	0.115	C	C	.	.	H	α-helix	trans	-60.5	-32.1	175.6	-26.9	36.1	0	0	0	114.2	A334 I335 N516 S523 N524 I574	A334-P520 HydrophobicContact CB-CB 3.99Å; A334-P520 HydrophobicContact CB-CG 4.05Å; I335-P520 HydrophobicContact CG1-CG 4.41Å; N516-P520 WeakPolarHBondContact O-CD 3.38Å; N516-P520 WeakPolarHBondContact O-CG 3.33Å; P520-S523 PolarHBondContact O-N 3.5Å; P520-N524 PolarHBondContact O-N 3.46Å; P520-I574 HydrophobicContact CB-CG2 4.49Å
521	I	91.6	Very high	91.9	Very high	54 Å²	54	21.5 Å²	21.5	28%	0.277	12%	0.118	S	C	.	.	H	α-helix	trans	-66.8	-43.1	177.3	-56.3	175.9	0	0	0	109.9	F509 I518 A519 N524 F525	F509-I521 HydrophobicContact CE1-CD1 3.98Å; F509-I521 HydrophobicContact CE1-CG2 4.07Å; F509-I521 HydrophobicContact CZ-CG2 4.44Å; I518-I521 WeakPolarHBondContact O-CB 3.35Å; I518-I521 PolarHBondContact O-N 3.42Å; A519-I521 VanDerWaalsContact C-N 3.27Å; A519-I521 PolarHBondContact O-N 3.33Å; I521-N524 WeakPolarHBondContact O-CB 3.17Å; I521-N524 PolarHBondContact O-N 2.99Å; I521-F525 HydrophobicContact CG2-CD2 4.07Å; I521-F525 HydrophobicContact CG2-CE2 3.74Å; I521-F525 WeakPolarHBondContact O-CD2 3.35Å; I521-F525 PolarHBondContact O-N 3.07Å
522	I	92	Very high	91.8	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	10%	0.101	C	C	.	.	H	α-helix	trans	-64	-43.8	175.2	-71.2	166.9	0	0	0	110.8	V219 M223 P338 I518 A519 N524 F525 F526	V219-I522 HydrophobicContact CB-CG1 4.1Å; V219-I522 HydrophobicContact CG1-CD1 4.07Å; V219-I522 HydrophobicContact CG1-CG1 3.57Å; M223-I522 HydrophobicContact CB-CD1 3.3Å; M223-I522 HydrophobicContact CE-CD1 4.36Å; M223-I522 HydrophobicContact CG-CD1 3.93Å; M223-I522 HydrophobicContact SD-CD1 3.59Å; M223-I522 VanDerWaalsContact SD-CD1 3.59Å; P338-I522 HydrophobicContact CB-CG2 4.19Å; P338-I522 HydrophobicContact CG-CG2 4.17Å; I518-I522 HydrophobicContact CG2-CD1 3.75Å; I518-I522 HydrophobicContact CG2-CG1 4.45Å; I518-I522 PolarHBondContact O-N 3.27Å; A519-I522 WeakPolarHBondContact O-CB 3.42Å; A519-I522 PolarHBondContact O-N 2.89Å; I522-N524 VanDerWaalsContact C-N 3.35Å; I522-N524 PolarHBondContact O-N 3.07Å; I522-F525 PolarHBondContact O-N 3.36Å; I522-F526 HydrophobicContact CG2-CD2 3.54Å; I522-F526 HydrophobicContact CG2-CE2 3.69Å; I522-F526 WeakPolarHBondContact O-CD2 3.48Å; I522-F526 PolarHBondContact O-N 3.11Å
523	S	93.1	Very high	91.8	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.3	-43.9	176.1	-65.6	0	0	0	0	112.3	A334 P338 A519 P520 F526 L527	A334-S523 PolarHBondContact O-OG 3.47Å; P338-S523 VanDerWaalsContact CD-OG 3.26Å; P338-S523 WeakPolarHBondContact CD-OG 3.36Å; P338-S523 WeakPolarHBondContact CG-OG 3.27Å; A519-S523 PolarHBondContact O-N 3.17Å; A519-S523 PolarHBondContact O-OG 2.88Å; P520-S523 PolarHBondContact O-N 3.5Å; S523-F526 PolarHBondContact O-N 3.31Å; S523-L527 VanDerWaalsContact O-CB 3.26Å; S523-L527 WeakPolarHBondContact O-CB 3.46Å; S523-L527 WeakPolarHBondContact O-CD1 3.16Å; S523-L527 VanDerWaalsContact O-CG 3.22Å; S523-L527 WeakPolarHBondContact O-CG 3.35Å; S523-L527 PolarHBondContact O-N 3.17Å
524	N	92.8	Very high	92.2	Very high	8 Å²	8	15.6 Å²	15.6	4%	0.043	9%	0.086	C	C	.	.	H	α-helix	trans	-55.9	-51.7	174.5	-172	57.4	0	0	0	111.7	P520 I521 I522 A528 M571 A578 T582	P520-N524 PolarHBondContact O-N 3.46Å; I521-N524 WeakPolarHBondContact O-CB 3.17Å; I521-N524 PolarHBondContact O-N 2.99Å; I522-N524 VanDerWaalsContact C-N 3.35Å; I522-N524 PolarHBondContact O-N 3.07Å; N524-A528 WeakPolarHBondContact O-CB 3.29Å; N524-A528 PolarHBondContact O-N 2.98Å; N524-M571 WeakPolarHBondContact OD1-CG 3.13Å; N524-M571 PolarHBondContact OD1-SD 2.96Å; N524-M571 VanDerWaalsContact OD1-SD 3.41Å; N524-A578 PolarHBondContact ND2-O 3.26Å; N524-T582 PolarHBondContact ND2-OG1 2.99Å
525	F	93	Very high	92.4	Very high	36 Å²	36	17.3 Å²	17.3	16%	0.158	9%	0.092	C	C	.	.	H	α-helix	trans	-71.4	-33.5	-178	-69.2	-64.4	0	0	0	114.2	I212 F215 A216 I521 I522 S529 T582	I212-F525 HydrophobicContact CG2-CD1 4.33Å; F215-F525 HydrophobicContact CD1-CD1 4.28Å; F215-F525 HydrophobicContact CD1-CD2 4.03Å; F215-F525 HydrophobicContact CD1-CE1 4.22Å; F215-F525 AromaticContact CD1-CE2 3.97Å; F215-F525 HydrophobicContact CD1-CE2 3.97Å; F215-F525 HydrophobicContact CD1-CG 4.2Å; F215-F525 HydrophobicContact CD1-CZ 4.07Å; F215-F525 AromaticContact CE1-CD2 4Å; F215-F525 HydrophobicContact CE1-CD2 4Å; F215-F525 HydrophobicContact CE1-CE1 4.35Å; F215-F525 AromaticContact CE1-CE2 3.56Å; F215-F525 HydrophobicContact CE1-CE2 3.56Å; F215-F525 AromaticContact CE1-CZ 3.75Å; F215-F525 HydrophobicContact CE1-CZ 3.75Å; A216-F525 HydrophobicContact CB-CB 3.88Å; I521-F525 HydrophobicContact CG2-CD2 4.07Å; I521-F525 HydrophobicContact CG2-CE2 3.74Å; I521-F525 WeakPolarHBondContact O-CD2 3.35Å; I521-F525 PolarHBondContact O-N 3.07Å; I522-F525 PolarHBondContact O-N 3.36Å; F525-S529 WeakPolarHBondContact O-CB 3.46Å; F525-S529 PolarHBondContact O-N 2.94Å; F525-S529 VanDerWaalsContact O-N 3.08Å; F525-T582 HydrophobicContact CD1-CG2 4.34Å; F525-T582 HydrophobicContact CE1-CG2 4.37Å
526	F	92.9	Very high	92.6	Very high	5 Å²	5	17.3 Å²	17.3	2%	0.022	9%	0.092	C	C	.	.	H	α-helix	trans	-71.7	-43.7	173.5	-82.6	-63.8	0	0	0	112.3	F213 A216 A220 F337 T341 I522 S523 A528 S529 Y530	F213-F526 HydrophobicContact CD2-CE1 4.05Å; F213-F526 AromaticContact CE2-CE1 3.9Å; F213-F526 HydrophobicContact CE2-CE1 3.9Å; A216-F526 HydrophobicContact CB-CD1 4.1Å; A216-F526 HydrophobicContact CB-CD2 4.23Å; A216-F526 HydrophobicContact CB-CE1 3.91Å; A216-F526 HydrophobicContact CB-CE2 4.06Å; A216-F526 HydrophobicContact CB-CG 4.25Å; A216-F526 HydrophobicContact CB-CZ 3.9Å; A220-F526 HydrophobicContact CB-CE2 4.31Å; F337-F526 HydrophobicContact CE1-CB 4.12Å; T341-F526 HydrophobicContact CG2-CB 3.84Å; T341-F526 HydrophobicContact CG2-CD1 4.43Å; T341-F526 HydrophobicContact CG2-CD2 3.69Å; T341-F526 HydrophobicContact CG2-CE2 4.33Å; T341-F526 HydrophobicContact CG2-CG 3.74Å; I522-F526 HydrophobicContact CG2-CD2 3.54Å; I522-F526 HydrophobicContact CG2-CE2 3.69Å; I522-F526 WeakPolarHBondContact O-CD2 3.48Å; I522-F526 PolarHBondContact O-N 3.11Å; S523-F526 PolarHBondContact O-N 3.31Å; F526-A528 VanDerWaalsContact C-N 3.32Å; F526-A528 PolarHBondContact O-N 3.35Å; F526-S529 PolarHBondContact O-N 3.38Å; F526-S529 PolarHBondContact O-OG 2.8Å; F526-Y530 HydrophobicContact CB-CE2 4.48Å; F526-Y530 HydrophobicContact CD1-CE1 4.07Å; F526-Y530 WeakPolarHBondContact O-CB 3.37Å; F526-Y530 WeakPolarHBondContact O-CD1 3.43Å; F526-Y530 VanDerWaalsContact O-CG 3.23Å; F526-Y530 PolarHBondContact O-N 3.45Å
527	L	94.2	Very high	92.7	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-57.2	-44.2	174.2	-75	168.2	0	0	0	111.6	V171 F337 S523 Y530 A531 C567 V570 M571 I574	V171-L527 HydrophobicContact CG1-CD2 4.21Å; F337-L527 HydrophobicContact CD1-CG 4.26Å; F337-L527 HydrophobicContact CE1-CD2 3.9Å; F337-L527 HydrophobicContact CE1-CG 3.72Å; F337-L527 HydrophobicContact CE2-CD2 3.88Å; F337-L527 HydrophobicContact CZ-CD2 3.49Å; F337-L527 VanDerWaalsContact CZ-CD2 3.49Å; F337-L527 HydrophobicContact CZ-CG 3.88Å; S523-L527 VanDerWaalsContact O-CB 3.26Å; S523-L527 WeakPolarHBondContact O-CB 3.46Å; S523-L527 WeakPolarHBondContact O-CD1 3.16Å; S523-L527 VanDerWaalsContact O-CG 3.22Å; S523-L527 WeakPolarHBondContact O-CG 3.35Å; S523-L527 PolarHBondContact O-N 3.17Å; L527-Y530 PolarHBondContact O-N 3.28Å; L527-A531 WeakPolarHBondContact O-CB 3.09Å; L527-A531 PolarHBondContact O-N 2.86Å; L527-C567 HydrophobicContact CD2-CB 4.32Å; L527-V570 HydrophobicContact CD1-CG1 3.88Å; L527-V570 HydrophobicContact CD2-CG1 4.43Å; L527-M571 HydrophobicContact CB-CB 4.24Å; L527-M571 HydrophobicContact CB-CG 4.35Å; L527-M571 HydrophobicContact CB-SD 4.16Å; L527-M571 HydrophobicContact CD1-CB 4.19Å; L527-I574 HydrophobicContact CD1-CD1 3.71Å
528	A	93.3	Very high	92.9	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-57	-51.8	173.3	0	0	0	0	0	112	N524 F526 Y530 A531 L532 M571 T582 E586	N524-A528 WeakPolarHBondContact O-CB 3.29Å; N524-A528 PolarHBondContact O-N 2.98Å; F526-A528 VanDerWaalsContact C-N 3.32Å; F526-A528 PolarHBondContact O-N 3.35Å; A528-Y530 VanDerWaalsContact C-N 3.28Å; A528-Y530 PolarHBondContact O-N 3.06Å; A528-A531 WeakPolarHBondContact O-CB 3.46Å; A528-A531 PolarHBondContact O-N 3.19Å; A528-L532 PolarHBondContact O-N 3.04Å; A528-M571 HydrophobicContact CB-CE 4.32Å; A528-M571 HydrophobicContact CB-SD 3.76Å; A528-T582 HydrophobicContact CB-CG2 3.59Å; A528-E586 WeakPolarHBondContact CB-OE1 3.24Å
529	S	92.6	Very high	92.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-59.3	-37.6	178.1	78.6	0	0	0	0	113.1	F525 F526 I533	F525-S529 WeakPolarHBondContact O-CB 3.46Å; F525-S529 PolarHBondContact O-N 2.94Å; F525-S529 VanDerWaalsContact O-N 3.08Å; F526-S529 PolarHBondContact O-N 3.38Å; F526-S529 PolarHBondContact O-OG 2.8Å; S529-I533 VanDerWaalsContact O-CG1 3.29Å; S529-I533 WeakPolarHBondContact O-CG1 3.42Å; S529-I533 PolarHBondContact O-N 3.35Å; S529-I533 VanDerWaalsContact O-N 3.08Å
530	Y	94.4	Very high	92.6	Very high	1 Å²	1	15.6 Å²	15.6	0%	0.004	8%	0.077	C	C	.	.	H	α-helix	trans	-75.1	-37	178.8	-64.7	-5.4	0	0	0	111.2	V171 T172 T175 F337 T341 I343 L344 F526 L527 A528 I533 N534	V171-Y530 HydrophobicContact CG1-CD2 4.34Å; T172-Y530 HydrophobicContact CG2-CE2 4.32Å; T175-Y530 HydrophobicContact CG2-CD1 3.89Å; T175-Y530 HydrophobicContact CG2-CD2 4.41Å; T175-Y530 HydrophobicContact CG2-CG 3.79Å; F337-Y530 HydrophobicContact CZ-CD2 4.08Å; F337-Y530 HydrophobicContact CZ-CE2 4Å; T341-Y530 WeakPolarHBondContact CA-OH 3.43Å; I343-Y530 HydrophobicContact CD1-CE2 4.42Å; L344-Y530 HydrophobicContact CD1-CE1 4.18Å; F526-Y530 HydrophobicContact CB-CE2 4.48Å; F526-Y530 HydrophobicContact CD1-CE1 4.07Å; F526-Y530 WeakPolarHBondContact O-CB 3.37Å; F526-Y530 WeakPolarHBondContact O-CD1 3.43Å; F526-Y530 VanDerWaalsContact O-CG 3.23Å; F526-Y530 PolarHBondContact O-N 3.45Å; L527-Y530 PolarHBondContact O-N 3.28Å; A528-Y530 VanDerWaalsContact C-N 3.28Å; A528-Y530 PolarHBondContact O-N 3.06Å; Y530-I533 PolarHBondContact O-N 2.68Å; Y530-N534 VanDerWaalsContact O-CB 3.29Å; Y530-N534 WeakPolarHBondContact O-CB 3.24Å; Y530-N534 VanDerWaalsContact O-CG 3.27Å; Y530-N534 PolarHBondContact O-N 3.15Å; Y530-N534 PolarHBondContact O-ND2 3.32Å
531	A	94.9	Very high	92.5	Very high	6 Å²	6	14.5 Å²	14.5	5%	0.05	7%	0.071	C	C	.	.	H	α-helix	trans	-59.1	-47.4	172.1	0	0	0	0	0	111.1	L527 A528 N534 F535 C567	L527-A531 WeakPolarHBondContact O-CB 3.09Å; L527-A531 PolarHBondContact O-N 2.86Å; A528-A531 WeakPolarHBondContact O-CB 3.46Å; A528-A531 PolarHBondContact O-N 3.19Å; A531-N534 PolarHBondContact O-N 3.44Å; A531-F535 VanDerWaalsContact O-CB 3.26Å; A531-F535 WeakPolarHBondContact O-CB 3.26Å; A531-F535 PolarHBondContact O-N 3.15Å; A531-C567 HydrophobicContact CB-CB 3.69Å
532	L	92.9	Very high	92.3	Very high	22 Å²	22	19.6 Å²	19.6	12%	0.115	9%	0.088	C	C	.	.	H	α-helix	trans	-62.9	-45.7	176.7	-74	-179	0	0	0	112.9	I209 I212 A528 N534 F535 S536 E586	I209-L532 HydrophobicContact CD1-CB 4.06Å; I209-L532 HydrophobicContact CG1-CB 3.57Å; I209-L532 HydrophobicContact CG1-CD1 3.86Å; I209-L532 HydrophobicContact CG1-CG 4.38Å; I212-L532 HydrophobicContact CD1-CD1 4.35Å; A528-L532 PolarHBondContact O-N 3.04Å; L532-N534 VanDerWaalsContact C-N 3.35Å; L532-N534 PolarHBondContact O-N 3.19Å; L532-F535 PolarHBondContact O-N 2.91Å; L532-S536 VanDerWaalsContact O-CB 3.27Å; L532-S536 WeakPolarHBondContact O-CB 3.31Å; L532-S536 PolarHBondContact O-N 2.83Å; L532-S536 PolarHBondContact O-OG 2.89Å; L532-E586 HydrophobicContact CD1-CG 4.07Å; L532-E586 WeakPolarHBondContact CD1-OE1 3.22Å; L532-E586 WeakPolarHBondContact CD2-OE2 3.28Å
533	I	93.7	Very high	91.7	Very high	1 Å²	1	20 Å²	20	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-57.5	-49.8	176.5	-73.1	165.8	0	0	0	110.2	T175 I182 I197 I209 L344 S529 Y530 S536 C537	T175-I533 HydrophobicContact CG2-CG2 4.29Å; I182-I533 HydrophobicContact CD1-CG2 4.13Å; I197-I533 HydrophobicContact CD1-CD1 4.21Å; I197-I533 HydrophobicContact CD1-CG1 4.4Å; I209-I533 HydrophobicContact CD1-CG1 4.11Å; I209-I533 HydrophobicContact CG2-CD1 4.2Å; I209-I533 HydrophobicContact CG2-CG1 3.92Å; L344-I533 HydrophobicContact CD1-CD1 4.03Å; S529-I533 VanDerWaalsContact O-CG1 3.29Å; S529-I533 WeakPolarHBondContact O-CG1 3.42Å; S529-I533 PolarHBondContact O-N 3.35Å; S529-I533 VanDerWaalsContact O-N 3.08Å; Y530-I533 PolarHBondContact O-N 2.68Å; I533-S536 PolarHBondContact O-N 3.2Å; I533-S536 PolarHBondContact O-OG 2.89Å; I533-C537 PolarHBondContact O-N 2.93Å; I533-C537 PolarHBondContact O-SG 3.42Å
534	N	95.9	Very high	91	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-47.4	179.1	-75.8	-36.5	0	0	0	112.3	T175 S178 Y530 A531 L532 S536 C537 F538 S560 A564	T175-N534 WeakPolarHBondContact CA-OD1 3.42Å; T175-N534 PolarHBondContact OG1-ND2 3.27Å; S178-N534 WeakPolarHBondContact CB-OD1 3.42Å; S178-N534 PolarHBondContact OG-OD1 3.3Å; Y530-N534 VanDerWaalsContact O-CB 3.29Å; Y530-N534 WeakPolarHBondContact O-CB 3.24Å; Y530-N534 VanDerWaalsContact O-CG 3.27Å; Y530-N534 PolarHBondContact O-N 3.15Å; Y530-N534 PolarHBondContact O-ND2 3.32Å; A531-N534 PolarHBondContact O-N 3.44Å; L532-N534 VanDerWaalsContact C-N 3.35Å; L532-N534 PolarHBondContact O-N 3.19Å; N534-S536 PolarHBondContact O-N 3.5Å; N534-C537 PolarHBondContact O-N 3.1Å; N534-F538 PolarHBondContact O-N 3.49Å; N534-S560 WeakPolarHBondContact CB-O 3.24Å; N534-S560 WeakPolarHBondContact O-CB 3.46Å; N534-A564 HydrophobicContact CB-CB 3.86Å
535	F	94	Very high	89.7	Confident	84 Å²	84	29.1 Å²	29.1	37%	0.368	13%	0.133	S	C	.	.	H	α-helix	trans	-63.8	-42.3	178.9	178.3	-104.5	0	0	0	112.5	F205 A531 L532 C537 F538 H539 A564	F205-F535 AromaticContact CE1-CD1 3.95Å; F205-F535 HydrophobicContact CE1-CD1 3.95Å; F205-F535 HydrophobicContact CE1-CE1 4.02Å; F205-F535 HydrophobicContact CZ-CD1 4.44Å; F205-F535 HydrophobicContact CZ-CE1 4.17Å; A531-F535 VanDerWaalsContact O-CB 3.26Å; A531-F535 WeakPolarHBondContact O-CB 3.26Å; A531-F535 PolarHBondContact O-N 3.15Å; L532-F535 PolarHBondContact O-N 2.91Å; F535-C537 PolarHBondContact O-N 3.43Å; F535-F538 HydrophobicContact CD2-CD1 4.48Å; F535-F538 HydrophobicContact CE2-CD1 4.48Å; F535-F538 WeakPolarHBondContact O-CB 3.31Å; F535-F538 PolarHBondContact O-N 2.93Å; F535-H539 WeakPolarHBondContact O-CB 3.46Å; F535-H539 PolarHBondContact O-N 3.05Å; F535-A564 HydrophobicContact CB-CB 3.96Å
536	S	91.1	Very high	88.4	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.007	15%	0.152	C	C	.	.	H	α-helix	trans	-65.5	-35.9	179.4	64.6	0	0	0	0	113	L201 L532 I533 N534 H539 A540	L201-S536 WeakPolarHBondContact CD1-OG 3.25Å; L532-S536 VanDerWaalsContact O-CB 3.27Å; L532-S536 WeakPolarHBondContact O-CB 3.31Å; L532-S536 PolarHBondContact O-N 2.83Å; L532-S536 PolarHBondContact O-OG 2.89Å; I533-S536 PolarHBondContact O-N 3.2Å; I533-S536 PolarHBondContact O-OG 2.89Å; N534-S536 PolarHBondContact O-N 3.5Å; S536-H539 PolarHBondContact O-N 2.86Å; S536-A540 WeakPolarHBondContact O-CB 3.28Å; S536-A540 PolarHBondContact O-N 3.36Å
537	C	92.1	Very high	87.4	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.4	-41.2	174	-64.7	0	0	0	0	111.3	I533 N534 F535 S541 W548 Y555	I533-C537 PolarHBondContact O-N 2.93Å; I533-C537 PolarHBondContact O-SG 3.42Å; N534-C537 PolarHBondContact O-N 3.1Å; F535-C537 PolarHBondContact O-N 3.43Å; C537-S541 WeakPolarHBondContact O-CB 3.24Å; C537-S541 PolarHBondContact O-N 3.22Å; C537-S541 VanDerWaalsContact O-N 3.11Å; C537-S541 PolarHBondContact O-OG 3.41Å; C537-W548 HydrophobicContact CB-CH2 4.1Å; C537-W548 HydrophobicContact CB-CZ2 3.99Å; C537-Y555 HydrophobicContact CB-CE2 4.27Å; C537-Y555 PolarHBondContact O-OH 2.99Å; C537-Y555 VanDerWaalsContact O-OH 3.09Å
538	F	93.7	Very high	86.8	Confident	26 Å²	26	34.9 Å²	34.9	11%	0.114	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-49.7	172	166.7	-101.8	0	0	0	111.3	N534 F535 A540 S541 Y542 M557 W558 L561	N534-F538 PolarHBondContact O-N 3.49Å; F535-F538 HydrophobicContact CD2-CD1 4.48Å; F535-F538 HydrophobicContact CE2-CD1 4.48Å; F535-F538 WeakPolarHBondContact O-CB 3.31Å; F535-F538 PolarHBondContact O-N 2.93Å; F538-A540 PolarHBondContact O-N 3.35Å; F538-S541 WeakPolarHBondContact O-CB 3.38Å; F538-S541 PolarHBondContact O-N 2.87Å; F538-Y542 HydrophobicContact CZ-CD2 4.33Å; F538-Y542 HydrophobicContact CZ-CG 4.46Å; F538-Y542 WeakPolarHBondContact O-CB 3.45Å; F538-Y542 PolarHBondContact O-N 3.22Å; F538-M557 HydrophobicContact CD2-CB 4.12Å; F538-M557 HydrophobicContact CD2-CG 4.33Å; F538-M557 WeakPolarHBondContact CD2-O 3.47Å; F538-W558 HydrophobicContact CE2-CE3 4.23Å; F538-W558 HydrophobicContact CE2-CZ3 4.07Å; F538-L561 HydrophobicContact CB-CB 4.41Å; F538-L561 HydrophobicContact CD1-CD1 3.91Å; F538-L561 HydrophobicContact CD2-CB 3.83Å; F538-L561 HydrophobicContact CD2-CD2 4.37Å; F538-L561 HydrophobicContact CD2-CG 4.49Å; F538-L561 HydrophobicContact CE1-CD1 4.01Å; F538-L561 HydrophobicContact CE1-CD2 4.36Å; F538-L561 HydrophobicContact CE2-CB 4.24Å; F538-L561 HydrophobicContact CE2-CD2 3.93Å; F538-L561 HydrophobicContact CG-CB 3.99Å; F538-L561 HydrophobicContact CG-CD1 4.22Å; F538-L561 HydrophobicContact CZ-CD1 4.4Å; F538-L561 HydrophobicContact CZ-CD2 3.93Å
539	H	89.3	Confident	86.5	Confident	43 Å²	43	44 Å²	44	20%	0.199	22%	0.216	C	C	.	.	H	α-helix	trans	-60.6	-44.3	-179.6	-176.9	-101.1	0	0	0	112.5	F205 F535 S536 S541 Y542 A543 S605	F205-H539 AromaticContact CE2-ND1 3.69Å; F205-H539 HydrophobicContact CZ-CB 4.49Å; F205-H539 AromaticContact CZ-ND1 3.96Å; F535-H539 WeakPolarHBondContact O-CB 3.46Å; F535-H539 PolarHBondContact O-N 3.05Å; S536-H539 PolarHBondContact O-N 2.86Å; H539-S541 VanDerWaalsContact C-N 3.33Å; H539-S541 PolarHBondContact O-N 2.79Å; H539-Y542 PolarHBondContact O-N 3.04Å; H539-A543 WeakPolarHBondContact O-CB 3.42Å; H539-A543 PolarHBondContact O-N 3.01Å; H539-S605 PolarHBondContact CE1-OG 3.3Å; H539-S605 PolarHBondContact ND1-OG 2.78Å; H539-S605 VanDerWaalsContact ND1-OG 3.11Å
540	A	86.4	Confident	86.3	Confident	3 Å²	3	45.5 Å²	45.5	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-37.8	176.7	0	0	0	0	0	112.7	L201 S536 F538 K544 S545 W548	L201-A540 HydrophobicContact CD2-CB 4Å; S536-A540 WeakPolarHBondContact O-CB 3.28Å; S536-A540 PolarHBondContact O-N 3.36Å; F538-A540 PolarHBondContact O-N 3.35Å; A540-K544 PolarHBondContact O-N 3.18Å; A540-S545 PolarHBondContact O-N 3.45Å; A540-W548 HydrophobicContact CB-CB 4.3Å; A540-W548 HydrophobicContact CB-CD2 3.65Å; A540-W548 HydrophobicContact CB-CE3 4.03Å; A540-W548 HydrophobicContact CB-CG 3.75Å
541	S	89.4	Confident	86	Confident	13 Å²	13	49.5 Å²	49.5	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-68.2	-47.1	174.9	-58.2	0	0	0	0	112.3	C537 F538 H539 A543 K544 W548 Y555	C537-S541 WeakPolarHBondContact O-CB 3.24Å; C537-S541 PolarHBondContact O-N 3.22Å; C537-S541 VanDerWaalsContact O-N 3.11Å; C537-S541 PolarHBondContact O-OG 3.41Å; F538-S541 WeakPolarHBondContact O-CB 3.38Å; F538-S541 PolarHBondContact O-N 2.87Å; H539-S541 VanDerWaalsContact C-N 3.33Å; H539-S541 PolarHBondContact O-N 2.79Å; S541-A543 VanDerWaalsContact C-N 3.33Å; S541-A543 PolarHBondContact O-N 3.37Å; S541-K544 PolarHBondContact O-N 3.25Å; S541-K544 VanDerWaalsContact O-N 3.08Å; S541-W548 PolarHBondContact OG-NE1 3.18Å; S541-Y555 PolarHBondContact OG-OH 3.19Å
542	Y	87.6	Confident	85.8	Confident	162 Å²	162	51.5 Å²	51.5	64%	0.635	27%	0.266	S	S	*	.	H	α-helix	trans	-63.3	-39.5	178.8	-177.6	-96.6	0	0	0	111.9	F538 H539 K544	F538-Y542 HydrophobicContact CZ-CD2 4.33Å; F538-Y542 HydrophobicContact CZ-CG 4.46Å; F538-Y542 WeakPolarHBondContact O-CB 3.45Å; F538-Y542 PolarHBondContact O-N 3.22Å; H539-Y542 PolarHBondContact O-N 3.04Å; Y542-K544 PolarHBondContact O-N 3.43Å
543	A	78.8	Confident	85.6	Confident	9 Å²	9	59.4 Å²	59.4	7%	0.074	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.1	173.7	0	0	0	0	0	114.4	H539 S541 S545 V609	H539-A543 WeakPolarHBondContact O-CB 3.42Å; H539-A543 PolarHBondContact O-N 3.01Å; S541-A543 VanDerWaalsContact C-N 3.33Å; S541-A543 PolarHBondContact O-N 3.37Å; A543-S545 PolarHBondContact O-N 2.97Å; A543-V609 HydrophobicContact CB-CG2 3.51Å
544	K	77.4	Confident	85.5	Confident	178 Å²	178	66 Å²	66	77%	0.774	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	42	-171.8	-62.6	-177.9	176.1	-179.5	0	112.5	A540 S541 Y542	A540-K544 PolarHBondContact O-N 3.18Å; S541-K544 PolarHBondContact O-N 3.25Å; S541-K544 VanDerWaalsContact O-N 3.08Å; Y542-K544 PolarHBondContact O-N 3.43Å
545	S	66.3	Low	85.4	Confident	22 Å²	22	67.8 Å²	67.8	15%	0.154	34%	0.335	C	S	.	.			trans	-59	127.5	-177.4	-178.2	0	0	0	0	110.6	A540 A543 G547 W548	A540-S545 PolarHBondContact O-N 3.45Å; A543-S545 PolarHBondContact O-N 2.97Å; S545-G547 PolarHBondContact O-N 2.98Å; S545-W548 PolarHBondContact O-N 3.49Å
546	P	65.9	Low	85.4	Confident	87 Å²	87	67.7 Å²	67.7	57%	0.565	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.5	-176.2	-28.2	35.9	0	0	0	115.1	R549	P546-R549 PolarHBondContact O-NE 3.39Å; P546-R549 PolarHBondContact O-NH2 3Å
547	G	70.9	Confident	85.5	Confident	55 Å²	55	70.6 Å²	70.6	57%	0.567	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	11.9	174.2	0	0	0	0	0	114.8	N185 S545	N185-G547 PolarHBondContact ND2-O 3.29Å; N185-G547 PolarHBondContact OD1-O 3.01Å; S545-G547 PolarHBondContact O-N 2.98Å
548	W	82.7	Confident	85.7	Confident	19 Å²	19	78 Å²	78	7%	0.072	38%	0.381	C	S	.	.			trans	-118.2	95.5	173.5	-179.7	-97.8	0	0	0	109.9	A181 I182 N185 L201 C537 A540 S541 S545 P550	A181-W548 HydrophobicContact CB-CH2 4.32Å; A181-W548 HydrophobicContact CB-CZ2 4.28Å; I182-W548 HydrophobicContact CG1-CH2 3.95Å; I182-W548 HydrophobicContact CG1-CZ3 4.14Å; N185-W548 HydrophobicContact CB-CE3 4.28Å; N185-W548 HydrophobicContact CB-CZ3 4.31Å; N185-W548 WeakPolarHBondContact OD1-CA 3.41Å; L201-W548 HydrophobicContact CD2-CE3 4.11Å; L201-W548 HydrophobicContact CD2-CH2 4.12Å; L201-W548 HydrophobicContact CD2-CZ3 3.65Å; L201-W548 HydrophobicContact CG-CZ3 4.38Å; C537-W548 HydrophobicContact CB-CH2 4.1Å; C537-W548 HydrophobicContact CB-CZ2 3.99Å; A540-W548 HydrophobicContact CB-CB 4.3Å; A540-W548 HydrophobicContact CB-CD2 3.65Å; A540-W548 HydrophobicContact CB-CE3 4.03Å; A540-W548 HydrophobicContact CB-CG 3.75Å; S541-W548 PolarHBondContact OG-NE1 3.18Å; S545-W548 PolarHBondContact O-N 3.49Å; W548-P550 HydrophobicContact CZ2-CB 4.42Å; W548-P550 HydrophobicContact CZ2-CG 4.1Å
549	R	87	Confident	85.7	Confident	191 Å²	191	79.6 Å²	79.6	72%	0.721	39%	0.39	S	S	*	.			trans	-134	67.1	-178.8	-54.6	-176.3	-162.5	-169.7	3.9	110	N185 P546 A551	N185-R549 PolarHBondContact OD1-N 3Å; P546-R549 PolarHBondContact O-NE 3.39Å; P546-R549 PolarHBondContact O-NH2 3Å; R549-A551 PolarHBondContact O-N 3.43Å
550	P	87.7	Confident	86	Confident	32 Å²	32	77.7 Å²	77.7	21%	0.208	38%	0.382	C	S	.	.			trans	-65.6	116.3	-177.3	27.2	-35	0	0	0	111.2	A181 W548 Y552 Y555	A181-P550 HydrophobicContact CB-CB 3.65Å; A181-P550 HydrophobicContact CB-CG 4.41Å; W548-P550 HydrophobicContact CZ2-CB 4.42Å; W548-P550 HydrophobicContact CZ2-CG 4.1Å; P550-Y552 PolarHBondContact O-N 3.05Å; P550-Y555 HydrophobicContact CB-CD1 4.34Å; P550-Y555 HydrophobicContact CG-CD1 3.79Å; P550-Y555 HydrophobicContact CG-CE1 3.96Å
551	A	87.4	Confident	86.5	Confident	85 Å²	85	80.1 Å²	80.1	70%	0.702	39%	0.394	S	S	*	.			trans	-79	1.2	-178	0	0	0	0	0	114.3	T184 R549 K553	T184-A551 PolarHBondContact OG1-N 3.24Å; R549-A551 PolarHBondContact O-N 3.43Å; A551-K553 PolarHBondContact O-N 3.44Å
552	Y	90.9	Very high	86.8	Confident	48 Å²	48	84.4 Å²	84.4	19%	0.188	42%	0.415	C	S	.	.			trans	-78.7	111.3	-173.6	-170.2	-106	0	0	0	113.5	L177 T184 P361 L365 P550 F554 Y555	L177-Y552 HydrophobicContact CD2-CE1 3.7Å; T184-Y552 WeakPolarHBondContact OG1-CB 3.34Å; T184-Y552 PolarHBondContact OG1-N 3.09Å; P361-Y552 HydrophobicContact CB-CD2 4.1Å; P361-Y552 HydrophobicContact CB-CE2 3.6Å; P361-Y552 HydrophobicContact CG-CD2 4.27Å; P361-Y552 HydrophobicContact CG-CE2 4.27Å; L365-Y552 WeakPolarHBondContact CD1-OH 3.38Å; P550-Y552 PolarHBondContact O-N 3.05Å; Y552-F554 VanDerWaalsContact C-N 3.28Å; Y552-F554 HydrophobicContact CD1-CB 4.39Å; Y552-F554 HydrophobicContact CE1-CB 3.77Å; Y552-F554 HydrophobicContact CE1-CD2 4.23Å; Y552-F554 PolarHBondContact O-N 3.43Å; Y552-Y555 VanDerWaalsContact O-CB 3.26Å; Y552-Y555 WeakPolarHBondContact O-CB 3.28Å; Y552-Y555 PolarHBondContact O-N 3.5Å
553	K	89.3	Confident	87.1	Confident	189 Å²	189	76.7 Å²	76.7	82%	0.822	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-31.2	-171.2	-175.2	173.3	179.7	177.3	0	116.5	A551	A551-K553 PolarHBondContact O-N 3.44Å
554	F	91.7	Very high	87.9	Confident	139 Å²	139	76.7 Å²	76.7	61%	0.61	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.2	11.6	-178.4	-56.2	-77.1	0	0	0	113.6	L177 Y552	L177-F554 HydrophobicContact CD2-CB 4.14Å; Y552-F554 VanDerWaalsContact C-N 3.28Å; Y552-F554 HydrophobicContact CD1-CB 4.39Å; Y552-F554 HydrophobicContact CE1-CB 3.77Å; Y552-F554 HydrophobicContact CE1-CD2 4.23Å; Y552-F554 PolarHBondContact O-N 3.43Å
555	Y	93.7	Very high	88.8	Confident	37 Å²	37	73.2 Å²	73.2	15%	0.145	37%	0.374	C	S	.	.			trans	-78.4	139	174.4	179.1	-108.8	0	0	0	112.1	A181 C537 S541 P550 Y552 S560	A181-Y555 HydrophobicContact CB-CD1 4.16Å; A181-Y555 HydrophobicContact CB-CD2 3.35Å; A181-Y555 HydrophobicContact CB-CE1 4.48Å; A181-Y555 HydrophobicContact CB-CE2 3.71Å; A181-Y555 HydrophobicContact CB-CG 3.6Å; C537-Y555 HydrophobicContact CB-CE2 4.27Å; C537-Y555 PolarHBondContact O-OH 2.99Å; C537-Y555 VanDerWaalsContact O-OH 3.09Å; S541-Y555 PolarHBondContact OG-OH 3.19Å; P550-Y555 HydrophobicContact CB-CD1 4.34Å; P550-Y555 HydrophobicContact CG-CD1 3.79Å; P550-Y555 HydrophobicContact CG-CE1 3.96Å; Y552-Y555 VanDerWaalsContact O-CB 3.26Å; Y552-Y555 WeakPolarHBondContact O-CB 3.28Å; Y552-Y555 PolarHBondContact O-N 3.5Å; Y555-S560 VanDerWaalsContact CE2-OG 3.24Å; Y555-S560 WeakPolarHBondContact CE2-OG 3.35Å
556	N	94.2	Very high	90.2	Very high	82 Å²	82	74.1 Å²	74.1	44%	0.439	38%	0.378	S	S	.	.			trans	-147	128.2	170.7	-178	-18.1	0	0	0	109.5	W558 L559 S560	N556-W558 PolarHBondContact O-N 3.37Å; N556-W558 PolarHBondContact OD1-N 3.05Å; N556-L559 HydrophobicContact CB-CB 4.19Å; N556-L559 WeakPolarHBondContact O-CB 3.34Å; N556-L559 PolarHBondContact O-N 3.21Å; N556-L559 VanDerWaalsContact O-N 3.08Å; N556-S560 PolarHBondContact O-N 2.88Å
557	M	93.2	Very high	91.6	Very high	62 Å²	62	70 Å²	70	31%	0.305	35%	0.351	S	S	.	.	H	α-helix	trans	-57.6	-35.1	-178.3	73.6	-179.2	79	0	0	113.2	F538 S560 L561	F538-M557 HydrophobicContact CD2-CB 4.12Å; F538-M557 HydrophobicContact CD2-CG 4.33Å; F538-M557 WeakPolarHBondContact CD2-O 3.47Å; M557-S560 PolarHBondContact O-N 3.1Å; M557-L561 PolarHBondContact O-N 3.18Å
558	W	95.4	Very high	92.7	Very high	156 Å²	156	69.1 Å²	69.1	59%	0.591	34%	0.335	S	S	*	.	H	α-helix	trans	-72.5	-30.6	180	-61.1	110.7	0	0	0	112.5	F538 N556 L561 L562	F538-W558 HydrophobicContact CE2-CE3 4.23Å; F538-W558 HydrophobicContact CE2-CZ3 4.07Å; N556-W558 PolarHBondContact O-N 3.37Å; N556-W558 PolarHBondContact OD1-N 3.05Å; W558-L561 HydrophobicContact CE3-CD2 3.92Å; W558-L561 HydrophobicContact CZ3-CD2 3.93Å; W558-L561 PolarHBondContact O-N 3.27Å; W558-L562 WeakPolarHBondContact O-CB 3.47Å; W558-L562 PolarHBondContact O-N 2.86Å
559	L	94.6	Very high	93.2	Very high	59 Å²	59	71.9 Å²	71.9	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-69.8	-38.9	173.5	-174.2	60.4	0	0	0	110.7	I174 L177 N556 L562 G563	I174-L559 HydrophobicContact CD1-CD1 3.94Å; I174-L559 HydrophobicContact CG1-CD1 3.95Å; I174-L559 HydrophobicContact CG1-CG 4.16Å; I174-L559 HydrophobicContact CG2-CG 4.25Å; I174-L559 VanDerWaalsContact CG2-O 3.3Å; I174-L559 WeakPolarHBondContact CG2-O 3.49Å; L177-L559 HydrophobicContact CD1-CD2 3.6Å; N556-L559 HydrophobicContact CB-CB 4.19Å; N556-L559 WeakPolarHBondContact O-CB 3.34Å; N556-L559 PolarHBondContact O-N 3.21Å; N556-L559 VanDerWaalsContact O-N 3.08Å; L559-L562 HydrophobicContact CD1-CD2 4.4Å; L559-L562 PolarHBondContact O-N 3.07Å; L559-G563 PolarHBondContact O-N 2.76Å
560	S	95.3	Very high	93.5	Very high	3 Å²	3	63 Å²	63	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-63.8	-41.2	170.3	-59.2	0	0	0	0	112.3	S178 N534 Y555 N556 M557 L562 G563 A564	S178-S560 PolarHBondContact OG-OG 3.11Å; N534-S560 WeakPolarHBondContact CB-O 3.24Å; N534-S560 WeakPolarHBondContact O-CB 3.46Å; Y555-S560 VanDerWaalsContact CE2-OG 3.24Å; Y555-S560 WeakPolarHBondContact CE2-OG 3.35Å; N556-S560 PolarHBondContact O-N 2.88Å; M557-S560 PolarHBondContact O-N 3.1Å; S560-L562 VanDerWaalsContact C-N 3.35Å; S560-L562 PolarHBondContact O-N 2.97Å; S560-G563 PolarHBondContact O-N 3.3Å; S560-A564 PolarHBondContact O-N 3.09Å
561	L	96.3	Very high	93.8	Very high	55 Å²	55	61.6 Å²	61.6	29%	0.288	31%	0.312	S	S	.	.	H	α-helix	trans	-61.1	-43.7	174.8	-177.5	62.4	0	0	0	111.8	F538 M557 W558 G563 A564 L565	F538-L561 HydrophobicContact CB-CB 4.41Å; F538-L561 HydrophobicContact CD1-CD1 3.91Å; F538-L561 HydrophobicContact CD2-CB 3.83Å; F538-L561 HydrophobicContact CD2-CD2 4.37Å; F538-L561 HydrophobicContact CD2-CG 4.49Å; F538-L561 HydrophobicContact CE1-CD1 4.01Å; F538-L561 HydrophobicContact CE1-CD2 4.36Å; F538-L561 HydrophobicContact CE2-CB 4.24Å; F538-L561 HydrophobicContact CE2-CD2 3.93Å; F538-L561 HydrophobicContact CG-CB 3.99Å; F538-L561 HydrophobicContact CG-CD1 4.22Å; F538-L561 HydrophobicContact CZ-CD1 4.4Å; F538-L561 HydrophobicContact CZ-CD2 3.93Å; M557-L561 PolarHBondContact O-N 3.18Å; W558-L561 HydrophobicContact CE3-CD2 3.92Å; W558-L561 HydrophobicContact CZ3-CD2 3.93Å; W558-L561 PolarHBondContact O-N 3.27Å; L561-G563 VanDerWaalsContact C-N 3.35Å; L561-G563 PolarHBondContact O-N 3.27Å; L561-A564 PolarHBondContact O-N 3.02Å; L561-L565 PolarHBondContact O-N 3.13Å
562	L	96.2	Very high	94.1	Very high	102 Å²	102	61.3 Å²	61.3	53%	0.534	30%	0.295	S	S	.	.	H	α-helix	trans	-59.7	-44.1	174.5	-179.9	63.1	0	0	0	111.6	W558 L559 S560 L565 L566	W558-L562 WeakPolarHBondContact O-CB 3.47Å; W558-L562 PolarHBondContact O-N 2.86Å; L559-L562 HydrophobicContact CD1-CD2 4.4Å; L559-L562 PolarHBondContact O-N 3.07Å; S560-L562 VanDerWaalsContact C-N 3.35Å; S560-L562 PolarHBondContact O-N 2.97Å; L562-L565 PolarHBondContact O-N 3.49Å; L562-L566 VanDerWaalsContact O-CB 3.25Å; L562-L566 WeakPolarHBondContact O-CB 3.41Å; L562-L566 PolarHBondContact O-N 3Å
563	G	94.8	Very high	94.2	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.9	-40.6	175.3	0	0	0	0	0	113.5	L559 S560 L561 L566 C567	L559-G563 PolarHBondContact O-N 2.76Å; S560-G563 PolarHBondContact O-N 3.3Å; L561-G563 VanDerWaalsContact C-N 3.35Å; L561-G563 PolarHBondContact O-N 3.27Å; G563-L566 PolarHBondContact O-N 3.49Å; G563-C567 PolarHBondContact O-N 3.1Å; G563-C567 PolarHBondContact O-SG 2.82Å
564	A	95.9	Very high	94.2	Very high	9 Å²	9	55.1 Å²	55.1	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-64.7	-44.5	176.5	0	0	0	0	0	112.2	N534 F535 S560 L561 C568	N534-A564 HydrophobicContact CB-CB 3.86Å; F535-A564 HydrophobicContact CB-CB 3.96Å; S560-A564 PolarHBondContact O-N 3.09Å; L561-A564 PolarHBondContact O-N 3.02Å; A564-C568 WeakPolarHBondContact O-CB 3.27Å; A564-C568 PolarHBondContact O-N 3.1Å
565	L	95.7	Very high	94.1	Very high	105 Å²	105	50.6 Å²	50.6	55%	0.55	26%	0.259	S	S	.	.	H	α-helix	trans	-65.6	-42.6	176.6	-172.4	151	0	0	0	111.4	L561 L562 C568 V569	L561-L565 PolarHBondContact O-N 3.13Å; L562-L565 PolarHBondContact O-N 3.49Å; L565-C568 WeakPolarHBondContact O-CB 3.42Å; L565-C568 PolarHBondContact O-N 3.11Å; L565-V569 HydrophobicContact CD2-CG2 3.9Å; L565-V569 WeakPolarHBondContact O-CG2 3.32Å; L565-V569 PolarHBondContact O-N 3.37Å
566	L	94.9	Very high	94.1	Very high	42 Å²	42	57 Å²	57	22%	0.22	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-47.7	177	-176.3	63.4	0	0	0	111.7	L167 V170 V171 L562 G563 C568 V569 V570	L167-L566 HydrophobicContact CD1-CD1 4.14Å; L167-L566 HydrophobicContact CD1-CD2 4.24Å; V170-L566 HydrophobicContact CG1-CD2 4.03Å; V171-L566 HydrophobicContact CG2-CD2 3.68Å; V171-L566 HydrophobicContact CG2-CG 4.01Å; L562-L566 VanDerWaalsContact O-CB 3.25Å; L562-L566 WeakPolarHBondContact O-CB 3.41Å; L562-L566 PolarHBondContact O-N 3Å; G563-L566 PolarHBondContact O-N 3.49Å; L566-C568 VanDerWaalsContact C-N 3.33Å; L566-C568 PolarHBondContact O-N 2.89Å; L566-V569 PolarHBondContact O-N 2.65Å; L566-V570 HydrophobicContact CD1-CG2 4.23Å; L566-V570 WeakPolarHBondContact O-CB 3.4Å; L566-V570 VanDerWaalsContact O-CG2 3.27Å; L566-V570 WeakPolarHBondContact O-CG2 3.11Å; L566-V570 PolarHBondContact O-N 2.82Å
567	C	95.1	Very high	94.1	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-58.2	-45.2	174.7	-70.7	0	0	0	0	111.9	L527 A531 G563 M571	L527-C567 HydrophobicContact CD2-CB 4.32Å; A531-C567 HydrophobicContact CB-CB 3.69Å; G563-C567 PolarHBondContact O-N 3.1Å; G563-C567 PolarHBondContact O-SG 2.82Å; C567-M571 VanDerWaalsContact O-CB 3.23Å; C567-M571 WeakPolarHBondContact O-CB 3.33Å; C567-M571 PolarHBondContact O-N 3.45Å
568	C	94.2	Very high	93.9	Very high	36 Å²	36	58.1 Å²	58.1	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-60.8	-51	179	-179.4	0	0	0	0	112	A564 L565 L566 V570 M571 F572 Y583	A564-C568 WeakPolarHBondContact O-CB 3.27Å; A564-C568 PolarHBondContact O-N 3.1Å; L565-C568 WeakPolarHBondContact O-CB 3.42Å; L565-C568 PolarHBondContact O-N 3.11Å; L566-C568 VanDerWaalsContact C-N 3.33Å; L566-C568 PolarHBondContact O-N 2.89Å; C568-V570 PolarHBondContact O-N 3.26Å; C568-M571 PolarHBondContact O-N 3Å; C568-F572 WeakPolarHBondContact O-CD2 3.28Å; C568-F572 PolarHBondContact O-N 3.15Å; C568-Y583 WeakPolarHBondContact CB-OH 3.35Å
569	V	94.3	Very high	93.8	Very high	78 Å²	78	50.7 Å²	50.7	47%	0.473	25%	0.253	S	S	.	.	H	α-helix	trans	-60.6	-48.3	179.3	170.7	0	0	0	0	111	L565 L566 M571 F572 V573	L565-V569 HydrophobicContact CD2-CG2 3.9Å; L565-V569 WeakPolarHBondContact O-CG2 3.32Å; L565-V569 PolarHBondContact O-N 3.37Å; L566-V569 PolarHBondContact O-N 2.65Å; V569-M571 VanDerWaalsContact C-N 3.32Å; V569-M571 PolarHBondContact O-N 2.99Å; V569-F572 PolarHBondContact O-N 2.83Å; V569-V573 HydrophobicContact CG1-CG2 4.47Å; V569-V573 VanDerWaalsContact O-CG2 3.32Å; V569-V573 WeakPolarHBondContact O-CG2 3.49Å; V569-V573 PolarHBondContact O-N 2.95Å
570	V	92.9	Very high	93.7	Very high	5 Å²	5	52.8 Å²	52.8	3%	0.03	26%	0.264	C	S	.	.	H	α-helix	trans	-60.4	-42.5	178.3	171.3	0	0	0	0	111	F333 L527 L566 C568 V573 I574	F333-V570 HydrophobicContact CD1-CG1 4.02Å; F333-V570 HydrophobicContact CE1-CG1 3.38Å; F333-V570 HydrophobicContact CZ-CG1 3.99Å; L527-V570 HydrophobicContact CD1-CG1 3.88Å; L527-V570 HydrophobicContact CD2-CG1 4.43Å; L566-V570 HydrophobicContact CD1-CG2 4.23Å; L566-V570 WeakPolarHBondContact O-CB 3.4Å; L566-V570 VanDerWaalsContact O-CG2 3.27Å; L566-V570 WeakPolarHBondContact O-CG2 3.11Å; L566-V570 PolarHBondContact O-N 2.82Å; C568-V570 PolarHBondContact O-N 3.26Å; V570-V573 PolarHBondContact O-N 3.32Å; V570-I574 HydrophobicContact CG1-CD1 3.8Å; V570-I574 HydrophobicContact CG1-CG1 4.42Å; V570-I574 VanDerWaalsContact O-CG1 3.27Å; V570-I574 WeakPolarHBondContact O-CG1 3.44Å; V570-I574 PolarHBondContact O-N 3.42Å
571	M	93.3	Very high	93.6	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-63	-43.1	178.7	-165.8	171.8	75.6	0	0	112.5	N524 L527 A528 C567 C568 V569 I574 N575 A579 Y583	N524-M571 WeakPolarHBondContact OD1-CG 3.13Å; N524-M571 PolarHBondContact OD1-SD 2.96Å; N524-M571 VanDerWaalsContact OD1-SD 3.41Å; L527-M571 HydrophobicContact CB-CB 4.24Å; L527-M571 HydrophobicContact CB-CG 4.35Å; L527-M571 HydrophobicContact CB-SD 4.16Å; L527-M571 HydrophobicContact CD1-CB 4.19Å; A528-M571 HydrophobicContact CB-CE 4.32Å; A528-M571 HydrophobicContact CB-SD 3.76Å; C567-M571 VanDerWaalsContact O-CB 3.23Å; C567-M571 WeakPolarHBondContact O-CB 3.33Å; C567-M571 PolarHBondContact O-N 3.45Å; C568-M571 PolarHBondContact O-N 3Å; V569-M571 VanDerWaalsContact C-N 3.32Å; V569-M571 PolarHBondContact O-N 2.99Å; M571-I574 PolarHBondContact O-N 2.63Å; M571-N575 PolarHBondContact O-N 2.63Å; M571-N575 VanDerWaalsContact O-N 3.11Å; M571-A579 HydrophobicContact CE-CB 3.95Å; M571-A579 HydrophobicContact CG-CB 3.91Å; M571-Y583 HydrophobicContact CE-CD2 3.7Å; M571-Y583 HydrophobicContact CE-CE1 4.26Å; M571-Y583 HydrophobicContact CE-CE2 3.16Å; M571-Y583 HydrophobicContact CE-CG 4.44Å; M571-Y583 VanDerWaalsContact CE-CZ 3.47Å
572	F	93.7	Very high	93.3	Very high	79 Å²	79	55 Å²	55	35%	0.346	28%	0.275	S	S	.	.	H	α-helix	trans	-65.8	-34.4	175.3	-91.2	-75.1	0	0	0	113.5	C568 V569 W576 A579 L580 Y583	C568-F572 WeakPolarHBondContact O-CD2 3.28Å; C568-F572 PolarHBondContact O-N 3.15Å; V569-F572 PolarHBondContact O-N 2.83Å; F572-W576 HydrophobicContact CD1-CB 4.09Å; F572-W576 WeakPolarHBondContact O-CA 2.96Å; F572-W576 PolarHBondContact O-N 3.13Å; F572-W576 VanDerWaalsContact O-N 3.14Å; F572-A579 HydrophobicContact CD1-CB 3.91Å; F572-A579 HydrophobicContact CD2-CB 4.3Å; F572-A579 HydrophobicContact CE1-CB 4.07Å; F572-A579 HydrophobicContact CE2-CB 4.46Å; F572-A579 HydrophobicContact CG-CB 4.02Å; F572-A579 HydrophobicContact CZ-CB 4.34Å; F572-L580 HydrophobicContact CE1-CB 4.25Å; F572-Y583 HydrophobicContact CD2-CE2 4.31Å; F572-Y583 AromaticContact CE2-CD2 3.72Å; F572-Y583 HydrophobicContact CE2-CD2 3.72Å; F572-Y583 AromaticContact CE2-CE2 3.65Å; F572-Y583 HydrophobicContact CE2-CE2 3.65Å; F572-Y583 HydrophobicContact CZ-CD2 4.04Å; F572-Y583 HydrophobicContact CZ-CE2 4.42Å
573	V	93	Very high	93	Very high	77 Å²	77	52.3 Å²	52.3	47%	0.467	26%	0.258	S	S	.	.	H	α-helix	trans	-75.8	-32.6	178.1	178.1	0	0	0	0	111.9	F330 V569 V570	F330-V573 HydrophobicContact CB-CG1 4.05Å; F330-V573 HydrophobicContact CD1-CB 4.28Å; F330-V573 HydrophobicContact CD1-CG1 3.74Å; F330-V573 HydrophobicContact CD2-CG1 3.44Å; F330-V573 VanDerWaalsContact CD2-CG1 3.44Å; F330-V573 HydrophobicContact CE1-CB 4.41Å; F330-V573 HydrophobicContact CE1-CG1 4.01Å; F330-V573 HydrophobicContact CE2-CG1 3.73Å; F330-V573 HydrophobicContact CG-CB 4.43Å; F330-V573 HydrophobicContact CG-CG1 3.45Å; F330-V573 VanDerWaalsContact CG-CG1 3.45Å; F330-V573 HydrophobicContact CZ-CG1 4Å; V569-V573 HydrophobicContact CG1-CG2 4.47Å; V569-V573 VanDerWaalsContact O-CG2 3.32Å; V569-V573 WeakPolarHBondContact O-CG2 3.49Å; V569-V573 PolarHBondContact O-N 2.95Å; V570-V573 PolarHBondContact O-N 3.32Å
574	I	89.6	Confident	92.9	Very high	31 Å²	31	54.3 Å²	54.3	16%	0.159	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-53.4	172.6	-68.5	167.1	0	0	0	110.8	F333 A334 P520 L527 V570 M571	F333-I574 HydrophobicContact CD1-CD1 3.94Å; F333-I574 HydrophobicContact CE1-CD1 4.09Å; A334-I574 HydrophobicContact CB-CB 4.43Å; A334-I574 HydrophobicContact CB-CD1 3.97Å; A334-I574 HydrophobicContact CB-CG1 3.99Å; A334-I574 HydrophobicContact CB-CG2 3.58Å; P520-I574 HydrophobicContact CB-CG2 4.49Å; L527-I574 HydrophobicContact CD1-CD1 3.71Å; V570-I574 HydrophobicContact CG1-CD1 3.8Å; V570-I574 HydrophobicContact CG1-CG1 4.42Å; V570-I574 VanDerWaalsContact O-CG1 3.27Å; V570-I574 WeakPolarHBondContact O-CG1 3.44Å; V570-I574 PolarHBondContact O-N 3.42Å; M571-I574 PolarHBondContact O-N 2.63Å
575	N	90.8	Very high	92.7	Very high	44 Å²	44	57.7 Å²	57.7	24%	0.235	29%	0.294	C	S	.	.			trans	-158	98.9	178.4	-177.1	-26.9	0	0	0	111	M571 W577 A578 A579	M571-N575 PolarHBondContact O-N 2.63Å; M571-N575 VanDerWaalsContact O-N 3.11Å; N575-W577 VanDerWaalsContact C-N 3.33Å; N575-W577 WeakPolarHBondContact ND2-CZ2 3.32Å; N575-W577 PolarHBondContact O-N 3.19Å; N575-W577 VanDerWaalsContact OD1-CG 3.25Å; N575-W577 PolarHBondContact OD1-N 2.94Å; N575-W577 PolarHBondContact OD1-NE1 3.32Å; N575-W577 VanDerWaalsContact OD1-NE1 3.16Å; N575-A578 HydrophobicContact CB-CB 4.01Å; N575-A578 VanDerWaalsContact CG-CB 3.42Å; N575-A578 PolarHBondContact O-N 3.42Å; N575-A578 WeakPolarHBondContact OD1-CB 3.36Å; N575-A578 PolarHBondContact OD1-N 3.28Å; N575-A579 VanDerWaalsContact O-CB 3.26Å; N575-A579 WeakPolarHBondContact O-CB 3.48Å; N575-A579 PolarHBondContact O-N 2.97Å
576	W	93.4	Very high	92.4	Very high	170 Å²	170	53.1 Å²	53.1	64%	0.644	27%	0.27	S	S	*	.	H	α-helix	trans	-60.9	-34.9	-175.6	70.6	-93	0	0	0	114.4	F572 L580	F572-W576 HydrophobicContact CD1-CB 4.09Å; F572-W576 WeakPolarHBondContact O-CA 2.96Å; F572-W576 PolarHBondContact O-N 3.13Å; F572-W576 VanDerWaalsContact O-N 3.14Å; W576-L580 VanDerWaalsContact O-CB 3.28Å; W576-L580 WeakPolarHBondContact O-CB 3.44Å; W576-L580 PolarHBondContact O-N 3.08Å
577	W	93.3	Very high	92.2	Very high	154 Å²	154	56 Å²	56	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-80.4	-36.3	-177.3	66.2	-102.2	0	0	0	111.4	N575 L581	N575-W577 VanDerWaalsContact C-N 3.33Å; N575-W577 WeakPolarHBondContact ND2-CZ2 3.32Å; N575-W577 PolarHBondContact O-N 3.19Å; N575-W577 VanDerWaalsContact OD1-CG 3.25Å; N575-W577 PolarHBondContact OD1-N 2.94Å; N575-W577 PolarHBondContact OD1-NE1 3.32Å; N575-W577 VanDerWaalsContact OD1-NE1 3.16Å; W577-L581 WeakPolarHBondContact O-CB 3.48Å; W577-L581 PolarHBondContact O-N 3.28Å
578	A	90.1	Very high	92	Very high	15 Å²	15	61.5 Å²	61.5	12%	0.124	31%	0.314	C	S	.	.	H	α-helix	trans	-69.8	-36.6	172.8	0	0	0	0	0	111.5	N524 N575 L581 T582	N524-A578 PolarHBondContact ND2-O 3.26Å; N575-A578 HydrophobicContact CB-CB 4.01Å; N575-A578 VanDerWaalsContact CG-CB 3.42Å; N575-A578 PolarHBondContact O-N 3.42Å; N575-A578 WeakPolarHBondContact OD1-CB 3.36Å; N575-A578 PolarHBondContact OD1-N 3.28Å; A578-L581 PolarHBondContact O-N 3.47Å; A578-T582 PolarHBondContact O-N 3.25Å; A578-T582 PolarHBondContact O-OG1 3.04Å; A578-T582 VanDerWaalsContact O-OG1 3.07Å
579	A	91.9	Very high	91.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-62.7	-47.1	173.1	0	0	0	0	0	111.6	M571 F572 N575 L581 T582 Y583	M571-A579 HydrophobicContact CE-CB 3.95Å; M571-A579 HydrophobicContact CG-CB 3.91Å; F572-A579 HydrophobicContact CD1-CB 3.91Å; F572-A579 HydrophobicContact CD2-CB 4.3Å; F572-A579 HydrophobicContact CE1-CB 4.07Å; F572-A579 HydrophobicContact CE2-CB 4.46Å; F572-A579 HydrophobicContact CG-CB 4.02Å; F572-A579 HydrophobicContact CZ-CB 4.34Å; N575-A579 VanDerWaalsContact O-CB 3.26Å; N575-A579 WeakPolarHBondContact O-CB 3.48Å; N575-A579 PolarHBondContact O-N 2.97Å; A579-L581 PolarHBondContact O-N 3.08Å; A579-T582 PolarHBondContact O-N 3.29Å; A579-Y583 WeakPolarHBondContact O-CD2 3.42Å; A579-Y583 PolarHBondContact O-N 3.03Å
580	L	92.7	Very high	91.5	Very high	103 Å²	103	60.3 Å²	60.3	54%	0.539	30%	0.297	S	S	.	.	H	α-helix	trans	-64.7	-37.4	177.7	-174.1	144.8	0	0	0	112.3	F572 W576 G584	F572-L580 HydrophobicContact CE1-CB 4.25Å; W576-L580 VanDerWaalsContact O-CB 3.28Å; W576-L580 WeakPolarHBondContact O-CB 3.44Å; W576-L580 PolarHBondContact O-N 3.08Å; L580-G584 PolarHBondContact O-N 3.31Å
581	L	92.8	Very high	91.2	Very high	100 Å²	100	64.4 Å²	64.4	52%	0.524	32%	0.318	S	S	.	.	H	α-helix	trans	-64.4	-45.9	173.6	-179.3	61.6	0	0	0	111.7	W577 A578 A579 G584 I585	W577-L581 WeakPolarHBondContact O-CB 3.48Å; W577-L581 PolarHBondContact O-N 3.28Å; A578-L581 PolarHBondContact O-N 3.47Å; A579-L581 PolarHBondContact O-N 3.08Å; L581-G584 PolarHBondContact O-N 2.97Å; L581-I585 HydrophobicContact CD1-CD1 4.32Å; L581-I585 HydrophobicContact CG-CD1 4.22Å; L581-I585 WeakPolarHBondContact O-CG1 3.45Å; L581-I585 PolarHBondContact O-N 3.29Å
582	T	90.5	Very high	91	Very high	5 Å²	5	68.1 Å²	68.1	3%	0.031	33%	0.333	C	S	.	.	H	α-helix	trans	-60.5	-48.1	176.5	-61.3	0	0	0	0	111.3	N524 F525 A528 A578 A579 G584 I585 E586	N524-T582 PolarHBondContact ND2-OG1 2.99Å; F525-T582 HydrophobicContact CD1-CG2 4.34Å; F525-T582 HydrophobicContact CE1-CG2 4.37Å; A528-T582 HydrophobicContact CB-CG2 3.59Å; A578-T582 PolarHBondContact O-N 3.25Å; A578-T582 PolarHBondContact O-OG1 3.04Å; A578-T582 VanDerWaalsContact O-OG1 3.07Å; A579-T582 PolarHBondContact O-N 3.29Å; T582-G584 VanDerWaalsContact C-N 3.32Å; T582-G584 PolarHBondContact O-N 3.02Å; T582-I585 PolarHBondContact O-N 3.09Å; T582-I585 VanDerWaalsContact O-N 3.15Å; T582-E586 PolarHBondContact O-N 3.12Å
583	Y	90.9	Very high	90.6	Very high	45 Å²	45	64.5 Å²	64.5	18%	0.176	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-34.4	176.2	-80.1	-50.6	0	0	0	113.2	C568 M571 F572 A579 I585 E586 I587	C568-Y583 WeakPolarHBondContact CB-OH 3.35Å; M571-Y583 HydrophobicContact CE-CD2 3.7Å; M571-Y583 HydrophobicContact CE-CE1 4.26Å; M571-Y583 HydrophobicContact CE-CE2 3.16Å; M571-Y583 HydrophobicContact CE-CG 4.44Å; M571-Y583 VanDerWaalsContact CE-CZ 3.47Å; F572-Y583 HydrophobicContact CD2-CE2 4.31Å; F572-Y583 AromaticContact CE2-CD2 3.72Å; F572-Y583 HydrophobicContact CE2-CD2 3.72Å; F572-Y583 AromaticContact CE2-CE2 3.65Å; F572-Y583 HydrophobicContact CE2-CE2 3.65Å; F572-Y583 HydrophobicContact CZ-CD2 4.04Å; F572-Y583 HydrophobicContact CZ-CE2 4.42Å; A579-Y583 WeakPolarHBondContact O-CD2 3.42Å; A579-Y583 PolarHBondContact O-N 3.03Å; Y583-I585 VanDerWaalsContact C-N 3.33Å; Y583-I585 PolarHBondContact O-N 2.93Å; Y583-E586 WeakPolarHBondContact CD1-OE2 3.43Å; Y583-E586 VanDerWaalsContact CE1-OE2 3.32Å; Y583-E586 WeakPolarHBondContact CE1-OE2 3.46Å; Y583-E586 PolarHBondContact O-N 2.89Å; Y583-I587 WeakPolarHBondContact O-CB 3.31Å; Y583-I587 VanDerWaalsContact O-CG1 3.27Å; Y583-I587 WeakPolarHBondContact O-CG1 3.18Å; Y583-I587 PolarHBondContact O-N 2.97Å
584	G	92.9	Very high	90.1	Very high	41 Å²	41	63 Å²	63	42%	0.423	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-40.5	172.3	0	0	0	0	0	112.8	L580 L581 T582 L588	L580-G584 PolarHBondContact O-N 3.31Å; L581-G584 PolarHBondContact O-N 2.97Å; T582-G584 VanDerWaalsContact C-N 3.32Å; T582-G584 PolarHBondContact O-N 3.02Å; G584-L588 WeakPolarHBondContact O-CB 3.26Å; G584-L588 PolarHBondContact O-N 3.25Å; G584-L588 VanDerWaalsContact O-N 3.15Å
585	I	91.6	Very high	89.7	Confident	80 Å²	80	67.1 Å²	67.1	41%	0.41	34%	0.335	S	S	.	.	H	α-helix	trans	-68.1	-44.9	174.7	-67.2	165.5	0	0	0	110.7	L581 T582 Y583 I587 L588 L589	L581-I585 HydrophobicContact CD1-CD1 4.32Å; L581-I585 HydrophobicContact CG-CD1 4.22Å; L581-I585 WeakPolarHBondContact O-CG1 3.45Å; L581-I585 PolarHBondContact O-N 3.29Å; T582-I585 PolarHBondContact O-N 3.09Å; T582-I585 VanDerWaalsContact O-N 3.15Å; Y583-I585 VanDerWaalsContact C-N 3.33Å; Y583-I585 PolarHBondContact O-N 2.93Å; I585-I587 PolarHBondContact O-N 2.77Å; I585-L588 PolarHBondContact O-N 3.06Å; I585-L589 HydrophobicContact CG2-CD1 3.78Å; I585-L589 HydrophobicContact CG2-CG 4.32Å; I585-L589 WeakPolarHBondContact O-CB 3.18Å; I585-L589 VanDerWaalsContact O-CG 3.25Å; I585-L589 WeakPolarHBondContact O-CG 3.26Å; I585-L589 PolarHBondContact O-N 2.84Å
586	E	88.3	Confident	89.1	Confident	10 Å²	10	70.5 Å²	70.5	5%	0.047	35%	0.347	C	S	.	.	H	α-helix	trans	-57.1	-49.2	176.5	-77.1	-178.2	-178.6	0	0	112.8	I212 A528 L532 T582 Y583 L588 L589 Y590	I212-E586 HydrophobicContact CD1-CG 3.24Å; I212-E586 WeakPolarHBondContact CD1-OE1 3.29Å; A528-E586 WeakPolarHBondContact CB-OE1 3.24Å; L532-E586 HydrophobicContact CD1-CG 4.07Å; L532-E586 WeakPolarHBondContact CD1-OE1 3.22Å; L532-E586 WeakPolarHBondContact CD2-OE2 3.28Å; T582-E586 PolarHBondContact O-N 3.12Å; Y583-E586 WeakPolarHBondContact CD1-OE2 3.43Å; Y583-E586 VanDerWaalsContact CE1-OE2 3.32Å; Y583-E586 WeakPolarHBondContact CE1-OE2 3.46Å; Y583-E586 PolarHBondContact O-N 2.89Å; E586-L588 VanDerWaalsContact C-N 3.32Å; E586-L588 PolarHBondContact O-N 3.5Å; E586-L589 PolarHBondContact O-N 2.92Å; E586-Y590 WeakPolarHBondContact O-CB 3.35Å; E586-Y590 PolarHBondContact O-N 3.39Å
587	I	90.1	Very high	88	Confident	101 Å²	101	70.1 Å²	70.1	52%	0.518	35%	0.35	S	S	.	.	H	α-helix	trans	-64.2	-39.2	-179.7	-68.9	166.5	0	0	0	110.5	Y583 I585 I591	Y583-I587 WeakPolarHBondContact O-CB 3.31Å; Y583-I587 VanDerWaalsContact O-CG1 3.27Å; Y583-I587 WeakPolarHBondContact O-CG1 3.18Å; Y583-I587 PolarHBondContact O-N 2.97Å; I585-I587 PolarHBondContact O-N 2.77Å; I587-I591 HydrophobicContact CG2-CD1 3.66Å; I587-I591 HydrophobicContact CG2-CG1 4.39Å; I587-I591 WeakPolarHBondContact O-CB 3.13Å; I587-I591 WeakPolarHBondContact O-CG1 3.35Å; I587-I591 PolarHBondContact O-N 2.68Å
588	L	92.3	Very high	86.7	Confident	117 Å²	117	63.7 Å²	63.7	61%	0.613	33%	0.328	S	S	*	.	H	α-helix	trans	-63.8	-43.8	175.3	-173.9	155.4	0	0	0	111.9	G584 I585 E586 Y592	G584-L588 WeakPolarHBondContact O-CB 3.26Å; G584-L588 PolarHBondContact O-N 3.25Å; G584-L588 VanDerWaalsContact O-N 3.15Å; I585-L588 PolarHBondContact O-N 3.06Å; E586-L588 VanDerWaalsContact C-N 3.32Å; E586-L588 PolarHBondContact O-N 3.5Å; L588-Y592 WeakPolarHBondContact O-CB 3.45Å; L588-Y592 PolarHBondContact O-N 3.16Å
589	L	89.8	Confident	85.2	Confident	20 Å²	20	69.5 Å²	69.5	11%	0.105	36%	0.357	C	S	.	.	H	α-helix	trans	-64	-46.7	176.9	-70.4	168	0	0	0	111.6	L211 Y479 I585 E586 Y592 V593	L211-L589 HydrophobicContact CD2-CD1 3.69Å; L211-L589 HydrophobicContact CD2-CD2 3.73Å; L211-L589 HydrophobicContact CD2-CG 4.39Å; Y479-L589 HydrophobicContact CE1-CD2 3.79Å; I585-L589 HydrophobicContact CG2-CD1 3.78Å; I585-L589 HydrophobicContact CG2-CG 4.32Å; I585-L589 WeakPolarHBondContact O-CB 3.18Å; I585-L589 VanDerWaalsContact O-CG 3.25Å; I585-L589 WeakPolarHBondContact O-CG 3.26Å; I585-L589 PolarHBondContact O-N 2.84Å; E586-L589 PolarHBondContact O-N 2.92Å; L589-Y592 WeakPolarHBondContact O-CB 3.36Å; L589-Y592 PolarHBondContact O-N 3.47Å; L589-V593 WeakPolarHBondContact O-CG2 3.38Å; L589-V593 PolarHBondContact O-N 3.29Å; L589-V593 VanDerWaalsContact O-N 3.13Å
590	Y	87.1	Confident	83.6	Confident	68 Å²	68	71 Å²	71	27%	0.267	37%	0.367	S	S	.	.	H	α-helix	trans	-58.1	-52.3	176.1	-178.1	-90.4	0	0	0	111.3	E204 F205 E586 Y592 V593 T594	E204-Y590 HydrophobicContact CB-CD2 3.97Å; E204-Y590 HydrophobicContact CB-CE2 3.6Å; E204-Y590 HydrophobicContact CG-CE2 4.48Å; F205-Y590 HydrophobicContact CE1-CE2 4.32Å; F205-Y590 HydrophobicContact CE2-CE2 4.42Å; F205-Y590 HydrophobicContact CZ-CE2 4.18Å; E586-Y590 WeakPolarHBondContact O-CB 3.35Å; E586-Y590 PolarHBondContact O-N 3.39Å; Y590-Y592 VanDerWaalsContact C-N 3.3Å; Y590-Y592 PolarHBondContact O-N 3.13Å; Y590-V593 PolarHBondContact O-N 3.24Å; Y590-V593 VanDerWaalsContact O-N 3.15Å; Y590-T594 PolarHBondContact O-N 3.12Å; Y590-T594 PolarHBondContact O-OG1 3.43Å
591	I	88.2	Confident	82.1	Confident	91 Å²	91	72.2 Å²	72.2	47%	0.467	37%	0.374	S	S	.	.	H	α-helix	trans	-59	-40.6	177.2	-70.2	169.9	0	0	0	111.2	I587 V593 T594 V595	I587-I591 HydrophobicContact CG2-CD1 3.66Å; I587-I591 HydrophobicContact CG2-CG1 4.39Å; I587-I591 WeakPolarHBondContact O-CB 3.13Å; I587-I591 WeakPolarHBondContact O-CG1 3.35Å; I587-I591 PolarHBondContact O-N 2.68Å; I591-V593 VanDerWaalsContact C-N 3.34Å; I591-V593 PolarHBondContact O-N 2.74Å; I591-T594 PolarHBondContact O-N 3.26Å; I591-V595 HydrophobicContact CG2-CG2 4.03Å; I591-V595 VanDerWaalsContact O-CB 3.31Å; I591-V595 WeakPolarHBondContact O-CB 3.25Å; I591-V595 VanDerWaalsContact O-CG2 3.26Å; I591-V595 WeakPolarHBondContact O-CG2 3.31Å; I591-V595 PolarHBondContact O-N 3.38Å
592	Y	88.9	Confident	80.4	Confident	80 Å²	80	69.9 Å²	69.9	31%	0.314	36%	0.358	S	S	.	.	H	α-helix	trans	-56.4	-48	176.5	-179.7	-83	0	0	0	111.2	Y479 L588 L589 Y590 K596	Y479-Y592 AromaticContact CD1-CD1 3.72Å; Y479-Y592 HydrophobicContact CD1-CD1 3.72Å; Y479-Y592 AromaticContact CD1-CE1 3.81Å; Y479-Y592 HydrophobicContact CD1-CE1 3.81Å; Y479-Y592 AromaticContact CE1-CD1 3.96Å; Y479-Y592 HydrophobicContact CE1-CD1 3.96Å; Y479-Y592 HydrophobicContact CE1-CE1 4.5Å; L588-Y592 WeakPolarHBondContact O-CB 3.45Å; L588-Y592 PolarHBondContact O-N 3.16Å; L589-Y592 WeakPolarHBondContact O-CB 3.36Å; L589-Y592 PolarHBondContact O-N 3.47Å; Y590-Y592 VanDerWaalsContact C-N 3.3Å; Y590-Y592 PolarHBondContact O-N 3.13Å; Y592-K596 HydrophobicContact CD1-CG 4.25Å; Y592-K596 HydrophobicContact CE1-CB 4.41Å; Y592-K596 HydrophobicContact CE1-CG 3.77Å; Y592-K596 HydrophobicContact CE2-CG 4.37Å; Y592-K596 VanDerWaalsContact O-CB 3.25Å; Y592-K596 WeakPolarHBondContact O-CB 3.37Å; Y592-K596 PolarHBondContact O-N 3.29Å
593	V	85.4	Confident	78.8	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.012	37%	0.373	C	S	.	.	H	α-helix	trans	-66.5	-48	-179.6	-178.5	0	0	0	0	111.3	P203 E204 I478 Y479 L589 Y590 I591 V595 K596 K597 P598	P203-V593 HydrophobicContact CB-CG1 4.45Å; E204-V593 HydrophobicContact CG-CG1 4.05Å; I478-V593 HydrophobicContact CG2-CB 4.46Å; I478-V593 HydrophobicContact CG2-CG1 4.13Å; I478-V593 HydrophobicContact CG2-CG2 3.47Å; I478-V593 VanDerWaalsContact CG2-CG2 3.47Å; Y479-V593 HydrophobicContact CE1-CG2 3.84Å; L589-V593 WeakPolarHBondContact O-CG2 3.38Å; L589-V593 PolarHBondContact O-N 3.29Å; L589-V593 VanDerWaalsContact O-N 3.13Å; Y590-V593 PolarHBondContact O-N 3.24Å; Y590-V593 VanDerWaalsContact O-N 3.15Å; I591-V593 VanDerWaalsContact C-N 3.34Å; I591-V593 PolarHBondContact O-N 2.74Å; V593-V595 VanDerWaalsContact C-N 3.3Å; V593-V595 PolarHBondContact O-N 2.81Å; V593-K596 PolarHBondContact O-N 3.14Å; V593-K597 PolarHBondContact O-N 3.34Å; V593-P598 HydrophobicContact CG1-CG 4.2Å
594	T	80.9	Confident	77.4	Confident	47 Å²	47	69.6 Å²	69.6	29%	0.288	37%	0.368	S	S	.	.	H	α-helix	trans	-62.5	-34	179.8	-57.5	0	0	0	0	112.7	E204 Y590 I591 K597	E204-T594 PolarHBondContact OE1-OG1 3.36Å; Y590-T594 PolarHBondContact O-N 3.12Å; Y590-T594 PolarHBondContact O-OG1 3.43Å; I591-T594 PolarHBondContact O-N 3.26Å; T594-K597 VanDerWaalsContact O-CG 3.28Å; T594-K597 WeakPolarHBondContact O-CG 3.39Å
595	V	82.1	Confident	75.9	Confident	117 Å²	117	67.9 Å²	67.9	71%	0.709	35%	0.349	S	S	*	.	H	α-helix	trans	-79.6	-40.2	176.2	172.6	0	0	0	0	112.2	I591 V593	I591-V595 HydrophobicContact CG2-CG2 4.03Å; I591-V595 VanDerWaalsContact O-CB 3.31Å; I591-V595 WeakPolarHBondContact O-CB 3.25Å; I591-V595 VanDerWaalsContact O-CG2 3.26Å; I591-V595 WeakPolarHBondContact O-CG2 3.31Å; I591-V595 PolarHBondContact O-N 3.38Å; V593-V595 VanDerWaalsContact C-N 3.3Å; V593-V595 PolarHBondContact O-N 2.81Å
596	K	77.2	Confident	74.6	Confident	114 Å²	114	66 Å²	66	50%	0.496	34%	0.342	S	S	.	.	H	α-helix	trans	-68.8	-33.4	179.1	-95.1	-74.6	-177.8	-179.4	0	113.2	Y592 V593	Y592-K596 HydrophobicContact CD1-CG 4.25Å; Y592-K596 HydrophobicContact CE1-CB 4.41Å; Y592-K596 HydrophobicContact CE1-CG 3.77Å; Y592-K596 HydrophobicContact CE2-CG 4.37Å; Y592-K596 VanDerWaalsContact O-CB 3.25Å; Y592-K596 WeakPolarHBondContact O-CB 3.37Å; Y592-K596 PolarHBondContact O-N 3.29Å; V593-K596 PolarHBondContact O-N 3.14Å
597	K	70.1	Confident	73.6	Confident	162 Å²	162	70 Å²	70	70%	0.704	36%	0.36	S	S	*	.			trans	43.4	72.4	-170.7	-62.7	-161.3	174.7	-164.6	0	111.4	V593 T594	V593-K597 PolarHBondContact O-N 3.34Å; T594-K597 VanDerWaalsContact O-CG 3.28Å; T594-K597 WeakPolarHBondContact O-CG 3.39Å
598	P	66.5	Low	72.5	Confident	20 Å²	20	65.8 Å²	65.8	13%	0.13	34%	0.341	C	S	.	.			trans	-55.3	152.4	178.9	25.8	-34.9	0	0	0	111	V593 V600	V593-P598 HydrophobicContact CG1-CG 4.2Å; P598-V600 HydrophobicContact CB-CB 4.28Å; P598-V600 HydrophobicContact CB-CG2 4.09Å; P598-V600 PolarHBondContact O-N 3.04Å
599	D	58.6	Low	71.3	Confident	136 Å²	136	63.2 Å²	63.2	73%	0.727	33%	0.33	S	S	*	.	S	Bend	trans	-73.7	42.1	-171.9	-44.4	-85	0	0	0	112.4	K480	K480-D599 IonicContact NZ-OD2 4Å; K480-D599 PolarHBondContact NZ-OD2 3.29Å
600	V	59.4	Low	70.6	Confident	33 Å²	33	66.7 Å²	66.7	20%	0.2	35%	0.352	C	S	.	.			trans	-139.6	82.2	-153.4	179.7	0	0	0	0	108.5	P598 W602	P598-V600 HydrophobicContact CB-CB 4.28Å; P598-V600 HydrophobicContact CB-CG2 4.09Å; P598-V600 PolarHBondContact O-N 3.04Å; V600-W602 HydrophobicContact CG1-CD2 3.84Å; V600-W602 HydrophobicContact CG1-CE3 4.42Å; V600-W602 HydrophobicContact CG1-CG 4.37Å; V600-W602 HydrophobicContact CG1-CH2 3.91Å; V600-W602 HydrophobicContact CG1-CZ2 3.22Å; V600-W602 HydrophobicContact CG1-CZ3 4.44Å; V600-W602 VanDerWaalsContact CG1-NE1 3.31Å; V600-W602 PolarHBondContact O-N 3.45Å
601	N	59.6	Low	70.2	Confident	128 Å²	128	70.4 Å²	70.4	68%	0.684	37%	0.37	S	S	*	.			trans	-91.1	88.2	-173.9	-168.1	22	0	0	0	111.9	G603	N601-G603 VanDerWaalsContact C-N 3.3Å; N601-G603 PolarHBondContact OD1-N 3.09Å
602	W	58.7	Low	69.6	Low	51 Å²	51	69.8 Å²	69.8	19%	0.193	37%	0.37	C	S	.	.	S	Bend	trans	-91.3	6.1	171	-54.9	-26.8	0	0	0	113	S198 R199 P203 D476 I478 V600	S198-W602 VanDerWaalsContact O-CE3 3.32Å; R199-W602 VanDerWaalsContact NE-CE2 3.31Å; R199-W602 VanDerWaalsContact NH2-CZ2 3.32Å; P203-W602 HydrophobicContact CB-CE3 3.93Å; P203-W602 HydrophobicContact CB-CZ3 3.8Å; P203-W602 HydrophobicContact CG-CE3 4.43Å; D476-W602 HydrophobicContact CB-CH2 3.67Å; D476-W602 HydrophobicContact CB-CZ2 3.77Å; D476-W602 VanDerWaalsContact CG-CH2 3.43Å; D476-W602 WeakPolarHBondContact OD1-CZ2 3.38Å; D476-W602 VanDerWaalsContact OD2-CH2 3.31Å; D476-W602 WeakPolarHBondContact OD2-CH2 3.36Å; I478-W602 HydrophobicContact CD1-CH2 3.96Å; I478-W602 HydrophobicContact CD1-CZ3 4.08Å; I478-W602 HydrophobicContact CG1-CH2 4.5Å; V600-W602 HydrophobicContact CG1-CD2 3.84Å; V600-W602 HydrophobicContact CG1-CE3 4.42Å; V600-W602 HydrophobicContact CG1-CG 4.37Å; V600-W602 HydrophobicContact CG1-CH2 3.91Å; V600-W602 HydrophobicContact CG1-CZ2 3.22Å; V600-W602 HydrophobicContact CG1-CZ3 4.44Å; V600-W602 VanDerWaalsContact CG1-NE1 3.31Å; V600-W602 PolarHBondContact O-N 3.45Å
603	G	55.9	Low	69.2	Low	34 Å²	34	68.6 Å²	68.6	35%	0.351	37%	0.374	S	S	.	.			trans	72.2	150.9	-152.7	0	0	0	0	0	111.4	N601	N601-G603 VanDerWaalsContact C-N 3.3Å; N601-G603 PolarHBondContact OD1-N 3.09Å
604	S	61.8	Low	69.2	Low	10 Å²	10	71.2 Å²	71.2	7%	0.07	40%	0.395	C	S	.	.			trans	-131.7	148.5	163.6	-174.2	0	0	0	0	110.1	E204 T606 Q607 A608	E204-S604 PolarHBondContact OE2-OG 2.92Å; S604-T606 WeakPolarHBondContact CB-OG1 3.48Å; S604-T606 PolarHBondContact O-N 3.44Å; S604-T606 PolarHBondContact OG-N 3.24Å; S604-T606 PolarHBondContact OG-OG1 3.24Å; S604-Q607 WeakPolarHBondContact O-CB 3.41Å; S604-Q607 PolarHBondContact O-N 3.38Å; S604-A608 PolarHBondContact O-N 2.93Å
605	S	60.9	Low	69.4	Low	5 Å²	5	72.3 Å²	72.3	4%	0.035	40%	0.402	C	S	.	.	H	α-helix	trans	-55.3	-34.5	168.1	52.9	0	0	0	0	111.4	H539 A608 V609	H539-S605 PolarHBondContact CE1-OG 3.3Å; H539-S605 PolarHBondContact ND1-OG 2.78Å; H539-S605 VanDerWaalsContact ND1-OG 3.11Å; S605-A608 PolarHBondContact O-N 2.94Å; S605-V609 WeakPolarHBondContact O-CG2 3.33Å; S605-V609 PolarHBondContact O-N 2.88Å
606	T	64.7	Low	69.5	Low	41 Å²	41	70.1 Å²	70.1	25%	0.252	39%	0.392	S	S	.	.	H	α-helix	trans	-64.8	-39.8	174.4	55.3	0	0	0	0	112.8	E204 S604 V609 T610	E204-T606 WeakPolarHBondContact OE2-CG2 3.44Å; E204-T606 PolarHBondContact OE2-OG1 3.13Å; S604-T606 WeakPolarHBondContact CB-OG1 3.48Å; S604-T606 PolarHBondContact O-N 3.44Å; S604-T606 PolarHBondContact OG-N 3.24Å; S604-T606 PolarHBondContact OG-OG1 3.24Å; T606-V609 PolarHBondContact O-N 3.13Å; T606-T610 WeakPolarHBondContact O-CG2 3.41Å; T606-T610 PolarHBondContact O-N 3.47Å
607	Q	68	Low	70	Confident	93 Å²	93	69.2 Å²	69.2	44%	0.435	39%	0.392	S	S	.	.	H	α-helix	trans	-64.7	-45.6	174.3	-68.8	170.3	-27.9	0	0	111.4	S604 V609 T610 F611	S604-Q607 WeakPolarHBondContact O-CB 3.41Å; S604-Q607 PolarHBondContact O-N 3.38Å; Q607-V609 VanDerWaalsContact C-N 3.35Å; Q607-V609 PolarHBondContact O-N 3.21Å; Q607-T610 WeakPolarHBondContact CA-OG1 3.46Å; Q607-T610 PolarHBondContact O-N 3.26Å; Q607-T610 VanDerWaalsContact O-N 3.09Å; Q607-T610 PolarHBondContact O-OG1 2.93Å; Q607-F611 PolarHBondContact O-N 3.42Å
608	A	66.1	Low	70.9	Confident	13 Å²	13	62.1 Å²	62.1	11%	0.107	36%	0.364	C	S	.	.	H	α-helix	trans	-58.7	-45.1	177.5	0	0	0	0	0	111.7	S604 S605 T610 F611 V612	S604-A608 PolarHBondContact O-N 2.93Å; S605-A608 PolarHBondContact O-N 2.94Å; A608-T610 VanDerWaalsContact C-N 3.34Å; A608-T610 PolarHBondContact O-N 3.01Å; A608-F611 PolarHBondContact O-N 3.22Å; A608-V612 WeakPolarHBondContact O-CG2 3.27Å; A608-V612 PolarHBondContact O-N 3.04Å
609	V	67.4	Low	71.8	Confident	62 Å²	62	67.4 Å²	67.4	38%	0.376	39%	0.391	S	S	.	.	H	α-helix	trans	-59	-42.9	173.2	172	0	0	0	0	111.5	A543 S605 T606 Q607 F611 S613	A543-V609 HydrophobicContact CB-CG2 3.51Å; S605-V609 WeakPolarHBondContact O-CG2 3.33Å; S605-V609 PolarHBondContact O-N 2.88Å; T606-V609 PolarHBondContact O-N 3.13Å; Q607-V609 VanDerWaalsContact C-N 3.35Å; Q607-V609 PolarHBondContact O-N 3.21Å; V609-F611 VanDerWaalsContact C-N 3.34Å; V609-F611 PolarHBondContact O-N 2.97Å; V609-S613 WeakPolarHBondContact O-CB 3.23Å; V609-S613 PolarHBondContact O-N 2.88Å
610	T	75.1	Confident	73.2	Confident	94 Å²	94	64.4 Å²	64.4	58%	0.577	38%	0.38	S	S	*	.	H	α-helix	trans	-65.1	-34.3	177	57.6	0	0	0	0	113.5	T606 Q607 A608 A614	T606-T610 WeakPolarHBondContact O-CG2 3.41Å; T606-T610 PolarHBondContact O-N 3.47Å; Q607-T610 WeakPolarHBondContact CA-OG1 3.46Å; Q607-T610 PolarHBondContact O-N 3.26Å; Q607-T610 VanDerWaalsContact O-N 3.09Å; Q607-T610 PolarHBondContact O-OG1 2.93Å; A608-T610 VanDerWaalsContact C-N 3.34Å; A608-T610 PolarHBondContact O-N 3.01Å; T610-A614 VanDerWaalsContact O-CB 3.28Å; T610-A614 WeakPolarHBondContact O-CB 3.24Å; T610-A614 PolarHBondContact O-N 2.98Å
611	F	79.3	Confident	74.5	Confident	145 Å²	145	66.3 Å²	66.3	64%	0.636	39%	0.389	S	S	*	.	H	α-helix	trans	-69.9	-50.2	175.3	-179.3	-94.8	0	0	0	111.8	Q607 A608 V609 S613 A614 V615	Q607-F611 PolarHBondContact O-N 3.42Å; A608-F611 PolarHBondContact O-N 3.22Å; V609-F611 VanDerWaalsContact C-N 3.34Å; V609-F611 PolarHBondContact O-N 2.97Å; F611-S613 VanDerWaalsContact C-N 3.28Å; F611-S613 PolarHBondContact O-N 3Å; F611-A614 PolarHBondContact O-N 2.74Å; F611-A614 VanDerWaalsContact O-N 3.1Å; F611-V615 HydrophobicContact CD1-CG2 4.25Å; F611-V615 HydrophobicContact CE1-CG2 3.81Å; F611-V615 HydrophobicContact CE2-CG2 4.3Å; F611-V615 HydrophobicContact CZ-CG2 3.84Å; F611-V615 WeakPolarHBondContact O-CG2 3.3Å; F611-V615 PolarHBondContact O-N 3.31Å
612	V	75.8	Confident	75.7	Confident	78 Å²	78	63.2 Å²	63.2	47%	0.473	38%	0.377	S	S	.	.	H	α-helix	trans	-60	-40.2	177.6	173.8	0	0	0	0	111	A608 S616	A608-V612 WeakPolarHBondContact O-CG2 3.27Å; A608-V612 PolarHBondContact O-N 3.04Å; V612-S616 VanDerWaalsContact O-CB 3.24Å; V612-S616 WeakPolarHBondContact O-CB 3.48Å; V612-S616 PolarHBondContact O-N 2.98Å
613	S	80.6	Confident	76.7	Confident	56 Å²	56	64.3 Å²	64.3	39%	0.392	40%	0.404	S	S	.	.	H	α-helix	trans	-64.3	-43.7	173.3	-174.7	0	0	0	0	112	V609 F611 V615 S616 N617	V609-S613 WeakPolarHBondContact O-CB 3.23Å; V609-S613 PolarHBondContact O-N 2.88Å; F611-S613 VanDerWaalsContact C-N 3.28Å; F611-S613 PolarHBondContact O-N 3Å; S613-V615 PolarHBondContact O-N 2.96Å; S613-S616 PolarHBondContact O-N 3.34Å; S613-N617 VanDerWaalsContact O-CB 3.27Å; S613-N617 WeakPolarHBondContact O-CB 3.27Å; S613-N617 PolarHBondContact O-N 3.5Å; S613-N617 PolarHBondContact O-ND2 2.92Å; S613-N617 PolarHBondContact OG-ND2 2.8Å
614	A	84.9	Confident	78.1	Confident	57 Å²	57	65.8 Å²	65.8	47%	0.471	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-43.7	177	0	0	0	0	0	112.6	T610 F611 A618	T610-A614 VanDerWaalsContact O-CB 3.28Å; T610-A614 WeakPolarHBondContact O-CB 3.24Å; T610-A614 PolarHBondContact O-N 2.98Å; F611-A614 PolarHBondContact O-N 2.74Å; F611-A614 VanDerWaalsContact O-N 3.1Å; A614-A618 VanDerWaalsContact O-CB 3.3Å; A614-A618 WeakPolarHBondContact O-CB 3.49Å; A614-A618 PolarHBondContact O-N 3.42Å
615	V	85.4	Confident	79	Confident	69 Å²	69	73.3 Å²	73.3	42%	0.418	44%	0.44	S	S	.	.	H	α-helix	trans	-65.1	-46.8	176.2	174.4	0	0	0	0	111.1	F611 S613 N617 A618 L619	F611-V615 HydrophobicContact CD1-CG2 4.25Å; F611-V615 HydrophobicContact CE1-CG2 3.81Å; F611-V615 HydrophobicContact CE2-CG2 4.3Å; F611-V615 HydrophobicContact CZ-CG2 3.84Å; F611-V615 WeakPolarHBondContact O-CG2 3.3Å; F611-V615 PolarHBondContact O-N 3.31Å; S613-V615 PolarHBondContact O-N 2.96Å; V615-N617 PolarHBondContact O-N 2.8Å; V615-A618 PolarHBondContact O-N 2.89Å; V615-L619 WeakPolarHBondContact O-CB 3.35Å; V615-L619 PolarHBondContact O-N 3.07Å
616	S	84.4	Confident	79.5	Confident	72 Å²	72	79.1 Å²	79.1	50%	0.503	47%	0.471	S	S	.	.	H	α-helix	trans	-60	-43.7	177.8	-175	0	0	0	0	112.2	V612 S613 L619 S620	V612-S616 VanDerWaalsContact O-CB 3.24Å; V612-S616 WeakPolarHBondContact O-CB 3.48Å; V612-S616 PolarHBondContact O-N 2.98Å; S613-S616 PolarHBondContact O-N 3.34Å; S616-L619 PolarHBondContact O-N 3.24Å; S616-S620 WeakPolarHBondContact O-CB 3.47Å; S616-S620 PolarHBondContact O-N 2.72Å; S616-S620 PolarHBondContact O-OG 2.94Å
617	N	87.5	Confident	80.1	Confident	94 Å²	94	81.2 Å²	81.2	50%	0.503	48%	0.478	S	S	.	.	H	α-helix	trans	-69.1	-34.4	176.6	-69.9	-40.2	0	0	0	113	S613 V615 S620 L621	S613-N617 VanDerWaalsContact O-CB 3.27Å; S613-N617 WeakPolarHBondContact O-CB 3.27Å; S613-N617 PolarHBondContact O-N 3.5Å; S613-N617 PolarHBondContact O-ND2 2.92Å; S613-N617 PolarHBondContact OG-ND2 2.8Å; V615-N617 PolarHBondContact O-N 2.8Å; N617-S620 WeakPolarHBondContact CA-OG 3.48Å; N617-S620 PolarHBondContact O-OG 2.79Å; N617-L621 WeakPolarHBondContact O-CB 3.41Å; N617-L621 PolarHBondContact O-N 3.26Å; N617-L621 VanDerWaalsContact O-N 3.09Å
618	A	87.4	Confident	80.3	Confident	13 Å²	13	78.9 Å²	78.9	11%	0.107	47%	0.47	C	S	.	.	H	α-helix	trans	-69.4	-38.4	175.1	0	0	0	0	0	111.8	A614 V615 S622 L720 M723	A614-A618 VanDerWaalsContact O-CB 3.3Å; A614-A618 WeakPolarHBondContact O-CB 3.49Å; A614-A618 PolarHBondContact O-N 3.42Å; V615-A618 PolarHBondContact O-N 2.89Å; A618-S622 PolarHBondContact O-N 2.84Å; A618-L720 HydrophobicContact CB-CD2 4.43Å; A618-M723 HydrophobicContact CB-CE 3.86Å
619	L	87	Confident	80.9	Confident	132 Å²	132	82.9 Å²	82.9	69%	0.691	49%	0.485	S	S	*	.	H	α-helix	trans	-71.3	-42.1	177.1	-173.3	142.6	0	0	0	111.8	V615 S616 L621 S622	V615-L619 WeakPolarHBondContact O-CB 3.35Å; V615-L619 PolarHBondContact O-N 3.07Å; S616-L619 PolarHBondContact O-N 3.24Å; L619-L621 VanDerWaalsContact C-N 3.33Å; L619-L621 PolarHBondContact O-N 3.26Å; L619-S622 VanDerWaalsContact O-CB 3.24Å; L619-S622 WeakPolarHBondContact O-CB 3.44Å; L619-S622 PolarHBondContact O-N 2.81Å
620	S	87.4	Confident	81.4	Confident	72 Å²	72	84.4 Å²	84.4	50%	0.503	49%	0.491	S	S	.	.	H	α-helix	trans	-64.7	-36.3	175.3	68.8	0	0	0	0	112.4	S616 N617 S622 G623	S616-S620 WeakPolarHBondContact O-CB 3.47Å; S616-S620 PolarHBondContact O-N 2.72Å; S616-S620 PolarHBondContact O-OG 2.94Å; N617-S620 WeakPolarHBondContact CA-OG 3.48Å; N617-S620 PolarHBondContact O-OG 2.79Å; S620-S622 PolarHBondContact O-N 3.05Å; S620-G623 PolarHBondContact O-N 3.47Å
621	L	86.6	Confident	81.9	Confident	73 Å²	73	82.2 Å²	82.2	38%	0.382	47%	0.473	S	S	.	.	H	α-helix	trans	-61.2	-30.6	171.5	-173.6	66.9	0	0	0	112.2	N617 L619 G623 V624 R722 M723	N617-L621 WeakPolarHBondContact O-CB 3.41Å; N617-L621 PolarHBondContact O-N 3.26Å; N617-L621 VanDerWaalsContact O-N 3.09Å; L619-L621 VanDerWaalsContact C-N 3.33Å; L619-L621 PolarHBondContact O-N 3.26Å; L621-G623 PolarHBondContact O-N 3.2Å; L621-V624 WeakPolarHBondContact O-CB 3.32Å; L621-V624 PolarHBondContact O-N 3.22Å; L621-V624 VanDerWaalsContact O-N 3.13Å; L621-R722 HydrophobicContact CD2-CB 3.9Å; L621-R722 HydrophobicContact CG-CB 3.86Å; L621-R722 HydrophobicContact CG-CG 4.4Å; L621-R722 WeakPolarHBondContact O-CG 3.24Å; L621-M723 HydrophobicContact CD2-CG 3.86Å
622	S	84.4	Confident	82.3	Confident	64 Å²	64	80.7 Å²	80.7	45%	0.448	46%	0.463	S	S	.	.	H	α-helix	trans	-65.3	-24.4	179	-158.6	0	0	0	0	113.8	A618 L619 S620 V624	A618-S622 PolarHBondContact O-N 2.84Å; L619-S622 VanDerWaalsContact O-CB 3.24Å; L619-S622 WeakPolarHBondContact O-CB 3.44Å; L619-S622 PolarHBondContact O-N 2.81Å; S620-S622 PolarHBondContact O-N 3.05Å; S622-V624 VanDerWaalsContact C-N 3.26Å; S622-V624 PolarHBondContact O-N 2.82Å
623	G	81	Confident	83	Confident	73 Å²	73	77.3 Å²	77.3	75%	0.753	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	3	174.8	0	0	0	0	0	114.7	S620 L621	S620-G623 PolarHBondContact O-N 3.47Å; L621-G623 PolarHBondContact O-N 3.2Å
624	V	85.3	Confident	83.5	Confident	66 Å²	66	76.7 Å²	76.7	40%	0.4	43%	0.434	S	S	.	.	S	Bend	trans	-96.1	136.4	179	-173.4	0	0	0	0	110.3	L621 S622 R722	L621-V624 WeakPolarHBondContact O-CB 3.32Å; L621-V624 PolarHBondContact O-N 3.22Å; L621-V624 VanDerWaalsContact O-N 3.13Å; S622-V624 VanDerWaalsContact C-N 3.26Å; S622-V624 PolarHBondContact O-N 2.82Å; V624-R722 PolarHBondContact O-NE 3.26Å; V624-R722 VanDerWaalsContact O-NE 3.16Å; V624-R722 PolarHBondContact O-NH2 3.29Å
625	E	79.3	Confident	84	Confident	167 Å²	167	74 Å²	74	78%	0.78	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-75.8	150.1	175.7	-63.7	-176.9	165.6	0	0	112.5	H627	E625-H627 PolarHBondContact O-N 3.48Å
626	D	72.4	Confident	84.5	Confident	128 Å²	128	70.7 Å²	70.7	68%	0.684	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-74.5	117.2	177.7	-58.1	-55.9	0	0	0	110.4	R722	D626-R722 IonicContact OD1-CZ 3.19Å; D626-R722 IonicContact OD1-NE 3.23Å; D626-R722 IonicContact OD1-NH1 3.94Å; D626-R722 PolarHBondContact OD1-NH1 3.12Å; D626-R722 IonicContact OD2-CZ 2.73Å; D626-R722 IonicContact OD2-NH1 2.7Å; D626-R722 PolarHBondContact OD2-NH1 3.41Å; D626-R722 IonicContact OD2-NH2 2.69Å
627	H	77.9	Confident	85	Confident	85 Å²	85	67.3 Å²	67.3	39%	0.394	37%	0.368	S	S	.	.			trans	-130.8	142.5	177.4	-170.6	-108.1	0	0	0	111.6	E625 K629 N630 F631	E625-H627 PolarHBondContact O-N 3.48Å; H627-K629 VanDerWaalsContact C-N 3.27Å; H627-K629 PolarHBondContact O-N 3.11Å; H627-K629 VanDerWaalsContact O-N 3.14Å; H627-N630 WeakPolarHBondContact O-CA 3.39Å; H627-N630 WeakPolarHBondContact O-CB 3.27Å; H627-N630 PolarHBondContact O-N 3.13Å; H627-F631 PolarHBondContact O-N 3.26Å
628	V	72.1	Confident	85.4	Confident	44 Å²	44	63.3 Å²	63.3	27%	0.267	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-52.3	-42	-173.8	-179.2	0	0	0	0	112.7	N630 F631 S1038 T1041	V628-N630 PolarHBondContact O-N 3.05Å; V628-F631 VanDerWaalsContact O-CB 3.23Å; V628-F631 WeakPolarHBondContact O-CB 3.45Å; V628-F631 PolarHBondContact O-N 2.91Å; V628-F631 VanDerWaalsContact O-N 3.13Å; V628-S1038 VanDerWaalsContact CG1-O 3.27Å; V628-S1038 WeakPolarHBondContact CG1-O 3.47Å; V628-S1038 WeakPolarHBondContact CG2-O 3.33Å; V628-T1041 HydrophobicContact CB-CG2 4Å; V628-T1041 HydrophobicContact CG1-CG2 3.78Å
629	K	77.1	Confident	85.5	Confident	97 Å²	97	62.7 Å²	62.7	42%	0.422	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-60.2	-29.1	176	-69.7	176.3	162.6	180	0	114.3	H627 R632 T1041 S1044	H627-K629 VanDerWaalsContact C-N 3.27Å; H627-K629 PolarHBondContact O-N 3.11Å; H627-K629 VanDerWaalsContact O-N 3.14Å; K629-R632 PolarHBondContact O-NH1 3Å; K629-T1041 HydrophobicContact CG-CG2 4.34Å; K629-S1044 VanDerWaalsContact CE-OXT 3.23Å; K629-S1044 WeakPolarHBondContact CE-OXT 3.5Å; K629-S1044 PolarHBondContact NZ-OXT 2.99Å
630	N	78.5	Confident	85.6	Confident	93 Å²	93	57 Å²	57	50%	0.497	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-87.2	-10.2	-177.9	-64.8	-13.5	0	0	0	111.8	H627 V628 R632	H627-N630 WeakPolarHBondContact O-CA 3.39Å; H627-N630 WeakPolarHBondContact O-CB 3.27Å; H627-N630 PolarHBondContact O-N 3.13Å; V628-N630 PolarHBondContact O-N 3.05Å; N630-R632 PolarHBondContact O-N 3.32Å
631	F	85.6	Confident	85.5	Confident	48 Å²	48	54.7 Å²	54.7	21%	0.211	30%	0.298	C	S	.	.			trans	-54.1	131.9	176.5	-178	-92.4	0	0	0	111.9	H627 V628 N726 L867 L870 V1039	H627-F631 PolarHBondContact O-N 3.26Å; V628-F631 VanDerWaalsContact O-CB 3.23Å; V628-F631 WeakPolarHBondContact O-CB 3.45Å; V628-F631 PolarHBondContact O-N 2.91Å; V628-F631 VanDerWaalsContact O-N 3.13Å; F631-N726 WeakPolarHBondContact CE2-ND2 3.49Å; F631-L867 HydrophobicContact CE1-CD1 4.31Å; F631-L867 HydrophobicContact CZ-CD1 4.33Å; F631-L870 HydrophobicContact CD1-CD2 3.69Å; F631-L870 HydrophobicContact CE1-CD2 3.75Å; F631-V1039 HydrophobicContact CD1-CB 3.74Å; F631-V1039 HydrophobicContact CD1-CG1 3.88Å; F631-V1039 HydrophobicContact CD2-CB 4.43Å; F631-V1039 HydrophobicContact CD2-CG1 3.81Å; F631-V1039 HydrophobicContact CE1-CB 3.9Å; F631-V1039 HydrophobicContact CE1-CG1 3.75Å; F631-V1039 HydrophobicContact CE2-CG1 3.67Å; F631-V1039 HydrophobicContact CG-CB 4.03Å; F631-V1039 HydrophobicContact CG-CG1 3.92Å; F631-V1039 HydrophobicContact CZ-CB 4.32Å; F631-V1039 HydrophobicContact CZ-CG1 3.64Å
632	R	87.9	Confident	85.4	Confident	113 Å²	113	51.2 Å²	51.2	43%	0.426	28%	0.28	S	S	.	.			trans	-133.7	144	171.1	-56.1	-65.4	175.1	-98.6	-4	107.4	K629 N630 Q634 Y659 N726	K629-R632 PolarHBondContact O-NH1 3Å; N630-R632 PolarHBondContact O-N 3.32Å; R632-Q634 PolarHBondContact O-N 3.24Å; R632-Q634 VanDerWaalsContact O-N 3.12Å; R632-Y659 WeakPolarHBondContact CB-O 3.36Å; R632-Y659 WeakPolarHBondContact CD-O 3.45Å; R632-Y659 VanDerWaalsContact CG-O 3.24Å; R632-Y659 WeakPolarHBondContact CG-O 3.33Å; R632-N726 PolarHBondContact O-ND2 2.81Å
633	P	89.7	Confident	85.5	Confident	7 Å²	7	50.3 Å²	50.3	5%	0.045	27%	0.267	C	S	.	.			trans	-63	118	170.2	26.8	-33	0	0	0	108.9	I635 F655 L871 I874	P633-I635 HydrophobicContact CB-CD1 4.29Å; P633-I635 HydrophobicContact CB-CG1 4.1Å; P633-F655 HydrophobicContact CG-CB 4.46Å; P633-L871 HydrophobicContact CB-CD2 4.25Å; P633-I874 HydrophobicContact CG-CD1 4.05Å
634	Q	92.3	Very high	85.8	Confident	43 Å²	43	47.2 Å²	47.2	20%	0.201	23%	0.234	C	C	.	.			trans	-113.3	91.6	176.2	-65.3	164.7	-71.4	0	0	106	R632 L661 R722 K724 P725 N726 T727	R632-Q634 PolarHBondContact O-N 3.24Å; R632-Q634 VanDerWaalsContact O-N 3.12Å; Q634-L661 CarbonylContact C-O 3.58Å; Q634-L661 WeakPolarHBondContact CA-O 3.4Å; Q634-L661 HydrophobicContact CB-CB 3.97Å; Q634-L661 HydrophobicContact CG-CB 4.03Å; Q634-R722 PolarHBondContact NE2-O 2.88Å; Q634-R722 VanDerWaalsContact NE2-O 3.16Å; Q634-K724 WeakPolarHBondContact CB-O 3.36Å; Q634-K724 PolarHBondContact NE2-O 3.04Å; Q634-K724 VanDerWaalsContact NE2-O 3.1Å; Q634-P725 CarbonylContact O-C 3.58Å; Q634-P725 VanDerWaalsContact O-CA 3.26Å; Q634-P725 WeakPolarHBondContact O-CA 3.43Å; Q634-P725 WeakPolarHBondContact O-CB 3.37Å; Q634-N726 HydrophobicContact CB-CB 4.46Å; Q634-N726 PolarHBondContact N-OD1 3.04Å; Q634-N726 PolarHBondContact O-N 2.88Å; Q634-N726 PolarHBondContact O-OD1 2.78Å; Q634-N726 PolarHBondContact OE1-ND2 3.02Å; Q634-T727 PolarHBondContact O-N 2.82Å; Q634-T727 VanDerWaalsContact O-N 3.15Å
635	I	94.7	Very high	86.1	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.7	-163.1	-49.6	-176.5	0	0	0	111.2	P633 V637 F655 T656 L661 C662 L663 T727 M729 L762	P633-I635 HydrophobicContact CB-CD1 4.29Å; P633-I635 HydrophobicContact CB-CG1 4.1Å; I635-V637 HydrophobicContact CB-CG2 4.43Å; I635-V637 HydrophobicContact CG2-CG2 3.72Å; I635-F655 HydrophobicContact CD1-CB 3.77Å; I635-F655 HydrophobicContact CD1-CD2 3.67Å; I635-F655 HydrophobicContact CD1-CG 4.1Å; I635-T656 HydrophobicContact CB-CG2 4.11Å; I635-T656 HydrophobicContact CD1-CG2 3.89Å; I635-T656 HydrophobicContact CG1-CG2 3.74Å; I635-L661 PolarHBondContact N-O 3.2Å; I635-C662 WeakPolarHBondContact O-CA 3.11Å; I635-L663 PolarHBondContact O-N 2.99Å; I635-T727 CarbonylContact C-O 3.56Å; I635-T727 WeakPolarHBondContact CA-O 3.39Å; I635-T727 HydrophobicContact CG1-CG2 4.43Å; I635-M729 HydrophobicContact CG2-CB 3.53Å; I635-M729 HydrophobicContact CG2-CG 4.45Å; I635-M729 HydrophobicContact CG2-SD 4.16Å; I635-L762 HydrophobicContact CD1-CD1 4.48Å
636	L	96	Very high	86.6	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	123	163.6	-172.8	151.5	0	0	0	108.8	L638 L663 C665 L714 S718 P725 T727 L728 M729	L636-L638 HydrophobicContact CD2-CD2 3.71Å; L636-L638 HydrophobicContact CD2-CG 4.19Å; L636-L663 HydrophobicContact CD1-CD1 4.37Å; L636-C665 HydrophobicContact CD2-CB 4.22Å; L636-L714 HydrophobicContact CD1-CB 4.24Å; L636-L714 WeakPolarHBondContact CD1-O 3.4Å; L636-S718 WeakPolarHBondContact CD1-OG 3.35Å; L636-P725 HydrophobicContact CB-CB 3.8Å; L636-P725 HydrophobicContact CB-CG 4.05Å; L636-P725 HydrophobicContact CD1-CG 3.96Å; L636-T727 PolarHBondContact N-O 2.86Å; L636-L728 HydrophobicContact CD2-CD1 3.71Å; L636-L728 CarbonylContact O-C 3.55Å; L636-M729 PolarHBondContact O-N 3.47Å
637	V	95.6	Very high	87.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	115.2	-172.1	-167.4	0	0	0	0	109.8	I635 T639 L648 A652 L663 C665 M729	I635-V637 HydrophobicContact CB-CG2 4.43Å; I635-V637 HydrophobicContact CG2-CG2 3.72Å; V637-T639 HydrophobicContact CB-CG2 4.35Å; V637-T639 HydrophobicContact CG1-CG2 3.78Å; V637-T639 PolarHBondContact O-N 2.91Å; V637-L648 HydrophobicContact CG1-CB 4.44Å; V637-L648 HydrophobicContact CG1-CD2 3.56Å; V637-L648 HydrophobicContact CG1-CG 3.61Å; V637-A652 HydrophobicContact CG1-CB 4.47Å; V637-A652 HydrophobicContact CG2-CB 3.42Å; V637-A652 VanDerWaalsContact CG2-CB 3.42Å; V637-L663 WeakPolarHBondContact CB-O 3.5Å; V637-L663 WeakPolarHBondContact CG2-O 3.43Å; V637-L663 PolarHBondContact N-O 2.84Å; V637-C665 WeakPolarHBondContact O-CB 3.41Å; V637-C665 PolarHBondContact O-N 3.03Å; V637-M729 WeakPolarHBondContact CA-O 3.43Å; V637-M729 HydrophobicContact CG1-CB 4.45Å; V637-M729 HydrophobicContact CG1-CG 4.44Å; V637-M729 HydrophobicContact CG2-CB 4.37Å
638	L	94.9	Very high	88.2	Confident	10 Å²	10	30.6 Å²	30.6	5%	0.052	15%	0.147	C	C	.	.			trans	-79.2	73.8	175.8	-62.1	-174	0	0	0	111	L636 G640 R645 C665 F707 A711 L714 L728 M729 I730 L750	L636-L638 HydrophobicContact CD2-CD2 3.71Å; L636-L638 HydrophobicContact CD2-CG 4.19Å; L638-G640 VanDerWaalsContact C-N 3.28Å; L638-G640 PolarHBondContact O-N 3.05Å; L638-R645 PolarHBondContact O-NH1 3.15Å; L638-C665 HydrophobicContact CD2-CB 3.81Å; L638-F707 HydrophobicContact CD1-CZ 4.22Å; L638-A711 HydrophobicContact CD1-CB 4.29Å; L638-L714 HydrophobicContact CD2-CD1 4.1Å; L638-L728 HydrophobicContact CD1-CD1 4.27Å; L638-L728 HydrophobicContact CG-CD1 4.08Å; L638-M729 PolarHBondContact N-O 2.97Å; L638-I730 HydrophobicContact CB-CG2 4.13Å; L638-I730 HydrophobicContact CD1-CG2 3.85Å; L638-I730 HydrophobicContact CG-CG2 4.1Å; L638-L750 HydrophobicContact CD1-CD2 3.53Å
639	T	90.9	Very high	89.2	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.135	C	C	.	.			trans	-69.6	-25	176.9	43.7	0	0	0	0	113	V637 R645 L649 S664 C665	V637-T639 HydrophobicContact CB-CG2 4.35Å; V637-T639 HydrophobicContact CG1-CG2 3.78Å; V637-T639 PolarHBondContact O-N 2.91Å; T639-R645 WeakPolarHBondContact O-CD 3.43Å; T639-R645 WeakPolarHBondContact O-CG 3.4Å; T639-L649 HydrophobicContact CG2-CB 4.08Å; T639-S664 WeakPolarHBondContact CG2-OG 3.48Å; T639-S664 PolarHBondContact OG1-OG 3.16Å; T639-C665 PolarHBondContact N-O 3.2Å; T639-C665 PolarHBondContact OG1-N 2.89Å; T639-C665 PolarHBondContact OG1-O 2.86Å
640	G	88.1	Confident	89.9	Confident	13 Å²	13	24.4 Å²	24.4	13%	0.134	12%	0.118	C	C	.	.	S	Bend	trans	64.2	-147.6	-146.8	0	0	0	0	0	107.9	L638 A642 C665	L638-G640 VanDerWaalsContact C-N 3.28Å; L638-G640 PolarHBondContact O-N 3.05Å; G640-A642 PolarHBondContact O-N 2.96Å; G640-C665 PolarHBondContact N-O 3.15Å
641	S	85.6	Confident	90.6	Very high	23 Å²	23	20 Å²	20	16%	0.161	9%	0.094	C	C	.	.	S	Bend	trans	-49.6	138.1	171.2	168.7	0	0	0	0	110.3	R643 A644 E666	S641-R643 PolarHBondContact O-N 3Å; S641-A644 WeakPolarHBondContact O-CB 3.41Å; S641-A644 PolarHBondContact O-N 2.75Å; S641-E666 WeakPolarHBondContact CA-OE1 3.43Å; S641-E666 VanDerWaalsContact CA-OE2 3.3Å; S641-E666 WeakPolarHBondContact CA-OE2 3.39Å; S641-E666 WeakPolarHBondContact CB-OE1 3.46Å; S641-E666 PolarHBondContact N-OE1 3.47Å; S641-E666 PolarHBondContact N-OE2 3.27Å
642	A	85.2	Confident	90.9	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-14.5	-175.2	0	0	0	0	0	113.8	G640 N686 W689 L690 Y699	G640-A642 PolarHBondContact O-N 2.96Å; A642-N686 HydrophobicContact CB-CB 4.1Å; A642-W689 HydrophobicContact CB-CE3 3.98Å; A642-W689 HydrophobicContact CB-CZ3 4.05Å; A642-W689 VanDerWaalsContact O-CH2 3.28Å; A642-W689 WeakPolarHBondContact O-CH2 3.41Å; A642-W689 WeakPolarHBondContact O-CZ3 3.48Å; A642-L690 HydrophobicContact CB-CD2 4.23Å; A642-L690 HydrophobicContact CB-CG 4.35Å; A642-Y699 HydrophobicContact CB-CD2 4.23Å; A642-Y699 HydrophobicContact CB-CE2 4.41Å
643	R	86.3	Confident	91.1	Very high	45 Å²	45	13.6 Å²	13.6	17%	0.17	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-23.4	176.4	-43.3	-165.5	-159.2	156.7	17.5	114.5	S641 P646 W689 V776 E780	S641-R643 PolarHBondContact O-N 3Å; R643-P646 WeakPolarHBondContact O-CD 3.44Å; R643-W689 HydrophobicContact CB-CZ2 4.31Å; R643-W689 HydrophobicContact CG-CD2 4Å; R643-W689 HydrophobicContact CG-CG 4.35Å; R643-W689 HydrophobicContact CG-CH2 4.45Å; R643-W689 HydrophobicContact CG-CZ2 3.94Å; R643-V776 HydrophobicContact CB-CG1 4.16Å; R643-V776 HydrophobicContact CB-CG2 4.21Å; R643-E780 IonicContact CZ-OE1 3.86Å; R643-E780 IonicContact NH1-OE1 3.55Å; R643-E780 PolarHBondContact NH1-OE1 3.42Å; R643-E780 IonicContact NH2-OE1 3.52Å; R643-E780 PolarHBondContact NH2-OE1 3.47Å
644	A	87.3	Confident	91.2	Very high	8 Å²	8	13.7 Å²	13.7	7%	0.066	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-34.3	-170.5	0	0	0	0	0	112.9	S641 D771 V772	S641-A644 WeakPolarHBondContact O-CB 3.41Å; S641-A644 PolarHBondContact O-N 2.75Å; A644-D771 CarbonylContact O-C 3.56Å; A644-D771 WeakPolarHBondContact O-CA 3.34Å; A644-V772 VanDerWaalsContact O-CG2 3.25Å; A644-V772 WeakPolarHBondContact O-CG2 3.48Å; A644-V772 PolarHBondContact O-N 3Å
645	R	91.3	Very high	91.1	Very high	72 Å²	72	11.7 Å²	11.7	27%	0.272	6%	0.061	S	C	.	.			trans	-129.1	64.2	-178.4	-59.2	-179.2	-169.1	130.8	11.5	112.5	L638 T639 A647 L648 L649 L770 D771	L638-R645 PolarHBondContact O-NH1 3.15Å; T639-R645 WeakPolarHBondContact O-CD 3.43Å; T639-R645 WeakPolarHBondContact O-CG 3.4Å; R645-A647 VanDerWaalsContact C-N 3.35Å; R645-A647 PolarHBondContact O-N 2.92Å; R645-L648 HydrophobicContact CB-CB 4.23Å; R645-L648 WeakPolarHBondContact O-CB 3.23Å; R645-L648 PolarHBondContact O-N 3.2Å; R645-L649 PolarHBondContact O-N 3.22Å; R645-L770 WeakPolarHBondContact CA-O 3.47Å; R645-D771 IonicContact CZ-OD2 3.93Å; R645-D771 IonicContact NE-OD2 3.52Å; R645-D771 PolarHBondContact NE-OD2 2.75Å; R645-D771 IonicContact NH2-OD2 3.5Å; R645-D771 PolarHBondContact NH2-OD2 2.8Å
646	P	89.9	Confident	90.9	Very high	24 Å²	24	11.8 Å²	11.8	16%	0.156	6%	0.061	C	C	.	.	H	α-helix	trans	-71.5	-26.6	-167.7	30.2	-34.6	0	0	0	113.1	R643 L649 D650 V772	R643-P646 WeakPolarHBondContact O-CD 3.44Å; P646-L649 PolarHBondContact O-N 3.15Å; P646-D650 WeakPolarHBondContact O-CB 3.43Å; P646-D650 PolarHBondContact O-N 3.28Å; P646-V772 HydrophobicContact CG-CG2 4.38Å
647	A	90.9	Very high	90.4	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.008	8%	0.079	C	C	.	.	H	α-helix	trans	-63.8	-42.1	173.7	0	0	0	0	0	112.3	R645 D650 L651 M766 L770 S844 F847	R645-A647 VanDerWaalsContact C-N 3.35Å; R645-A647 PolarHBondContact O-N 2.92Å; A647-D650 PolarHBondContact O-N 3.28Å; A647-L651 WeakPolarHBondContact O-CB 3.4Å; A647-L651 PolarHBondContact O-N 2.92Å; A647-M766 HydrophobicContact CB-SD 4.01Å; A647-L770 HydrophobicContact CB-CD2 3.91Å; A647-S844 PolarHBondContact N-O 3.28Å; A647-F847 HydrophobicContact CB-CD2 4.04Å; A647-F847 HydrophobicContact CB-CE2 4.39Å; A647-F847 WeakPolarHBondContact O-CD2 3.39Å
648	L	92.6	Very high	89.7	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.2	-47.4	178.1	-166.3	73.7	0	0	0	110	V637 R645 L651 A652 M729 L764 L770	V637-L648 HydrophobicContact CG1-CB 4.44Å; V637-L648 HydrophobicContact CG1-CD2 3.56Å; V637-L648 HydrophobicContact CG1-CG 3.61Å; R645-L648 HydrophobicContact CB-CB 4.23Å; R645-L648 WeakPolarHBondContact O-CB 3.23Å; R645-L648 PolarHBondContact O-N 3.2Å; L648-L651 PolarHBondContact O-N 3.46Å; L648-A652 WeakPolarHBondContact O-CB 3.23Å; L648-A652 PolarHBondContact O-N 3.39Å; L648-M729 HydrophobicContact CD1-CE 3.84Å; L648-M729 HydrophobicContact CD1-CG 4.03Å; L648-M729 HydrophobicContact CG-CE 4.38Å; L648-M729 HydrophobicContact CG-CG 4.43Å; L648-L764 HydrophobicContact CD1-CB 3.72Å; L648-L764 HydrophobicContact CD1-CD2 3.76Å; L648-L764 HydrophobicContact CD1-CG 4.37Å; L648-L770 HydrophobicContact CD1-CD1 4.49Å
649	L	92.6	Very high	89.3	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-63.8	-41.1	175.8	-179	63.6	0	0	0	113.3	T639 R645 P646 L651 A652 H653 W689 L690 A697	T639-L649 HydrophobicContact CG2-CB 4.08Å; R645-L649 PolarHBondContact O-N 3.22Å; P646-L649 PolarHBondContact O-N 3.15Å; L649-L651 VanDerWaalsContact C-N 3.35Å; L649-A652 PolarHBondContact O-N 2.86Å; L649-H653 VanDerWaalsContact O-CB 3.23Å; L649-H653 WeakPolarHBondContact O-CB 3.24Å; L649-H653 PolarHBondContact O-N 2.64Å; L649-W689 HydrophobicContact CD2-CZ3 4.06Å; L649-L690 HydrophobicContact CD1-CD2 4.5Å; L649-L690 HydrophobicContact CD2-CD2 3.63Å; L649-A697 HydrophobicContact CD1-CB 4.35Å
650	D	91.9	Very high	89.1	Confident	11 Å²	11	27.9 Å²	27.9	6%	0.059	14%	0.14	C	C	.	.	H	α-helix	trans	-70.7	-29.3	-179.9	-108.6	58.8	0	0	0	113.4	P646 A647 S654 R695 F847 K848 K880	P646-D650 WeakPolarHBondContact O-CB 3.43Å; P646-D650 PolarHBondContact O-N 3.28Å; A647-D650 PolarHBondContact O-N 3.28Å; D650-S654 PolarHBondContact O-N 2.85Å; D650-S654 PolarHBondContact O-OG 3.36Å; D650-R695 IonicContact OD1-CZ 3.49Å; D650-R695 IonicContact OD1-NE 2.63Å; D650-R695 PolarHBondContact OD1-NE 3.37Å; D650-R695 IonicContact OD1-NH2 3.2Å; D650-R695 PolarHBondContact OD1-NH2 3.25Å; D650-R695 IonicContact OD2-CZ 3.76Å; D650-R695 IonicContact OD2-NE 3.82Å; D650-R695 IonicContact OD2-NH2 3.08Å; D650-R695 PolarHBondContact OD2-NH2 3.45Å; D650-F847 HydrophobicContact CB-CB 4.02Å; D650-K848 WeakPolarHBondContact OD2-CA 3.35Å; D650-K880 IonicContact OD2-NZ 3.77Å; D650-K880 PolarHBondContact OD2-NZ 2.94Å
651	L	92.6	Very high	89.3	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-74.8	-47.9	171.6	-172.7	60.3	0	0	0	110.7	A647 L648 L649 H653 S654 F655 M729 L764 F847 L875 W881 M1030	A647-L651 WeakPolarHBondContact O-CB 3.4Å; A647-L651 PolarHBondContact O-N 2.92Å; L648-L651 PolarHBondContact O-N 3.46Å; L649-L651 VanDerWaalsContact C-N 3.35Å; L651-H653 PolarHBondContact O-N 3.28Å; L651-S654 WeakPolarHBondContact O-CA 3.33Å; L651-S654 VanDerWaalsContact O-CB 3.27Å; L651-S654 WeakPolarHBondContact O-CB 3.42Å; L651-S654 PolarHBondContact O-N 3.17Å; L651-F655 HydrophobicContact CD1-CE2 4.28Å; L651-F655 HydrophobicContact CD1-CZ 4.15Å; L651-F655 HydrophobicContact CD2-CE2 4.48Å; L651-F655 HydrophobicContact CG-CE2 3.83Å; L651-F655 HydrophobicContact CG-CZ 4.12Å; L651-F655 WeakPolarHBondContact O-CD2 3.47Å; L651-F655 PolarHBondContact O-N 3.2Å; L651-M729 HydrophobicContact CB-CE 4.04Å; L651-M729 HydrophobicContact CD2-CE 3.88Å; L651-M729 HydrophobicContact CG-CE 4.02Å; L651-L764 HydrophobicContact CD2-CD1 3.79Å; L651-L764 HydrophobicContact CD2-CD2 4.03Å; L651-L764 HydrophobicContact CD2-CG 4.48Å; L651-F847 HydrophobicContact CB-CD2 4.06Å; L651-F847 HydrophobicContact CB-CE2 4.45Å; L651-F847 HydrophobicContact CB-CG 4.36Å; L651-F847 HydrophobicContact CD1-CD1 4.46Å; L651-F847 HydrophobicContact CD2-CE2 4.3Å; L651-F847 HydrophobicContact CD2-CZ 4.42Å; L651-L875 HydrophobicContact CD1-CD1 4.36Å; L651-L875 HydrophobicContact CD1-CD2 4.41Å; L651-W881 HydrophobicContact CD1-CZ2 4.1Å; L651-M1030 HydrophobicContact CD2-SD 4.35Å
652	A	93.1	Very high	89.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-54.4	-48.5	174.2	0	0	0	0	0	112.4	V637 L648 L649 S654 F655 T656 M729	V637-A652 HydrophobicContact CG1-CB 4.47Å; V637-A652 HydrophobicContact CG2-CB 3.42Å; V637-A652 VanDerWaalsContact CG2-CB 3.42Å; L648-A652 WeakPolarHBondContact O-CB 3.23Å; L648-A652 PolarHBondContact O-N 3.39Å; L649-A652 PolarHBondContact O-N 2.86Å; A652-S654 PolarHBondContact O-N 3.31Å; A652-F655 PolarHBondContact O-N 2.84Å; A652-F655 VanDerWaalsContact O-N 3.11Å; A652-T656 PolarHBondContact O-N 2.69Å; A652-T656 PolarHBondContact O-OG1 2.58Å; A652-T656 VanDerWaalsContact O-OG1 3.11Å; A652-M729 HydrophobicContact CB-CE 4.49Å; A652-M729 HydrophobicContact CB-SD 3.75Å
653	H	91.4	Very high	90.2	Very high	27 Å²	27	28.3 Å²	28.3	13%	0.125	14%	0.137	C	C	.	.	H	α-helix	trans	-64.3	-20.9	175.6	-178.1	64.4	0	0	0	113.3	L649 L651 T656 K657 K696	L649-H653 VanDerWaalsContact O-CB 3.23Å; L649-H653 WeakPolarHBondContact O-CB 3.24Å; L649-H653 PolarHBondContact O-N 2.64Å; L651-H653 PolarHBondContact O-N 3.28Å; H653-T656 WeakPolarHBondContact CA-OG1 3.4Å; H653-K657 VanDerWaalsContact O-CA 3.23Å; H653-K657 WeakPolarHBondContact O-CA 3.26Å; H653-K657 WeakPolarHBondContact O-CB 3.47Å; H653-K657 PolarHBondContact O-N 3.11Å; H653-K696 PolarHBondContact CE1-N 2.91Å
654	S	91.6	Very high	90.6	Very high	8 Å²	8	26.1 Å²	26.1	6%	0.056	13%	0.129	C	C	.	.	H	α-helix	trans	-75.1	-35.7	173.4	-61.4	0	0	0	0	111.9	D650 L651 A652 R878	D650-S654 PolarHBondContact O-N 2.85Å; D650-S654 PolarHBondContact O-OG 3.36Å; L651-S654 WeakPolarHBondContact O-CA 3.33Å; L651-S654 VanDerWaalsContact O-CB 3.27Å; L651-S654 WeakPolarHBondContact O-CB 3.42Å; L651-S654 PolarHBondContact O-N 3.17Å; A652-S654 PolarHBondContact O-N 3.31Å; S654-R878 WeakPolarHBondContact O-CG 3.48Å; S654-R878 PolarHBondContact O-NE 3.04Å
655	F	91.6	Very high	90.9	Very high	1 Å²	1	25.8 Å²	25.8	0%	0.004	13%	0.126	C	C	.	.	H	α-helix	trans	-68.5	-54.4	170.7	-57.2	-60.8	0	0	0	111.6	P633 I635 L651 A652 M729 L871 L875 R878 M1030	P633-F655 HydrophobicContact CG-CB 4.46Å; I635-F655 HydrophobicContact CD1-CB 3.77Å; I635-F655 HydrophobicContact CD1-CD2 3.67Å; I635-F655 HydrophobicContact CD1-CG 4.1Å; L651-F655 HydrophobicContact CD1-CE2 4.28Å; L651-F655 HydrophobicContact CD1-CZ 4.15Å; L651-F655 HydrophobicContact CD2-CE2 4.48Å; L651-F655 HydrophobicContact CG-CE2 3.83Å; L651-F655 HydrophobicContact CG-CZ 4.12Å; L651-F655 WeakPolarHBondContact O-CD2 3.47Å; L651-F655 PolarHBondContact O-N 3.2Å; A652-F655 PolarHBondContact O-N 2.84Å; A652-F655 VanDerWaalsContact O-N 3.11Å; F655-M729 HydrophobicContact CE2-CE 4.44Å; F655-M729 HydrophobicContact CE2-SD 4.49Å; F655-L871 HydrophobicContact CB-CD2 4.48Å; F655-L871 HydrophobicContact CD1-CB 4.18Å; F655-L871 HydrophobicContact CD1-CD2 3.81Å; F655-L871 HydrophobicContact CE1-CB 3.78Å; F655-L871 HydrophobicContact CE1-CD2 4.14Å; F655-L871 HydrophobicContact CE1-CG 4.47Å; F655-L871 HydrophobicContact CG-CD2 4.06Å; F655-L871 HydrophobicContact CZ-CB 4.42Å; F655-L875 HydrophobicContact CD1-CD2 3.72Å; F655-L875 HydrophobicContact CD1-CG 3.9Å; F655-L875 HydrophobicContact CE1-CD1 3.65Å; F655-L875 HydrophobicContact CE1-CD2 3.62Å; F655-L875 HydrophobicContact CE1-CG 3.47Å; F655-L875 VanDerWaalsContact CE1-CG 3.47Å; F655-L875 HydrophobicContact CZ-CD1 4.1Å; F655-L875 HydrophobicContact CZ-CD2 4.31Å; F655-L875 HydrophobicContact CZ-CG 4.33Å; F655-R878 PolarHBondContact O-NH2 3.33Å; F655-M1030 HydrophobicContact CE1-CE 4.36Å; F655-M1030 HydrophobicContact CE2-CE 4.43Å; F655-M1030 HydrophobicContact CE2-SD 3.87Å; F655-M1030 HydrophobicContact CZ-CE 3.66Å; F655-M1030 HydrophobicContact CZ-SD 3.61Å
656	T	90.3	Very high	91	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-77	-55.5	-170	58.1	0	0	0	0	112.6	I635 A652 H653 N658 Y659 G660 L661 C662	I635-T656 HydrophobicContact CB-CG2 4.11Å; I635-T656 HydrophobicContact CD1-CG2 3.89Å; I635-T656 HydrophobicContact CG1-CG2 3.74Å; A652-T656 PolarHBondContact O-N 2.69Å; A652-T656 PolarHBondContact O-OG1 2.58Å; A652-T656 VanDerWaalsContact O-OG1 3.11Å; H653-T656 WeakPolarHBondContact CA-OG1 3.4Å; T656-N658 PolarHBondContact O-N 3.34Å; T656-Y659 PolarHBondContact O-N 2.91Å; T656-G660 PolarHBondContact O-N 2.94Å; T656-L661 WeakPolarHBondContact CG2-O 3.46Å; T656-C662 HydrophobicContact CG2-CB 3.97Å; T656-C662 WeakPolarHBondContact OG1-CB 3.5Å; T656-C662 PolarHBondContact OG1-SG 3.31Å
657	K	84.3	Confident	91.2	Very high	87 Å²	87	23.9 Å²	23.9	38%	0.378	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	-77.5	177.8	-169.5	-169.4	175.2	-166.2	0	116.4	H653 K696	H653-K657 VanDerWaalsContact O-CA 3.23Å; H653-K657 WeakPolarHBondContact O-CA 3.26Å; H653-K657 WeakPolarHBondContact O-CB 3.47Å; H653-K657 PolarHBondContact O-N 3.11Å; K657-K696 WeakPolarHBondContact O-CD 3.42Å
658	N	82.6	Confident	91.2	Very high	92 Å²	92	25.7 Å²	25.7	49%	0.492	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.1	-6.2	-174.3	-89.7	8.8	0	0	0	111.8	T656 K696	T656-N658 PolarHBondContact O-N 3.34Å; N658-K696 WeakPolarHBondContact OD1-CD 3.38Å; N658-K696 WeakPolarHBondContact OD1-CE 3.23Å; N658-K696 PolarHBondContact OD1-NZ 3.16Å
659	Y	85.4	Confident	91.1	Very high	145 Å²	145	29.8 Å²	29.8	57%	0.569	15%	0.153	S	C	*	.	S	Bend	trans	-123.9	-0.7	-160	-57.3	-72	0	0	0	113.6	R632 T656	R632-Y659 WeakPolarHBondContact CB-O 3.36Å; R632-Y659 WeakPolarHBondContact CD-O 3.45Å; R632-Y659 VanDerWaalsContact CG-O 3.24Å; R632-Y659 WeakPolarHBondContact CG-O 3.33Å; T656-Y659 PolarHBondContact O-N 2.91Å
660	G	87.5	Confident	90.9	Very high	26 Å²	26	30.6 Å²	30.6	27%	0.268	16%	0.162	S	C	.	.	S	Bend	trans	-158.2	162	179.8	0	0	0	0	0	110.1	T656	T656-G660 PolarHBondContact O-N 2.94Å
661	L	91.8	Very high	90.7	Very high	27 Å²	27	33.3 Å²	33.3	14%	0.141	18%	0.18	C	C	.	.			trans	-70.8	145.3	179.3	-176.8	62.9	0	0	0	110.7	Q634 I635 T656 L663 F698 M723	Q634-L661 CarbonylContact C-O 3.58Å; Q634-L661 WeakPolarHBondContact CA-O 3.4Å; Q634-L661 HydrophobicContact CB-CB 3.97Å; Q634-L661 HydrophobicContact CG-CB 4.03Å; I635-L661 PolarHBondContact N-O 3.2Å; T656-L661 WeakPolarHBondContact CG2-O 3.46Å; L661-L663 HydrophobicContact CD1-CD2 3.97Å; L661-L663 HydrophobicContact CD2-CD1 4.36Å; L661-L663 HydrophobicContact CD2-CD2 4.26Å; L661-L663 HydrophobicContact CD2-CG 4.25Å; L661-L663 HydrophobicContact CG-CD2 4.1Å; L661-L663 HydrophobicContact CG-CG 4.19Å; L661-F698 HydrophobicContact CD1-CD2 3.66Å; L661-F698 HydrophobicContact CD1-CE2 3.69Å; L661-M723 WeakPolarHBondContact CD2-O 3.49Å
662	C	94.1	Very high	90.3	Very high	4 Å²	4	38.4 Å²	38.4	3%	0.027	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	120.6	172.6	-156.3	0	0	0	0	108.2	I635 T656 A697 F698	I635-C662 WeakPolarHBondContact O-CA 3.11Å; T656-C662 HydrophobicContact CG2-CB 3.97Å; T656-C662 WeakPolarHBondContact OG1-CB 3.5Å; T656-C662 PolarHBondContact OG1-SG 3.31Å; C662-A697 HydrophobicContact CB-CB 4.01Å; C662-A697 CarbonylContact O-C 3.59Å; C662-A697 WeakPolarHBondContact O-CA 3.31Å; C662-A697 WeakPolarHBondContact O-CB 3.47Å; C662-F698 PolarHBondContact O-N 2.86Å
663	L	94.7	Very high	89.9	Confident	13 Å²	13	43.4 Å²	43.4	7%	0.068	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	130.7	175.3	-53.5	178.2	0	0	0	108.8	I635 L636 V637 L661 F698 P725	I635-L663 PolarHBondContact O-N 2.99Å; L636-L663 HydrophobicContact CD1-CD1 4.37Å; V637-L663 WeakPolarHBondContact CB-O 3.5Å; V637-L663 WeakPolarHBondContact CG2-O 3.43Å; V637-L663 PolarHBondContact N-O 2.84Å; L661-L663 HydrophobicContact CD1-CD2 3.97Å; L661-L663 HydrophobicContact CD2-CD1 4.36Å; L661-L663 HydrophobicContact CD2-CD2 4.26Å; L661-L663 HydrophobicContact CD2-CG 4.25Å; L661-L663 HydrophobicContact CG-CD2 4.1Å; L661-L663 HydrophobicContact CG-CG 4.19Å; L663-F698 CarbonylContact C-O 3.51Å; L663-F698 WeakPolarHBondContact CA-O 3.4Å; L663-F698 HydrophobicContact CD2-CB 3.91Å; L663-F698 HydrophobicContact CD2-CD2 4.21Å; L663-P725 HydrophobicContact CD1-CB 4.41Å; L663-P725 HydrophobicContact CD1-CG 4.01Å
664	S	94.6	Very high	89.6	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.6	171.1	-154.1	0	0	0	0	106.9	T639 F698 Y699 A700	T639-S664 WeakPolarHBondContact CG2-OG 3.48Å; T639-S664 PolarHBondContact OG1-OG 3.16Å; S664-F698 PolarHBondContact N-O 3.1Å; S664-Y699 WeakPolarHBondContact O-CA 3.2Å; S664-Y699 WeakPolarHBondContact O-CD2 3.42Å; S664-A700 PolarHBondContact O-N 3.17Å
665	C	94.4	Very high	89.4	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.007	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	134.9	-164.6	-70.8	0	0	0	0	112.6	L636 V637 L638 T639 G640 A700 L714	L636-C665 HydrophobicContact CD2-CB 4.22Å; V637-C665 WeakPolarHBondContact O-CB 3.41Å; V637-C665 PolarHBondContact O-N 3.03Å; L638-C665 HydrophobicContact CD2-CB 3.81Å; T639-C665 PolarHBondContact N-O 3.2Å; T639-C665 PolarHBondContact OG1-N 2.89Å; T639-C665 PolarHBondContact OG1-O 2.86Å; G640-C665 PolarHBondContact N-O 3.15Å; C665-A700 WeakPolarHBondContact CA-O 3.26Å; C665-L714 HydrophobicContact CB-CD1 3.97Å; C665-L714 HydrophobicContact CB-CD2 4.48Å
666	E	93.5	Very high	89.2	Confident	37 Å²	37	53 Å²	53	17%	0.173	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	129.8	174.3	-175.8	149.4	-128.6	0	0	110.2	S641 L668 Y699 A700 A701 V702	S641-E666 WeakPolarHBondContact CA-OE1 3.43Å; S641-E666 VanDerWaalsContact CA-OE2 3.3Å; S641-E666 WeakPolarHBondContact CA-OE2 3.39Å; S641-E666 WeakPolarHBondContact CB-OE1 3.46Å; S641-E666 PolarHBondContact N-OE1 3.47Å; S641-E666 PolarHBondContact N-OE2 3.27Å; E666-L668 HydrophobicContact CG-CD2 3.74Å; E666-L668 HydrophobicContact CG-CG 4.05Å; E666-Y699 HydrophobicContact CB-CE2 4.37Å; E666-Y699 WeakPolarHBondContact CB-OH 3.23Å; E666-Y699 PolarHBondContact OE2-OH 2.83Å; E666-A700 PolarHBondContact N-O 2.74Å; E666-A700 VanDerWaalsContact N-O 3.11Å; E666-A701 HydrophobicContact CB-CB 4.38Å; E666-A701 VanDerWaalsContact O-CA 3.24Å; E666-A701 WeakPolarHBondContact O-CA 3.19Å; E666-V702 PolarHBondContact O-N 2.79Å; E666-V702 VanDerWaalsContact O-N 3.09Å
667	V	93.1	Very high	89.1	Confident	19 Å²	19	56.3 Å²	56.3	12%	0.115	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.1	167.2	178.7	0	0	0	0	106.3	V669 F707 A711 L714	V667-V669 HydrophobicContact CG1-CG2 4.31Å; V667-F707 HydrophobicContact CB-CD2 3.94Å; V667-F707 HydrophobicContact CB-CE2 4.04Å; V667-F707 HydrophobicContact CG1-CD2 4.06Å; V667-F707 HydrophobicContact CG2-CE2 4.34Å; V667-A711 HydrophobicContact CG2-CB 4.41Å; V667-L714 HydrophobicContact CG2-CD1 3.59Å
668	L	91.4	Very high	89.1	Confident	39 Å²	39	55 Å²	55	20%	0.204	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.5	175.2	-62	171.7	0	0	0	107.9	E666 V675 M679 V702 C704	E666-L668 HydrophobicContact CG-CD2 3.74Å; E666-L668 HydrophobicContact CG-CG 4.05Å; L668-V675 HydrophobicContact CB-CG1 3.31Å; L668-V675 HydrophobicContact CD1-CG1 3.83Å; L668-V675 HydrophobicContact CG-CG1 4.21Å; L668-M679 HydrophobicContact CD1-CB 3.71Å; L668-M679 HydrophobicContact CD1-CG 4Å; L668-V702 PolarHBondContact N-O 2.85Å; L668-C704 PolarHBondContact O-N 3.44Å; L668-C704 VanDerWaalsContact O-N 3.16Å
669	V	90.1	Very high	89.4	Confident	85 Å²	85	51.8 Å²	51.8	52%	0.515	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.3	-176.1	-177.6	0	0	0	0	109.1	V667 C704 D705 F707	V667-V669 HydrophobicContact CG1-CG2 4.31Å; V669-C704 WeakPolarHBondContact CA-O 3Å; V669-D705 WeakPolarHBondContact CG1-O 3.35Å; V669-F707 HydrophobicContact CG2-CB 3.99Å; V669-F707 HydrophobicContact CG2-CD2 4.45Å
670	G	88.6	Confident	89.5	Confident	18 Å²	18	49.6 Å²	49.6	19%	0.186	29%	0.289	C	S	.	.	S	Bend	trans	144.6	176.6	177	0	0	0	0	0	114.1	R672 C704	G670-R672 PolarHBondContact O-N 2.94Å; G670-C704 PolarHBondContact N-O 2.61Å; G670-C704 VanDerWaalsContact N-O 3.1Å
671	P	87.8	Confident	89.3	Confident	68 Å²	68	54.1 Å²	54.1	44%	0.442	31%	0.307	S	S	.	.			trans	-61.8	122.6	-173.1	25.2	-34.4	0	0	0	111.6	S673 E674 V675	P671-S673 PolarHBondContact O-N 2.94Å; P671-E674 HydrophobicContact CG-CB 4.47Å; P671-E674 HydrophobicContact CG-CG 4.34Å; P671-E674 PolarHBondContact O-N 3.45Å; P671-V675 PolarHBondContact O-N 3.18Å
672	R	84.6	Confident	88.9	Confident	107 Å²	107	53.2 Å²	53.2	40%	0.404	30%	0.304	S	S	.	.	H	α-helix	trans	-48.9	-33.5	-171.8	-64.8	-176.9	179.2	81.1	2.8	114.4	G670 E674 V675 L676 D705 E709	G670-R672 PolarHBondContact O-N 2.94Å; R672-E674 PolarHBondContact O-N 3.2Å; R672-V675 PolarHBondContact O-N 2.93Å; R672-L676 HydrophobicContact CB-CD1 4.29Å; R672-L676 VanDerWaalsContact O-CB 3.29Å; R672-L676 WeakPolarHBondContact O-CB 3.37Å; R672-L676 WeakPolarHBondContact O-CD1 3.49Å; R672-L676 WeakPolarHBondContact O-CG 3.41Å; R672-L676 PolarHBondContact O-N 2.96Å; R672-D705 IonicContact CZ-OD2 3.78Å; R672-D705 VanDerWaalsContact CZ-OD2 3.27Å; R672-D705 IonicContact NH1-OD1 2.87Å; R672-D705 IonicContact NH1-OD2 3.93Å; R672-D705 PolarHBondContact NH1-OD2 2.71Å; R672-D705 IonicContact NH2-OD2 2.88Å; R672-D705 PolarHBondContact NH2-OD2 3.31Å; R672-E709 IonicContact NH2-OE1 2.77Å; R672-E709 PolarHBondContact NH2-OE1 3.33Å
673	S	84.7	Confident	88.6	Confident	105 Å²	105	56.3 Å²	56.3	73%	0.734	32%	0.319	S	S	*	.	H	α-helix	trans	-57.9	-43.9	177.8	-168.2	0	0	0	0	113.5	P671 P677	P671-S673 PolarHBondContact O-N 2.94Å; S673-P677 WeakPolarHBondContact O-CD 3.42Å
674	E	85.3	Confident	88.1	Confident	149 Å²	149	61.8 Å²	61.8	70%	0.696	34%	0.344	S	S	*	.	H	α-helix	trans	-83.6	-34.1	-178.5	-62.2	176	-173	0	0	111.3	P671 R672	P671-E674 HydrophobicContact CG-CB 4.47Å; P671-E674 HydrophobicContact CG-CG 4.34Å; P671-E674 PolarHBondContact O-N 3.45Å; R672-E674 PolarHBondContact O-N 3.2Å
675	V	87.5	Confident	87.8	Confident	16 Å²	16	67.3 Å²	67.3	10%	0.097	37%	0.365	C	S	.	.	H	α-helix	trans	-78.3	-37.7	-174.4	-179.7	0	0	0	0	112.7	L668 P671 R672 A678 M679 A703	L668-V675 HydrophobicContact CB-CG1 3.31Å; L668-V675 HydrophobicContact CD1-CG1 3.83Å; L668-V675 HydrophobicContact CG-CG1 4.21Å; P671-V675 PolarHBondContact O-N 3.18Å; R672-V675 PolarHBondContact O-N 2.93Å; V675-A678 WeakPolarHBondContact O-CB 3.43Å; V675-A678 PolarHBondContact O-N 3.12Å; V675-A678 VanDerWaalsContact O-N 3.13Å; V675-M679 WeakPolarHBondContact O-CB 3.38Å; V675-M679 PolarHBondContact O-N 3.09Å; V675-A703 HydrophobicContact CB-CB 4.14Å; V675-A703 HydrophobicContact CG1-CB 3.5Å; V675-A703 VanDerWaalsContact CG1-CB 3.5Å
676	L	87.3	Confident	87.6	Confident	74 Å²	74	67.3 Å²	67.3	39%	0.387	37%	0.365	S	S	.	.	H	α-helix	trans	-59.5	-43.5	-176.6	-76.8	168.7	0	0	0	114.1	R672 A678 M679 N680 A703	R672-L676 HydrophobicContact CB-CD1 4.29Å; R672-L676 VanDerWaalsContact O-CB 3.29Å; R672-L676 WeakPolarHBondContact O-CB 3.37Å; R672-L676 WeakPolarHBondContact O-CD1 3.49Å; R672-L676 WeakPolarHBondContact O-CG 3.41Å; R672-L676 PolarHBondContact O-N 2.96Å; L676-A678 PolarHBondContact O-N 3.21Å; L676-M679 HydrophobicContact CD2-CE 3.76Å; L676-M679 HydrophobicContact CD2-SD 4.48Å; L676-M679 PolarHBondContact O-N 3.2Å; L676-N680 PolarHBondContact O-N 3.26Å; L676-N680 PolarHBondContact O-ND2 2.88Å; L676-A703 HydrophobicContact CD2-CB 4.34Å
677	P	87.4	Confident	87.4	Confident	70 Å²	70	67.4 Å²	67.4	46%	0.455	37%	0.366	S	S	.	.	H	α-helix	trans	-62	-39.4	172.8	-23.8	34.5	0	0	0	113.1	S673 N681	S673-P677 WeakPolarHBondContact O-CD 3.42Å; P677-N681 WeakPolarHBondContact O-CB 3.26Å; P677-N681 PolarHBondContact O-N 2.76Å; P677-N681 PolarHBondContact O-ND2 2.87Å
678	A	84.8	Confident	87.1	Confident	60 Å²	60	71.8 Å²	71.8	50%	0.496	39%	0.385	S	S	.	.	H	α-helix	trans	-67.4	-41.1	177	0	0	0	0	0	111.6	V675 L676 G682	V675-A678 WeakPolarHBondContact O-CB 3.43Å; V675-A678 PolarHBondContact O-N 3.12Å; V675-A678 VanDerWaalsContact O-N 3.13Å; L676-A678 PolarHBondContact O-N 3.21Å; A678-G682 WeakPolarHBondContact O-CA 3.07Å; A678-G682 PolarHBondContact O-N 2.98Å
679	M	88.8	Confident	87	Confident	25 Å²	25	72.9 Å²	72.9	12%	0.123	39%	0.386	C	S	.	.	H	α-helix	trans	-59.6	-54	176.6	-169	-174.4	77.1	0	0	111.6	L668 V675 L676 N681 G682 M683 A701 A703	L668-M679 HydrophobicContact CD1-CB 3.71Å; L668-M679 HydrophobicContact CD1-CG 4Å; V675-M679 WeakPolarHBondContact O-CB 3.38Å; V675-M679 PolarHBondContact O-N 3.09Å; L676-M679 HydrophobicContact CD2-CE 3.76Å; L676-M679 HydrophobicContact CD2-SD 4.48Å; L676-M679 PolarHBondContact O-N 3.2Å; M679-N681 PolarHBondContact O-N 3.46Å; M679-G682 CarbonylContact O-C 3.59Å; M679-G682 WeakPolarHBondContact O-CA 3.44Å; M679-G682 PolarHBondContact O-N 3.24Å; M679-G682 VanDerWaalsContact O-N 3.11Å; M679-M683 HydrophobicContact CE-SD 4.48Å; M679-M683 HydrophobicContact CG-SD 4.41Å; M679-M683 WeakPolarHBondContact O-CG 3.42Å; M679-M683 PolarHBondContact O-N 3.38Å; M679-A701 HydrophobicContact CG-CB 3.65Å; M679-A701 HydrophobicContact SD-CB 4.27Å; M679-A703 HydrophobicContact SD-CB 4.07Å
680	N	86.9	Confident	87	Confident	98 Å²	98	68.8 Å²	68.8	52%	0.524	36%	0.362	S	S	.	.	H	α-helix	trans	-62.1	-45	-176.5	-71.3	-20.9	0	0	0	111.9	L676 G682 M683	L676-N680 PolarHBondContact O-N 3.26Å; L676-N680 PolarHBondContact O-ND2 2.88Å; N680-G682 VanDerWaalsContact C-N 3.33Å; N680-G682 PolarHBondContact O-N 2.93Å; N680-M683 PolarHBondContact O-N 3.11Å
681	N	84	Confident	86.9	Confident	121 Å²	121	73.8 Å²	73.8	65%	0.647	38%	0.38	S	S	*	.	H	α-helix	trans	-66.9	-34.2	174.6	-71.5	-51.3	0	0	0	112.3	P677 M679 R685	P677-N681 WeakPolarHBondContact O-CB 3.26Å; P677-N681 PolarHBondContact O-N 2.76Å; P677-N681 PolarHBondContact O-ND2 2.87Å; M679-N681 PolarHBondContact O-N 3.46Å; N681-R685 VanDerWaalsContact O-CB 3.27Å; N681-R685 WeakPolarHBondContact O-CB 3.13Å; N681-R685 PolarHBondContact O-N 3.29Å
682	G	84.3	Confident	86.8	Confident	9 Å²	9	79.1 Å²	79.1	9%	0.093	40%	0.396	C	S	.	.	H	α-helix	trans	-66.7	-39.2	175.6	0	0	0	0	0	113.2	A678 M679 N680 R685 N686	A678-G682 WeakPolarHBondContact O-CA 3.07Å; A678-G682 PolarHBondContact O-N 2.98Å; M679-G682 CarbonylContact O-C 3.59Å; M679-G682 WeakPolarHBondContact O-CA 3.44Å; M679-G682 PolarHBondContact O-N 3.24Å; M679-G682 VanDerWaalsContact O-N 3.11Å; N680-G682 VanDerWaalsContact C-N 3.33Å; N680-G682 PolarHBondContact O-N 2.93Å; G682-R685 PolarHBondContact O-N 3.11Å; G682-N686 VanDerWaalsContact O-CB 3.32Å; G682-N686 WeakPolarHBondContact O-CB 3.13Å; G682-N686 PolarHBondContact O-N 2.91Å
683	M	87.1	Confident	86.8	Confident	68 Å²	68	76.4 Å²	76.4	34%	0.335	39%	0.39	S	S	.	.	H	α-helix	trans	-59.5	-54	-177.4	-77.9	178.9	75.2	0	0	112.8	M679 N680 N686 Q687 Y699 A701	M679-M683 HydrophobicContact CE-SD 4.48Å; M679-M683 HydrophobicContact CG-SD 4.41Å; M679-M683 WeakPolarHBondContact O-CG 3.42Å; M679-M683 PolarHBondContact O-N 3.38Å; N680-M683 PolarHBondContact O-N 3.11Å; M683-N686 PolarHBondContact O-N 3.49Å; M683-Q687 WeakPolarHBondContact O-CB 3.42Å; M683-Q687 PolarHBondContact O-N 3.33Å; M683-Y699 HydrophobicContact CB-CD1 4.15Å; M683-Y699 HydrophobicContact CB-CE1 4.18Å; M683-Y699 HydrophobicContact CG-CD1 3.9Å; M683-Y699 HydrophobicContact CG-CE1 3.68Å; M683-A701 HydrophobicContact CG-CB 4.12Å
684	E	85.1	Confident	86.8	Confident	128 Å²	128	80 Å²	80	60%	0.598	39%	0.392	S	S	*	.	H	α-helix	trans	-66.3	-42.4	179.3	-156	-164.9	157.7	0	0	111.1	N686 Q687 Q688	E684-N686 VanDerWaalsContact C-N 3.32Å; E684-N686 PolarHBondContact O-N 3.05Å; E684-Q687 PolarHBondContact O-N 3.46Å; E684-Q688 HydrophobicContact CG-CG 4.32Å; E684-Q688 WeakPolarHBondContact O-CB 3.32Å; E684-Q688 WeakPolarHBondContact O-CG 3.49Å; E684-Q688 PolarHBondContact O-N 2.98Å; E684-Q688 PolarHBondContact OE1-NE2 3.22Å
685	R	86.9	Confident	86.9	Confident	116 Å²	116	74.6 Å²	74.6	44%	0.438	37%	0.365	S	S	.	.	H	α-helix	trans	-57	-42.8	178.6	-174.2	171.5	76.1	138	-0	112.5	N681 G682 W689 E780	N681-R685 VanDerWaalsContact O-CB 3.27Å; N681-R685 WeakPolarHBondContact O-CB 3.13Å; N681-R685 PolarHBondContact O-N 3.29Å; G682-R685 PolarHBondContact O-N 3.11Å; R685-W689 WeakPolarHBondContact O-CB 3.41Å; R685-W689 PolarHBondContact O-N 3.1Å; R685-E780 IonicContact CZ-OE2 3.82Å; R685-E780 VanDerWaalsContact NH1-CD 3.26Å; R685-E780 IonicContact NH1-OE1 2.74Å; R685-E780 PolarHBondContact NH1-OE1 3.5Å; R685-E780 VanDerWaalsContact NH1-OE1 3.08Å; R685-E780 IonicContact NH1-OE2 3.29Å; R685-E780 PolarHBondContact NH1-OE2 3.46Å; R685-E780 IonicContact NH2-OE2 3.2Å
686	N	89.6	Confident	86.9	Confident	2 Å²	2	79.8 Å²	79.8	1%	0.011	39%	0.387	C	S	.	.	H	α-helix	trans	-77.4	-38.1	178.7	-76.4	-17.6	0	0	0	112	A642 G682 M683 E684 W689 L690 Y699	A642-N686 HydrophobicContact CB-CB 4.1Å; G682-N686 VanDerWaalsContact O-CB 3.32Å; G682-N686 WeakPolarHBondContact O-CB 3.13Å; G682-N686 PolarHBondContact O-N 2.91Å; M683-N686 PolarHBondContact O-N 3.49Å; E684-N686 VanDerWaalsContact C-N 3.32Å; E684-N686 PolarHBondContact O-N 3.05Å; N686-W689 WeakPolarHBondContact O-CB 3.4Å; N686-W689 PolarHBondContact O-N 2.87Å; N686-L690 WeakPolarHBondContact O-CG 3.23Å; N686-L690 PolarHBondContact O-N 3.05Å; N686-Y699 HydrophobicContact CB-CD1 4.18Å; N686-Y699 HydrophobicContact CB-CD2 3.63Å; N686-Y699 HydrophobicContact CB-CE1 4.18Å; N686-Y699 HydrophobicContact CB-CE2 3.61Å; N686-Y699 HydrophobicContact CB-CG 3.89Å; N686-Y699 VanDerWaalsContact ND2-CE2 3.35Å; N686-Y699 WeakPolarHBondContact ND2-CE2 3.34Å; N686-Y699 VanDerWaalsContact ND2-CZ 3.33Å; N686-Y699 PolarHBondContact ND2-OH 2.78Å
687	Q	90.6	Very high	87	Confident	39 Å²	39	76.6 Å²	76.6	18%	0.182	37%	0.371	C	S	.	.	H	α-helix	trans	-63.7	-43.6	174.5	-171.7	59.5	39.4	0	0	112.1	M683 E684 W689 L690 H691 A697	M683-Q687 WeakPolarHBondContact O-CB 3.42Å; M683-Q687 PolarHBondContact O-N 3.33Å; E684-Q687 PolarHBondContact O-N 3.46Å; Q687-W689 VanDerWaalsContact C-N 3.31Å; Q687-W689 PolarHBondContact O-N 2.87Å; Q687-L690 PolarHBondContact O-N 2.89Å; Q687-H691 PolarHBondContact NE2-NE2 3.39Å; Q687-H691 PolarHBondContact O-CD2 3.19Å; Q687-H691 PolarHBondContact O-N 2.84Å; Q687-H691 VanDerWaalsContact O-N 3.07Å; Q687-A697 PolarHBondContact NE2-O 3.11Å
688	Q	86.7	Confident	87.3	Confident	110 Å²	110	79.5 Å²	79.5	51%	0.514	38%	0.376	S	S	.	.	H	α-helix	trans	-59.9	-39.7	172.7	-72.2	-176.5	15.4	0	0	111.8	E684 H691 K692	E684-Q688 HydrophobicContact CG-CG 4.32Å; E684-Q688 WeakPolarHBondContact O-CB 3.32Å; E684-Q688 WeakPolarHBondContact O-CG 3.49Å; E684-Q688 PolarHBondContact O-N 2.98Å; E684-Q688 PolarHBondContact OE1-NE2 3.22Å; Q688-H691 PolarHBondContact O-N 2.68Å; Q688-K692 WeakPolarHBondContact O-CB 3.43Å; Q688-K692 PolarHBondContact O-N 2.9Å
689	W	89.2	Confident	87.7	Confident	62 Å²	62	77.5 Å²	77.5	24%	0.235	36%	0.356	C	S	.	.	H	α-helix	trans	-65.3	-39.3	176.8	-178.1	98.8	0	0	0	112.7	A642 R643 L649 R685 N686 Q687 K692 N693	A642-W689 HydrophobicContact CB-CE3 3.98Å; A642-W689 HydrophobicContact CB-CZ3 4.05Å; A642-W689 VanDerWaalsContact O-CH2 3.28Å; A642-W689 WeakPolarHBondContact O-CH2 3.41Å; A642-W689 WeakPolarHBondContact O-CZ3 3.48Å; R643-W689 HydrophobicContact CB-CZ2 4.31Å; R643-W689 HydrophobicContact CG-CD2 4Å; R643-W689 HydrophobicContact CG-CG 4.35Å; R643-W689 HydrophobicContact CG-CH2 4.45Å; R643-W689 HydrophobicContact CG-CZ2 3.94Å; L649-W689 HydrophobicContact CD2-CZ3 4.06Å; R685-W689 WeakPolarHBondContact O-CB 3.41Å; R685-W689 PolarHBondContact O-N 3.1Å; N686-W689 WeakPolarHBondContact O-CB 3.4Å; N686-W689 PolarHBondContact O-N 2.87Å; Q687-W689 VanDerWaalsContact C-N 3.31Å; Q687-W689 PolarHBondContact O-N 2.87Å; W689-K692 PolarHBondContact O-N 2.94Å; W689-N693 VanDerWaalsContact CD2-ND2 3.32Å; W689-N693 PolarHBondContact NE1-ND2 3.13Å; W689-N693 WeakPolarHBondContact O-CB 3.27Å; W689-N693 PolarHBondContact O-N 2.67Å; W689-N693 PolarHBondContact O-ND2 3.36Å
690	L	89.8	Confident	87.9	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-60.4	-48.3	172.9	-70.6	172.6	0	0	0	111	A642 L649 N686 Q687 N693 K694 R695 A697	A642-L690 HydrophobicContact CB-CD2 4.23Å; A642-L690 HydrophobicContact CB-CG 4.35Å; L649-L690 HydrophobicContact CD1-CD2 4.5Å; L649-L690 HydrophobicContact CD2-CD2 3.63Å; N686-L690 WeakPolarHBondContact O-CG 3.23Å; N686-L690 PolarHBondContact O-N 3.05Å; Q687-L690 PolarHBondContact O-N 2.89Å; L690-N693 CarbonylContact O-C 3.56Å; L690-N693 PolarHBondContact O-N 2.71Å; L690-K694 PolarHBondContact O-N 3.39Å; L690-K694 VanDerWaalsContact O-N 3.13Å; L690-R695 HydrophobicContact CB-CB 4.43Å; L690-R695 HydrophobicContact CD2-CB 3.93Å; L690-R695 PolarHBondContact O-N 3.36Å; L690-A697 HydrophobicContact CD1-CB 4.24Å
691	H	86.2	Confident	88.2	Confident	123 Å²	123	73.4 Å²	73.4	57%	0.569	34%	0.34	S	S	*	.	H	α-helix	trans	-60.2	-46.5	176.2	-73.1	-59.7	0	0	0	112.4	Q687 Q688 N693 K694	Q687-H691 PolarHBondContact NE2-NE2 3.39Å; Q687-H691 PolarHBondContact O-CD2 3.19Å; Q687-H691 PolarHBondContact O-N 2.84Å; Q687-H691 VanDerWaalsContact O-N 3.07Å; Q688-H691 PolarHBondContact O-N 2.68Å; H691-N693 VanDerWaalsContact C-N 3.3Å; H691-N693 PolarHBondContact O-N 2.72Å; H691-K694 WeakPolarHBondContact O-CA 3.21Å; H691-K694 PolarHBondContact O-N 3.43Å
692	K	86	Confident	88.6	Confident	180 Å²	180	69 Å²	69	78%	0.783	32%	0.318	S	S	*	.	H	α-helix	trans	-58.4	-40.4	177.6	-172.8	178.1	-178.7	-179.4	0	112.1	Q688 W689 K694	Q688-K692 WeakPolarHBondContact O-CB 3.43Å; Q688-K692 PolarHBondContact O-N 2.9Å; W689-K692 PolarHBondContact O-N 2.94Å; K692-K694 PolarHBondContact O-N 2.89Å
693	N	84.6	Confident	89	Confident	50 Å²	50	69.2 Å²	69.2	27%	0.267	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	6.9	175.5	-73.6	-68.5	0	0	0	114.1	W689 L690 H691 R695	W689-N693 VanDerWaalsContact CD2-ND2 3.32Å; W689-N693 PolarHBondContact NE1-ND2 3.13Å; W689-N693 WeakPolarHBondContact O-CB 3.27Å; W689-N693 PolarHBondContact O-N 2.67Å; W689-N693 PolarHBondContact O-ND2 3.36Å; L690-N693 CarbonylContact O-C 3.56Å; L690-N693 PolarHBondContact O-N 2.71Å; H691-N693 VanDerWaalsContact C-N 3.3Å; H691-N693 PolarHBondContact O-N 2.72Å; N693-R695 HydrophobicContact CB-CG 4.2Å; N693-R695 PolarHBondContact O-N 3.07Å; N693-R695 PolarHBondContact O-NH1 3.31Å
694	K	85.6	Confident	89.1	Confident	179 Å²	179	66.2 Å²	66.2	78%	0.778	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	31.8	-178.7	-55.9	-179.2	-179.3	179.2	0	112.9	L690 H691 K692	L690-K694 PolarHBondContact O-N 3.39Å; L690-K694 VanDerWaalsContact O-N 3.13Å; H691-K694 WeakPolarHBondContact O-CA 3.21Å; H691-K694 PolarHBondContact O-N 3.43Å; K692-K694 PolarHBondContact O-N 2.89Å
695	R	86.1	Confident	89.3	Confident	37 Å²	37	63.6 Å²	63.6	14%	0.14	29%	0.294	C	S	.	.			trans	-86.5	125.3	172.7	-64.6	-60.1	179.5	-91.6	11.8	108.8	D650 L690 N693 A697	D650-R695 IonicContact OD1-CZ 3.49Å; D650-R695 IonicContact OD1-NE 2.63Å; D650-R695 PolarHBondContact OD1-NE 3.37Å; D650-R695 IonicContact OD1-NH2 3.2Å; D650-R695 PolarHBondContact OD1-NH2 3.25Å; D650-R695 IonicContact OD2-CZ 3.76Å; D650-R695 IonicContact OD2-NE 3.82Å; D650-R695 IonicContact OD2-NH2 3.08Å; D650-R695 PolarHBondContact OD2-NH2 3.45Å; L690-R695 HydrophobicContact CB-CB 4.43Å; L690-R695 HydrophobicContact CD2-CB 3.93Å; L690-R695 PolarHBondContact O-N 3.36Å; N693-R695 HydrophobicContact CB-CG 4.2Å; N693-R695 PolarHBondContact O-N 3.07Å; N693-R695 PolarHBondContact O-NH1 3.31Å; R695-A697 PolarHBondContact O-N 3.25Å
696	K	87.3	Confident	89.4	Confident	125 Å²	125	62.1 Å²	62.1	54%	0.543	30%	0.295	S	S	.	.			trans	-90.8	87.9	172	-66.3	-171.7	174.7	-175.3	0	108.4	H653 K657 N658	H653-K696 PolarHBondContact CE1-N 2.91Å; K657-K696 WeakPolarHBondContact O-CD 3.42Å; N658-K696 WeakPolarHBondContact OD1-CD 3.38Å; N658-K696 WeakPolarHBondContact OD1-CE 3.23Å; N658-K696 PolarHBondContact OD1-NZ 3.16Å
697	A	90.9	Very high	89.5	Confident	7 Å²	7	65.3 Å²	65.3	6%	0.058	31%	0.309	C	S	.	.			trans	-144.3	154.9	167.8	0	0	0	0	0	107.8	L649 C662 Q687 L690 R695	L649-A697 HydrophobicContact CD1-CB 4.35Å; C662-A697 HydrophobicContact CB-CB 4.01Å; C662-A697 CarbonylContact O-C 3.59Å; C662-A697 WeakPolarHBondContact O-CA 3.31Å; C662-A697 WeakPolarHBondContact O-CB 3.47Å; Q687-A697 PolarHBondContact NE2-O 3.11Å; L690-A697 HydrophobicContact CD1-CB 4.24Å; R695-A697 PolarHBondContact O-N 3.25Å
698	F	92.9	Very high	89.5	Confident	130 Å²	130	67.2 Å²	67.2	57%	0.57	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.1	146.4	163.1	-55.8	-86.2	0	0	0	108.3	L661 C662 L663 S664	L661-F698 HydrophobicContact CD1-CD2 3.66Å; L661-F698 HydrophobicContact CD1-CE2 3.69Å; C662-F698 PolarHBondContact O-N 2.86Å; L663-F698 CarbonylContact C-O 3.51Å; L663-F698 WeakPolarHBondContact CA-O 3.4Å; L663-F698 HydrophobicContact CD2-CB 3.91Å; L663-F698 HydrophobicContact CD2-CD2 4.21Å; S664-F698 PolarHBondContact N-O 3.1Å
699	Y	94.1	Very high	89.7	Confident	18 Å²	18	65.1 Å²	65.1	7%	0.071	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.6	173.2	-178.6	-91.8	0	0	0	110.2	A642 S664 E666 M683 N686 A701	A642-Y699 HydrophobicContact CB-CD2 4.23Å; A642-Y699 HydrophobicContact CB-CE2 4.41Å; S664-Y699 WeakPolarHBondContact O-CA 3.2Å; S664-Y699 WeakPolarHBondContact O-CD2 3.42Å; E666-Y699 HydrophobicContact CB-CE2 4.37Å; E666-Y699 WeakPolarHBondContact CB-OH 3.23Å; E666-Y699 PolarHBondContact OE2-OH 2.83Å; M683-Y699 HydrophobicContact CB-CD1 4.15Å; M683-Y699 HydrophobicContact CB-CE1 4.18Å; M683-Y699 HydrophobicContact CG-CD1 3.9Å; M683-Y699 HydrophobicContact CG-CE1 3.68Å; N686-Y699 HydrophobicContact CB-CD1 4.18Å; N686-Y699 HydrophobicContact CB-CD2 3.63Å; N686-Y699 HydrophobicContact CB-CE1 4.18Å; N686-Y699 HydrophobicContact CB-CE2 3.61Å; N686-Y699 HydrophobicContact CB-CG 3.89Å; N686-Y699 VanDerWaalsContact ND2-CE2 3.35Å; N686-Y699 WeakPolarHBondContact ND2-CE2 3.34Å; N686-Y699 VanDerWaalsContact ND2-CZ 3.33Å; N686-Y699 PolarHBondContact ND2-OH 2.78Å; Y699-A701 HydrophobicContact CE1-CB 3.83Å
700	A	92.9	Very high	89.9	Confident	25 Å²	25	62.1 Å²	62.1	21%	0.207	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	143.1	174	0	0	0	0	0	109.6	S664 C665 E666 L714	S664-A700 PolarHBondContact O-N 3.17Å; C665-A700 WeakPolarHBondContact CA-O 3.26Å; E666-A700 PolarHBondContact N-O 2.74Å; E666-A700 VanDerWaalsContact N-O 3.11Å; A700-L714 HydrophobicContact CB-CD2 4.38Å
701	A	92.8	Very high	90	Very high	13 Å²	13	62.2 Å²	62.2	11%	0.107	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	149.4	176.2	0	0	0	0	0	110.7	E666 M679 M683 Y699	E666-A701 HydrophobicContact CB-CB 4.38Å; E666-A701 VanDerWaalsContact O-CA 3.24Å; E666-A701 WeakPolarHBondContact O-CA 3.19Å; M679-A701 HydrophobicContact CG-CB 3.65Å; M679-A701 HydrophobicContact SD-CB 4.27Å; M683-A701 HydrophobicContact CG-CB 4.12Å; Y699-A701 HydrophobicContact CE1-CB 3.83Å
702	V	93.1	Very high	90.4	Very high	29 Å²	29	59.6 Å²	59.6	18%	0.176	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	142.1	177	171.8	0	0	0	0	109.1	E666 L668 T713 L714	E666-V702 PolarHBondContact O-N 2.79Å; E666-V702 VanDerWaalsContact O-N 3.09Å; L668-V702 PolarHBondContact N-O 2.85Å; V702-T713 HydrophobicContact CG1-CG2 4.22Å; V702-T713 HydrophobicContact CG2-CG2 4.39Å; V702-L714 HydrophobicContact CB-CG 4.38Å; V702-L714 HydrophobicContact CG2-CD2 3.75Å; V702-L714 HydrophobicContact CG2-CG 3.78Å
703	A	91.9	Very high	90.7	Very high	12 Å²	12	53.7 Å²	53.7	10%	0.099	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	111.3	176.8	0	0	0	0	0	109.8	V675 L676 M679	V675-A703 HydrophobicContact CB-CB 4.14Å; V675-A703 HydrophobicContact CG1-CB 3.5Å; V675-A703 VanDerWaalsContact CG1-CB 3.5Å; L676-A703 HydrophobicContact CD2-CB 4.34Å; M679-A703 HydrophobicContact SD-CB 4.07Å
704	C	90.1	Very high	91.1	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.034	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	159.5	-178.4	-82.1	0	0	0	0	110.7	L668 V669 G670 N706 E709 G710	L668-C704 PolarHBondContact O-N 3.44Å; L668-C704 VanDerWaalsContact O-N 3.16Å; V669-C704 WeakPolarHBondContact CA-O 3Å; G670-C704 PolarHBondContact N-O 2.61Å; G670-C704 VanDerWaalsContact N-O 3.1Å; C704-N706 VanDerWaalsContact C-N 3.33Å; C704-N706 WeakPolarHBondContact CB-O 3.46Å; C704-E709 PolarHBondContact SG-OE1 2.72Å; C704-G710 VanDerWaalsContact SG-CA 3.57Å
705	D	88.3	Confident	91.4	Very high	73 Å²	73	43.3 Å²	43.3	39%	0.39	21%	0.214	S	C	.	.	S	Bend	trans	-76.4	-26.3	177.4	-48.9	-65.9	0	0	0	111	V669 R672	V669-D705 WeakPolarHBondContact CG1-O 3.35Å; R672-D705 IonicContact CZ-OD2 3.78Å; R672-D705 VanDerWaalsContact CZ-OD2 3.27Å; R672-D705 IonicContact NH1-OD1 2.87Å; R672-D705 IonicContact NH1-OD2 3.93Å; R672-D705 PolarHBondContact NH1-OD2 2.71Å; R672-D705 IonicContact NH2-OD2 2.88Å; R672-D705 PolarHBondContact NH2-OD2 3.31Å
706	N	89.6	Confident	91.6	Very high	86 Å²	86	47.1 Å²	47.1	46%	0.46	23%	0.233	S	C	.	.	S	Bend	trans	-120.6	145.5	176	-58.7	-66.6	0	0	0	112.6	C704 E709 G710	C704-N706 VanDerWaalsContact C-N 3.33Å; C704-N706 WeakPolarHBondContact CB-O 3.46Å; N706-E709 HydrophobicContact CB-CB 4.16Å; N706-E709 PolarHBondContact ND2-OE2 2.93Å; N706-G710 PolarHBondContact O-N 2.92Å
707	F	90.8	Very high	91.8	Very high	69 Å²	69	45 Å²	45	30%	0.303	24%	0.239	S	C	.	.	H	α-helix	trans	-63.6	-42.7	178.2	176.4	-101	0	0	0	113	L638 V667 V669 G710 A711 L750	L638-F707 HydrophobicContact CD1-CZ 4.22Å; V667-F707 HydrophobicContact CB-CD2 3.94Å; V667-F707 HydrophobicContact CB-CE2 4.04Å; V667-F707 HydrophobicContact CG1-CD2 4.06Å; V667-F707 HydrophobicContact CG2-CE2 4.34Å; V669-F707 HydrophobicContact CG2-CB 3.99Å; V669-F707 HydrophobicContact CG2-CD2 4.45Å; F707-G710 PolarHBondContact O-N 3.07Å; F707-A711 PolarHBondContact O-N 2.77Å; F707-L750 HydrophobicContact CE1-CD2 4.06Å; F707-L750 HydrophobicContact CZ-CD2 4.49Å
708	R	91.6	Very high	91.8	Very high	79 Å²	79	45.3 Å²	45.3	30%	0.298	24%	0.241	S	C	.	.	H	α-helix	trans	-64.1	-48.1	-177	-172.6	179.5	-179.5	177	-2.1	112.1	G710 A711 E712 G749 D753	R708-G710 VanDerWaalsContact C-N 3.34Å; R708-G710 PolarHBondContact O-N 3Å; R708-A711 CarbonylContact O-C 3.51Å; R708-A711 PolarHBondContact O-N 3.43Å; R708-A711 VanDerWaalsContact O-N 3.09Å; R708-E712 PolarHBondContact O-N 3.46Å; R708-G749 VanDerWaalsContact CZ-CA 3.46Å; R708-D753 IonicContact CZ-OD1 3.27Å; R708-D753 IonicContact CZ-OD2 3.79Å; R708-D753 IonicContact NE-OD1 2.65Å; R708-D753 IonicContact NE-OD2 3.69Å; R708-D753 PolarHBondContact NE-OD2 3.36Å; R708-D753 IonicContact NH2-OD1 3.23Å; R708-D753 PolarHBondContact NH2-OD1 2.77Å; R708-D753 IonicContact NH2-OD2 3.18Å; R708-D753 PolarHBondContact NH2-OD2 2.89Å
709	E	91.1	Very high	91.6	Very high	65 Å²	65	41.5 Å²	41.5	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-56.4	-44.2	175.9	-176.3	-161.4	139.8	0	0	112.3	R672 C704 N706 A711 E712 T713	R672-E709 IonicContact NH2-OE1 2.77Å; R672-E709 PolarHBondContact NH2-OE1 3.33Å; C704-E709 PolarHBondContact SG-OE1 2.72Å; N706-E709 HydrophobicContact CB-CB 4.16Å; N706-E709 PolarHBondContact ND2-OE2 2.93Å; E709-A711 VanDerWaalsContact C-N 3.34Å; E709-A711 PolarHBondContact O-N 2.95Å; E709-E712 PolarHBondContact O-N 3.25Å; E709-T713 WeakPolarHBondContact O-CB 3Å; E709-T713 PolarHBondContact O-N 2.84Å; E709-T713 PolarHBondContact O-OG1 3.21Å
710	G	91.9	Very high	91.3	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.9	-33.6	175.8	0	0	0	0	0	113.3	C704 N706 F707 R708 L714	C704-G710 VanDerWaalsContact SG-CA 3.57Å; N706-G710 PolarHBondContact O-N 2.92Å; F707-G710 PolarHBondContact O-N 3.07Å; R708-G710 VanDerWaalsContact C-N 3.34Å; R708-G710 PolarHBondContact O-N 3Å; G710-L714 WeakPolarHBondContact O-CG 3.27Å; G710-L714 PolarHBondContact O-N 2.64Å; G710-L714 VanDerWaalsContact O-N 3.15Å
711	A	93.1	Very high	90.9	Very high	2 Å²	2	47.2 Å²	47.2	2%	0.017	28%	0.278	C	S	.	.	H	α-helix	trans	-74.8	-36.9	175.3	0	0	0	0	0	112.6	L638 V667 F707 R708 E709 L714 L715 L750	L638-A711 HydrophobicContact CD1-CB 4.29Å; V667-A711 HydrophobicContact CG2-CB 4.41Å; F707-A711 PolarHBondContact O-N 2.77Å; R708-A711 CarbonylContact O-C 3.51Å; R708-A711 PolarHBondContact O-N 3.43Å; R708-A711 VanDerWaalsContact O-N 3.09Å; E709-A711 VanDerWaalsContact C-N 3.34Å; E709-A711 PolarHBondContact O-N 2.95Å; A711-L714 WeakPolarHBondContact O-CB 3.5Å; A711-L714 PolarHBondContact O-N 3.3Å; A711-L715 WeakPolarHBondContact O-CG 3.33Å; A711-L715 PolarHBondContact O-N 3.15Å; A711-L750 HydrophobicContact CB-CD1 3.64Å; A711-L750 HydrophobicContact CB-CD2 4.12Å; A711-L750 HydrophobicContact CB-CG 4.48Å
712	E	93.1	Very high	90.5	Very high	68 Å²	68	51 Å²	51	32%	0.318	29%	0.289	S	S	.	.	H	α-helix	trans	-62.5	-47.4	170.7	172.6	171.7	-164.7	0	0	111.3	R708 E709 L714 L715 Q716 F757	R708-E712 PolarHBondContact O-N 3.46Å; E709-E712 PolarHBondContact O-N 3.25Å; E712-L714 PolarHBondContact O-N 3.1Å; E712-L715 WeakPolarHBondContact O-CA 3.38Å; E712-L715 WeakPolarHBondContact O-CB 3.01Å; E712-L715 PolarHBondContact O-N 3.36Å; E712-Q716 HydrophobicContact CG-CG 4.44Å; E712-Q716 WeakPolarHBondContact O-CG 3.37Å; E712-Q716 PolarHBondContact O-N 3.33Å; E712-Q716 PolarHBondContact OE1-NE2 3.01Å; E712-F757 HydrophobicContact CG-CE2 3.91Å; E712-F757 HydrophobicContact CG-CZ 3.98Å
713	T	93.4	Very high	90.2	Very high	56 Å²	56	53.6 Å²	53.6	34%	0.344	30%	0.301	S	S	.	.	H	α-helix	trans	-54.4	-42	174.8	-59.6	0	0	0	0	111	V702 E709 A717	V702-T713 HydrophobicContact CG1-CG2 4.22Å; V702-T713 HydrophobicContact CG2-CG2 4.39Å; E709-T713 WeakPolarHBondContact O-CB 3Å; E709-T713 PolarHBondContact O-N 2.84Å; E709-T713 PolarHBondContact O-OG1 3.21Å; T713-A717 VanDerWaalsContact O-CB 3.32Å; T713-A717 WeakPolarHBondContact O-CB 3.16Å; T713-A717 PolarHBondContact O-N 2.82Å
714	L	93.3	Very high	90.1	Very high	6 Å²	6	59 Å²	59	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-37.6	174.2	-79.4	169.1	0	0	0	113.3	L636 L638 C665 V667 A700 V702 G710 A711 E712 S718	L636-L714 HydrophobicContact CD1-CB 4.24Å; L636-L714 WeakPolarHBondContact CD1-O 3.4Å; L638-L714 HydrophobicContact CD2-CD1 4.1Å; C665-L714 HydrophobicContact CB-CD1 3.97Å; C665-L714 HydrophobicContact CB-CD2 4.48Å; V667-L714 HydrophobicContact CG2-CD1 3.59Å; A700-L714 HydrophobicContact CB-CD2 4.38Å; V702-L714 HydrophobicContact CB-CG 4.38Å; V702-L714 HydrophobicContact CG2-CD2 3.75Å; V702-L714 HydrophobicContact CG2-CG 3.78Å; G710-L714 WeakPolarHBondContact O-CG 3.27Å; G710-L714 PolarHBondContact O-N 2.64Å; G710-L714 VanDerWaalsContact O-N 3.15Å; A711-L714 WeakPolarHBondContact O-CB 3.5Å; A711-L714 PolarHBondContact O-N 3.3Å; E712-L714 PolarHBondContact O-N 3.1Å; L714-S718 WeakPolarHBondContact O-CB 3.4Å; L714-S718 PolarHBondContact O-N 2.87Å; L714-S718 PolarHBondContact O-OG 2.96Å
715	L	91.9	Very high	90.3	Very high	4 Å²	4	59 Å²	59	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-69.9	-34.2	177	-73	169.9	0	0	0	112.7	A711 E712 L728 L750 A754 F757 Y759	A711-L715 WeakPolarHBondContact O-CG 3.33Å; A711-L715 PolarHBondContact O-N 3.15Å; E712-L715 WeakPolarHBondContact O-CA 3.38Å; E712-L715 WeakPolarHBondContact O-CB 3.01Å; E712-L715 PolarHBondContact O-N 3.36Å; L715-L728 HydrophobicContact CD2-CB 4.25Å; L715-L728 HydrophobicContact CD2-CD1 4.27Å; L715-L728 HydrophobicContact CD2-CD2 4.42Å; L715-L750 HydrophobicContact CD1-CD1 3.91Å; L715-A754 HydrophobicContact CD1-CB 4.28Å; L715-F757 HydrophobicContact CB-CD2 4.05Å; L715-F757 HydrophobicContact CD1-CD2 4.12Å; L715-Y759 HydrophobicContact CB-CE2 4.38Å; L715-Y759 HydrophobicContact CD2-CD1 3.98Å; L715-Y759 HydrophobicContact CD2-CD2 4.13Å; L715-Y759 HydrophobicContact CD2-CE1 3.93Å; L715-Y759 HydrophobicContact CD2-CE2 4.06Å; L715-Y759 HydrophobicContact CD2-CG 4.1Å; L715-Y759 PolarHBondContact O-OH 2.64Å
716	Q	90.3	Very high	90.4	Very high	118 Å²	118	56.8 Å²	56.8	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-81.7	-48.8	179.1	-63.5	-177.7	17.1	0	0	112.8	E712 F757	E712-Q716 HydrophobicContact CG-CG 4.44Å; E712-Q716 WeakPolarHBondContact O-CG 3.37Å; E712-Q716 PolarHBondContact O-N 3.33Å; E712-Q716 PolarHBondContact OE1-NE2 3.01Å; Q716-F757 HydrophobicContact CG-CD1 4.45Å; Q716-F757 HydrophobicContact CG-CE1 3.92Å; Q716-F757 HydrophobicContact CG-CE2 4.36Å; Q716-F757 HydrophobicContact CG-CZ 3.91Å; Q716-F757 VanDerWaalsContact NE2-CZ 3.28Å
717	A	90.1	Very high	90.6	Very high	79 Å²	79	52.8 Å²	52.8	65%	0.653	29%	0.288	S	S	*	.	H	α-helix	trans	-98	-4.1	-165.7	0	0	0	0	0	115.5	T713 G719	T713-A717 VanDerWaalsContact O-CB 3.32Å; T713-A717 WeakPolarHBondContact O-CB 3.16Å; T713-A717 PolarHBondContact O-N 2.82Å; A717-G719 PolarHBondContact O-N 3.03Å
718	S	91.8	Very high	90.9	Very high	15 Å²	15	49.5 Å²	49.5	11%	0.105	27%	0.274	C	S	.	.			trans	-72.7	125.5	-177.3	-73.6	0	0	0	0	113.9	L636 L714 P725	L636-S718 WeakPolarHBondContact CD1-OG 3.35Å; L714-S718 WeakPolarHBondContact O-CB 3.4Å; L714-S718 PolarHBondContact O-N 2.87Å; L714-S718 PolarHBondContact O-OG 2.96Å; S718-P725 WeakPolarHBondContact O-CD 3.26Å
719	G	87.9	Confident	91.1	Very high	49 Å²	49	45.8 Å²	45.8	51%	0.505	26%	0.26	S	S	.	.	S	Bend	trans	112.1	-163.2	166.8	0	0	0	0	0	114.3	A717 M723	A717-G719 PolarHBondContact O-N 3.03Å; G719-M723 VanDerWaalsContact CA-O 3.26Å; G719-M723 WeakPolarHBondContact CA-O 3.41Å
720	L	87.4	Confident	91.3	Very high	112 Å²	112	42.9 Å²	42.9	59%	0.586	25%	0.246	S	C	*	.	B	Isolated β-bridge	trans	-147.3	115.9	179.5	-176.2	64	0	0	0	111.4	A618 R722 M723	A618-L720 HydrophobicContact CB-CD2 4.43Å; L720-R722 PolarHBondContact O-N 3.46Å; L720-M723 PolarHBondContact N-O 2.83Å; L720-M723 WeakPolarHBondContact O-CA 3.5Å; L720-M723 WeakPolarHBondContact O-CB 3.37Å; L720-M723 PolarHBondContact O-N 2.87Å
721	G	84.6	Confident	91.4	Very high	52 Å²	52	43.6 Å²	43.6	54%	0.536	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	-125.3	-178.2	0	0	0	0	0	112.1	M723	G721-M723 PolarHBondContact O-N 2.91Å
722	R	84.9	Confident	91.4	Very high	92 Å²	92	44.4 Å²	44.4	35%	0.347	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.4	174.6	-66.1	-72.8	-172.3	-163.1	-3.1	114	L621 V624 D626 Q634 L720 K724	L621-R722 HydrophobicContact CD2-CB 3.9Å; L621-R722 HydrophobicContact CG-CB 3.86Å; L621-R722 HydrophobicContact CG-CG 4.4Å; L621-R722 WeakPolarHBondContact O-CG 3.24Å; V624-R722 PolarHBondContact O-NE 3.26Å; V624-R722 VanDerWaalsContact O-NE 3.16Å; V624-R722 PolarHBondContact O-NH2 3.29Å; D626-R722 IonicContact OD1-CZ 3.19Å; D626-R722 IonicContact OD1-NE 3.23Å; D626-R722 IonicContact OD1-NH1 3.94Å; D626-R722 PolarHBondContact OD1-NH1 3.12Å; D626-R722 IonicContact OD2-CZ 2.73Å; D626-R722 IonicContact OD2-NH1 2.7Å; D626-R722 PolarHBondContact OD2-NH1 3.41Å; D626-R722 IonicContact OD2-NH2 2.69Å; Q634-R722 PolarHBondContact NE2-O 2.88Å; Q634-R722 VanDerWaalsContact NE2-O 3.16Å; L720-R722 PolarHBondContact O-N 3.46Å; R722-K724 VanDerWaalsContact C-N 3.26Å; R722-K724 PolarHBondContact O-N 3.4Å
723	M	87.5	Confident	91.4	Very high	83 Å²	83	42.8 Å²	42.8	41%	0.409	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-89.4	56.5	173.7	-60.2	-165.1	-61.5	0	0	111.5	A618 L621 L661 G719 L720 G721	A618-M723 HydrophobicContact CB-CE 3.86Å; L621-M723 HydrophobicContact CD2-CG 3.86Å; L661-M723 WeakPolarHBondContact CD2-O 3.49Å; G719-M723 VanDerWaalsContact CA-O 3.26Å; G719-M723 WeakPolarHBondContact CA-O 3.41Å; L720-M723 PolarHBondContact N-O 2.83Å; L720-M723 WeakPolarHBondContact O-CA 3.5Å; L720-M723 WeakPolarHBondContact O-CB 3.37Å; L720-M723 PolarHBondContact O-N 2.87Å; G721-M723 PolarHBondContact O-N 2.91Å
724	K	90.1	Very high	91.1	Very high	127 Å²	127	47 Å²	47	55%	0.552	26%	0.259	S	S	*	.			trans	-104.3	160.9	169.7	67.8	173.7	-174.9	170.1	0	110.9	Q634 R722	Q634-K724 WeakPolarHBondContact CB-O 3.36Å; Q634-K724 PolarHBondContact NE2-O 3.04Å; Q634-K724 VanDerWaalsContact NE2-O 3.1Å; R722-K724 VanDerWaalsContact C-N 3.26Å; R722-K724 PolarHBondContact O-N 3.4Å
725	P	93.1	Very high	90.9	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.019	28%	0.279	C	S	.	.			trans	-71.3	160	171.4	29.3	-27.6	0	0	0	111	Q634 L636 L663 S718 Y759	Q634-P725 CarbonylContact O-C 3.58Å; Q634-P725 VanDerWaalsContact O-CA 3.26Å; Q634-P725 WeakPolarHBondContact O-CA 3.43Å; Q634-P725 WeakPolarHBondContact O-CB 3.37Å; L636-P725 HydrophobicContact CB-CB 3.8Å; L636-P725 HydrophobicContact CB-CG 4.05Å; L636-P725 HydrophobicContact CD1-CG 3.96Å; L663-P725 HydrophobicContact CD1-CB 4.41Å; L663-P725 HydrophobicContact CD1-CG 4.01Å; S718-P725 WeakPolarHBondContact O-CD 3.26Å; P725-Y759 HydrophobicContact CB-CE1 3.99Å; P725-Y759 HydrophobicContact CG-CE1 4.01Å
726	N	91.8	Very high	90.9	Very high	28 Å²	28	50.7 Å²	50.7	15%	0.15	28%	0.278	C	S	.	.			trans	-136.9	-4.2	177.8	65.9	22.5	0	0	0	112.7	F631 R632 Q634 Y759 G760	F631-N726 WeakPolarHBondContact CE2-ND2 3.49Å; R632-N726 PolarHBondContact O-ND2 2.81Å; Q634-N726 HydrophobicContact CB-CB 4.46Å; Q634-N726 PolarHBondContact N-OD1 3.04Å; Q634-N726 PolarHBondContact O-N 2.88Å; Q634-N726 PolarHBondContact O-OD1 2.78Å; Q634-N726 PolarHBondContact OE1-ND2 3.02Å; N726-Y759 VanDerWaalsContact C-CD1 3.49Å; N726-G760 PolarHBondContact O-N 2.96Å
727	T	93.5	Very high	90.8	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	121.2	-178.5	-52.4	0	0	0	0	109.1	Q634 I635 L636 G760 L762	Q634-T727 PolarHBondContact O-N 2.82Å; Q634-T727 VanDerWaalsContact O-N 3.15Å; I635-T727 CarbonylContact C-O 3.56Å; I635-T727 WeakPolarHBondContact CA-O 3.39Å; I635-T727 HydrophobicContact CG1-CG2 4.43Å; L636-T727 PolarHBondContact N-O 2.86Å; T727-G760 CarbonylContact C-O 3.58Å; T727-G760 WeakPolarHBondContact CA-O 3.21Å; T727-G760 WeakPolarHBondContact CG2-O 3.47Å; T727-L762 HydrophobicContact CG2-CD1 3.53Å; T727-L762 HydrophobicContact CG2-CD2 4.41Å; T727-L762 HydrophobicContact CG2-CG 3.63Å
728	L	95.8	Very high	90.6	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	137.7	169.6	174.9	63.5	0	0	0	109.6	L636 L638 L715 I730 L750 A754 G760 L762	L636-L728 HydrophobicContact CD2-CD1 3.71Å; L636-L728 CarbonylContact O-C 3.55Å; L638-L728 HydrophobicContact CD1-CD1 4.27Å; L638-L728 HydrophobicContact CG-CD1 4.08Å; L715-L728 HydrophobicContact CD2-CB 4.25Å; L715-L728 HydrophobicContact CD2-CD1 4.27Å; L715-L728 HydrophobicContact CD2-CD2 4.42Å; L728-I730 HydrophobicContact CD1-CG2 3.88Å; L728-I730 HydrophobicContact CD2-CG2 4.13Å; L728-I730 HydrophobicContact CG-CG2 3.91Å; L728-L750 HydrophobicContact CD2-CD1 4.19Å; L728-L750 HydrophobicContact CD2-CG 4.27Å; L728-A754 HydrophobicContact CB-CB 4.46Å; L728-A754 HydrophobicContact CD2-CB 3.51Å; L728-G760 PolarHBondContact N-O 3.33Å; L728-L762 PolarHBondContact O-N 3.26Å
729	M	95.6	Very high	90.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	118.4	176.5	-175.1	167.1	179.2	0	0	111.7	I635 L636 V637 L638 L648 L651 A652 F655 L762	I635-M729 HydrophobicContact CG2-CB 3.53Å; I635-M729 HydrophobicContact CG2-CG 4.45Å; I635-M729 HydrophobicContact CG2-SD 4.16Å; L636-M729 PolarHBondContact O-N 3.47Å; V637-M729 WeakPolarHBondContact CA-O 3.43Å; V637-M729 HydrophobicContact CG1-CB 4.45Å; V637-M729 HydrophobicContact CG1-CG 4.44Å; V637-M729 HydrophobicContact CG2-CB 4.37Å; L638-M729 PolarHBondContact N-O 2.97Å; L648-M729 HydrophobicContact CD1-CE 3.84Å; L648-M729 HydrophobicContact CD1-CG 4.03Å; L648-M729 HydrophobicContact CG-CE 4.38Å; L648-M729 HydrophobicContact CG-CG 4.43Å; L651-M729 HydrophobicContact CB-CE 4.04Å; L651-M729 HydrophobicContact CD2-CE 3.88Å; L651-M729 HydrophobicContact CG-CE 4.02Å; A652-M729 HydrophobicContact CB-CE 4.49Å; A652-M729 HydrophobicContact CB-SD 3.75Å; F655-M729 HydrophobicContact CE2-CE 4.44Å; F655-M729 HydrophobicContact CE2-SD 4.49Å; M729-L762 WeakPolarHBondContact CA-O 3.5Å; M729-L762 HydrophobicContact CB-CB 4.14Å; M729-L762 HydrophobicContact CB-CD1 4.33Å; M729-L762 HydrophobicContact CG-CB 4.03Å; M729-L762 HydrophobicContact CG-CD1 4.35Å; M729-L762 HydrophobicContact SD-CD1 4.1Å
730	I	95.2	Very high	90.2	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	160	-177.2	70.8	178.7	0	0	0	111.7	L638 L728 Y747 L751 L762 V763 L764	L638-I730 HydrophobicContact CB-CG2 4.13Å; L638-I730 HydrophobicContact CD1-CG2 3.85Å; L638-I730 HydrophobicContact CG-CG2 4.1Å; L728-I730 HydrophobicContact CD1-CG2 3.88Å; L728-I730 HydrophobicContact CD2-CG2 4.13Å; L728-I730 HydrophobicContact CG-CG2 3.91Å; I730-Y747 HydrophobicContact CD1-CD2 4.47Å; I730-Y747 HydrophobicContact CD1-CE2 3.63Å; I730-Y747 HydrophobicContact CG1-CE2 4.41Å; I730-L751 HydrophobicContact CD1-CD2 3.73Å; I730-L751 HydrophobicContact CD1-CG 4.32Å; I730-L762 PolarHBondContact N-O 2.83Å; I730-V763 HydrophobicContact CD1-CG2 4.19Å; I730-V763 HydrophobicContact CG1-CB 4.43Å; I730-V763 HydrophobicContact CG1-CG1 4.28Å; I730-V763 HydrophobicContact CG1-CG2 3.95Å; I730-V763 WeakPolarHBondContact O-CA 3.39Å; I730-L764 PolarHBondContact O-N 2.84Å
731	G	94.1	Very high	90.2	Very high	15 Å²	15	55.8 Å²	55.8	16%	0.155	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	151.2	168.3	0	0	0	0	0	111.8	Y747 L770	G731-Y747 WeakPolarHBondContact O-CE2 3.38Å; G731-Y747 PolarHBondContact O-OH 3.46Å; G731-L770 VanDerWaalsContact CA-CD1 3.48Å
732	F	94.2	Very high	90.2	Very high	19 Å²	19	57.5 Å²	57.5	8%	0.083	28%	0.28	C	S	.	.			trans	-69	125.5	172.6	-174.9	-105.3	0	0	0	111.6	R734 Y747 V763 L764 R765 M1016 L1019 D1020	F732-R734 VanDerWaalsContact C-N 3.29Å; F732-R734 PolarHBondContact O-N 3.03Å; F732-Y747 WeakPolarHBondContact CA-OH 3.39Å; F732-V763 HydrophobicContact CB-CG1 4.05Å; F732-V763 HydrophobicContact CD2-CG1 4.15Å; F732-L764 WeakPolarHBondContact CB-O 3.38Å; F732-L764 PolarHBondContact N-O 2.95Å; F732-R765 HydrophobicContact CB-CB 3.79Å; F732-R765 HydrophobicContact CB-CG 4.09Å; F732-R765 HydrophobicContact CD1-CG 3.98Å; F732-R765 HydrophobicContact CG-CB 4.22Å; F732-R765 HydrophobicContact CG-CG 4.19Å; F732-M1016 HydrophobicContact CE2-CE 3.82Å; F732-M1016 HydrophobicContact CZ-CE 3.9Å; F732-L1019 HydrophobicContact CE2-CB 3.84Å; F732-L1019 HydrophobicContact CZ-CB 4.49Å; F732-D1020 HydrophobicContact CZ-CB 4.03Å
733	K	91.9	Very high	90.4	Very high	35 Å²	35	54.9 Å²	54.9	15%	0.152	28%	0.278	C	S	.	.			trans	-73.6	76.8	178.9	-172.5	179.9	166.3	64.9	0	111.5	N735 W736 A743 Y747 M1016	K733-N735 WeakPolarHBondContact CG-OD1 3.34Å; K733-N735 PolarHBondContact NZ-OD1 2.65Å; K733-N735 PolarHBondContact O-N 3.26Å; K733-N735 VanDerWaalsContact O-N 3.16Å; K733-W736 HydrophobicContact CG-CB 4.46Å; K733-W736 PolarHBondContact O-N 2.74Å; K733-A743 WeakPolarHBondContact CD-O 3.37Å; K733-A743 WeakPolarHBondContact CE-O 3.25Å; K733-Y747 HydrophobicContact CB-CD1 4.16Å; K733-Y747 HydrophobicContact CB-CD2 3.91Å; K733-Y747 HydrophobicContact CB-CE1 4.12Å; K733-Y747 HydrophobicContact CB-CE2 3.86Å; K733-Y747 HydrophobicContact CB-CG 4.06Å; K733-Y747 HydrophobicContact CD-CD2 4.35Å; K733-Y747 HydrophobicContact CD-CG 4.11Å; K733-Y747 PolarHBondContact N-OH 3.32Å; K733-M1016 HydrophobicContact CB-CE 4.35Å
734	R	88.8	Confident	90.5	Very high	144 Å²	144	51 Å²	51	54%	0.543	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-33.7	-180	-176.2	-176.1	-179.7	163.4	13	113.7	F732 W736 N767 Q768	F732-R734 VanDerWaalsContact C-N 3.29Å; F732-R734 PolarHBondContact O-N 3.03Å; R734-W736 VanDerWaalsContact C-N 3.28Å; R734-W736 PolarHBondContact O-N 2.77Å; R734-N767 PolarHBondContact NH1-O 2.96Å; R734-Q768 PolarHBondContact NH1-O 2.67Å; R734-Q768 VanDerWaalsContact NH1-O 3.09Å
735	N	89.2	Confident	90.5	Very high	86 Å²	86	48.1 Å²	48.1	46%	0.46	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	15.8	-176.3	74.2	-16.6	0	0	0	114.6	K733 R737 T738 A739	K733-N735 WeakPolarHBondContact CG-OD1 3.34Å; K733-N735 PolarHBondContact NZ-OD1 2.65Å; K733-N735 PolarHBondContact O-N 3.26Å; K733-N735 VanDerWaalsContact O-N 3.16Å; N735-R737 PolarHBondContact O-N 2.98Å; N735-T738 CarbonylContact O-C 3.56Å; N735-T738 PolarHBondContact O-N 3.03Å; N735-T738 PolarHBondContact O-OG1 3.35Å; N735-A739 WeakPolarHBondContact O-CB 3.49Å; N735-A739 PolarHBondContact O-N 2.73Å
736	W	90	Very high	90.4	Very high	1 Å²	1	48.3 Å²	48.3	0%	0.004	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-54.6	-35.9	-176.7	70.5	-86.2	0	0	0	114.1	K733 R734 T738 V744 M939 F943 F1013 M1016 A1017 D1020	K733-W736 HydrophobicContact CG-CB 4.46Å; K733-W736 PolarHBondContact O-N 2.74Å; R734-W736 VanDerWaalsContact C-N 3.28Å; R734-W736 PolarHBondContact O-N 2.77Å; W736-T738 VanDerWaalsContact C-N 3.26Å; W736-T738 PolarHBondContact O-N 2.89Å; W736-V744 HydrophobicContact CB-CG2 4.13Å; W736-M939 HydrophobicContact CH2-CG 4.35Å; W736-M939 HydrophobicContact CH2-SD 4.43Å; W736-M939 HydrophobicContact CZ2-CG 4.2Å; W736-M939 HydrophobicContact CZ2-SD 3.83Å; W736-F943 HydrophobicContact CH2-CE2 4.41Å; W736-F943 HydrophobicContact CZ3-CD2 4.32Å; W736-F943 HydrophobicContact CZ3-CE2 4.01Å; W736-F943 HydrophobicContact CZ3-CZ 4.31Å; W736-F1013 HydrophobicContact CE3-CD1 4.15Å; W736-F1013 HydrophobicContact CZ3-CD1 4.06Å; W736-M1016 HydrophobicContact CB-CE 3.9Å; W736-M1016 HydrophobicContact CD2-CB 4.04Å; W736-M1016 HydrophobicContact CE3-CB 4.09Å; W736-M1016 HydrophobicContact CG-CB 4.4Å; W736-M1016 HydrophobicContact CG-CE 3.84Å; W736-A1017 HydrophobicContact CH2-CB 3.88Å; W736-A1017 HydrophobicContact CZ2-CB 4.27Å; W736-D1020 HydrophobicContact CZ2-CB 4.08Å; W736-D1020 PolarHBondContact NE1-OD2 3.49Å
737	R	88.5	Confident	90.4	Very high	115 Å²	115	48 Å²	48	43%	0.434	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-71.6	-10.9	176.7	-76.1	179.4	-88	146.4	-6.6	115.5	N735 F943 D1020	N735-R737 PolarHBondContact O-N 2.98Å; R737-F943 HydrophobicContact CB-CZ 4.24Å; R737-F943 HydrophobicContact CG-CE2 3.92Å; R737-F943 HydrophobicContact CG-CZ 3.93Å; R737-D1020 IonicContact CZ-OD2 3.63Å; R737-D1020 IonicContact NE-OD2 3.57Å; R737-D1020 IonicContact NH2-OD2 3.71Å; R737-D1020 PolarHBondContact NH2-OD2 3.09Å
738	T	87.6	Confident	90.4	Very high	122 Å²	122	48 Å²	48	75%	0.748	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-131.3	17.4	-179	69.3	0	0	0	0	111.9	N735 W736	N735-T738 CarbonylContact O-C 3.56Å; N735-T738 PolarHBondContact O-N 3.03Å; N735-T738 PolarHBondContact O-OG1 3.35Å; W736-T738 VanDerWaalsContact C-N 3.26Å; W736-T738 PolarHBondContact O-N 2.89Å
739	A	85.2	Confident	90.1	Very high	29 Å²	29	48.1 Å²	48.1	24%	0.24	25%	0.247	C	C	.	.	S	Bend	trans	-104.3	159.6	177.2	0	0	0	0	0	109.7	N735 A743 V744	N735-A739 WeakPolarHBondContact O-CB 3.49Å; N735-A739 PolarHBondContact O-N 2.73Å; A739-A743 HydrophobicContact CB-CB 4.49Å; A739-V744 HydrophobicContact CB-CG2 4.43Å
740	E	85.6	Confident	90	Very high	159 Å²	159	48.2 Å²	48.2	74%	0.743	25%	0.248	S	C	*	.			trans	-59.4	150	169.9	-66.3	168.1	-176.9	0	0	110.9	D742 A743 V744	E740-D742 PolarHBondContact O-N 3.37Å; E740-A743 WeakPolarHBondContact O-CB 3.46Å; E740-A743 PolarHBondContact O-N 2.96Å; E740-A743 VanDerWaalsContact O-N 3.15Å; E740-V744 PolarHBondContact O-N 3.28Å
741	T	85.9	Confident	89.8	Confident	55 Å²	55	48 Å²	48	34%	0.337	25%	0.247	S	C	.	.	H	α-helix	trans	-58.5	-49.5	-175	45.2	0	0	0	0	111.7	A743 V744 Q745 W964 F1013	T741-A743 VanDerWaalsContact C-N 3.27Å; T741-A743 PolarHBondContact O-N 3.48Å; T741-V744 WeakPolarHBondContact O-CA 3.24Å; T741-V744 WeakPolarHBondContact O-CB 3.42Å; T741-V744 PolarHBondContact O-N 2.96Å; T741-Q745 WeakPolarHBondContact O-CG 3.46Å; T741-Q745 PolarHBondContact O-N 3.21Å; T741-W964 HydrophobicContact CG2-CD2 3.92Å; T741-W964 HydrophobicContact CG2-CE3 4.14Å; T741-W964 HydrophobicContact CG2-CG 4.45Å; T741-W964 HydrophobicContact CG2-CH2 4.2Å; T741-W964 HydrophobicContact CG2-CZ2 3.99Å; T741-W964 HydrophobicContact CG2-CZ3 4.28Å; T741-F1013 HydrophobicContact CG2-CZ 4.12Å
742	D	86.4	Confident	89.6	Confident	89 Å²	89	47.8 Å²	47.8	48%	0.476	24%	0.242	S	C	.	.	H	α-helix	trans	-55.4	-40.6	176.7	172.9	58.7	0	0	0	112.2	E740 V744 Q745 S746	E740-D742 PolarHBondContact O-N 3.37Å; D742-V744 PolarHBondContact O-N 3.02Å; D742-V744 VanDerWaalsContact O-N 3.09Å; D742-Q745 PolarHBondContact O-N 3.42Å; D742-Q745 VanDerWaalsContact O-N 3.15Å; D742-S746 WeakPolarHBondContact O-CB 3.49Å; D742-S746 PolarHBondContact O-N 2.84Å; D742-S746 PolarHBondContact O-OG 3.01Å; D742-S746 PolarHBondContact OD1-OG 3.05Å; D742-S746 VanDerWaalsContact OD1-OG 3.13Å
743	A	88.1	Confident	89.5	Confident	37 Å²	37	47.4 Å²	47.4	31%	0.306	24%	0.241	S	C	.	.	H	α-helix	trans	-65.8	-15.1	177.9	0	0	0	0	0	113.8	K733 A739 E740 T741	K733-A743 WeakPolarHBondContact CD-O 3.37Å; K733-A743 WeakPolarHBondContact CE-O 3.25Å; A739-A743 HydrophobicContact CB-CB 4.49Å; E740-A743 WeakPolarHBondContact O-CB 3.46Å; E740-A743 PolarHBondContact O-N 2.96Å; E740-A743 VanDerWaalsContact O-N 3.15Å; T741-A743 VanDerWaalsContact C-N 3.27Å; T741-A743 PolarHBondContact O-N 3.48Å
744	V	90.3	Very high	89.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-90.2	-46.8	169.6	-178	0	0	0	0	110.5	W736 A739 E740 T741 D742 S746 Y747 V748 F1013 M1016	W736-V744 HydrophobicContact CB-CG2 4.13Å; A739-V744 HydrophobicContact CB-CG2 4.43Å; E740-V744 PolarHBondContact O-N 3.28Å; T741-V744 WeakPolarHBondContact O-CA 3.24Å; T741-V744 WeakPolarHBondContact O-CB 3.42Å; T741-V744 PolarHBondContact O-N 2.96Å; D742-V744 PolarHBondContact O-N 3.02Å; D742-V744 VanDerWaalsContact O-N 3.09Å; V744-S746 PolarHBondContact O-N 3.34Å; V744-Y747 WeakPolarHBondContact O-CB 3.5Å; V744-Y747 PolarHBondContact O-N 3.42Å; V744-V748 PolarHBondContact O-N 3.44Å; V744-F1013 HydrophobicContact CB-CE1 4.44Å; V744-F1013 HydrophobicContact CB-CE2 4.36Å; V744-F1013 HydrophobicContact CB-CZ 3.98Å; V744-F1013 HydrophobicContact CG1-CE1 4.25Å; V744-F1013 HydrophobicContact CG1-CE2 4.24Å; V744-F1013 HydrophobicContact CG1-CZ 4.07Å; V744-F1013 HydrophobicContact CG2-CE1 4.25Å; V744-F1013 HydrophobicContact CG2-CZ 4.1Å; V744-M1016 HydrophobicContact CG1-CG 4.07Å
745	Q	89.3	Confident	89.3	Confident	67 Å²	67	39.4 Å²	39.4	31%	0.313	21%	0.21	S	C	.	.	H	α-helix	trans	-64.9	-38.1	179.7	-56.2	-159	-95.9	0	0	112.4	T741 D742 Y747 G749 D1012	T741-Q745 WeakPolarHBondContact O-CG 3.46Å; T741-Q745 PolarHBondContact O-N 3.21Å; D742-Q745 PolarHBondContact O-N 3.42Å; D742-Q745 VanDerWaalsContact O-N 3.15Å; Q745-Y747 VanDerWaalsContact C-N 3.29Å; Q745-Y747 PolarHBondContact O-N 3.21Å; Q745-G749 WeakPolarHBondContact O-CA 3.39Å; Q745-G749 PolarHBondContact O-N 3.4Å; Q745-D1012 HydrophobicContact CG-CB 4.49Å; Q745-D1012 VanDerWaalsContact CG-OD2 3.29Å; Q745-D1012 WeakPolarHBondContact CG-OD2 3.49Å; Q745-D1012 PolarHBondContact NE2-OD2 3.26Å
746	S	91.6	Very high	89.3	Confident	8 Å²	8	38.9 Å²	38.9	6%	0.056	21%	0.207	C	C	.	.	H	α-helix	trans	-65.6	-28	171	-79.6	0	0	0	0	113	D742 V744 L750	D742-S746 WeakPolarHBondContact O-CB 3.49Å; D742-S746 PolarHBondContact O-N 2.84Å; D742-S746 PolarHBondContact O-OG 3.01Å; D742-S746 PolarHBondContact OD1-OG 3.05Å; D742-S746 VanDerWaalsContact OD1-OG 3.13Å; V744-S746 PolarHBondContact O-N 3.34Å; S746-L750 VanDerWaalsContact O-CB 3.31Å; S746-L750 WeakPolarHBondContact O-CB 3.14Å; S746-L750 PolarHBondContact O-N 3.27Å; S746-L750 VanDerWaalsContact O-N 3.15Å
747	Y	92.7	Very high	89.2	Confident	20 Å²	20	42.1 Å²	42.1	8%	0.078	22%	0.221	C	C	.	.	H	α-helix	trans	-78.3	-43.8	177	-177.6	-92.9	0	0	0	112.3	I730 G731 F732 K733 V744 Q745 L751 V763 M1016	I730-Y747 HydrophobicContact CD1-CD2 4.47Å; I730-Y747 HydrophobicContact CD1-CE2 3.63Å; I730-Y747 HydrophobicContact CG1-CE2 4.41Å; G731-Y747 WeakPolarHBondContact O-CE2 3.38Å; G731-Y747 PolarHBondContact O-OH 3.46Å; F732-Y747 WeakPolarHBondContact CA-OH 3.39Å; K733-Y747 HydrophobicContact CB-CD1 4.16Å; K733-Y747 HydrophobicContact CB-CD2 3.91Å; K733-Y747 HydrophobicContact CB-CE1 4.12Å; K733-Y747 HydrophobicContact CB-CE2 3.86Å; K733-Y747 HydrophobicContact CB-CG 4.06Å; K733-Y747 HydrophobicContact CD-CD2 4.35Å; K733-Y747 HydrophobicContact CD-CG 4.11Å; K733-Y747 PolarHBondContact N-OH 3.32Å; V744-Y747 WeakPolarHBondContact O-CB 3.5Å; V744-Y747 PolarHBondContact O-N 3.42Å; Q745-Y747 VanDerWaalsContact C-N 3.29Å; Q745-Y747 PolarHBondContact O-N 3.21Å; Y747-L751 HydrophobicContact CE1-CD1 4.16Å; Y747-L751 PolarHBondContact O-N 3.07Å; Y747-V763 WeakPolarHBondContact OH-CG1 3.32Å; Y747-M1016 HydrophobicContact CD1-CE 4.3Å; Y747-M1016 HydrophobicContact CD1-SD 3.71Å; Y747-M1016 HydrophobicContact CE1-CE 4.16Å; Y747-M1016 HydrophobicContact CE1-SD 3.73Å
748	V	91.4	Very high	89.2	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-71.2	-41.6	174.6	175.4	0	0	0	0	110.8	V744 L750 L751 H752 D1012 Y1015 M1016	V744-V748 PolarHBondContact O-N 3.44Å; V748-L750 VanDerWaalsContact C-N 3.34Å; V748-L750 PolarHBondContact O-N 3.26Å; V748-L751 WeakPolarHBondContact O-CA 3.44Å; V748-L751 WeakPolarHBondContact O-CB 3.47Å; V748-L751 PolarHBondContact O-N 2.82Å; V748-H752 PolarHBondContact O-CD2 2.75Å; V748-H752 VanDerWaalsContact O-CD2 3.22Å; V748-H752 PolarHBondContact O-N 3.5Å; V748-H752 VanDerWaalsContact O-N 3.12Å; V748-D1012 HydrophobicContact CB-CB 4.06Å; V748-D1012 WeakPolarHBondContact CB-OD1 3.44Å; V748-D1012 HydrophobicContact CG1-CB 4.27Å; V748-D1012 WeakPolarHBondContact CG1-OD1 3.47Å; V748-D1012 HydrophobicContact CG2-CB 4.01Å; V748-Y1015 HydrophobicContact CG1-CD1 3.7Å; V748-Y1015 HydrophobicContact CG1-CE1 4.19Å; V748-Y1015 HydrophobicContact CG2-CD1 4.16Å; V748-M1016 HydrophobicContact CG2-CG 3.6Å; V748-M1016 HydrophobicContact CG2-SD 4.07Å
749	G	90.8	Very high	89.4	Confident	4 Å²	4	36.4 Å²	36.4	4%	0.041	19%	0.191	C	C	.	.	H	α-helix	trans	-50.6	-51.1	171.7	0	0	0	0	0	112.2	R708 Q745 L751 H752 D753	R708-G749 VanDerWaalsContact CZ-CA 3.46Å; Q745-G749 WeakPolarHBondContact O-CA 3.39Å; Q745-G749 PolarHBondContact O-N 3.4Å; G749-L751 VanDerWaalsContact C-N 3.26Å; G749-L751 PolarHBondContact O-N 3.33Å; G749-H752 CarbonylContact O-C 3.58Å; G749-H752 WeakPolarHBondContact O-CA 3.48Å; G749-H752 WeakPolarHBondContact O-CB 3.46Å; G749-H752 PolarHBondContact O-N 3.5Å; G749-D753 PolarHBondContact O-N 2.93Å; G749-D753 VanDerWaalsContact O-OD2 3.06Å
750	L	92.8	Very high	89.7	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-58.4	-32.8	175.6	174.7	62.1	0	0	0	113.9	L638 F707 A711 L715 L728 S746 V748 A754	L638-L750 HydrophobicContact CD1-CD2 3.53Å; F707-L750 HydrophobicContact CE1-CD2 4.06Å; F707-L750 HydrophobicContact CZ-CD2 4.49Å; A711-L750 HydrophobicContact CB-CD1 3.64Å; A711-L750 HydrophobicContact CB-CD2 4.12Å; A711-L750 HydrophobicContact CB-CG 4.48Å; L715-L750 HydrophobicContact CD1-CD1 3.91Å; L728-L750 HydrophobicContact CD2-CD1 4.19Å; L728-L750 HydrophobicContact CD2-CG 4.27Å; S746-L750 VanDerWaalsContact O-CB 3.31Å; S746-L750 WeakPolarHBondContact O-CB 3.14Å; S746-L750 PolarHBondContact O-N 3.27Å; S746-L750 VanDerWaalsContact O-N 3.15Å; V748-L750 VanDerWaalsContact C-N 3.34Å; V748-L750 PolarHBondContact O-N 3.26Å; L750-A754 VanDerWaalsContact O-CB 3.29Å; L750-A754 WeakPolarHBondContact O-CB 3.32Å; L750-A754 PolarHBondContact O-N 3.11Å
751	L	91.4	Very high	90.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67	-40	173.7	-69.4	169.9	0	0	0	111.2	I730 Y747 V748 G749 F755 T761 V763 Y1015 L1019	I730-L751 HydrophobicContact CD1-CD2 3.73Å; I730-L751 HydrophobicContact CD1-CG 4.32Å; Y747-L751 HydrophobicContact CE1-CD1 4.16Å; Y747-L751 PolarHBondContact O-N 3.07Å; V748-L751 WeakPolarHBondContact O-CA 3.44Å; V748-L751 WeakPolarHBondContact O-CB 3.47Å; V748-L751 PolarHBondContact O-N 2.82Å; G749-L751 VanDerWaalsContact C-N 3.26Å; G749-L751 PolarHBondContact O-N 3.33Å; L751-F755 WeakPolarHBondContact O-CD2 3.33Å; L751-F755 VanDerWaalsContact O-CG 3.32Å; L751-F755 WeakPolarHBondContact O-CG 3.42Å; L751-F755 PolarHBondContact O-N 3.41Å; L751-T761 HydrophobicContact CD2-CG2 3.54Å; L751-V763 HydrophobicContact CD2-CG2 3.87Å; L751-Y1015 HydrophobicContact CD1-CE1 3.94Å; L751-L1019 HydrophobicContact CD1-CD1 4.48Å
752	H	89.9	Confident	90.5	Very high	10 Å²	10	25 Å²	25	5%	0.046	13%	0.129	C	C	.	.	H	α-helix	trans	-66.3	-46.6	172.6	-69.3	-73.4	0	0	0	112	H81 V748 G749 A754 F755 D756 A1005 K1007	H81-H752 AromaticContact NE2-ND1 3.9Å; V748-H752 PolarHBondContact O-CD2 2.75Å; V748-H752 VanDerWaalsContact O-CD2 3.22Å; V748-H752 PolarHBondContact O-N 3.5Å; V748-H752 VanDerWaalsContact O-N 3.12Å; G749-H752 CarbonylContact O-C 3.58Å; G749-H752 WeakPolarHBondContact O-CA 3.48Å; G749-H752 WeakPolarHBondContact O-CB 3.46Å; G749-H752 PolarHBondContact O-N 3.5Å; H752-A754 VanDerWaalsContact C-N 3.27Å; H752-A754 PolarHBondContact O-N 3.06Å; H752-F755 CarbonylContact O-C 3.59Å; H752-F755 WeakPolarHBondContact O-CA 3.42Å; H752-F755 WeakPolarHBondContact O-CB 3.21Å; H752-F755 PolarHBondContact O-N 2.69Å; H752-D756 VanDerWaalsContact O-CG 3.27Å; H752-D756 PolarHBondContact O-N 2.93Å; H752-A1005 PolarHBondContact CE1-O 3.09Å; H752-K1007 HydrophobicContact CB-CD 4.07Å; H752-K1007 HydrophobicContact CB-CG 4.47Å
753	D	91.3	Very high	91	Very high	12 Å²	12	20.8 Å²	20.8	6%	0.064	11%	0.106	C	C	.	.	H	α-helix	trans	-63.4	-36.8	-177.9	-50	-30.6	0	0	0	110.9	R708 G749 F755 D756 F757 K1007	R708-D753 IonicContact CZ-OD1 3.27Å; R708-D753 IonicContact CZ-OD2 3.79Å; R708-D753 IonicContact NE-OD1 2.65Å; R708-D753 IonicContact NE-OD2 3.69Å; R708-D753 PolarHBondContact NE-OD2 3.36Å; R708-D753 IonicContact NH2-OD1 3.23Å; R708-D753 PolarHBondContact NH2-OD1 2.77Å; R708-D753 IonicContact NH2-OD2 3.18Å; R708-D753 PolarHBondContact NH2-OD2 2.89Å; G749-D753 PolarHBondContact O-N 2.93Å; G749-D753 VanDerWaalsContact O-OD2 3.06Å; D753-F755 VanDerWaalsContact C-N 3.3Å; D753-F755 PolarHBondContact O-N 3.29Å; D753-D756 PolarHBondContact O-N 2.92Å; D753-F757 HydrophobicContact CB-CE2 4.24Å; D753-F757 WeakPolarHBondContact O-CD2 3.4Å; D753-F757 PolarHBondContact O-N 2.93Å; D753-K1007 IonicContact OD1-NZ 3.34Å
754	A	90.5	Very high	91.3	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.9	-33.8	171.8	0	0	0	0	0	113.3	L715 L728 L750 H752 Y759	L715-A754 HydrophobicContact CD1-CB 4.28Å; L728-A754 HydrophobicContact CB-CB 4.46Å; L728-A754 HydrophobicContact CD2-CB 3.51Å; L750-A754 VanDerWaalsContact O-CB 3.29Å; L750-A754 WeakPolarHBondContact O-CB 3.32Å; L750-A754 PolarHBondContact O-N 3.11Å; H752-A754 VanDerWaalsContact C-N 3.27Å; H752-A754 PolarHBondContact O-N 3.06Å; A754-Y759 WeakPolarHBondContact O-CB 3.37Å; A754-Y759 PolarHBondContact O-N 2.76Å
755	F	87.9	Confident	91.5	Very high	11 Å²	11	20.2 Å²	20.2	5%	0.048	10%	0.096	C	C	.	.	H	α-helix	trans	-71	-43.3	170.9	-62.6	-36.8	0	0	0	111.5	L77 L751 H752 D753 F757 E758 T761 L1002 I1004 R1033	L77-F755 HydrophobicContact CD2-CB 3.75Å; L77-F755 HydrophobicContact CD2-CD1 4.1Å; L77-F755 HydrophobicContact CD2-CG 4.25Å; L77-F755 WeakPolarHBondContact CD2-O 3.45Å; L77-F755 HydrophobicContact CG-CB 4.16Å; L751-F755 WeakPolarHBondContact O-CD2 3.33Å; L751-F755 VanDerWaalsContact O-CG 3.32Å; L751-F755 WeakPolarHBondContact O-CG 3.42Å; L751-F755 PolarHBondContact O-N 3.41Å; H752-F755 CarbonylContact O-C 3.59Å; H752-F755 WeakPolarHBondContact O-CA 3.42Å; H752-F755 WeakPolarHBondContact O-CB 3.21Å; H752-F755 PolarHBondContact O-N 2.69Å; D753-F755 VanDerWaalsContact C-N 3.3Å; D753-F755 PolarHBondContact O-N 3.29Å; F755-F757 PolarHBondContact O-N 2.79Å; F755-E758 WeakPolarHBondContact O-CA 3.13Å; F755-E758 PolarHBondContact O-N 2.96Å; F755-T761 HydrophobicContact CE1-CG2 4.44Å; F755-L1002 HydrophobicContact CZ-CD2 3.93Å; F755-I1004 HydrophobicContact CE2-CD1 4.29Å; F755-I1004 HydrophobicContact CE2-CG1 4.16Å; F755-I1004 HydrophobicContact CZ-CD1 4.27Å; F755-I1004 HydrophobicContact CZ-CG1 4.17Å; F755-R1033 HydrophobicContact CE1-CB 4.01Å; F755-R1033 HydrophobicContact CE1-CG 4.04Å; F755-R1033 HydrophobicContact CZ-CB 4.44Å; F755-R1033 HydrophobicContact CZ-CG 4.49Å
756	D	87.8	Confident	91.5	Very high	74 Å²	74	17.3 Å²	17.3	40%	0.396	8%	0.083	S	C	.	.	H	α-helix	trans	-60.9	-32.1	179.6	-63	-24.2	0	0	0	111.8	H81 H752 D753 E758 K1007	H81-D756 IonicContact CE1-OD1 2.84Å; H81-D756 IonicContact NE2-OD1 2.95Å; H752-D756 VanDerWaalsContact O-CG 3.27Å; H752-D756 PolarHBondContact O-N 2.93Å; D753-D756 PolarHBondContact O-N 2.92Å; D756-E758 VanDerWaalsContact C-N 3.34Å; D756-E758 PolarHBondContact O-N 2.66Å; D756-K1007 IonicContact OD2-NZ 2.71Å; D756-K1007 PolarHBondContact OD2-NZ 3.36Å
757	F	88.3	Confident	91.2	Very high	70 Å²	70	20.2 Å²	20.2	31%	0.307	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	13	172.2	-61	-56.7	0	0	0	115.3	E712 L715 Q716 D753 F755 Y759	E712-F757 HydrophobicContact CG-CE2 3.91Å; E712-F757 HydrophobicContact CG-CZ 3.98Å; L715-F757 HydrophobicContact CB-CD2 4.05Å; L715-F757 HydrophobicContact CD1-CD2 4.12Å; Q716-F757 HydrophobicContact CG-CD1 4.45Å; Q716-F757 HydrophobicContact CG-CE1 3.92Å; Q716-F757 HydrophobicContact CG-CE2 4.36Å; Q716-F757 HydrophobicContact CG-CZ 3.91Å; Q716-F757 VanDerWaalsContact NE2-CZ 3.28Å; D753-F757 HydrophobicContact CB-CE2 4.24Å; D753-F757 WeakPolarHBondContact O-CD2 3.4Å; D753-F757 PolarHBondContact O-N 2.93Å; F755-F757 PolarHBondContact O-N 2.79Å; F757-Y759 VanDerWaalsContact C-N 3.3Å; F757-Y759 HydrophobicContact CB-CD2 3.72Å; F757-Y759 HydrophobicContact CB-CE2 3.94Å; F757-Y759 WeakPolarHBondContact O-CD2 3.38Å; F757-Y759 PolarHBondContact O-N 2.86Å
758	E	88.8	Confident	90.8	Very high	98 Å²	98	23.2 Å²	23.2	46%	0.458	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	32.4	-177.1	-51.6	-175.1	111.1	0	0	115.2	F755 D756 N1035 K1037	F755-E758 WeakPolarHBondContact O-CA 3.13Å; F755-E758 PolarHBondContact O-N 2.96Å; D756-E758 VanDerWaalsContact C-N 3.34Å; D756-E758 PolarHBondContact O-N 2.66Å; E758-N1035 HydrophobicContact CB-CB 4.43Å; E758-N1035 WeakPolarHBondContact O-CB 3.4Å; E758-N1035 PolarHBondContact O-ND2 3.03Å; E758-K1037 WeakPolarHBondContact OE1-CE 3.26Å; E758-K1037 IonicContact OE1-NZ 3.39Å; E758-K1037 PolarHBondContact OE1-NZ 2.95Å; E758-K1037 IonicContact OE2-NZ 3.11Å; E758-K1037 PolarHBondContact OE2-NZ 3.11Å
759	Y	90.7	Very high	90.4	Very high	19 Å²	19	24 Å²	24	8%	0.075	12%	0.12	C	C	.	.			trans	-79.7	150.5	174.1	-82.2	-110	0	0	0	111.8	L715 P725 N726 A754 F757	L715-Y759 HydrophobicContact CB-CE2 4.38Å; L715-Y759 HydrophobicContact CD2-CD1 3.98Å; L715-Y759 HydrophobicContact CD2-CD2 4.13Å; L715-Y759 HydrophobicContact CD2-CE1 3.93Å; L715-Y759 HydrophobicContact CD2-CE2 4.06Å; L715-Y759 HydrophobicContact CD2-CG 4.1Å; L715-Y759 PolarHBondContact O-OH 2.64Å; P725-Y759 HydrophobicContact CB-CE1 3.99Å; P725-Y759 HydrophobicContact CG-CE1 4.01Å; N726-Y759 VanDerWaalsContact C-CD1 3.49Å; A754-Y759 WeakPolarHBondContact O-CB 3.37Å; A754-Y759 PolarHBondContact O-N 2.76Å; F757-Y759 VanDerWaalsContact C-N 3.3Å; F757-Y759 HydrophobicContact CB-CD2 3.72Å; F757-Y759 HydrophobicContact CB-CE2 3.94Å; F757-Y759 WeakPolarHBondContact O-CD2 3.38Å; F757-Y759 PolarHBondContact O-N 2.86Å
760	G	92.1	Very high	90.2	Very high	2 Å²	2	24.5 Å²	24.5	2%	0.021	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	130.4	159.2	0	0	0	0	0	110	N726 T727 L728 R1033	N726-G760 PolarHBondContact O-N 2.96Å; T727-G760 CarbonylContact C-O 3.58Å; T727-G760 WeakPolarHBondContact CA-O 3.21Å; T727-G760 WeakPolarHBondContact CG2-O 3.47Å; L728-G760 PolarHBondContact N-O 3.33Å; G760-R1033 CarbonylContact C-O 3.46Å; G760-R1033 VanDerWaalsContact CA-O 3.24Å; G760-R1033 WeakPolarHBondContact CA-O 3.26Å
761	T	93.4	Very high	89.9	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	128	-174.8	-61.4	0	0	0	0	111.2	L751 F755 V763 L1002 V1032 R1033	L751-T761 HydrophobicContact CD2-CG2 3.54Å; F755-T761 HydrophobicContact CE1-CG2 4.44Å; T761-V763 HydrophobicContact CG2-CG2 4.41Å; T761-L1002 HydrophobicContact CG2-CD2 4.23Å; T761-V1032 WeakPolarHBondContact O-CA 3.25Å; T761-R1033 PolarHBondContact N-O 3.48Å; T761-R1033 PolarHBondContact O-N 3.27Å
762	L	95.6	Very high	89.7	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.5	177.9	-53	179	0	0	0	110.8	I635 T727 L728 M729 I730 L871 M1030 L1031 V1032	I635-L762 HydrophobicContact CD1-CD1 4.48Å; T727-L762 HydrophobicContact CG2-CD1 3.53Å; T727-L762 HydrophobicContact CG2-CD2 4.41Å; T727-L762 HydrophobicContact CG2-CG 3.63Å; L728-L762 PolarHBondContact O-N 3.26Å; M729-L762 WeakPolarHBondContact CA-O 3.5Å; M729-L762 HydrophobicContact CB-CB 4.14Å; M729-L762 HydrophobicContact CB-CD1 4.33Å; M729-L762 HydrophobicContact CG-CB 4.03Å; M729-L762 HydrophobicContact CG-CD1 4.35Å; M729-L762 HydrophobicContact SD-CD1 4.1Å; I730-L762 PolarHBondContact N-O 2.83Å; L762-L871 HydrophobicContact CD1-CD1 3.98Å; L762-L871 HydrophobicContact CD2-CD1 3.47Å; L762-L871 VanDerWaalsContact CD2-CD1 3.47Å; L762-L871 HydrophobicContact CG-CD1 4.38Å; L762-M1030 HydrophobicContact CD1-SD 4.42Å; L762-M1030 HydrophobicContact CD2-SD 4.44Å; L762-L1031 WeakPolarHBondContact CA-O 3.37Å; L762-V1032 HydrophobicContact CD2-CB 4.11Å; L762-V1032 HydrophobicContact CD2-CG1 3.75Å; L762-V1032 HydrophobicContact CD2-CG2 3.74Å
763	V	95.9	Very high	89.3	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.006	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	115.2	174.2	-171.3	0	0	0	0	109.8	I730 F732 Y747 L751 T761 M1030 L1031	I730-V763 HydrophobicContact CD1-CG2 4.19Å; I730-V763 HydrophobicContact CG1-CB 4.43Å; I730-V763 HydrophobicContact CG1-CG1 4.28Å; I730-V763 HydrophobicContact CG1-CG2 3.95Å; I730-V763 WeakPolarHBondContact O-CA 3.39Å; F732-V763 HydrophobicContact CB-CG1 4.05Å; F732-V763 HydrophobicContact CD2-CG1 4.15Å; Y747-V763 WeakPolarHBondContact OH-CG1 3.32Å; L751-V763 HydrophobicContact CD2-CG2 3.87Å; T761-V763 HydrophobicContact CG2-CG2 4.41Å; V763-M1030 WeakPolarHBondContact O-CA 3.46Å; V763-L1031 HydrophobicContact CB-CB 4.2Å; V763-L1031 HydrophobicContact CB-CD1 4.35Å; V763-L1031 PolarHBondContact N-O 2.78Å; V763-L1031 PolarHBondContact O-N 3.3Å
764	L	95.4	Very high	88.8	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	127.7	177.8	179.5	65.3	0	0	0	111.1	L648 L651 I730 F732 L770 F847	L648-L764 HydrophobicContact CD1-CB 3.72Å; L648-L764 HydrophobicContact CD1-CD2 3.76Å; L648-L764 HydrophobicContact CD1-CG 4.37Å; L651-L764 HydrophobicContact CD2-CD1 3.79Å; L651-L764 HydrophobicContact CD2-CD2 4.03Å; L651-L764 HydrophobicContact CD2-CG 4.48Å; I730-L764 PolarHBondContact O-N 2.84Å; F732-L764 WeakPolarHBondContact CB-O 3.38Å; F732-L764 PolarHBondContact N-O 2.95Å; L764-L770 HydrophobicContact CB-CD1 4.31Å; L764-L770 HydrophobicContact CD2-CD1 4.28Å; L764-L770 HydrophobicContact CD2-CD2 3.85Å; L764-L770 HydrophobicContact CG-CD1 4.22Å; L764-L770 HydrophobicContact CG-CD2 4.36Å; L764-L770 VanDerWaalsContact O-CD1 3.26Å; L764-L770 WeakPolarHBondContact O-CD1 3.24Å; L764-F847 HydrophobicContact CD2-CE2 4.22Å
765	R	93.9	Very high	88.2	Confident	26 Å²	26	32.9 Å²	32.9	10%	0.098	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.5	169.3	-174.7	178.9	178.2	157	4.1	111.5	F732 D1020 T1023 I1029	F732-R765 HydrophobicContact CB-CB 3.79Å; F732-R765 HydrophobicContact CB-CG 4.09Å; F732-R765 HydrophobicContact CD1-CG 3.98Å; F732-R765 HydrophobicContact CG-CB 4.22Å; F732-R765 HydrophobicContact CG-CG 4.19Å; R765-D1020 IonicContact CZ-OD1 3.49Å; R765-D1020 VanDerWaalsContact CZ-OD1 3.29Å; R765-D1020 PolarHBondContact NH1-O 2.82Å; R765-D1020 IonicContact NH1-OD1 2.73Å; R765-D1020 PolarHBondContact NH1-OD1 2.94Å; R765-D1020 IonicContact NH2-OD1 3.53Å; R765-D1020 PolarHBondContact NH2-OD1 3.02Å; R765-T1023 WeakPolarHBondContact CD-O 3.45Å; R765-T1023 WeakPolarHBondContact CD-OG1 3.28Å; R765-T1023 PolarHBondContact NE-O 2.95Å; R765-T1023 PolarHBondContact NH1-O 2.84Å; R765-T1023 PolarHBondContact NH1-OG1 2.88Å; R765-I1029 HydrophobicContact CB-CG2 3.89Å; R765-I1029 PolarHBondContact N-O 3.07Å; R765-I1029 PolarHBondContact O-N 3.1Å; R765-I1029 VanDerWaalsContact O-N 3.15Å
766	M	90.1	Very high	87.6	Confident	6 Å²	6	33.7 Å²	33.7	3%	0.03	17%	0.174	C	C	.	.			trans	-138.6	143.3	171.6	-65.9	-174.3	66.9	0	0	109.9	A647 Q768 G769 L770 A843 Q846 F847 P1028	A647-M766 HydrophobicContact CB-SD 4.01Å; M766-Q768 VanDerWaalsContact C-N 3.29Å; M766-Q768 PolarHBondContact O-N 2.84Å; M766-G769 PolarHBondContact O-N 3.25Å; M766-G769 VanDerWaalsContact O-N 3.14Å; M766-L770 HydrophobicContact CB-CD2 4.42Å; M766-L770 HydrophobicContact CG-CD2 3.99Å; M766-L770 HydrophobicContact SD-CD2 3.59Å; M766-L770 VanDerWaalsContact SD-CD2 3.59Å; M766-A843 HydrophobicContact CE-CB 4.03Å; M766-Q846 HydrophobicContact CE-CB 4.42Å; M766-Q846 VanDerWaalsContact CE-OE1 3.32Å; M766-F847 HydrophobicContact CE-CE2 4.5Å; M766-F847 HydrophobicContact SD-CE2 3.85Å; M766-F847 HydrophobicContact SD-CZ 4.44Å; M766-P1028 HydrophobicContact CE-CG 4.35Å; M766-P1028 HydrophobicContact CG-CB 4.23Å
767	N	84.5	Confident	87.1	Confident	68 Å²	68	35.6 Å²	35.6	36%	0.364	18%	0.18	S	C	.	.	S	Bend	trans	-68.8	-22.8	-172.5	-70.8	-13.8	0	0	0	114.8	R734 L1026	R734-N767 PolarHBondContact NH1-O 2.96Å; N767-L1026 VanDerWaalsContact CG-O 3.31Å; N767-L1026 PolarHBondContact ND2-O 2.85Å; N767-L1026 PolarHBondContact OD1-O 2.86Å
768	Q	83.3	Confident	86.4	Confident	83 Å²	83	35.7 Å²	35.7	39%	0.388	18%	0.182	S	C	.	.	S	Bend	trans	-80.4	-34.1	174.7	-64.2	78.9	-0.2	0	0	110.9	R734 M766 L840 A843	R734-Q768 PolarHBondContact NH1-O 2.67Å; R734-Q768 VanDerWaalsContact NH1-O 3.09Å; M766-Q768 VanDerWaalsContact C-N 3.29Å; M766-Q768 PolarHBondContact O-N 2.84Å; Q768-L840 HydrophobicContact CB-CD1 4.24Å; Q768-A843 HydrophobicContact CB-CB 3.83Å; Q768-A843 HydrophobicContact CG-CB 3.69Å
769	G	84.3	Confident	85.7	Confident	17 Å²	17	37 Å²	37	18%	0.175	19%	0.188	C	C	.	.			trans	119.2	178.6	-164.2	0	0	0	0	0	110.7	M766	M766-G769 PolarHBondContact O-N 3.25Å; M766-G769 VanDerWaalsContact O-N 3.14Å
770	L	86.3	Confident	84.9	Confident	16 Å²	16	39.2 Å²	39.2	8%	0.084	20%	0.199	C	C	.	.	S	Bend	trans	-125	-18	178.1	-77.2	172.7	0	0	0	113.7	R645 A647 L648 G731 L764 M766	R645-L770 WeakPolarHBondContact CA-O 3.47Å; A647-L770 HydrophobicContact CB-CD2 3.91Å; L648-L770 HydrophobicContact CD1-CD1 4.49Å; G731-L770 VanDerWaalsContact CA-CD1 3.48Å; L764-L770 HydrophobicContact CB-CD1 4.31Å; L764-L770 HydrophobicContact CD2-CD1 4.28Å; L764-L770 HydrophobicContact CD2-CD2 3.85Å; L764-L770 HydrophobicContact CG-CD1 4.22Å; L764-L770 HydrophobicContact CG-CD2 4.36Å; L764-L770 VanDerWaalsContact O-CD1 3.26Å; L764-L770 WeakPolarHBondContact O-CD1 3.24Å; M766-L770 HydrophobicContact CB-CD2 4.42Å; M766-L770 HydrophobicContact CG-CD2 3.99Å; M766-L770 HydrophobicContact SD-CD2 3.59Å; M766-L770 VanDerWaalsContact SD-CD2 3.59Å
771	D	86.9	Confident	84.2	Confident	51 Å²	51	45.6 Å²	45.6	27%	0.273	23%	0.229	S	C	.	.			trans	-95.7	137.1	-172.5	-138.2	-42	0	0	0	111.6	A644 R645 S773 L840	A644-D771 CarbonylContact O-C 3.56Å; A644-D771 WeakPolarHBondContact O-CA 3.34Å; R645-D771 IonicContact CZ-OD2 3.93Å; R645-D771 IonicContact NE-OD2 3.52Å; R645-D771 PolarHBondContact NE-OD2 2.75Å; R645-D771 IonicContact NH2-OD2 3.5Å; R645-D771 PolarHBondContact NH2-OD2 2.8Å; D771-S773 PolarHBondContact OD1-N 2.91Å; D771-L840 WeakPolarHBondContact O-CD2 3.45Å
772	V	86.1	Confident	83.2	Confident	9 Å²	9	51.8 Å²	51.8	6%	0.055	26%	0.259	C	S	.	.			trans	-134.7	21	176	-66.7	0	0	0	0	111.9	A644 P646 H774 L775 V776 L840	A644-V772 VanDerWaalsContact O-CG2 3.25Å; A644-V772 WeakPolarHBondContact O-CG2 3.48Å; A644-V772 PolarHBondContact O-N 3Å; P646-V772 HydrophobicContact CG-CG2 4.38Å; V772-H774 VanDerWaalsContact C-N 3.33Å; V772-H774 PolarHBondContact O-N 3.11Å; V772-L775 HydrophobicContact CB-CD1 4.41Å; V772-L775 HydrophobicContact CG1-CD1 4.32Å; V772-L775 PolarHBondContact O-N 3Å; V772-L775 VanDerWaalsContact O-N 3.16Å; V772-V776 HydrophobicContact CG2-CG2 4.38Å; V772-V776 WeakPolarHBondContact O-CG2 3.36Å; V772-V776 PolarHBondContact O-N 2.62Å; V772-L840 HydrophobicContact CG1-CD1 4.48Å; V772-L840 HydrophobicContact CG1-CD2 4.15Å; V772-L840 HydrophobicContact CG1-CG 3.82Å
773	S	82.9	Confident	82.1	Confident	40 Å²	40	56.4 Å²	56.4	28%	0.28	28%	0.283	S	S	.	.	H	α-helix	trans	-51	-49.2	-178.7	68.9	0	0	0	0	112.6	D771 L775 V776 E777	D771-S773 PolarHBondContact OD1-N 2.91Å; S773-L775 VanDerWaalsContact C-N 3.29Å; S773-L775 PolarHBondContact O-N 2.88Å; S773-V776 WeakPolarHBondContact O-CA 3.45Å; S773-V776 WeakPolarHBondContact O-CB 3.5Å; S773-V776 PolarHBondContact O-N 3.02Å; S773-E777 WeakPolarHBondContact CB-OE1 3.09Å; S773-E777 VanDerWaalsContact O-CD 3.32Å; S773-E777 WeakPolarHBondContact O-CG 3.43Å; S773-E777 PolarHBondContact O-N 2.98Å
774	H	79.3	Confident	81.2	Confident	68 Å²	68	62.3 Å²	62.3	32%	0.315	31%	0.309	S	S	.	.	H	α-helix	trans	-57.1	-39.1	-179.4	65.7	-67.2	0	0	0	113.1	V772 E777 E778 N837	V772-H774 VanDerWaalsContact C-N 3.33Å; V772-H774 PolarHBondContact O-N 3.11Å; H774-E777 PolarHBondContact O-N 2.85Å; H774-E778 WeakPolarHBondContact O-CB 3.47Å; H774-E778 VanDerWaalsContact O-CG 3.29Å; H774-E778 WeakPolarHBondContact O-CG 3.39Å; H774-E778 PolarHBondContact O-N 3.43Å; H774-N837 PolarHBondContact NE2-OD1 2.84Å
775	L	77.9	Confident	80.2	Confident	32 Å²	32	64.8 Å²	64.8	17%	0.168	33%	0.329	C	S	.	.	H	α-helix	trans	-72.8	-31	178	-57.5	178.1	0	0	0	112.5	V772 S773 E779 N837 V841	V772-L775 HydrophobicContact CB-CD1 4.41Å; V772-L775 HydrophobicContact CG1-CD1 4.32Å; V772-L775 PolarHBondContact O-N 3Å; V772-L775 VanDerWaalsContact O-N 3.16Å; S773-L775 VanDerWaalsContact C-N 3.29Å; S773-L775 PolarHBondContact O-N 2.88Å; L775-E779 WeakPolarHBondContact O-CB 3.37Å; L775-E779 PolarHBondContact O-N 3.47Å; L775-N837 HydrophobicContact CD1-CB 4.08Å; L775-N837 HydrophobicContact CD2-CB 4.05Å; L775-V841 HydrophobicContact CD1-CG2 3.49Å; L775-V841 VanDerWaalsContact CD1-CG2 3.49Å
776	V	76	Confident	79.3	Confident	27 Å²	27	65.8 Å²	65.8	16%	0.164	34%	0.343	C	S	.	.	H	α-helix	trans	-75.7	-35.4	176.1	175.3	0	0	0	0	110.7	R643 V772 S773 E780	R643-V776 HydrophobicContact CB-CG1 4.16Å; R643-V776 HydrophobicContact CB-CG2 4.21Å; V772-V776 HydrophobicContact CG2-CG2 4.38Å; V772-V776 WeakPolarHBondContact O-CG2 3.36Å; V772-V776 PolarHBondContact O-N 2.62Å; S773-V776 WeakPolarHBondContact O-CA 3.45Å; S773-V776 WeakPolarHBondContact O-CB 3.5Å; S773-V776 PolarHBondContact O-N 3.02Å; V776-E780 WeakPolarHBondContact O-CG 3.3Å; V776-E780 PolarHBondContact O-N 2.83Å
777	E	77.5	Confident	78.5	Confident	114 Å²	114	71.7 Å²	71.7	53%	0.533	37%	0.369	S	S	.	.	H	α-helix	trans	-66.6	-50.8	173.4	-73.2	147.1	-152.8	0	0	110.6	S773 H774 E779 E780 E781	S773-E777 WeakPolarHBondContact CB-OE1 3.09Å; S773-E777 VanDerWaalsContact O-CD 3.32Å; S773-E777 WeakPolarHBondContact O-CG 3.43Å; S773-E777 PolarHBondContact O-N 2.98Å; H774-E777 PolarHBondContact O-N 2.85Å; E777-E779 VanDerWaalsContact C-N 3.3Å; E777-E779 PolarHBondContact O-N 2.84Å; E777-E780 PolarHBondContact O-N 3.43Å; E777-E780 VanDerWaalsContact O-N 3.15Å; E777-E781 PolarHBondContact O-N 3.44Å
778	E	74.4	Confident	78.1	Confident	72 Å²	72	73.1 Å²	73.1	34%	0.336	37%	0.373	S	S	.	.	H	α-helix	trans	-54.9	-41.8	172	-74.8	173.3	-178.8	0	0	112.3	H774 M782	H774-E778 WeakPolarHBondContact O-CB 3.47Å; H774-E778 VanDerWaalsContact O-CG 3.29Å; H774-E778 WeakPolarHBondContact O-CG 3.39Å; H774-E778 PolarHBondContact O-N 3.43Å; E778-M782 HydrophobicContact CB-CE 4.49Å; E778-M782 WeakPolarHBondContact O-CB 3.32Å; E778-M782 WeakPolarHBondContact O-CE 3.47Å; E778-M782 WeakPolarHBondContact O-CG 3.4Å; E778-M782 PolarHBondContact O-N 2.89Å
779	E	73.6	Confident	77.6	Confident	127 Å²	127	74.6 Å²	74.6	59%	0.593	38%	0.38	S	S	*	.	H	α-helix	trans	-66.9	-42.3	176.2	-170.9	-177.1	-166.1	0	0	112.2	L775 E777 L783	L775-E779 WeakPolarHBondContact O-CB 3.37Å; L775-E779 PolarHBondContact O-N 3.47Å; E777-E779 VanDerWaalsContact C-N 3.3Å; E777-E779 PolarHBondContact O-N 2.84Å; E779-L783 VanDerWaalsContact O-CB 3.23Å; E779-L783 WeakPolarHBondContact O-CB 3.47Å; E779-L783 PolarHBondContact O-N 2.98Å
780	E	73.1	Confident	76.9	Confident	64 Å²	64	82 Å²	82	30%	0.299	40%	0.403	S	S	.	.	H	α-helix	trans	-69.4	-36.2	178.1	-74.3	-157	150.5	0	0	112.6	R643 R685 V776 E777 L783 K784	R643-E780 IonicContact CZ-OE1 3.86Å; R643-E780 IonicContact NH1-OE1 3.55Å; R643-E780 PolarHBondContact NH1-OE1 3.42Å; R643-E780 IonicContact NH2-OE1 3.52Å; R643-E780 PolarHBondContact NH2-OE1 3.47Å; R685-E780 IonicContact CZ-OE2 3.82Å; R685-E780 VanDerWaalsContact NH1-CD 3.26Å; R685-E780 IonicContact NH1-OE1 2.74Å; R685-E780 PolarHBondContact NH1-OE1 3.5Å; R685-E780 VanDerWaalsContact NH1-OE1 3.08Å; R685-E780 IonicContact NH1-OE2 3.29Å; R685-E780 PolarHBondContact NH1-OE2 3.46Å; R685-E780 IonicContact NH2-OE2 3.2Å; V776-E780 WeakPolarHBondContact O-CG 3.3Å; V776-E780 PolarHBondContact O-N 2.83Å; E777-E780 PolarHBondContact O-N 3.43Å; E777-E780 VanDerWaalsContact O-N 3.15Å; E780-L783 PolarHBondContact O-N 2.86Å; E780-K784 VanDerWaalsContact O-CB 3.29Å; E780-K784 WeakPolarHBondContact O-CB 3.48Å; E780-K784 PolarHBondContact O-N 3.4Å
781	E	76.8	Confident	76.3	Confident	137 Å²	137	83.5 Å²	83.5	64%	0.64	42%	0.417	S	S	*	.	H	α-helix	trans	-67	-47.4	173.9	-70.7	-159	148.9	0	0	112.2	E777 L783 K784 A785	E777-E781 PolarHBondContact O-N 3.44Å; E781-L783 VanDerWaalsContact C-N 3.3Å; E781-L783 PolarHBondContact O-N 3.47Å; E781-K784 WeakPolarHBondContact O-CB 3.21Å; E781-K784 PolarHBondContact O-N 3.32Å; E781-K784 VanDerWaalsContact O-N 3.12Å; E781-A785 PolarHBondContact O-N 3.04Å
782	M	73.8	Confident	75.5	Confident	129 Å²	129	85.7 Å²	85.7	64%	0.635	43%	0.428	S	S	*	.	H	α-helix	trans	-59.6	-40.5	174.3	-77	-170.6	-75	0	0	111.9	E778 K784 A786	E778-M782 HydrophobicContact CB-CE 4.49Å; E778-M782 WeakPolarHBondContact O-CB 3.32Å; E778-M782 WeakPolarHBondContact O-CE 3.47Å; E778-M782 WeakPolarHBondContact O-CG 3.4Å; E778-M782 PolarHBondContact O-N 2.89Å; M782-K784 VanDerWaalsContact C-N 3.33Å; M782-A786 VanDerWaalsContact O-CB 3.23Å; M782-A786 WeakPolarHBondContact O-CB 3.36Å; M782-A786 PolarHBondContact O-N 3.21Å
783	L	72.4	Confident	74.7	Confident	97 Å²	97	89.6 Å²	89.6	51%	0.508	45%	0.449	S	S	.	.	H	α-helix	trans	-68.4	-31.9	176.8	-165.1	86.3	0	0	0	112.3	E779 E780 E781 K787	E779-L783 VanDerWaalsContact O-CB 3.23Å; E779-L783 WeakPolarHBondContact O-CB 3.47Å; E779-L783 PolarHBondContact O-N 2.98Å; E780-L783 PolarHBondContact O-N 2.86Å; E781-L783 VanDerWaalsContact C-N 3.3Å; E781-L783 PolarHBondContact O-N 3.47Å; L783-K787 VanDerWaalsContact O-CG 3.29Å; L783-K787 WeakPolarHBondContact O-CG 3.32Å; L783-K787 PolarHBondContact O-N 3.25Å
784	K	76.8	Confident	73.8	Confident	125 Å²	125	93.8 Å²	93.8	54%	0.543	47%	0.468	S	S	.	.	H	α-helix	trans	-69.5	-53	175.1	-178.1	-177.1	170.3	-170	0	110.5	E780 E781 M782 A786 K787 E788	E780-K784 VanDerWaalsContact O-CB 3.29Å; E780-K784 WeakPolarHBondContact O-CB 3.48Å; E780-K784 PolarHBondContact O-N 3.4Å; E781-K784 WeakPolarHBondContact O-CB 3.21Å; E781-K784 PolarHBondContact O-N 3.32Å; E781-K784 VanDerWaalsContact O-N 3.12Å; M782-K784 VanDerWaalsContact C-N 3.33Å; K784-A786 VanDerWaalsContact C-N 3.29Å; K784-A786 PolarHBondContact O-N 2.88Å; K784-K787 WeakPolarHBondContact O-CA 3.18Å; K784-K787 WeakPolarHBondContact O-CB 3.44Å; K784-K787 PolarHBondContact O-N 3.34Å; K784-E788 WeakPolarHBondContact CE-OE1 3.5Å; K784-E788 WeakPolarHBondContact CG-OE1 3.38Å; K784-E788 PolarHBondContact O-N 3.17Å
785	A	75	Confident	73.1	Confident	53 Å²	53	97.6 Å²	97.6	44%	0.438	49%	0.486	S	S	.	.	H	α-helix	trans	-56.3	-42.5	175.5	0	0	0	0	0	111.9	E781 K787 E788 Q789	E781-A785 PolarHBondContact O-N 3.04Å; A785-K787 VanDerWaalsContact C-N 3.26Å; A785-K787 PolarHBondContact O-N 2.84Å; A785-E788 PolarHBondContact O-N 2.93Å; A785-Q789 WeakPolarHBondContact O-CB 3.35Å; A785-Q789 PolarHBondContact O-N 3.15Å
786	A	73.9	Confident	71.9	Confident	46 Å²	46	103.8 Å²	103.8	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-68.3	-18.6	176.5	0	0	0	0	0	114.5	M782 K784 R790	M782-A786 VanDerWaalsContact O-CB 3.23Å; M782-A786 WeakPolarHBondContact O-CB 3.36Å; M782-A786 PolarHBondContact O-N 3.21Å; K784-A786 VanDerWaalsContact C-N 3.29Å; K784-A786 PolarHBondContact O-N 2.88Å; A786-R790 WeakPolarHBondContact O-CD 3.28Å; A786-R790 VanDerWaalsContact O-CG 3.25Å; A786-R790 WeakPolarHBondContact O-CG 3.47Å
787	K	73.3	Confident	70.9	Confident	131 Å²	131	110.1 Å²	110.1	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-84.6	-41.5	169.6	-75.2	168	-176.7	172.6	0	111.6	L783 K784 A785 R790 A791	L783-K787 VanDerWaalsContact O-CG 3.29Å; L783-K787 WeakPolarHBondContact O-CG 3.32Å; L783-K787 PolarHBondContact O-N 3.25Å; K784-K787 WeakPolarHBondContact O-CA 3.18Å; K784-K787 WeakPolarHBondContact O-CB 3.44Å; K784-K787 PolarHBondContact O-N 3.34Å; A785-K787 VanDerWaalsContact C-N 3.26Å; A785-K787 PolarHBondContact O-N 2.84Å; K787-R790 CarbonylContact O-C 3.59Å; K787-R790 PolarHBondContact O-N 2.88Å; K787-R790 VanDerWaalsContact O-N 3.16Å; K787-A791 PolarHBondContact O-N 3.46Å
788	E	77.5	Confident	69.3	Low	98 Å²	98	109.4 Å²	109.4	46%	0.458	55%	0.551	S	S	.	*	H	α-helix	trans	-64.4	-43.1	178.6	-71.8	165.3	175.7	0	0	110.6	K784 A785 R790 A791 L792	K784-E788 WeakPolarHBondContact CE-OE1 3.5Å; K784-E788 WeakPolarHBondContact CG-OE1 3.38Å; K784-E788 PolarHBondContact O-N 3.17Å; A785-E788 PolarHBondContact O-N 2.93Å; E788-R790 VanDerWaalsContact C-N 3.3Å; E788-R790 PolarHBondContact O-N 3.46Å; E788-A791 WeakPolarHBondContact O-CB 3.49Å; E788-A791 PolarHBondContact O-N 2.86Å; E788-A791 VanDerWaalsContact O-N 3.08Å; E788-L792 WeakPolarHBondContact O-CG 3.45Å; E788-L792 PolarHBondContact O-N 3.18Å
789	Q	72.9	Confident	67.6	Low	114 Å²	114	113.9 Å²	113.9	53%	0.533	58%	0.577	S	S	.	*	H	α-helix	trans	-55.8	-43.7	170.1	-166.1	68.5	44.6	0	0	112	A785 L792 D793	A785-Q789 WeakPolarHBondContact O-CB 3.35Å; A785-Q789 PolarHBondContact O-N 3.15Å; Q789-L792 PolarHBondContact O-N 2.68Å; Q789-D793 PolarHBondContact O-N 2.82Å
790	R	69.6	Low	66.2	Low	173 Å²	173	112 Å²	112	65%	0.653	59%	0.592	S	S	*	*	H	α-helix	trans	-72.3	-25.6	176.6	-73.4	175.3	-175.9	-177.5	4.1	113.6	A786 K787 E788 N794	A786-R790 WeakPolarHBondContact O-CD 3.28Å; A786-R790 VanDerWaalsContact O-CG 3.25Å; A786-R790 WeakPolarHBondContact O-CG 3.47Å; K787-R790 CarbonylContact O-C 3.59Å; K787-R790 PolarHBondContact O-N 2.88Å; K787-R790 VanDerWaalsContact O-N 3.16Å; E788-R790 VanDerWaalsContact C-N 3.3Å; E788-R790 PolarHBondContact O-N 3.46Å; R790-N794 PolarHBondContact O-N 3.01Å; R790-N794 PolarHBondContact O-ND2 3.21Å
791	A	71.7	Confident	64.2	Low	47 Å²	47	112.2 Å²	112.2	39%	0.388	61%	0.611	S	S	.	*	H	α-helix	trans	-68.9	-49.4	172.5	0	0	0	0	0	109	K787 E788 D793 N794 E795	K787-A791 PolarHBondContact O-N 3.46Å; E788-A791 WeakPolarHBondContact O-CB 3.49Å; E788-A791 PolarHBondContact O-N 2.86Å; E788-A791 VanDerWaalsContact O-N 3.08Å; A791-D793 PolarHBondContact O-N 2.96Å; A791-N794 PolarHBondContact O-N 2.73Å; A791-N794 VanDerWaalsContact O-N 3.07Å; A791-E795 WeakPolarHBondContact O-CG 3.27Å; A791-E795 PolarHBondContact O-N 3.45Å
792	L	70.9	Confident	62.7	Low	96 Å²	96	115.9 Å²	115.9	50%	0.503	63%	0.625	S	S	.	*	H	α-helix	trans	-56.1	-48.5	173.7	-67.6	164.9	0	0	0	111.8	E788 Q789 N794 E795 M796	E788-L792 WeakPolarHBondContact O-CG 3.45Å; E788-L792 PolarHBondContact O-N 3.18Å; Q789-L792 PolarHBondContact O-N 2.68Å; L792-N794 PolarHBondContact O-N 3.35Å; L792-E795 PolarHBondContact O-N 3.42Å; L792-M796 VanDerWaalsContact O-CB 3.31Å; L792-M796 WeakPolarHBondContact O-CB 3.32Å; L792-M796 PolarHBondContact O-N 2.95Å
793	D	68.6	Low	60.7	Low	92 Å²	92	116.2 Å²	116.2	49%	0.492	63%	0.634	S	S	.	*	H	α-helix	trans	-57.8	-30.4	176.8	-68.9	-23.1	0	0	0	113.2	Q789 A791	Q789-D793 PolarHBondContact O-N 2.82Å; A791-D793 PolarHBondContact O-N 2.96Å
794	N	65.8	Low	59.2	Low	127 Å²	127	122.2 Å²	122.2	68%	0.679	66%	0.656	S	S	*	*	H	α-helix	trans	-84	-38.2	176.6	-79.3	-66.9	0	0	0	112.5	R790 A791 L792 M796 M797	R790-N794 PolarHBondContact O-N 3.01Å; R790-N794 PolarHBondContact O-ND2 3.21Å; A791-N794 PolarHBondContact O-N 2.73Å; A791-N794 VanDerWaalsContact O-N 3.07Å; L792-N794 PolarHBondContact O-N 3.35Å; N794-M796 VanDerWaalsContact C-N 3.29Å; N794-M796 PolarHBondContact O-N 3.49Å; N794-M797 PolarHBondContact O-N 3.21Å
795	E	63.4	Low	57.1	Low	149 Å²	149	119.6 Å²	119.6	70%	0.696	67%	0.665	S	S	*	*	H	α-helix	trans	-67.9	-30.1	176.1	-72.6	-178.4	169.9	0	0	112.1	A791 L792 M797	A791-E795 WeakPolarHBondContact O-CG 3.27Å; A791-E795 PolarHBondContact O-N 3.45Å; L792-E795 PolarHBondContact O-N 3.42Å; E795-M797 PolarHBondContact O-N 3.35Å; E795-M797 VanDerWaalsContact O-N 3.15Å
796	M	53	Low	55.4	Low	162 Å²	162	124.7 Å²	124.7	80%	0.798	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	4.8	177.4	-144.2	161.3	-163.7	0	0	113.9	L792 N794 P798	L792-M796 VanDerWaalsContact O-CB 3.31Å; L792-M796 WeakPolarHBondContact O-CB 3.32Å; L792-M796 PolarHBondContact O-N 2.95Å; N794-M796 VanDerWaalsContact C-N 3.29Å; N794-M796 PolarHBondContact O-N 3.49Å; M796-P798 WeakPolarHBondContact O-CD 3.29Å
797	M	54.6	Low	53.4	Low	160 Å²	160	132.8 Å²	132.8	79%	0.788	71%	0.711	S	S	*	*			trans	-117.9	57.8	176	-77	-71.1	-75	0	0	113.8	N794 E795	N794-M797 PolarHBondContact O-N 3.21Å; E795-M797 PolarHBondContact O-N 3.35Å; E795-M797 VanDerWaalsContact O-N 3.15Å
798	P	45.2	Very low	51.7	Low	99 Å²	99	138.3 Å²	138.3	64%	0.643	73%	0.729	S	S	*	*			trans	-73.9	141.8	173.4	32.5	-34.5	0	0	0	112.1	M796	M796-P798 WeakPolarHBondContact O-CD 3.29Å
799	N	38.9	Very low	49.6	Very low	165 Å²	165	143.2 Å²	143.2	88%	0.882	75%	0.749	S	S	*	*	S	Bend	trans	63.5	113.5	174.7	-67.8	-32.9	0	0	0	117.9	G801	N799-G801 PolarHBondContact O-N 3.1Å
800	G	43	Very low	47.9	Very low	87 Å²	87	143 Å²	143	90%	0.897	76%	0.76	S	S	*	*			trans	-77.1	100.2	171.8	0	0	0	0	0	113.5
801	G	32.2	Very low	46	Very low	69 Å²	69	146.4 Å²	146.4	71%	0.711	77%	0.772	S	S	*	*			trans	-80.6	126.4	163.5	0	0	0	0	0	111.8	N799 T803	N799-G801 PolarHBondContact O-N 3.1Å; G801-T803 PolarHBondContact O-N 3.16Å
802	K	45	Very low	44	Very low	215 Å²	215	152.6 Å²	152.6	94%	0.935	79%	0.793	S	S	*	*			trans	-80.1	103.7	173.2	-75.2	179.6	-180	172.1	0	110.9
803	T	30.2	Very low	42.1	Very low	135 Å²	135	153 Å²	153	83%	0.828	80%	0.804	S	S	*	*			trans	-123.2	123	162.3	39.2	0	0	0	0	110.8	G801 G805	G801-T803 PolarHBondContact O-N 3.16Å; T803-G805 PolarHBondContact O-N 3.31Å
804	K	42.4	Very low	40.1	Very low	223 Å²	223	153.7 Å²	153.7	97%	0.97	82%	0.816	S	S	*	*			trans	-74.1	122.2	166.2	-72.6	-179.1	177.8	178.8	0	107.6
805	G	32.4	Very low	38.9	Very low	71 Å²	71	156.4 Å²	156.4	73%	0.732	82%	0.824	S	S	*	*			trans	-145.2	119.7	173.9	0	0	0	0	0	111.1	T803 F807	T803-G805 PolarHBondContact O-N 3.31Å; G805-F807 PolarHBondContact O-N 3.06Å
806	L	38	Very low	37.4	Very low	160 Å²	160	158 Å²	158	84%	0.838	83%	0.832	S	S	*	*			trans	-67.5	126.4	159.3	-83.5	61.7	0	0	0	107
807	F	32.3	Very low	36.3	Very low	215 Å²	215	156.4 Å²	156.4	94%	0.943	83%	0.831	S	S	*	*			trans	177.8	80.3	138.4	-90.8	-56.2	0	0	0	110.5	G805	G805-F807 PolarHBondContact O-N 3.06Å
808	R	38.3	Very low	35	Very low	248 Å²	248	155.9 Å²	155.9	94%	0.936	83%	0.83	S	S	*	*			trans	-99	95.1	168	-177.3	-174.6	179.7	-171.4	0.4	109.7
809	K	33.3	Very low	34.7	Very low	201 Å²	201	157.8 Å²	157.8	87%	0.874	84%	0.84	S	S	*	*			trans	-158.2	140.1	164.3	-117.4	174.8	-175	-179.2	0	112.6
810	S	36.8	Very low	34.3	Very low	110 Å²	110	155.6 Å²	155.6	77%	0.769	83%	0.833	S	S	*	*			trans	44.3	115.4	160.5	-160.9	0	0	0	0	119.8
811	R	29.3	Very low	34	Very low	243 Å²	243	163.6 Å²	163.6	92%	0.917	84%	0.836	S	S	*	*			trans	-143.3	102.1	133	-122.1	176.9	-176.2	176.9	0.5	110.5
812	H	29.8	Very low	33.9	Very low	178 Å²	178	164.7 Å²	164.7	82%	0.824	84%	0.838	S	S	*	*			trans	-80.1	148.7	159.9	-126.8	-92.9	0	0	0	108.4
813	S	32.3	Very low	33.3	Very low	105 Å²	105	160.8 Å²	160.8	73%	0.734	83%	0.833	S	S	*	*			trans	35.5	110.2	160.6	-163.5	0	0	0	0	119.7
814	S	26.8	Very low	34	Very low	106 Å²	106	160.2 Å²	160.2	74%	0.741	83%	0.834	S	S	*	*			trans	-158.5	114.8	135.2	57.8	0	0	0	0	110.4
815	Q	39.7	Very low	33.8	Very low	183 Å²	183	155 Å²	155	86%	0.855	82%	0.82	S	S	*	*			trans	-73.2	126.5	160.8	-62.3	160.5	-78.1	0	0	108.3
816	Q	31.2	Very low	34.1	Very low	184 Å²	184	156.2 Å²	156.2	86%	0.86	82%	0.817	S	S	*	*			trans	169.8	149.9	146.5	-99.2	168.8	-1.3	0	0	111.7
817	V	29.8	Very low	34.4	Very low	127 Å²	127	151.5 Å²	151.5	77%	0.77	81%	0.806	S	S	*	*			trans	61.2	128.5	171.5	-131.9	0	0	0	0	115
818	L	29.1	Very low	35.4	Very low	149 Å²	149	147.3 Å²	147.3	78%	0.78	80%	0.801	S	S	*	*			cis	-118.9	139.9	19.2	-93.1	77.4	0	0	0	114.1
819	T	38.9	Very low	36.4	Very low	139 Å²	139	138.3 Å²	138.3	85%	0.853	78%	0.775	S	S	*	*			trans	-114.3	94.6	168.3	48.8	0	0	0	0	110.8
820	T	30.1	Very low	38.1	Very low	119 Å²	119	132.6 Å²	132.6	73%	0.73	76%	0.758	S	S	*	*			trans	-146.3	99.1	171.2	33.6	0	0	0	0	112.5
821	R	35.2	Very low	39.5	Very low	256 Å²	256	132.8 Å²	132.8	97%	0.966	76%	0.757	S	S	*	*	S	Bend	trans	50.8	71.5	153.5	-69.9	-177.1	164.4	168.9	-5.1	118.8
822	A	31.9	Very low	41.4	Very low	91 Å²	91	128.9 Å²	128.9	75%	0.752	75%	0.749	S	S	*	*			trans	-155.8	164.1	134.6	0	0	0	0	0	109.3
823	V	32.2	Very low	43.5	Very low	134 Å²	134	123.3 Å²	123.3	81%	0.812	73%	0.727	S	S	*	*			trans	58.2	91.3	176.7	-167.7	0	0	0	0	114.8
824	S	43.9	Very low	45.4	Very low	123 Å²	123	120.2 Å²	120.2	86%	0.86	71%	0.708	S	S	*	*			trans	-122.6	71.9	162.1	173.5	0	0	0	0	109.4
825	V	38.5	Very low	47.7	Very low	112 Å²	112	121.4 Å²	121.4	68%	0.679	70%	0.7	S	S	*	*			trans	-136.8	143.3	167.3	-172.4	0	0	0	0	107.1
826	C	39.1	Very low	49.5	Very low	98 Å²	98	117.6 Å²	117.6	66%	0.662	69%	0.685	S	S	*	*			trans	51.5	83.1	179.2	-65	0	0	0	0	116.2
827	G	43.2	Very low	51.9	Low	60 Å²	60	109.8 Å²	109.8	62%	0.619	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-61.2	159.3	143.5	0	0	0	0	0	110.1
828	P	54.3	Low	54.3	Low	127 Å²	127	110.2 Å²	110.2	83%	0.825	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-56.7	132.9	-176.3	23.7	-33.9	0	0	0	110.8
829	P	59	Low	56.8	Low	59 Å²	59	109 Å²	109	38%	0.383	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-60.4	148.8	-174.9	23.3	-33.4	0	0	0	110.8	V833 A834	P829-V833 HydrophobicContact CB-CB 4.28Å; P829-V833 HydrophobicContact CB-CG1 4.11Å; P829-A834 HydrophobicContact CG-CB 4.41Å
830	P	68.8	Low	58.9	Low	81 Å²	81	103.1 Å²	103.1	53%	0.526	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-49.5	142.3	-178.6	-28.4	34.7	0	0	0	111.5	Q832 V833 A834	P830-Q832 CarbonylContact O-C 3.56Å; P830-Q832 PolarHBondContact O-N 3.29Å; P830-V833 HydrophobicContact CB-CG2 4.26Å; P830-V833 HydrophobicContact CG-CG2 4.38Å; P830-V833 WeakPolarHBondContact O-CA 3.35Å; P830-V833 WeakPolarHBondContact O-CB 3.45Å; P830-V833 PolarHBondContact O-N 2.94Å; P830-A834 PolarHBondContact O-N 3.17Å
831	P	67.5	Low	61.4	Low	114 Å²	114	101.1 Å²	101.1	74%	0.74	58%	0.581	S	S	*	*	H	α-helix	trans	-60.2	-21.4	-168.4	20.8	-33	0	0	0	114.1	K835	P831-K835 WeakPolarHBondContact O-CB 3.24Å; P831-K835 PolarHBondContact O-N 2.98Å
832	Q	67.4	Low	63.7	Low	161 Å²	161	94.7 Å²	94.7	75%	0.752	56%	0.562	S	S	*	*	H	α-helix	trans	-69.9	-45.6	169.6	-64	179.2	-8.5	0	0	112.4	P830 K835 I836	P830-Q832 CarbonylContact O-C 3.56Å; P830-Q832 PolarHBondContact O-N 3.29Å; Q832-K835 PolarHBondContact O-N 3.49Å; Q832-I836 VanDerWaalsContact O-CG1 3.31Å; Q832-I836 WeakPolarHBondContact O-CG1 3.35Å; Q832-I836 PolarHBondContact O-N 2.91Å; Q832-I836 VanDerWaalsContact O-N 3.07Å
833	V	74.3	Confident	66.1	Low	61 Å²	61	90.7 Å²	90.7	37%	0.37	53%	0.529	S	S	.	.	H	α-helix	trans	-65.7	-44.2	177.3	179.8	0	0	0	0	110.6	P829 P830 K835 I836 N837	P829-V833 HydrophobicContact CB-CB 4.28Å; P829-V833 HydrophobicContact CB-CG1 4.11Å; P830-V833 HydrophobicContact CB-CG2 4.26Å; P830-V833 HydrophobicContact CG-CG2 4.38Å; P830-V833 WeakPolarHBondContact O-CA 3.35Å; P830-V833 WeakPolarHBondContact O-CB 3.45Å; P830-V833 PolarHBondContact O-N 2.94Å; V833-K835 VanDerWaalsContact C-N 3.29Å; V833-K835 PolarHBondContact O-N 3.07Å; V833-I836 WeakPolarHBondContact O-CB 3.29Å; V833-I836 PolarHBondContact O-N 3.27Å; V833-N837 PolarHBondContact O-N 3.22Å
834	A	71.7	Confident	68.5	Low	41 Å²	41	85.1 Å²	85.1	34%	0.339	50%	0.496	S	S	.	.	H	α-helix	trans	-55.1	-44.5	174.7	0	0	0	0	0	112	P829 P830 I836 N837 E838	P829-A834 HydrophobicContact CG-CB 4.41Å; P830-A834 PolarHBondContact O-N 3.17Å; A834-I836 VanDerWaalsContact C-N 3.31Å; A834-I836 PolarHBondContact O-N 3.3Å; A834-N837 PolarHBondContact O-N 2.77Å; A834-E838 WeakPolarHBondContact O-CB 3.25Å; A834-E838 PolarHBondContact O-N 3.42Å
835	K	76.7	Confident	70.4	Confident	130 Å²	130	80.1 Å²	80.1	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-72.1	-19.9	177.9	-165.2	170.8	-170.7	170.3	0	114	P831 Q832 V833 K839	P831-K835 WeakPolarHBondContact O-CB 3.24Å; P831-K835 PolarHBondContact O-N 2.98Å; Q832-K835 PolarHBondContact O-N 3.49Å; V833-K835 VanDerWaalsContact C-N 3.29Å; V833-K835 PolarHBondContact O-N 3.07Å; K835-K839 WeakPolarHBondContact O-CG 3.2Å
836	I	76.4	Confident	72.7	Confident	104 Å²	104	77.2 Å²	77.2	53%	0.533	44%	0.443	S	S	.	.	H	α-helix	trans	-78.9	-47.1	170.2	-70.5	162.9	0	0	0	109.5	Q832 V833 A834 E838 K839 L840	Q832-I836 VanDerWaalsContact O-CG1 3.31Å; Q832-I836 WeakPolarHBondContact O-CG1 3.35Å; Q832-I836 PolarHBondContact O-N 2.91Å; Q832-I836 VanDerWaalsContact O-N 3.07Å; V833-I836 WeakPolarHBondContact O-CB 3.29Å; V833-I836 PolarHBondContact O-N 3.27Å; A834-I836 VanDerWaalsContact C-N 3.31Å; A834-I836 PolarHBondContact O-N 3.3Å; I836-E838 PolarHBondContact O-N 2.99Å; I836-K839 PolarHBondContact O-N 2.94Å; I836-L840 VanDerWaalsContact O-CB 3.31Å; I836-L840 WeakPolarHBondContact O-CB 3.13Å; I836-L840 PolarHBondContact O-N 3.31Å
837	N	81.8	Confident	75	Confident	19 Å²	19	72.5 Å²	72.5	10%	0.102	41%	0.411	C	S	.	.	H	α-helix	trans	-59.1	-43.3	176.9	-70.8	-15.7	0	0	0	111.8	H774 L775 V833 A834 K839 L840 V841	H774-N837 PolarHBondContact NE2-OD1 2.84Å; L775-N837 HydrophobicContact CD1-CB 4.08Å; L775-N837 HydrophobicContact CD2-CB 4.05Å; V833-N837 PolarHBondContact O-N 3.22Å; A834-N837 PolarHBondContact O-N 2.77Å; N837-K839 PolarHBondContact O-N 3.29Å; N837-L840 WeakPolarHBondContact O-CB 3.41Å; N837-L840 PolarHBondContact O-N 3.01Å; N837-V841 WeakPolarHBondContact O-CG2 3.36Å; N837-V841 PolarHBondContact O-N 2.96Å
838	E	80.9	Confident	77	Confident	137 Å²	137	75.9 Å²	75.9	64%	0.64	41%	0.409	S	S	*	.	H	α-helix	trans	-57.1	-50.6	174.6	-178.3	-176.9	-148.2	0	0	112.2	A834 I836 L840 V841 E842	A834-E838 WeakPolarHBondContact O-CB 3.25Å; A834-E838 PolarHBondContact O-N 3.42Å; I836-E838 PolarHBondContact O-N 2.99Å; E838-L840 VanDerWaalsContact C-N 3.3Å; E838-L840 PolarHBondContact O-N 2.93Å; E838-V841 PolarHBondContact O-N 3.25Å; E838-E842 PolarHBondContact O-N 3.39Å
839	K	81.6	Confident	78.5	Confident	123 Å²	123	75.1 Å²	75.1	54%	0.535	39%	0.393	S	S	.	.	H	α-helix	trans	-63	-35.9	177.5	-74.7	177.6	175.1	-173.1	0	112.8	K835 I836 N837 A843	K835-K839 WeakPolarHBondContact O-CG 3.2Å; I836-K839 PolarHBondContact O-N 2.94Å; N837-K839 PolarHBondContact O-N 3.29Å; K839-A843 VanDerWaalsContact O-CB 3.24Å; K839-A843 WeakPolarHBondContact O-CB 3.28Å; K839-A843 PolarHBondContact O-N 3.19Å
840	L	82.9	Confident	79.9	Confident	15 Å²	15	78 Å²	78	8%	0.079	40%	0.399	C	S	.	.	H	α-helix	trans	-68	-42	177.3	178.1	63.4	0	0	0	111.1	Q768 D771 V772 I836 N837 E838 A843 S844	Q768-L840 HydrophobicContact CB-CD1 4.24Å; D771-L840 WeakPolarHBondContact O-CD2 3.45Å; V772-L840 HydrophobicContact CG1-CD1 4.48Å; V772-L840 HydrophobicContact CG1-CD2 4.15Å; V772-L840 HydrophobicContact CG1-CG 3.82Å; I836-L840 VanDerWaalsContact O-CB 3.31Å; I836-L840 WeakPolarHBondContact O-CB 3.13Å; I836-L840 PolarHBondContact O-N 3.31Å; N837-L840 WeakPolarHBondContact O-CB 3.41Å; N837-L840 PolarHBondContact O-N 3.01Å; E838-L840 VanDerWaalsContact C-N 3.3Å; E838-L840 PolarHBondContact O-N 2.93Å; L840-A843 PolarHBondContact O-N 3.4Å; L840-S844 WeakPolarHBondContact O-CB 3.12Å; L840-S844 PolarHBondContact O-N 2.99Å
841	V	82.8	Confident	80.9	Confident	77 Å²	77	74.7 Å²	74.7	47%	0.467	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-41.7	173.5	171.7	0	0	0	0	111.8	L775 N837 E838 S844 G845	L775-V841 HydrophobicContact CD1-CG2 3.49Å; L775-V841 VanDerWaalsContact CD1-CG2 3.49Å; N837-V841 WeakPolarHBondContact O-CG2 3.36Å; N837-V841 PolarHBondContact O-N 2.96Å; E838-V841 PolarHBondContact O-N 3.25Å; V841-S844 PolarHBondContact O-N 3.34Å; V841-S844 PolarHBondContact O-OG 3.36Å; V841-G845 PolarHBondContact O-N 3.09Å
842	E	83.3	Confident	81.9	Confident	122 Å²	122	72.9 Å²	72.9	57%	0.57	37%	0.365	S	S	*	.	H	α-helix	trans	-63.4	-45.8	174.2	175.3	159.9	-133.1	0	0	111.9	E838 S844 G845 Q846 K849	E838-E842 PolarHBondContact O-N 3.39Å; E842-S844 VanDerWaalsContact C-N 3.33Å; E842-S844 PolarHBondContact O-N 3.15Å; E842-G845 CarbonylContact O-C 3.58Å; E842-G845 WeakPolarHBondContact O-CA 3.32Å; E842-G845 PolarHBondContact O-N 3.45Å; E842-Q846 PolarHBondContact O-N 3.35Å; E842-K849 IonicContact OE1-NZ 3.26Å; E842-K849 PolarHBondContact OE1-NZ 3.19Å
843	A	81.8	Confident	82.8	Confident	6 Å²	6	73.7 Å²	73.7	5%	0.05	37%	0.366	C	S	.	.	H	α-helix	trans	-61.6	-40.5	178.1	0	0	0	0	0	111.9	M766 Q768 K839 L840 G845 Q846	M766-A843 HydrophobicContact CE-CB 4.03Å; Q768-A843 HydrophobicContact CB-CB 3.83Å; Q768-A843 HydrophobicContact CG-CB 3.69Å; K839-A843 VanDerWaalsContact O-CB 3.24Å; K839-A843 WeakPolarHBondContact O-CB 3.28Å; K839-A843 PolarHBondContact O-N 3.19Å; L840-A843 PolarHBondContact O-N 3.4Å; A843-G845 PolarHBondContact O-N 3.18Å; A843-Q846 WeakPolarHBondContact O-CB 3.34Å; A843-Q846 PolarHBondContact O-N 3.26Å
844	S	83.6	Confident	83.5	Confident	18 Å²	18	72.2 Å²	72.2	13%	0.126	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-27.6	175.6	91.5	0	0	0	0	112.2	A647 L840 V841 E842	A647-S844 PolarHBondContact N-O 3.28Å; L840-S844 WeakPolarHBondContact O-CB 3.12Å; L840-S844 PolarHBondContact O-N 2.99Å; V841-S844 PolarHBondContact O-N 3.34Å; V841-S844 PolarHBondContact O-OG 3.36Å; E842-S844 VanDerWaalsContact C-N 3.33Å; E842-S844 PolarHBondContact O-N 3.15Å
845	G	82.7	Confident	84.6	Confident	18 Å²	18	71.3 Å²	71.3	19%	0.186	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.7	172.6	0	0	0	0	0	116.1	V841 E842 A843 F847 K848	V841-G845 PolarHBondContact O-N 3.09Å; E842-G845 CarbonylContact O-C 3.58Å; E842-G845 WeakPolarHBondContact O-CA 3.32Å; E842-G845 PolarHBondContact O-N 3.45Å; A843-G845 PolarHBondContact O-N 3.18Å; G845-F847 PolarHBondContact O-N 3.19Å; G845-K848 VanDerWaalsContact O-CB 3.23Å; G845-K848 WeakPolarHBondContact O-CB 2.97Å; G845-K848 PolarHBondContact O-N 3.42Å; G845-K848 VanDerWaalsContact O-N 3.11Å
846	Q	86.3	Confident	85.5	Confident	50 Å²	50	65.1 Å²	65.1	23%	0.234	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-57	-53	-172.4	-179.5	177.5	-9.3	0	0	112.3	M766 E842 A843 K848 K849 Q851	M766-Q846 HydrophobicContact CE-CB 4.42Å; M766-Q846 VanDerWaalsContact CE-OE1 3.32Å; E842-Q846 PolarHBondContact O-N 3.35Å; A843-Q846 WeakPolarHBondContact O-CB 3.34Å; A843-Q846 PolarHBondContact O-N 3.26Å; Q846-K848 PolarHBondContact O-N 3.17Å; Q846-K849 PolarHBondContact O-N 3.15Å; Q846-Q851 PolarHBondContact O-NE2 3.39Å
847	F	88.2	Confident	86.4	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-73.3	-9.8	-178.1	-57	-54.5	0	0	0	113.5	A647 D650 L651 L764 M766 G845 K880 W881 P1028	A647-F847 HydrophobicContact CB-CD2 4.04Å; A647-F847 HydrophobicContact CB-CE2 4.39Å; A647-F847 WeakPolarHBondContact O-CD2 3.39Å; D650-F847 HydrophobicContact CB-CB 4.02Å; L651-F847 HydrophobicContact CB-CD2 4.06Å; L651-F847 HydrophobicContact CB-CE2 4.45Å; L651-F847 HydrophobicContact CB-CG 4.36Å; L651-F847 HydrophobicContact CD1-CD1 4.46Å; L651-F847 HydrophobicContact CD2-CE2 4.3Å; L651-F847 HydrophobicContact CD2-CZ 4.42Å; L764-F847 HydrophobicContact CD2-CE2 4.22Å; M766-F847 HydrophobicContact CE-CE2 4.5Å; M766-F847 HydrophobicContact SD-CE2 3.85Å; M766-F847 HydrophobicContact SD-CZ 4.44Å; G845-F847 PolarHBondContact O-N 3.19Å; F847-K880 WeakPolarHBondContact O-CD 3.38Å; F847-K880 WeakPolarHBondContact O-CE 3.43Å; F847-K880 PolarHBondContact O-NZ 3.48Å; F847-W881 HydrophobicContact CD1-CH2 4.03Å; F847-W881 AromaticContact CD1-CZ2 3.67Å; F847-W881 HydrophobicContact CD1-CZ2 3.67Å; F847-W881 AromaticContact CE1-CH2 3.87Å; F847-W881 HydrophobicContact CE1-CH2 3.87Å; F847-W881 AromaticContact CE1-CZ2 3.95Å; F847-W881 HydrophobicContact CE1-CZ2 3.95Å; F847-P1028 HydrophobicContact CZ-CB 4.02Å
848	K	84.9	Confident	87.1	Confident	131 Å²	131	59.3 Å²	59.3	57%	0.57	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-71.9	-38.5	173.2	-167.6	174.3	-178.1	176.1	0	111.7	D650 G845 Q846	D650-K848 WeakPolarHBondContact OD2-CA 3.35Å; G845-K848 VanDerWaalsContact O-CB 3.23Å; G845-K848 WeakPolarHBondContact O-CB 2.97Å; G845-K848 PolarHBondContact O-N 3.42Å; G845-K848 VanDerWaalsContact O-N 3.11Å; Q846-K848 PolarHBondContact O-N 3.17Å
849	K	87.1	Confident	87.7	Confident	111 Å²	111	52.8 Å²	52.8	48%	0.483	27%	0.266	S	S	.	.	S	Bend	trans	-72	160.4	177.5	-59.9	173.2	-176.1	173.5	0	110.5	E842 Q846 Q851	E842-K849 IonicContact OE1-NZ 3.26Å; E842-K849 PolarHBondContact OE1-NZ 3.19Å; Q846-K849 PolarHBondContact O-N 3.15Å; K849-Q851 PolarHBondContact O-NE2 3.49Å; K849-Q851 VanDerWaalsContact O-NE2 3.16Å
850	K	88.2	Confident	88.1	Confident	120 Å²	120	47 Å²	47	52%	0.522	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-70.5	134.8	165.2	-173.2	-163.3	171.7	-167.3	0	107.5	K880 D883	K850-K880 WeakPolarHBondContact CG-O 3.37Å; K850-D883 WeakPolarHBondContact CE-OD2 3.5Å; K850-D883 IonicContact NZ-OD1 3.63Å; K850-D883 IonicContact NZ-OD2 3.79Å; K850-D883 PolarHBondContact NZ-OD2 3.44Å
851	Q	89.3	Confident	88.2	Confident	10 Å²	10	46.6 Å²	46.6	5%	0.047	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-73.2	149.9	177.1	-57.8	-49.3	-64	0	0	110.7	Q846 K849 K880 W881	Q846-Q851 PolarHBondContact O-NE2 3.39Å; K849-Q851 PolarHBondContact O-NE2 3.49Å; K849-Q851 VanDerWaalsContact O-NE2 3.16Å; Q851-K880 PolarHBondContact N-O 3.48Å; Q851-W881 HydrophobicContact CB-CE3 4.21Å; Q851-W881 HydrophobicContact CG-CD2 3.77Å; Q851-W881 HydrophobicContact CG-CE3 3.67Å; Q851-W881 HydrophobicContact CG-CH2 3.96Å; Q851-W881 HydrophobicContact CG-CZ2 4.05Å; Q851-W881 HydrophobicContact CG-CZ3 3.78Å
852	P	87.3	Confident	88.2	Confident	77 Å²	77	44.1 Å²	44.1	50%	0.5	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-69.4	173.9	174	31.3	-35.7	0	0	0	111.4	G854 C884	P852-G854 PolarHBondContact O-N 2.93Å; P852-C884 PolarHBondContact O-SG 2.93Å; P852-C884 VanDerWaalsContact O-SG 3.42Å
853	K	87.8	Confident	87.8	Confident	177 Å²	177	38.7 Å²	38.7	77%	0.77	20%	0.197	S	C	*	.	S	Bend	trans	-63	132.2	168	-71.5	174.8	177	177.5	0	109.2	D883	K853-D883 HydrophobicContact CG-CB 4.12Å
854	G	89	Confident	87.6	Confident	30 Å²	30	38.5 Å²	38.5	31%	0.309	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	170.7	-157.8	-179.4	0	0	0	0	0	111.4	P852 C884 K885 N996	P852-G854 PolarHBondContact O-N 2.93Å; G854-C884 WeakPolarHBondContact O-CA 3.5Å; G854-K885 PolarHBondContact O-N 3.33Å; G854-N996 VanDerWaalsContact CA-OD1 3.23Å; G854-N996 WeakPolarHBondContact CA-OD1 3.5Å
855	T	93.8	Very high	87.1	Confident	22 Å²	22	37.6 Å²	37.6	14%	0.135	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	150.8	-176.6	64.4	0	0	0	0	113.2	D857 K885 R887 I916 N996	T855-D857 WeakPolarHBondContact CB-OD1 3.43Å; T855-D857 PolarHBondContact OG1-OD1 3.49Å; T855-K885 CarbonylContact C-O 3.6Å; T855-K885 VanDerWaalsContact CA-O 3.24Å; T855-K885 WeakPolarHBondContact CA-O 3.47Å; T855-R887 HydrophobicContact CG2-CG 3.93Å; T855-I916 HydrophobicContact CG2-CD1 3.98Å; T855-N996 PolarHBondContact N-OD1 3.48Å; T855-N996 PolarHBondContact O-N 2.83Å
856	I	95.4	Very high	87.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	120	156.7	-59.8	167.4	0	0	0	105	V858 P872 L875 T876 W881 C884 K885 L886 R887 L997 V999	I856-V858 HydrophobicContact CG2-CG2 4.36Å; I856-P872 HydrophobicContact CG2-CB 3.78Å; I856-L875 HydrophobicContact CD1-CB 4.14Å; I856-L875 HydrophobicContact CD1-CD1 4.45Å; I856-T876 HydrophobicContact CD1-CG2 4.22Å; I856-W881 HydrophobicContact CD1-CD2 4.42Å; I856-W881 HydrophobicContact CD1-CE3 3.75Å; I856-W881 HydrophobicContact CD1-CZ3 4.2Å; I856-W881 HydrophobicContact CG1-CE3 4.02Å; I856-W881 HydrophobicContact CG1-CZ3 4.08Å; I856-C884 HydrophobicContact CD1-CB 4.22Å; I856-C884 HydrophobicContact CG1-CB 4.12Å; I856-K885 PolarHBondContact N-O 3.43Å; I856-L886 HydrophobicContact CB-CD2 4.17Å; I856-L886 HydrophobicContact CG2-CD2 4.32Å; I856-L886 WeakPolarHBondContact O-CA 3.47Å; I856-R887 PolarHBondContact O-N 2.96Å; I856-L997 WeakPolarHBondContact CA-O 3.49Å; I856-L997 HydrophobicContact CG1-CB 4.46Å; I856-L997 HydrophobicContact CG2-CB 4.36Å; I856-L997 HydrophobicContact CG2-CD2 4.34Å; I856-V999 HydrophobicContact CG2-CG2 4.16Å
857	D	96	Very high	87.2	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.6	-175.9	-70	0.2	0	0	0	109.2	T855 R887 F889 S992 A995 L997 I998 V999	T855-D857 WeakPolarHBondContact CB-OD1 3.43Å; T855-D857 PolarHBondContact OG1-OD1 3.49Å; D857-R887 IonicContact OD1-CZ 2.82Å; D857-R887 IonicContact OD1-NE 2.65Å; D857-R887 PolarHBondContact OD1-NE 2.95Å; D857-R887 IonicContact OD1-NH2 2.72Å; D857-R887 PolarHBondContact OD1-NH2 3.05Å; D857-R887 IonicContact OD2-CZ 3.27Å; D857-R887 IonicContact OD2-NE 3.53Å; D857-R887 IonicContact OD2-NH2 2.74Å; D857-R887 PolarHBondContact OD2-NH2 2.95Å; D857-F889 HydrophobicContact CB-CD2 4.36Å; D857-F889 HydrophobicContact CB-CE2 3.9Å; D857-S992 WeakPolarHBondContact CB-OG 3.19Å; D857-S992 WeakPolarHBondContact OD2-CA 3.45Å; D857-S992 VanDerWaalsContact OD2-CB 3.24Å; D857-S992 WeakPolarHBondContact OD2-CB 3.11Å; D857-S992 PolarHBondContact OD2-OG 3.27Å; D857-A995 HydrophobicContact CB-CB 4.23Å; D857-L997 PolarHBondContact N-O 2.74Å; D857-I998 CarbonylContact O-C 3.42Å; D857-I998 WeakPolarHBondContact O-CA 3.38Å; D857-V999 PolarHBondContact O-N 3.2Å
858	V	95.4	Very high	87.3	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	105.7	-173.3	-170.5	0	0	0	0	109.8	I856 W860 T868 L869 P872 L886 R887 I888 F889 V999	I856-V858 HydrophobicContact CG2-CG2 4.36Å; V858-W860 PolarHBondContact O-N 3.33Å; V858-T868 HydrophobicContact CG1-CG2 3.79Å; V858-T868 WeakPolarHBondContact CG1-O 3.27Å; V858-L869 HydrophobicContact CG1-CD2 4.18Å; V858-P872 HydrophobicContact CG1-CG 4.18Å; V858-P872 HydrophobicContact CG2-CB 3.8Å; V858-P872 HydrophobicContact CG2-CG 3.54Å; V858-L886 HydrophobicContact CG2-CD2 4.25Å; V858-R887 PolarHBondContact N-O 3.37Å; V858-I888 HydrophobicContact CB-CG1 4.33Å; V858-I888 CarbonylContact O-C 3.37Å; V858-I888 WeakPolarHBondContact O-CA 3.46Å; V858-F889 PolarHBondContact O-N 3.21Å; V858-V999 CarbonylContact C-O 3.52Å; V858-V999 WeakPolarHBondContact CA-O 3.38Å; V858-V999 HydrophobicContact CG1-CB 4.35Å; V858-V999 HydrophobicContact CG2-CB 4.44Å
859	W	94.1	Very high	87.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	92	177.8	-73.5	74.1	0	0	0	109.5	L861 F889 V921 L987 L988 H991 S992 V999 L1000 S1001	W859-L861 HydrophobicContact CE3-CD2 4.36Å; W859-L861 PolarHBondContact O-N 3.17Å; W859-F889 WeakPolarHBondContact CA-O 3.38Å; W859-F889 AromaticContact CD1-CD2 3.86Å; W859-F889 HydrophobicContact CD2-CB 3.61Å; W859-F889 HydrophobicContact CD2-CD2 4.39Å; W859-F889 AromaticContact CD2-CG 3.97Å; W859-F889 HydrophobicContact CD2-CG 3.97Å; W859-F889 AromaticContact CE2-CD1 3.97Å; W859-F889 AromaticContact CE2-CD2 3.87Å; W859-F889 AromaticContact CE2-CG 3.61Å; W859-F889 HydrophobicContact CE3-CB 3.91Å; W859-F889 HydrophobicContact CG-CB 3.9Å; W859-F889 HydrophobicContact CG-CD2 4.39Å; W859-F889 HydrophobicContact CG-CG 4.34Å; W859-F889 HydrophobicContact CH2-CD1 4.14Å; W859-F889 HydrophobicContact CH2-CG 4.46Å; W859-F889 HydrophobicContact CZ2-CB 4.3Å; W859-F889 AromaticContact CZ2-CD1 3.75Å; W859-F889 HydrophobicContact CZ2-CD1 3.75Å; W859-F889 HydrophobicContact CZ2-CD2 4.41Å; W859-F889 HydrophobicContact CZ2-CE1 4.16Å; W859-F889 AromaticContact CZ2-CG 3.9Å; W859-F889 HydrophobicContact CZ2-CG 3.9Å; W859-F889 HydrophobicContact CZ3-CB 4.36Å; W859-F889 AromaticContact NE1-CD2 3.51Å; W859-F889 AromaticContact NE1-CE2 3.97Å; W859-F889 AromaticContact NE1-CG 3.76Å; W859-V921 HydrophobicContact CH2-CG2 4.31Å; W859-V921 HydrophobicContact CZ3-CG2 4.15Å; W859-L987 HydrophobicContact CH2-CB 3.91Å; W859-L987 HydrophobicContact CZ3-CB 4.33Å; W859-L988 HydrophobicContact CD2-CD2 3.75Å; W859-L988 HydrophobicContact CE3-CD2 4.44Å; W859-L988 HydrophobicContact CG-CD2 3.89Å; W859-L988 HydrophobicContact CZ2-CD2 4.07Å; W859-L988 HydrophobicContact CZ2-CG 4.47Å; W859-H991 HydrophobicContact CZ2-CB 4.23Å; W859-S992 PolarHBondContact NE1-OG 3.05Å; W859-V999 PolarHBondContact N-O 3.14Å; W859-L1000 HydrophobicContact CB-CB 4.39Å; W859-L1000 HydrophobicContact CB-CD1 3.49Å; W859-L1000 VanDerWaalsContact CB-CD1 3.49Å; W859-L1000 HydrophobicContact CG-CD1 4.3Å; W859-S1001 PolarHBondContact O-N 3.41Å; W859-S1001 VanDerWaalsContact O-N 3.12Å; W859-S1001 PolarHBondContact O-OG 2.75Å
860	W	90.6	Very high	87.7	Confident	1 Å²	1	24.1 Å²	24.1	0%	0.004	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	83.8	-176.4	-164.4	27.3	0	0	0	109.9	P56 Y61 V858 F862 D864 T868 L869 F889 M904 L907	P56-W860 HydrophobicContact CB-CD2 4.04Å; P56-W860 HydrophobicContact CB-CE3 3.79Å; P56-W860 HydrophobicContact CB-CH2 3.66Å; P56-W860 HydrophobicContact CB-CZ2 3.9Å; P56-W860 HydrophobicContact CB-CZ3 3.59Å; P56-W860 HydrophobicContact CG-CD2 3.47Å; P56-W860 VanDerWaalsContact CG-CD2 3.47Å; P56-W860 HydrophobicContact CG-CE3 3.72Å; P56-W860 HydrophobicContact CG-CG 3.94Å; P56-W860 HydrophobicContact CG-CH2 4.11Å; P56-W860 HydrophobicContact CG-CZ2 3.88Å; P56-W860 HydrophobicContact CG-CZ3 4.02Å; Y61-W860 HydrophobicContact CE2-CH2 4.32Å; Y61-W860 WeakPolarHBondContact OH-CZ2 2.99Å; V858-W860 PolarHBondContact O-N 3.33Å; W860-F862 VanDerWaalsContact CD1-O 3.29Å; W860-F862 PolarHBondContact NE1-O 3.11Å; W860-F862 VanDerWaalsContact NE1-O 3.1Å; W860-D864 PolarHBondContact NE1-OD1 2.7Å; W860-T868 HydrophobicContact CB-CG2 4.18Å; W860-T868 HydrophobicContact CG-CG2 4.1Å; W860-L869 HydrophobicContact CD2-CD1 4.24Å; W860-L869 HydrophobicContact CD2-CD2 4.36Å; W860-L869 HydrophobicContact CD2-CG 3.98Å; W860-L869 HydrophobicContact CE3-CD1 3.62Å; W860-L869 HydrophobicContact CE3-CD2 4.08Å; W860-L869 HydrophobicContact CE3-CG 3.81Å; W860-L869 HydrophobicContact CH2-CD1 3.77Å; W860-L869 HydrophobicContact CH2-CG 4.42Å; W860-L869 HydrophobicContact CZ2-CD1 4.35Å; W860-L869 HydrophobicContact CZ3-CD1 3.37Å; W860-L869 HydrophobicContact CZ3-CG 4.05Å; W860-F889 PolarHBondContact N-O 3.3Å; W860-M904 HydrophobicContact CE3-CE 3.44Å; W860-M904 VanDerWaalsContact CE3-CE 3.44Å; W860-M904 HydrophobicContact CZ3-CE 3.46Å; W860-M904 VanDerWaalsContact CZ3-CE 3.46Å; W860-M904 HydrophobicContact CZ3-SD 4.32Å; W860-L907 HydrophobicContact CH2-CD2 4.35Å; W860-L907 HydrophobicContact CZ3-CD2 4.17Å
861	L	85.9	Confident	87.8	Confident	7 Å²	7	18.4 Å²	18.4	4%	0.037	10%	0.1	C	C	.	.			trans	-86.4	-28.7	-174.5	-58.2	177.2	0	0	0	112.7	W859 A891 L984 L1000 S1001	W859-L861 HydrophobicContact CE3-CD2 4.36Å; W859-L861 PolarHBondContact O-N 3.17Å; L861-A891 HydrophobicContact CD2-CB 3.99Å; L861-L984 HydrophobicContact CD1-CD1 3.92Å; L861-L984 HydrophobicContact CD1-CD2 3.93Å; L861-L1000 HydrophobicContact CD1-CD1 3.74Å; L861-L1000 HydrophobicContact CG-CD1 4.34Å; L861-S1001 PolarHBondContact N-OG 3.14Å
862	F	81	Confident	88	Confident	26 Å²	26	18 Å²	18	11%	0.114	10%	0.098	C	C	.	.	S	Bend	trans	-135	143	-174	-53.1	-66.7	0	0	0	111.3	F47 D53 W860 D864	F47-F862 HydrophobicContact CE2-CE1 4.08Å; D53-F862 HydrophobicContact CB-CD1 3.78Å; D53-F862 HydrophobicContact CB-CE1 4.15Å; W860-F862 VanDerWaalsContact CD1-O 3.29Å; W860-F862 PolarHBondContact NE1-O 3.11Å; W860-F862 VanDerWaalsContact NE1-O 3.1Å; F862-D864 PolarHBondContact O-N 2.76Å
863	D	76.2	Confident	88.2	Confident	8 Å²	8	18.3 Å²	18.3	4%	0.043	9%	0.09	C	C	.	.			trans	-75.9	95.6	179.4	-172.2	34.5	0	0	0	112.8	R54 F60 Y61 R74 H1036	R54-D863 PolarHBondContact O-N 2.84Å; F60-D863 HydrophobicContact CD2-CB 4.44Å; F60-D863 WeakPolarHBondContact CD2-OD2 3.04Å; F60-D863 WeakPolarHBondContact CG-OD2 3Å; Y61-D863 PolarHBondContact OH-OD1 3.08Å; R74-D863 IonicContact CZ-OD2 3.97Å; R74-D863 IonicContact NE-OD2 3.28Å; R74-D863 PolarHBondContact NE-OD2 3.08Å; R74-D863 IonicContact NH2-OD1 3.37Å; R74-D863 PolarHBondContact NH2-OD1 2.82Å; R74-D863 IonicContact NH2-OD2 2.71Å; R74-D863 PolarHBondContact NH2-OD2 3.26Å; D863-H1036 PolarHBondContact O-CE1 2.81Å; D863-H1036 PolarHBondContact O-ND1 3.45Å
864	D	76.9	Confident	88.4	Confident	1 Å²	1	10.9 Å²	10.9	1%	0.005	6%	0.059	C	C	.	.			trans	-93.5	14	-174.5	78.4	-29.5	0	0	0	114.2	W860 F862 G866 L867 T868 G1034	W860-D864 PolarHBondContact NE1-OD1 2.7Å; F862-D864 PolarHBondContact O-N 2.76Å; D864-G866 VanDerWaalsContact C-N 3.29Å; D864-G866 WeakPolarHBondContact OD1-CA 3.4Å; D864-G866 PolarHBondContact OD1-N 3.25Å; D864-L867 PolarHBondContact OD1-N 3.48Å; D864-T868 VanDerWaalsContact CG-OG1 3.31Å; D864-T868 WeakPolarHBondContact OD2-CB 3.29Å; D864-T868 PolarHBondContact OD2-N 2.8Å; D864-T868 PolarHBondContact OD2-OG1 2.96Å; D864-G1034 CarbonylContact O-C 3.26Å; D864-G1034 VanDerWaalsContact O-CA 3.27Å; D864-G1034 WeakPolarHBondContact O-CA 3.46Å; D864-G1034 PolarHBondContact OD2-N 3.02Å
865	G	73.1	Confident	88.5	Confident	0 Å²	0	9.5 Å²	9.5	0%	0	4%	0.044	C	C	.	.	S	Bend	trans	84	-0	-169.8	0	0	0	0	0	114.2	S1038 V1039	G865-S1038 WeakPolarHBondContact O-CA 3.49Å; G865-V1039 PolarHBondContact O-N 3.12Å
866	G	83.3	Confident	88.3	Confident	0 Å²	0	10 Å²	10	0%	0	5%	0.047	C	C	.	.	S	Bend	trans	98.5	9.1	173.6	0	0	0	0	0	114.4	Y61 D864 T868 L869 L870	Y61-G866 PolarHBondContact OH-N 2.77Å; Y61-G866 VanDerWaalsContact OH-N 3.11Å; D864-G866 VanDerWaalsContact C-N 3.29Å; D864-G866 WeakPolarHBondContact OD1-CA 3.4Å; D864-G866 PolarHBondContact OD1-N 3.25Å; G866-T868 VanDerWaalsContact C-N 3.33Å; G866-L869 PolarHBondContact O-N 3.49Å; G866-L870 WeakPolarHBondContact O-CB 3.35Å; G866-L870 PolarHBondContact O-N 2.88Å
867	L	87.8	Confident	88.1	Confident	3 Å²	3	13.5 Å²	13.5	2%	0.016	7%	0.069	C	C	.	.	H	α-helix	trans	-65.8	-38.9	179.8	-173.7	65.3	0	0	0	111.1	F631 D864 L869 L870 L871 V1032 V1039	F631-L867 HydrophobicContact CE1-CD1 4.31Å; F631-L867 HydrophobicContact CZ-CD1 4.33Å; D864-L867 PolarHBondContact OD1-N 3.48Å; L867-L869 PolarHBondContact O-N 3.44Å; L867-L870 PolarHBondContact O-N 2.78Å; L867-L871 HydrophobicContact CD1-CD1 4.01Å; L867-L871 HydrophobicContact CD1-CD2 4.23Å; L867-L871 HydrophobicContact CD1-CG 3.86Å; L867-L871 HydrophobicContact CD2-CD1 4.43Å; L867-L871 HydrophobicContact CG-CD1 3.86Å; L867-L871 HydrophobicContact CG-CG 4.15Å; L867-L871 WeakPolarHBondContact O-CG 3.44Å; L867-L871 PolarHBondContact O-N 3.15Å; L867-L871 VanDerWaalsContact O-N 3.09Å; L867-V1032 HydrophobicContact CB-CG1 4.47Å; L867-V1032 HydrophobicContact CD2-CG1 4.26Å; L867-V1032 HydrophobicContact CG-CG1 4.19Å; L867-V1039 HydrophobicContact CB-CG2 4.15Å; L867-V1039 HydrophobicContact CD1-CG2 4.44Å
868	T	90.6	Very high	87.8	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-55	-33.1	172.5	-66.1	0	0	0	0	112.7	V858 W860 D864 G866 P872 V999	V858-T868 HydrophobicContact CG1-CG2 3.79Å; V858-T868 WeakPolarHBondContact CG1-O 3.27Å; W860-T868 HydrophobicContact CB-CG2 4.18Å; W860-T868 HydrophobicContact CG-CG2 4.1Å; D864-T868 VanDerWaalsContact CG-OG1 3.31Å; D864-T868 WeakPolarHBondContact OD2-CB 3.29Å; D864-T868 PolarHBondContact OD2-N 2.8Å; D864-T868 PolarHBondContact OD2-OG1 2.96Å; G866-T868 VanDerWaalsContact C-N 3.33Å; T868-P872 WeakPolarHBondContact O-CD 3.47Å; T868-P872 WeakPolarHBondContact O-CG 3.24Å; T868-V999 HydrophobicContact CG2-CG1 4.32Å
869	L	89.7	Confident	87.5	Confident	3 Å²	3	24 Å²	24	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-86	-41.1	173.2	-71.2	-174.5	0	0	0	113.4	V858 W860 G866 L867 P872 Y873 I888 L908 I913 L1040	V858-L869 HydrophobicContact CG1-CD2 4.18Å; W860-L869 HydrophobicContact CD2-CD1 4.24Å; W860-L869 HydrophobicContact CD2-CD2 4.36Å; W860-L869 HydrophobicContact CD2-CG 3.98Å; W860-L869 HydrophobicContact CE3-CD1 3.62Å; W860-L869 HydrophobicContact CE3-CD2 4.08Å; W860-L869 HydrophobicContact CE3-CG 3.81Å; W860-L869 HydrophobicContact CH2-CD1 3.77Å; W860-L869 HydrophobicContact CH2-CG 4.42Å; W860-L869 HydrophobicContact CZ2-CD1 4.35Å; W860-L869 HydrophobicContact CZ3-CD1 3.37Å; W860-L869 HydrophobicContact CZ3-CG 4.05Å; G866-L869 PolarHBondContact O-N 3.49Å; L867-L869 PolarHBondContact O-N 3.44Å; L869-P872 WeakPolarHBondContact O-CD 3.42Å; L869-P872 WeakPolarHBondContact O-CG 3.39Å; L869-Y873 WeakPolarHBondContact O-CB 3.3Å; L869-Y873 PolarHBondContact O-N 3.28Å; L869-I888 HydrophobicContact CD2-CD1 4.02Å; L869-L908 HydrophobicContact CD1-CD2 3.93Å; L869-L908 HydrophobicContact CD2-CD2 4.44Å; L869-I913 HydrophobicContact CB-CD1 4.44Å; L869-L1040 HydrophobicContact CB-CD1 4.16Å
870	L	89.9	Confident	87.3	Confident	20 Å²	20	26.2 Å²	26.2	11%	0.105	12%	0.123	C	C	.	.	H	α-helix	trans	-65.2	-42	-173	177	59.7	0	0	0	112.4	F631 G866 L867 Y873 I874 V1039 L1040	F631-L870 HydrophobicContact CD1-CD2 3.69Å; F631-L870 HydrophobicContact CE1-CD2 3.75Å; G866-L870 WeakPolarHBondContact O-CB 3.35Å; G866-L870 PolarHBondContact O-N 2.88Å; L867-L870 PolarHBondContact O-N 2.78Å; L870-Y873 HydrophobicContact CD1-CD1 4.5Å; L870-Y873 PolarHBondContact O-N 3.25Å; L870-I874 HydrophobicContact CD1-CD1 3.81Å; L870-I874 HydrophobicContact CD1-CG1 4.01Å; L870-I874 HydrophobicContact CG-CD1 3.82Å; L870-I874 HydrophobicContact CG-CG1 4.42Å; L870-I874 WeakPolarHBondContact O-CB 3.45Å; L870-I874 VanDerWaalsContact O-CG1 3.27Å; L870-I874 WeakPolarHBondContact O-CG1 3.32Å; L870-I874 PolarHBondContact O-N 3.14Å; L870-V1039 HydrophobicContact CB-CG2 4.23Å; L870-V1039 HydrophobicContact CD2-CB 3.93Å; L870-V1039 HydrophobicContact CD2-CG2 3.74Å; L870-L1040 HydrophobicContact CB-CD2 4.4Å; L870-L1040 HydrophobicContact CB-CG 4.44Å; L870-L1040 HydrophobicContact CD1-CD2 4.03Å
871	L	91.9	Very high	87.4	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62	-53.4	-179.1	-68.9	175	0	0	0	113.7	P633 F655 L762 L867 Y873 I874 L875 M1030 V1032	P633-L871 HydrophobicContact CB-CD2 4.25Å; F655-L871 HydrophobicContact CB-CD2 4.48Å; F655-L871 HydrophobicContact CD1-CB 4.18Å; F655-L871 HydrophobicContact CD1-CD2 3.81Å; F655-L871 HydrophobicContact CE1-CB 3.78Å; F655-L871 HydrophobicContact CE1-CD2 4.14Å; F655-L871 HydrophobicContact CE1-CG 4.47Å; F655-L871 HydrophobicContact CG-CD2 4.06Å; F655-L871 HydrophobicContact CZ-CB 4.42Å; L762-L871 HydrophobicContact CD1-CD1 3.98Å; L762-L871 HydrophobicContact CD2-CD1 3.47Å; L762-L871 VanDerWaalsContact CD2-CD1 3.47Å; L762-L871 HydrophobicContact CG-CD1 4.38Å; L867-L871 HydrophobicContact CD1-CD1 4.01Å; L867-L871 HydrophobicContact CD1-CD2 4.23Å; L867-L871 HydrophobicContact CD1-CG 3.86Å; L867-L871 HydrophobicContact CD2-CD1 4.43Å; L867-L871 HydrophobicContact CG-CD1 3.86Å; L867-L871 HydrophobicContact CG-CG 4.15Å; L867-L871 WeakPolarHBondContact O-CG 3.44Å; L867-L871 PolarHBondContact O-N 3.15Å; L867-L871 VanDerWaalsContact O-N 3.09Å; L871-Y873 VanDerWaalsContact C-N 3.34Å; L871-Y873 PolarHBondContact O-N 2.75Å; L871-I874 WeakPolarHBondContact O-CB 3.43Å; L871-I874 PolarHBondContact O-N 2.87Å; L871-L875 PolarHBondContact O-N 3.26Å; L871-M1030 HydrophobicContact CB-CE 4.31Å; L871-M1030 HydrophobicContact CD1-CE 4.13Å; L871-V1032 HydrophobicContact CD1-CG1 4.32Å
872	P	92.7	Very high	87.5	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-66.9	-32.4	176.6	25.3	-33.5	0	0	0	112.8	I856 V858 T868 L869 L875 T876 L886 V999	I856-P872 HydrophobicContact CG2-CB 3.78Å; V858-P872 HydrophobicContact CG1-CG 4.18Å; V858-P872 HydrophobicContact CG2-CB 3.8Å; V858-P872 HydrophobicContact CG2-CG 3.54Å; T868-P872 WeakPolarHBondContact O-CD 3.47Å; T868-P872 WeakPolarHBondContact O-CG 3.24Å; L869-P872 WeakPolarHBondContact O-CD 3.42Å; L869-P872 WeakPolarHBondContact O-CG 3.39Å; P872-L875 WeakPolarHBondContact O-CB 3.46Å; P872-L875 PolarHBondContact O-N 2.73Å; P872-T876 PolarHBondContact O-N 3.3Å; P872-L886 HydrophobicContact CB-CD2 3.83Å; P872-V999 HydrophobicContact CB-CG2 4.13Å; P872-V999 HydrophobicContact CG-CG2 4.31Å
873	Y	91.3	Very high	87.8	Confident	85 Å²	85	35 Å²	35	33%	0.333	16%	0.164	S	C	.	.	H	α-helix	trans	-59.4	-48.9	169.9	172.4	-114	0	0	0	111.3	L869 L870 L871 L875 T876 T877 I913	L869-Y873 WeakPolarHBondContact O-CB 3.3Å; L869-Y873 PolarHBondContact O-N 3.28Å; L870-Y873 HydrophobicContact CD1-CD1 4.5Å; L870-Y873 PolarHBondContact O-N 3.25Å; L871-Y873 VanDerWaalsContact C-N 3.34Å; L871-Y873 PolarHBondContact O-N 2.75Å; Y873-L875 VanDerWaalsContact C-N 3.25Å; Y873-L875 PolarHBondContact O-N 3.33Å; Y873-T876 PolarHBondContact O-N 3.16Å; Y873-T876 VanDerWaalsContact O-N 3.13Å; Y873-T876 PolarHBondContact O-OG1 3.17Å; Y873-T877 PolarHBondContact O-N 2.66Å; Y873-I913 HydrophobicContact CD2-CG1 4.17Å; Y873-I913 HydrophobicContact CD2-CG2 4.21Å; Y873-I913 HydrophobicContact CG-CD1 4.5Å; Y873-I913 HydrophobicContact CG-CG1 4.17Å
874	I	91.1	Very high	88.6	Confident	21 Å²	21	34.9 Å²	34.9	11%	0.108	16%	0.164	C	C	.	.	H	α-helix	trans	-55.1	-40.6	175	-74.7	170.7	0	0	0	111.1	P633 L870 L871 T877 R878	P633-I874 HydrophobicContact CG-CD1 4.05Å; L870-I874 HydrophobicContact CD1-CD1 3.81Å; L870-I874 HydrophobicContact CD1-CG1 4.01Å; L870-I874 HydrophobicContact CG-CD1 3.82Å; L870-I874 HydrophobicContact CG-CG1 4.42Å; L870-I874 WeakPolarHBondContact O-CB 3.45Å; L870-I874 VanDerWaalsContact O-CG1 3.27Å; L870-I874 WeakPolarHBondContact O-CG1 3.32Å; L870-I874 PolarHBondContact O-N 3.14Å; L871-I874 WeakPolarHBondContact O-CB 3.43Å; L871-I874 PolarHBondContact O-N 2.87Å; I874-T877 PolarHBondContact O-N 3.08Å; I874-T877 PolarHBondContact O-OG1 3.4Å; I874-R878 WeakPolarHBondContact O-CG 3.36Å
875	L	91.5	Very high	89.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-47.5	176.6	-69.2	178.8	0	0	0	112.4	L651 F655 I856 L871 P872 Y873 T877 R878 W881 L997	L651-L875 HydrophobicContact CD1-CD1 4.36Å; L651-L875 HydrophobicContact CD1-CD2 4.41Å; F655-L875 HydrophobicContact CD1-CD2 3.72Å; F655-L875 HydrophobicContact CD1-CG 3.9Å; F655-L875 HydrophobicContact CE1-CD1 3.65Å; F655-L875 HydrophobicContact CE1-CD2 3.62Å; F655-L875 HydrophobicContact CE1-CG 3.47Å; F655-L875 VanDerWaalsContact CE1-CG 3.47Å; F655-L875 HydrophobicContact CZ-CD1 4.1Å; F655-L875 HydrophobicContact CZ-CD2 4.31Å; F655-L875 HydrophobicContact CZ-CG 4.33Å; I856-L875 HydrophobicContact CD1-CB 4.14Å; I856-L875 HydrophobicContact CD1-CD1 4.45Å; L871-L875 PolarHBondContact O-N 3.26Å; P872-L875 WeakPolarHBondContact O-CB 3.46Å; P872-L875 PolarHBondContact O-N 2.73Å; Y873-L875 VanDerWaalsContact C-N 3.25Å; Y873-L875 PolarHBondContact O-N 3.33Å; L875-T877 PolarHBondContact O-N 2.92Å; L875-T877 VanDerWaalsContact O-N 3.11Å; L875-R878 VanDerWaalsContact O-CB 3.26Å; L875-R878 WeakPolarHBondContact O-CB 3.43Å; L875-R878 WeakPolarHBondContact O-CG 3.48Å; L875-R878 PolarHBondContact O-N 3.26Å; L875-W881 HydrophobicContact CB-CB 4.49Å; L875-W881 HydrophobicContact CB-CG 4.25Å; L875-W881 HydrophobicContact CD1-CZ2 4.46Å; L875-W881 WeakPolarHBondContact O-CB 3.3Å; L875-L997 HydrophobicContact CD1-CD2 3.51Å
876	T	91.1	Very high	90.3	Very high	32 Å²	32	41.3 Å²	41.3	20%	0.196	19%	0.192	C	C	.	.	H	α-helix	trans	-59.8	-26.6	-179.1	64.6	0	0	0	0	113.4	I856 P872 Y873 R878 L886	I856-T876 HydrophobicContact CD1-CG2 4.22Å; P872-T876 PolarHBondContact O-N 3.3Å; Y873-T876 PolarHBondContact O-N 3.16Å; Y873-T876 VanDerWaalsContact O-N 3.13Å; Y873-T876 PolarHBondContact O-OG1 3.17Å; T876-R878 PolarHBondContact O-N 2.9Å; T876-L886 HydrophobicContact CG2-CD2 3.98Å; T876-L886 HydrophobicContact CG2-CG 3.97Å
877	T	89.1	Confident	90.8	Very high	75 Å²	75	44 Å²	44	46%	0.46	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-14.6	172.2	77.2	0	0	0	0	114.1	Y873 I874 L875	Y873-T877 PolarHBondContact O-N 2.66Å; I874-T877 PolarHBondContact O-N 3.08Å; I874-T877 PolarHBondContact O-OG1 3.4Å; L875-T877 PolarHBondContact O-N 2.92Å; L875-T877 VanDerWaalsContact O-N 3.11Å
878	R	90.2	Very high	91.1	Very high	32 Å²	32	43.9 Å²	43.9	12%	0.121	20%	0.201	C	C	.	.	S	Bend	trans	-91.6	137.7	-173.6	-50.8	-49.4	-167.8	-143.1	10.8	111.5	S654 F655 I874 L875 T876 K880 W881 K882	S654-R878 WeakPolarHBondContact O-CG 3.48Å; S654-R878 PolarHBondContact O-NE 3.04Å; F655-R878 PolarHBondContact O-NH2 3.33Å; I874-R878 WeakPolarHBondContact O-CG 3.36Å; L875-R878 VanDerWaalsContact O-CB 3.26Å; L875-R878 WeakPolarHBondContact O-CB 3.43Å; L875-R878 WeakPolarHBondContact O-CG 3.48Å; L875-R878 PolarHBondContact O-N 3.26Å; T876-R878 PolarHBondContact O-N 2.9Å; R878-K880 PolarHBondContact O-N 3.29Å; R878-W881 CarbonylContact O-C 3.59Å; R878-W881 PolarHBondContact O-N 2.9Å; R878-K882 PolarHBondContact O-N 3.5Å
879	K	89.9	Confident	91.2	Very high	189 Å²	189	44 Å²	44	82%	0.822	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-26.6	178	-172.5	175.4	179.4	178.9	0	114.9
880	K	90.2	Very high	91.1	Very high	47 Å²	47	44.2 Å²	44.2	20%	0.204	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-29.9	174.9	-75.2	-176.7	175.5	179.2	0	113.6	D650 F847 K850 Q851 R878	D650-K880 IonicContact OD2-NZ 3.77Å; D650-K880 PolarHBondContact OD2-NZ 2.94Å; F847-K880 WeakPolarHBondContact O-CD 3.38Å; F847-K880 WeakPolarHBondContact O-CE 3.43Å; F847-K880 PolarHBondContact O-NZ 3.48Å; K850-K880 WeakPolarHBondContact CG-O 3.37Å; Q851-K880 PolarHBondContact N-O 3.48Å; R878-K880 PolarHBondContact O-N 3.29Å
881	W	91.8	Very high	90.9	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.9	4.8	-169.5	-61.1	92.9	0	0	0	113.5	L651 F847 Q851 I856 L875 R878 D883 C884 N996 L997	L651-W881 HydrophobicContact CD1-CZ2 4.1Å; F847-W881 HydrophobicContact CD1-CH2 4.03Å; F847-W881 AromaticContact CD1-CZ2 3.67Å; F847-W881 HydrophobicContact CD1-CZ2 3.67Å; F847-W881 AromaticContact CE1-CH2 3.87Å; F847-W881 HydrophobicContact CE1-CH2 3.87Å; F847-W881 AromaticContact CE1-CZ2 3.95Å; F847-W881 HydrophobicContact CE1-CZ2 3.95Å; Q851-W881 HydrophobicContact CB-CE3 4.21Å; Q851-W881 HydrophobicContact CG-CD2 3.77Å; Q851-W881 HydrophobicContact CG-CE3 3.67Å; Q851-W881 HydrophobicContact CG-CH2 3.96Å; Q851-W881 HydrophobicContact CG-CZ2 4.05Å; Q851-W881 HydrophobicContact CG-CZ3 3.78Å; I856-W881 HydrophobicContact CD1-CD2 4.42Å; I856-W881 HydrophobicContact CD1-CE3 3.75Å; I856-W881 HydrophobicContact CD1-CZ3 4.2Å; I856-W881 HydrophobicContact CG1-CE3 4.02Å; I856-W881 HydrophobicContact CG1-CZ3 4.08Å; L875-W881 HydrophobicContact CB-CB 4.49Å; L875-W881 HydrophobicContact CB-CG 4.25Å; L875-W881 HydrophobicContact CD1-CZ2 4.46Å; L875-W881 WeakPolarHBondContact O-CB 3.3Å; R878-W881 CarbonylContact O-C 3.59Å; R878-W881 PolarHBondContact O-N 2.9Å; W881-D883 PolarHBondContact O-N 3.15Å; W881-C884 HydrophobicContact CE3-CB 4.32Å; W881-C884 WeakPolarHBondContact O-CB 3.42Å; W881-C884 PolarHBondContact O-N 3.27Å; W881-N996 HydrophobicContact CZ3-CB 4.16Å; W881-L997 HydrophobicContact CH2-CB 3.86Å; W881-L997 HydrophobicContact CH2-CD2 4.05Å; W881-L997 HydrophobicContact CH2-CG 4.49Å; W881-L997 HydrophobicContact CZ3-CB 3.91Å; W881-L997 HydrophobicContact CZ3-CD2 4.45Å
882	K	87.4	Confident	90.3	Very high	159 Å²	159	43.7 Å²	43.7	69%	0.691	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-30.8	-178.2	-178.2	-175.9	174	-171.4	0	113.8	R878	R878-K882 PolarHBondContact O-N 3.5Å
883	D	88.8	Confident	89.5	Confident	59 Å²	59	48.6 Å²	48.6	32%	0.316	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.6	-176.8	-60.1	5.1	0	0	0	112.3	K850 K853 W881	K850-D883 WeakPolarHBondContact CE-OD2 3.5Å; K850-D883 IonicContact NZ-OD1 3.63Å; K850-D883 IonicContact NZ-OD2 3.79Å; K850-D883 PolarHBondContact NZ-OD2 3.44Å; K853-D883 HydrophobicContact CG-CB 4.12Å; W881-D883 PolarHBondContact O-N 3.15Å
884	C	91.4	Very high	88.7	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.034	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	141.2	172.8	-49.5	0	0	0	0	109.5	P852 G854 I856 W881	P852-C884 PolarHBondContact O-SG 2.93Å; P852-C884 VanDerWaalsContact O-SG 3.42Å; G854-C884 WeakPolarHBondContact O-CA 3.5Å; I856-C884 HydrophobicContact CD1-CB 4.22Å; I856-C884 HydrophobicContact CG1-CB 4.12Å; W881-C884 HydrophobicContact CE3-CB 4.32Å; W881-C884 WeakPolarHBondContact O-CB 3.42Å; W881-C884 PolarHBondContact O-N 3.27Å
885	K	92.1	Very high	87.9	Confident	131 Å²	131	51.7 Å²	51.7	57%	0.57	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.8	151.3	-177	-62.3	-178.4	-177.1	179.5	0	111.5	G854 T855 I856 I916	G854-K885 PolarHBondContact O-N 3.33Å; T855-K885 CarbonylContact C-O 3.6Å; T855-K885 VanDerWaalsContact CA-O 3.24Å; T855-K885 WeakPolarHBondContact CA-O 3.47Å; I856-K885 PolarHBondContact N-O 3.43Å; K885-I916 HydrophobicContact CB-CD1 3.49Å; K885-I916 VanDerWaalsContact CB-CD1 3.49Å; K885-I916 HydrophobicContact CB-CG1 3.6Å; K885-I916 HydrophobicContact CD-CD1 3.83Å; K885-I916 HydrophobicContact CD-CG1 3.79Å; K885-I916 HydrophobicContact CG-CD1 4.34Å; K885-I916 HydrophobicContact CG-CG1 4.36Å
886	L	93.6	Very high	87.5	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	130.1	179.4	-59.9	172.6	0	0	0	111.7	I856 V858 P872 T876 I913 C915 I916	I856-L886 HydrophobicContact CB-CD2 4.17Å; I856-L886 HydrophobicContact CG2-CD2 4.32Å; I856-L886 WeakPolarHBondContact O-CA 3.47Å; V858-L886 HydrophobicContact CG2-CD2 4.25Å; P872-L886 HydrophobicContact CB-CD2 3.83Å; T876-L886 HydrophobicContact CG2-CD2 3.98Å; T876-L886 HydrophobicContact CG2-CG 3.97Å; L886-I913 HydrophobicContact CD1-CG2 3.69Å; L886-C915 HydrophobicContact CB-CB 4.34Å; L886-C915 CarbonylContact O-C 3.55Å; L886-C915 WeakPolarHBondContact O-CA 3.23Å; L886-I916 PolarHBondContact O-N 3.25Å
887	R	94.4	Very high	87.1	Confident	56 Å²	56	56.6 Å²	56.6	21%	0.211	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	140.9	155.5	-62.5	-164.9	-65.5	171.9	-1.7	108.2	T855 I856 D857 V858 F889 I916 H991	T855-R887 HydrophobicContact CG2-CG 3.93Å; I856-R887 PolarHBondContact O-N 2.96Å; D857-R887 IonicContact OD1-CZ 2.82Å; D857-R887 IonicContact OD1-NE 2.65Å; D857-R887 PolarHBondContact OD1-NE 2.95Å; D857-R887 IonicContact OD1-NH2 2.72Å; D857-R887 PolarHBondContact OD1-NH2 3.05Å; D857-R887 IonicContact OD2-CZ 3.27Å; D857-R887 IonicContact OD2-NE 3.53Å; D857-R887 IonicContact OD2-NH2 2.74Å; D857-R887 PolarHBondContact OD2-NH2 2.95Å; V858-R887 PolarHBondContact N-O 3.37Å; R887-F889 HydrophobicContact CB-CE2 3.89Å; R887-I916 HydrophobicContact CG-CD1 4.1Å; R887-H991 PolarHBondContact NH2-O 2.67Å
888	I	93.5	Very high	87	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	124.4	-178.7	-64.3	172.1	0	0	0	108.6	V858 L869 I890 L908 C915 D917 I918 T919	V858-I888 HydrophobicContact CB-CG1 4.33Å; V858-I888 CarbonylContact O-C 3.37Å; V858-I888 WeakPolarHBondContact O-CA 3.46Å; L869-I888 HydrophobicContact CD2-CD1 4.02Å; I888-I890 HydrophobicContact CG2-CG2 4.15Å; I888-L908 HydrophobicContact CD1-CD1 3.52Å; I888-L908 HydrophobicContact CD1-CD2 3.62Å; I888-L908 HydrophobicContact CD1-CG 4.24Å; I888-C915 HydrophobicContact CD1-CB 3.98Å; I888-C915 HydrophobicContact CG1-CB 4.34Å; I888-D917 PolarHBondContact N-O 2.98Å; I888-I918 CarbonylContact O-C 3.42Å; I888-I918 VanDerWaalsContact O-CA 3.32Å; I888-I918 WeakPolarHBondContact O-CA 3.23Å; I888-T919 PolarHBondContact O-N 3.15Å
889	F	92.6	Very high	86.7	Confident	2 Å²	2	61 Å²	61	1%	0.009	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.2	176.5	-63.1	-96.3	0	0	0	107.7	D857 V858 W859 W860 R887 T919 V921 H991	D857-F889 HydrophobicContact CB-CD2 4.36Å; D857-F889 HydrophobicContact CB-CE2 3.9Å; V858-F889 PolarHBondContact O-N 3.21Å; W859-F889 WeakPolarHBondContact CA-O 3.38Å; W859-F889 AromaticContact CD1-CD2 3.86Å; W859-F889 HydrophobicContact CD2-CB 3.61Å; W859-F889 HydrophobicContact CD2-CD2 4.39Å; W859-F889 AromaticContact CD2-CG 3.97Å; W859-F889 HydrophobicContact CD2-CG 3.97Å; W859-F889 AromaticContact CE2-CD1 3.97Å; W859-F889 AromaticContact CE2-CD2 3.87Å; W859-F889 AromaticContact CE2-CG 3.61Å; W859-F889 HydrophobicContact CE3-CB 3.91Å; W859-F889 HydrophobicContact CG-CB 3.9Å; W859-F889 HydrophobicContact CG-CD2 4.39Å; W859-F889 HydrophobicContact CG-CG 4.34Å; W859-F889 HydrophobicContact CH2-CD1 4.14Å; W859-F889 HydrophobicContact CH2-CG 4.46Å; W859-F889 HydrophobicContact CZ2-CB 4.3Å; W859-F889 AromaticContact CZ2-CD1 3.75Å; W859-F889 HydrophobicContact CZ2-CD1 3.75Å; W859-F889 HydrophobicContact CZ2-CD2 4.41Å; W859-F889 HydrophobicContact CZ2-CE1 4.16Å; W859-F889 AromaticContact CZ2-CG 3.9Å; W859-F889 HydrophobicContact CZ2-CG 3.9Å; W859-F889 HydrophobicContact CZ3-CB 4.36Å; W859-F889 AromaticContact NE1-CD2 3.51Å; W859-F889 AromaticContact NE1-CE2 3.97Å; W859-F889 AromaticContact NE1-CG 3.76Å; W860-F889 PolarHBondContact N-O 3.3Å; R887-F889 HydrophobicContact CB-CE2 3.89Å; F889-T919 WeakPolarHBondContact CA-O 3.42Å; F889-T919 HydrophobicContact CD1-CG2 3.93Å; F889-T919 HydrophobicContact CE1-CG2 3.99Å; F889-V921 HydrophobicContact CD1-CG2 4.35Å; F889-H991 HydrophobicContact CE1-CB 3.66Å; F889-H991 HydrophobicContact CZ-CB 3.96Å
890	I	89.5	Confident	86.3	Confident	7 Å²	7	53 Å²	53	4%	0.036	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	150.3	174.2	67.7	179.4	0	0	0	109.2	I888 D900 M904 T919 V920 V921	I888-I890 HydrophobicContact CG2-CG2 4.15Å; I890-D900 HydrophobicContact CD1-CB 4.33Å; I890-M904 HydrophobicContact CD1-CB 4.18Å; I890-M904 HydrophobicContact CD1-CG 3.64Å; I890-M904 HydrophobicContact CG2-CE 3.69Å; I890-T919 PolarHBondContact N-O 3.43Å; I890-V920 HydrophobicContact CD1-CG1 4.38Å; I890-V920 HydrophobicContact CD1-CG2 3.78Å; I890-V920 HydrophobicContact CG1-CB 4.19Å; I890-V920 HydrophobicContact CG1-CG1 4.07Å; I890-V920 HydrophobicContact CG1-CG2 3.85Å; I890-V920 WeakPolarHBondContact O-CA 3.4Å; I890-V921 PolarHBondContact O-N 2.83Å
891	A	84.1	Confident	86.2	Confident	4 Å²	4	53.1 Å²	53.1	3%	0.033	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	135.8	164.5	0	0	0	0	0	109.4	F47 L861 V921 I924	F47-A891 HydrophobicContact CD1-CB 4.47Å; F47-A891 HydrophobicContact CE1-CB 3.38Å; F47-A891 HydrophobicContact CZ-CB 3.41Å; F47-A891 VanDerWaalsContact CZ-CB 3.41Å; L861-A891 HydrophobicContact CD2-CB 3.99Å; A891-V921 WeakPolarHBondContact CA-O 3.48Å; A891-I924 HydrophobicContact CB-CD1 3.39Å
892	G	79.4	Confident	85.9	Confident	5 Å²	5	59.1 Å²	59.1	5%	0.052	30%	0.304	C	S	.	.			trans	-136.4	176.1	177.4	0	0	0	0	0	111.9	V921	G892-V921 PolarHBondContact N-O 3.3Å
893	Q	76.3	Confident	85.8	Confident	104 Å²	104	55.5 Å²	55.5	49%	0.486	29%	0.29	S	S	.	.			trans	-93.3	140.9	178.5	-71.1	-178.1	-17	0	0	111.3	G895 R896 D900	Q893-G895 PolarHBondContact O-N 2.93Å; Q893-R896 HydrophobicContact CB-CB 4.26Å; Q893-R896 PolarHBondContact O-N 3.12Å; Q893-D900 PolarHBondContact N-OD2 2.97Å
894	P	74.9	Confident	85.7	Confident	91 Å²	91	53.3 Å²	53.3	59%	0.591	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	127	177.4	23.5	-33.4	0	0	0	110.3	D922	P894-D922 HydrophobicContact CB-CB 4.36Å
895	G	75	Confident	85.5	Confident	81 Å²	81	60.7 Å²	60.7	84%	0.835	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	-8.2	-175	0	0	0	0	0	116.3	Q893	Q893-G895 PolarHBondContact O-N 2.93Å
896	R	82.2	Confident	85.2	Confident	95 Å²	95	57 Å²	57	36%	0.358	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-2.9	176	-151.5	-178.6	-171.9	-89.7	-0.9	114.1	Q893 E898 I899 D900 E903	Q893-R896 HydrophobicContact CB-CB 4.26Å; Q893-R896 PolarHBondContact O-N 3.12Å; R896-E898 PolarHBondContact O-N 3.26Å; R896-I899 HydrophobicContact CG-CB 4.2Å; R896-I899 HydrophobicContact CG-CD1 4.26Å; R896-I899 WeakPolarHBondContact O-CB 3.26Å; R896-I899 PolarHBondContact O-N 2.87Å; R896-D900 WeakPolarHBondContact CD-OD1 3.47Å; R896-D900 IonicContact CZ-OD1 3.84Å; R896-D900 IonicContact NE-OD1 2.68Å; R896-D900 IonicContact NH1-OD1 2.69Å; R896-D900 PolarHBondContact NH1-OD1 2.82Å; R896-D900 PolarHBondContact O-N 2.89Å; R896-D900 VanDerWaalsContact O-N 3.15Å; R896-E903 IonicContact CZ-OE1 2.62Å; R896-E903 IonicContact NH1-OE1 3.66Å; R896-E903 PolarHBondContact NH1-OE1 2.9Å; R896-E903 IonicContact NH2-OE1 3.63Å; R896-E903 PolarHBondContact NH2-OE1 3.19Å
897	T	83.4	Confident	84.8	Confident	39 Å²	39	56.9 Å²	56.9	24%	0.239	30%	0.295	C	S	.	.	H	α-helix	trans	-48.7	-47.2	-167.1	51.9	0	0	0	0	116	I899 D900 K901 V920 D922	T897-I899 VanDerWaalsContact C-N 3.34Å; T897-I899 PolarHBondContact O-N 3.08Å; T897-D900 PolarHBondContact O-N 3.44Å; T897-K901 VanDerWaalsContact O-CB 3.26Å; T897-K901 WeakPolarHBondContact O-CB 3.42Å; T897-K901 PolarHBondContact O-N 3.18Å; T897-V920 HydrophobicContact CG2-CB 4.24Å; T897-V920 HydrophobicContact CG2-CG1 3.93Å; T897-V920 WeakPolarHBondContact O-CG2 3.1Å; T897-D922 HydrophobicContact CG2-CB 3.83Å; T897-D922 WeakPolarHBondContact CG2-OD2 3.41Å
898	E	85.3	Confident	84.4	Confident	111 Å²	111	54.3 Å²	54.3	52%	0.519	29%	0.286	S	S	.	.	H	α-helix	trans	-70.5	-26.6	179.8	-79.2	-60.7	137.6	0	0	113.8	R896 Q902	R896-E898 PolarHBondContact O-N 3.26Å; E898-Q902 VanDerWaalsContact O-CG 3.27Å; E898-Q902 WeakPolarHBondContact O-CG 3.49Å; E898-Q902 PolarHBondContact O-N 3.16Å; E898-Q902 VanDerWaalsContact O-N 3.13Å
899	I	84.5	Confident	84.1	Confident	88 Å²	88	61.5 Å²	61.5	45%	0.451	32%	0.319	S	S	.	.	H	α-helix	trans	-72.5	-50	174.4	-57.8	174.8	0	0	0	109	R896 T897 K901 Q902 E903	R896-I899 HydrophobicContact CG-CB 4.2Å; R896-I899 HydrophobicContact CG-CD1 4.26Å; R896-I899 WeakPolarHBondContact O-CB 3.26Å; R896-I899 PolarHBondContact O-N 2.87Å; T897-I899 VanDerWaalsContact C-N 3.34Å; T897-I899 PolarHBondContact O-N 3.08Å; I899-K901 PolarHBondContact O-N 3.35Å; I899-Q902 PolarHBondContact O-N 3.07Å; I899-E903 HydrophobicContact CG2-CG 4.39Å; I899-E903 WeakPolarHBondContact CG2-OE1 3.48Å; I899-E903 PolarHBondContact O-N 3.28Å
900	D	82.7	Confident	83.7	Confident	22 Å²	22	65.8 Å²	65.8	12%	0.118	34%	0.337	C	S	.	.	H	α-helix	trans	-57.6	-39.6	177.7	-58.9	-14.4	0	0	0	110.8	I890 Q893 R896 T897 M904 V920	I890-D900 HydrophobicContact CD1-CB 4.33Å; Q893-D900 PolarHBondContact N-OD2 2.97Å; R896-D900 WeakPolarHBondContact CD-OD1 3.47Å; R896-D900 IonicContact CZ-OD1 3.84Å; R896-D900 IonicContact NE-OD1 2.68Å; R896-D900 IonicContact NH1-OD1 2.69Å; R896-D900 PolarHBondContact NH1-OD1 2.82Å; R896-D900 PolarHBondContact O-N 2.89Å; R896-D900 VanDerWaalsContact O-N 3.15Å; T897-D900 PolarHBondContact O-N 3.44Å; D900-M904 WeakPolarHBondContact O-CB 3.35Å; D900-M904 WeakPolarHBondContact O-CG 3.32Å; D900-M904 PolarHBondContact O-N 2.88Å; D900-V920 HydrophobicContact CB-CG1 4.38Å
901	K	87.3	Confident	83.3	Confident	50 Å²	50	66.5 Å²	66.5	22%	0.217	34%	0.34	C	S	.	.	H	α-helix	trans	-61.6	-41.4	173.8	-170.7	166.2	177.1	140.1	0	112.8	T897 I899 R905 D917 I918 V920	T897-K901 VanDerWaalsContact O-CB 3.26Å; T897-K901 WeakPolarHBondContact O-CB 3.42Å; T897-K901 PolarHBondContact O-N 3.18Å; I899-K901 PolarHBondContact O-N 3.35Å; K901-R905 WeakPolarHBondContact O-CB 3.34Å; K901-R905 PolarHBondContact O-N 3.48Å; K901-D917 IonicContact NZ-OD1 3.08Å; K901-D917 PolarHBondContact NZ-OD1 3.4Å; K901-I918 WeakPolarHBondContact CD-O 3.47Å; K901-I918 WeakPolarHBondContact CE-O 3.25Å; K901-I918 HydrophobicContact CG-CB 4.32Å; K901-I918 HydrophobicContact CG-CG2 4.36Å; K901-I918 PolarHBondContact NZ-O 3.38Å; K901-V920 HydrophobicContact CB-CG2 3.75Å; K901-V920 HydrophobicContact CG-CG2 4.41Å
902	Q	86.4	Confident	83.5	Confident	127 Å²	127	76.5 Å²	76.5	59%	0.593	38%	0.377	S	S	*	.	H	α-helix	trans	-73.5	-43.4	178.5	-74.3	178	42.2	0	0	112.7	E898 I899 M904 R905 S906	E898-Q902 VanDerWaalsContact O-CG 3.27Å; E898-Q902 WeakPolarHBondContact O-CG 3.49Å; E898-Q902 PolarHBondContact O-N 3.16Å; E898-Q902 VanDerWaalsContact O-N 3.13Å; I899-Q902 PolarHBondContact O-N 3.07Å; Q902-M904 VanDerWaalsContact C-N 3.31Å; Q902-M904 PolarHBondContact O-N 3.15Å; Q902-R905 PolarHBondContact O-N 3.04Å; Q902-S906 PolarHBondContact O-N 3.15Å
903	E	85.1	Confident	83.9	Confident	82 Å²	82	76.7 Å²	76.7	38%	0.383	38%	0.377	S	S	.	.	H	α-helix	trans	-56.1	-47.5	174.2	-71.5	-174	-143.8	0	0	110.4	R896 I899 S906 L907	R896-E903 IonicContact CZ-OE1 2.62Å; R896-E903 IonicContact NH1-OE1 3.66Å; R896-E903 PolarHBondContact NH1-OE1 2.9Å; R896-E903 IonicContact NH2-OE1 3.63Å; R896-E903 PolarHBondContact NH2-OE1 3.19Å; I899-E903 HydrophobicContact CG2-CG 4.39Å; I899-E903 WeakPolarHBondContact CG2-OE1 3.48Å; I899-E903 PolarHBondContact O-N 3.28Å; E903-S906 WeakPolarHBondContact O-CB 3.48Å; E903-S906 PolarHBondContact O-N 3.02Å; E903-L907 PolarHBondContact O-N 3.45Å
904	M	85.9	Confident	84.3	Confident	13 Å²	13	80.7 Å²	80.7	6%	0.064	39%	0.393	C	S	.	.	H	α-helix	trans	-69.8	-33.8	178.9	-74.8	-66.4	-73.2	0	0	113.7	P56 W860 I890 D900 Q902 S906 L907 L908 I918	P56-M904 HydrophobicContact CB-CE 4.41Å; P56-M904 HydrophobicContact CB-SD 4.38Å; W860-M904 HydrophobicContact CE3-CE 3.44Å; W860-M904 VanDerWaalsContact CE3-CE 3.44Å; W860-M904 HydrophobicContact CZ3-CE 3.46Å; W860-M904 VanDerWaalsContact CZ3-CE 3.46Å; W860-M904 HydrophobicContact CZ3-SD 4.32Å; I890-M904 HydrophobicContact CD1-CB 4.18Å; I890-M904 HydrophobicContact CD1-CG 3.64Å; I890-M904 HydrophobicContact CG2-CE 3.69Å; D900-M904 WeakPolarHBondContact O-CB 3.35Å; D900-M904 WeakPolarHBondContact O-CG 3.32Å; D900-M904 PolarHBondContact O-N 2.88Å; Q902-M904 VanDerWaalsContact C-N 3.31Å; Q902-M904 PolarHBondContact O-N 3.15Å; M904-S906 VanDerWaalsContact C-N 3.31Å; M904-S906 PolarHBondContact O-N 3.37Å; M904-L907 PolarHBondContact O-N 2.95Å; M904-L907 HydrophobicContact SD-CD2 3.78Å; M904-L908 WeakPolarHBondContact O-CB 3.31Å; M904-L908 WeakPolarHBondContact O-CD1 3.38Å; M904-L908 WeakPolarHBondContact O-CG 3.47Å; M904-L908 PolarHBondContact O-N 3.35Å; M904-I918 HydrophobicContact CB-CG2 4.47Å
905	R	87.4	Confident	85	Confident	160 Å²	160	78.1 Å²	78.1	60%	0.604	38%	0.377	S	S	*	.	H	α-helix	trans	-61.9	-39.6	170.5	-167.3	-179.3	-174.2	93.8	-4.4	111.5	K901 Q902 H909 I918	K901-R905 WeakPolarHBondContact O-CB 3.34Å; K901-R905 PolarHBondContact O-N 3.48Å; Q902-R905 PolarHBondContact O-N 3.04Å; R905-H909 VanDerWaalsContact O-CB 3.32Å; R905-H909 WeakPolarHBondContact O-CB 3.29Å; R905-H909 PolarHBondContact O-N 2.72Å; R905-I918 HydrophobicContact CB-CD1 3.81Å; R905-I918 HydrophobicContact CG-CD1 4.27Å
906	S	86.1	Confident	85.6	Confident	54 Å²	54	78.5 Å²	78.5	38%	0.378	36%	0.358	S	S	.	.	H	α-helix	trans	-65.4	-44	175.2	-170.7	0	0	0	0	111.9	Q902 E903 M904 H909 K910	Q902-S906 PolarHBondContact O-N 3.15Å; E903-S906 WeakPolarHBondContact O-CB 3.48Å; E903-S906 PolarHBondContact O-N 3.02Å; M904-S906 VanDerWaalsContact C-N 3.31Å; M904-S906 PolarHBondContact O-N 3.37Å; S906-H909 PolarHBondContact O-N 2.83Å; S906-K910 WeakPolarHBondContact O-CG 3.35Å; S906-K910 PolarHBondContact O-N 2.83Å
907	L	84.3	Confident	85.9	Confident	2 Å²	2	76.9 Å²	76.9	1%	0.01	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-49.1	176.7	-176.6	61.4	0	0	0	112.3	I58 W860 E903 M904 H909 K910 F911	I58-L907 HydrophobicContact CB-CD1 4.09Å; I58-L907 HydrophobicContact CD1-CD1 4.22Å; I58-L907 HydrophobicContact CG1-CD1 3.89Å; W860-L907 HydrophobicContact CH2-CD2 4.35Å; W860-L907 HydrophobicContact CZ3-CD2 4.17Å; E903-L907 PolarHBondContact O-N 3.45Å; M904-L907 PolarHBondContact O-N 2.95Å; M904-L907 HydrophobicContact SD-CD2 3.78Å; L907-H909 VanDerWaalsContact C-N 3.33Å; L907-H909 PolarHBondContact O-N 2.71Å; L907-K910 WeakPolarHBondContact O-CB 3.46Å; L907-K910 PolarHBondContact O-N 3.2Å; L907-F911 HydrophobicContact CD1-CD2 4.17Å; L907-F911 HydrophobicContact CD1-CE2 3.49Å; L907-F911 VanDerWaalsContact CD1-CE2 3.49Å; L907-F911 HydrophobicContact CD1-CZ 3.72Å; L907-F911 HydrophobicContact CD2-CE2 4.14Å; L907-F911 HydrophobicContact CG-CD2 4.03Å; L907-F911 HydrophobicContact CG-CE2 3.59Å; L907-F911 HydrophobicContact CG-CZ 4.32Å; L907-F911 WeakPolarHBondContact O-CD2 3.49Å; L907-F911 PolarHBondContact O-N 2.9Å
908	L	87.4	Confident	86.3	Confident	3 Å²	3	75.1 Å²	75.1	2%	0.016	35%	0.346	C	S	.	.	H	α-helix	trans	-65.5	-35.1	179.2	-70.2	163.3	0	0	0	112.4	L869 I888 M904 F911 R912 I913 I918	L869-L908 HydrophobicContact CD1-CD2 3.93Å; L869-L908 HydrophobicContact CD2-CD2 4.44Å; I888-L908 HydrophobicContact CD1-CD1 3.52Å; I888-L908 HydrophobicContact CD1-CD2 3.62Å; I888-L908 HydrophobicContact CD1-CG 4.24Å; M904-L908 WeakPolarHBondContact O-CB 3.31Å; M904-L908 WeakPolarHBondContact O-CD1 3.38Å; M904-L908 WeakPolarHBondContact O-CG 3.47Å; M904-L908 PolarHBondContact O-N 3.35Å; L908-F911 CarbonylContact O-C 3.55Å; L908-F911 PolarHBondContact O-N 2.79Å; L908-R912 PolarHBondContact O-N 3.22Å; L908-I913 HydrophobicContact CD2-CB 4.15Å; L908-I913 HydrophobicContact CD2-CD1 4.47Å; L908-I913 HydrophobicContact CD2-CG2 4.21Å; L908-I913 PolarHBondContact O-N 2.62Å; L908-I918 HydrophobicContact CD1-CD1 3.69Å; L908-I918 HydrophobicContact CD1-CG1 4.11Å
909	H	87.1	Confident	86.5	Confident	152 Å²	152	71.4 Å²	71.4	70%	0.704	33%	0.331	S	S	*	.	H	α-helix	trans	-63.8	-42.6	172.2	-175.5	-103.7	0	0	0	112	R905 S906 L907 F911 R912	R905-H909 VanDerWaalsContact O-CB 3.32Å; R905-H909 WeakPolarHBondContact O-CB 3.29Å; R905-H909 PolarHBondContact O-N 2.72Å; S906-H909 PolarHBondContact O-N 2.83Å; L907-H909 VanDerWaalsContact C-N 3.33Å; L907-H909 PolarHBondContact O-N 2.71Å; H909-F911 PolarHBondContact O-N 3.49Å; H909-R912 WeakPolarHBondContact O-CA 3.39Å; H909-R912 PolarHBondContact O-N 2.98Å
910	K	82.8	Confident	86.7	Confident	92 Å²	92	68.2 Å²	68.2	40%	0.4	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-40.2	174.4	-72	168.5	-177.4	176.3	0	112.1	I58 S906 L907 R912 F1042	I58-K910 HydrophobicContact CD1-CD 3.81Å; S906-K910 WeakPolarHBondContact O-CG 3.35Å; S906-K910 PolarHBondContact O-N 2.83Å; L907-K910 WeakPolarHBondContact O-CB 3.46Å; L907-K910 PolarHBondContact O-N 3.2Å; K910-R912 PolarHBondContact O-N 3.12Å; K910-F1042 HydrophobicContact CB-CB 4.06Å; K910-F1042 HydrophobicContact CB-CG 4.31Å
911	F	82.6	Confident	86.9	Confident	22 Å²	22	67.3 Å²	67.3	10%	0.096	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-5.4	171	-63.2	-41.5	0	0	0	114.6	Y61 L907 L908 H909 I913 L1040 F1042	Y61-F911 HydrophobicContact CD1-CE1 4.29Å; Y61-F911 AromaticContact CD1-CZ 3.65Å; Y61-F911 HydrophobicContact CD1-CZ 3.65Å; Y61-F911 HydrophobicContact CD2-CZ 4.3Å; Y61-F911 HydrophobicContact CE1-CZ 4.16Å; Y61-F911 HydrophobicContact CG-CE1 4.49Å; Y61-F911 AromaticContact CG-CZ 3.73Å; Y61-F911 HydrophobicContact CG-CZ 3.73Å; L907-F911 HydrophobicContact CD1-CD2 4.17Å; L907-F911 HydrophobicContact CD1-CE2 3.49Å; L907-F911 VanDerWaalsContact CD1-CE2 3.49Å; L907-F911 HydrophobicContact CD1-CZ 3.72Å; L907-F911 HydrophobicContact CD2-CE2 4.14Å; L907-F911 HydrophobicContact CG-CD2 4.03Å; L907-F911 HydrophobicContact CG-CE2 3.59Å; L907-F911 HydrophobicContact CG-CZ 4.32Å; L907-F911 WeakPolarHBondContact O-CD2 3.49Å; L907-F911 PolarHBondContact O-N 2.9Å; L908-F911 CarbonylContact O-C 3.55Å; L908-F911 PolarHBondContact O-N 2.79Å; H909-F911 PolarHBondContact O-N 3.49Å; F911-I913 HydrophobicContact CB-CD1 3.97Å; F911-I913 HydrophobicContact CB-CG1 3.97Å; F911-I913 PolarHBondContact O-N 2.74Å; F911-L1040 HydrophobicContact CD1-CB 4.22Å; F911-L1040 HydrophobicContact CD2-CD1 4.25Å; F911-L1040 HydrophobicContact CE1-CB 3.84Å; F911-L1040 HydrophobicContact CE2-CD1 4.26Å; F911-L1040 HydrophobicContact CG-CD1 4.49Å; F911-L1040 HydrophobicContact CZ-CB 4.04Å; F911-F1042 HydrophobicContact CD1-CB 4.25Å; F911-F1042 HydrophobicContact CE1-CB 4.33Å; F911-F1042 HydrophobicContact CE1-CD1 4.04Å
912	R	86.8	Confident	86.6	Confident	213 Å²	213	67.7 Å²	67.7	80%	0.804	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	22.1	-176.4	-53.9	178.8	178.8	-178.9	-1.3	114.3	L908 H909 K910	L908-R912 PolarHBondContact O-N 3.22Å; H909-R912 WeakPolarHBondContact O-CA 3.39Å; H909-R912 PolarHBondContact O-N 2.98Å; K910-R912 PolarHBondContact O-N 3.12Å
913	I	87.6	Confident	86.3	Confident	9 Å²	9	63.9 Å²	63.9	5%	0.046	30%	0.299	C	S	.	.			trans	-82.5	125.3	178.4	-62.5	175.8	0	0	0	109.1	L869 Y873 L886 L908 F911 L1040	L869-I913 HydrophobicContact CB-CD1 4.44Å; Y873-I913 HydrophobicContact CD2-CG1 4.17Å; Y873-I913 HydrophobicContact CD2-CG2 4.21Å; Y873-I913 HydrophobicContact CG-CD1 4.5Å; Y873-I913 HydrophobicContact CG-CG1 4.17Å; L886-I913 HydrophobicContact CD1-CG2 3.69Å; L908-I913 HydrophobicContact CD2-CB 4.15Å; L908-I913 HydrophobicContact CD2-CD1 4.47Å; L908-I913 HydrophobicContact CD2-CG2 4.21Å; L908-I913 PolarHBondContact O-N 2.62Å; F911-I913 HydrophobicContact CB-CD1 3.97Å; F911-I913 HydrophobicContact CB-CG1 3.97Å; F911-I913 PolarHBondContact O-N 2.74Å; I913-L1040 HydrophobicContact CD1-CD1 4.36Å
914	K	85.9	Confident	86.1	Confident	189 Å²	189	60.4 Å²	60.4	82%	0.822	28%	0.283	S	S	*	.			trans	-96.7	104.3	-178.8	-63.7	-171.2	179.3	-172.2	0	111.5
915	C	88.6	Confident	85.6	Confident	37 Å²	37	63.5 Å²	63.5	25%	0.25	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	163.4	166.4	58.8	0	0	0	0	111.9	L886 I888	L886-C915 HydrophobicContact CB-CB 4.34Å; L886-C915 CarbonylContact O-C 3.55Å; L886-C915 WeakPolarHBondContact O-CA 3.23Å; I888-C915 HydrophobicContact CD1-CB 3.98Å; I888-C915 HydrophobicContact CG1-CB 4.34Å
916	I	88.5	Confident	85.4	Confident	88 Å²	88	60.7 Å²	60.7	45%	0.451	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	-52.8	167.1	-50.9	168.1	0	0	0	109.3	T855 K885 L886 R887	T855-I916 HydrophobicContact CG2-CD1 3.98Å; K885-I916 HydrophobicContact CB-CD1 3.49Å; K885-I916 VanDerWaalsContact CB-CD1 3.49Å; K885-I916 HydrophobicContact CB-CG1 3.6Å; K885-I916 HydrophobicContact CD-CD1 3.83Å; K885-I916 HydrophobicContact CD-CG1 3.79Å; K885-I916 HydrophobicContact CG-CD1 4.34Å; K885-I916 HydrophobicContact CG-CG1 4.36Å; L886-I916 PolarHBondContact O-N 3.25Å; R887-I916 HydrophobicContact CG-CD1 4.1Å
917	D	89.1	Confident	85.4	Confident	62 Å²	62	65.3 Å²	65.3	33%	0.332	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	159.1	-167.8	-172.7	25.4	0	0	0	109.3	I888 K901	I888-D917 PolarHBondContact N-O 2.98Å; K901-D917 IonicContact NZ-OD1 3.08Å; K901-D917 PolarHBondContact NZ-OD1 3.4Å
918	I	90.7	Very high	85.6	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	112.7	177.5	-58.4	168.8	0	0	0	106.1	I888 K901 M904 R905 L908	I888-I918 CarbonylContact O-C 3.42Å; I888-I918 VanDerWaalsContact O-CA 3.32Å; I888-I918 WeakPolarHBondContact O-CA 3.23Å; K901-I918 WeakPolarHBondContact CD-O 3.47Å; K901-I918 WeakPolarHBondContact CE-O 3.25Å; K901-I918 HydrophobicContact CG-CB 4.32Å; K901-I918 HydrophobicContact CG-CG2 4.36Å; K901-I918 PolarHBondContact NZ-O 3.38Å; M904-I918 HydrophobicContact CB-CG2 4.47Å; R905-I918 HydrophobicContact CB-CD1 3.81Å; R905-I918 HydrophobicContact CG-CD1 4.27Å; L908-I918 HydrophobicContact CD1-CD1 3.69Å; L908-I918 HydrophobicContact CD1-CG1 4.11Å
919	T	90.8	Very high	85.7	Confident	33 Å²	33	73 Å²	73	20%	0.202	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	127.2	177.9	-50.1	0	0	0	0	108.3	I888 F889 I890 V921	I888-T919 PolarHBondContact O-N 3.15Å; F889-T919 WeakPolarHBondContact CA-O 3.42Å; F889-T919 HydrophobicContact CD1-CG2 3.93Å; F889-T919 HydrophobicContact CE1-CG2 3.99Å; I890-T919 PolarHBondContact N-O 3.43Å; T919-V921 HydrophobicContact CG2-CG2 4.33Å
920	V	87.8	Confident	85.8	Confident	21 Å²	21	71.4 Å²	71.4	13%	0.127	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131	171.8	-170.2	0	0	0	0	107.2	I890 T897 D900 K901	I890-V920 HydrophobicContact CD1-CG1 4.38Å; I890-V920 HydrophobicContact CD1-CG2 3.78Å; I890-V920 HydrophobicContact CG1-CB 4.19Å; I890-V920 HydrophobicContact CG1-CG1 4.07Å; I890-V920 HydrophobicContact CG1-CG2 3.85Å; I890-V920 WeakPolarHBondContact O-CA 3.4Å; T897-V920 HydrophobicContact CG2-CB 4.24Å; T897-V920 HydrophobicContact CG2-CG1 3.93Å; T897-V920 WeakPolarHBondContact O-CG2 3.1Å; D900-V920 HydrophobicContact CB-CG1 4.38Å; K901-V920 HydrophobicContact CB-CG2 3.75Å; K901-V920 HydrophobicContact CG-CG2 4.41Å
921	V	86.3	Confident	86.2	Confident	3 Å²	3	72.2 Å²	72.2	2%	0.018	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	111.1	-175.2	-170.1	0	0	0	0	107.1	W859 F889 I890 A891 G892 T919 D923 I924 L987	W859-V921 HydrophobicContact CH2-CG2 4.31Å; W859-V921 HydrophobicContact CZ3-CG2 4.15Å; F889-V921 HydrophobicContact CD1-CG2 4.35Å; I890-V921 PolarHBondContact O-N 2.83Å; A891-V921 WeakPolarHBondContact CA-O 3.48Å; G892-V921 PolarHBondContact N-O 3.3Å; T919-V921 HydrophobicContact CG2-CG2 4.33Å; V921-D923 WeakPolarHBondContact CG1-OD1 3.44Å; V921-I924 HydrophobicContact CB-CD1 4.16Å; V921-I924 HydrophobicContact CB-CG1 4.31Å; V921-I924 HydrophobicContact CG1-CD1 4.13Å; V921-I924 HydrophobicContact CG1-CG1 3.77Å; V921-I924 WeakPolarHBondContact O-CD1 3.31Å; V921-L987 HydrophobicContact CG1-CD1 4.01Å; V921-L987 HydrophobicContact CG1-CD2 4.28Å
922	D	81.1	Confident	86.5	Confident	58 Å²	58	72.5 Å²	72.5	31%	0.31	34%	0.343	S	S	.	.			trans	-112.7	-5.2	-173	59.6	-19.4	0	0	0	113.6	P894 T897 I924	P894-D922 HydrophobicContact CB-CB 4.36Å; T897-D922 HydrophobicContact CG2-CB 3.83Å; T897-D922 WeakPolarHBondContact CG2-OD2 3.41Å; D922-I924 VanDerWaalsContact C-N 3.34Å
923	D	81.1	Confident	86.6	Confident	46 Å²	46	63.8 Å²	63.8	25%	0.246	31%	0.312	C	S	.	.			trans	-95.7	17.3	-179.1	75.8	-33.4	0	0	0	113.6	V921 H925 I926 R983 L987	V921-D923 WeakPolarHBondContact CG1-OD1 3.44Å; D923-H925 PolarHBondContact O-N 3.06Å; D923-I926 HydrophobicContact CB-CD1 3.82Å; D923-I926 HydrophobicContact CB-CG1 4.3Å; D923-I926 WeakPolarHBondContact O-CB 3.38Å; D923-I926 WeakPolarHBondContact O-CG1 3.29Å; D923-I926 PolarHBondContact O-N 3.44Å; D923-R983 PolarHBondContact O-NE 3.49Å; D923-R983 IonicContact OD2-CZ 2.74Å; D923-R983 IonicContact OD2-NH2 3.74Å; D923-R983 PolarHBondContact OD2-NH2 3.09Å; D923-L987 WeakPolarHBondContact OD1-CD2 3.35Å; D923-L987 WeakPolarHBondContact OD2-CD2 3.41Å
924	I	80.1	Confident	86.8	Confident	9 Å²	9	69.1 Å²	69.1	5%	0.046	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-27.3	-179.3	-61.9	179.1	0	0	0	111.8	A891 V921 D922 I926 L980 L984 L987	A891-I924 HydrophobicContact CB-CD1 3.39Å; V921-I924 HydrophobicContact CB-CD1 4.16Å; V921-I924 HydrophobicContact CB-CG1 4.31Å; V921-I924 HydrophobicContact CG1-CD1 4.13Å; V921-I924 HydrophobicContact CG1-CG1 3.77Å; V921-I924 WeakPolarHBondContact O-CD1 3.31Å; D922-I924 VanDerWaalsContact C-N 3.34Å; I924-I926 VanDerWaalsContact C-N 3.31Å; I924-L980 HydrophobicContact CG2-CD1 3.29Å; I924-L984 HydrophobicContact CG2-CD2 4.46Å; I924-L987 HydrophobicContact CG1-CD1 4.12Å
925	H	75.4	Confident	86.9	Confident	79 Å²	79	64.5 Å²	64.5	37%	0.366	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.2	-179.7	-44.4	-54	0	0	0	113.6	F47 D923	F47-H925 VanDerWaalsContact CB-CE1 3.43Å; F47-H925 WeakPolarHBondContact CB-CE1 3.49Å; F47-H925 AromaticContact CD1-CE1 3.68Å; F47-H925 AromaticContact CG-CE1 3.91Å; F47-H925 PolarHBondContact O-CE1 3.32Å; F47-H925 PolarHBondContact O-ND1 3.41Å; D923-H925 PolarHBondContact O-N 3.06Å
926	I	84.1	Confident	87.1	Confident	100 Å²	100	63.1 Å²	63.1	51%	0.513	31%	0.305	S	S	.	.	S	Bend	trans	-73.1	132.7	178.4	-58.1	-174.1	0	0	0	109.2	D923 I924 R983	D923-I926 HydrophobicContact CB-CD1 3.82Å; D923-I926 HydrophobicContact CB-CG1 4.3Å; D923-I926 WeakPolarHBondContact O-CB 3.38Å; D923-I926 WeakPolarHBondContact O-CG1 3.29Å; D923-I926 PolarHBondContact O-N 3.44Å; I924-I926 VanDerWaalsContact C-N 3.31Å; I926-R983 VanDerWaalsContact O-CD 3.3Å; I926-R983 WeakPolarHBondContact O-CD 3.44Å; I926-R983 WeakPolarHBondContact O-CG 3.41Å
927	K	84.5	Confident	87.1	Confident	152 Å²	152	63.7 Å²	63.7	66%	0.661	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-57.5	133.7	176.9	-69.6	-157	174.8	-154.6	0	110.6	E975	K927-E975 IonicContact NZ-OE1 3.36Å
928	P	90.1	Very high	87.2	Confident	4 Å²	4	66.6 Å²	66.6	3%	0.026	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-66.4	165.1	-179.9	28.5	-35.7	0	0	0	111.9	I933 H979 V982 R983	P928-I933 HydrophobicContact CG-CD1 4.1Å; P928-I933 HydrophobicContact CG-CG1 3.9Å; P928-H979 HydrophobicContact CG-CB 4.03Å; P928-V982 HydrophobicContact CB-CB 3.92Å; P928-V982 HydrophobicContact CB-CG1 3.63Å; P928-V982 HydrophobicContact CG-CB 3.98Å; P928-V982 HydrophobicContact CG-CG1 4.08Å; P928-R983 HydrophobicContact CB-CB 4.23Å
929	R	89.4	Confident	87.2	Confident	162 Å²	162	67 Å²	67	61%	0.611	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-66.9	136.4	-178.7	-60.4	176.1	-174	-170.2	3.6	111.1	D931 N932 I933 E986	R929-D931 PolarHBondContact O-N 3.19Å; R929-D931 VanDerWaalsContact O-N 3.07Å; R929-N932 WeakPolarHBondContact O-CA 3.45Å; R929-N932 WeakPolarHBondContact O-CB 3.2Å; R929-N932 PolarHBondContact O-N 3.43Å; R929-I933 PolarHBondContact O-N 3.45Å; R929-I933 VanDerWaalsContact O-N 3.12Å; R929-E986 VanDerWaalsContact CB-OE1 3.3Å; R929-E986 WeakPolarHBondContact CB-OE1 3.07Å; R929-E986 VanDerWaalsContact CG-OE1 3.31Å; R929-E986 WeakPolarHBondContact CG-OE1 3.35Å; R929-E986 PolarHBondContact N-OE1 3.16Å
930	N	89.1	Confident	87.2	Confident	118 Å²	118	66 Å²	66	63%	0.631	32%	0.316	S	S	*	.	H	α-helix	trans	-51.5	-35.7	179.1	-63.2	-3.4	0	0	0	113.4	N932 I933 K934	N930-N932 PolarHBondContact O-N 3.34Å; N930-I933 PolarHBondContact O-N 3.5Å; N930-K934 WeakPolarHBondContact O-CG 3.34Å; N930-K934 PolarHBondContact O-N 3.2Å
931	D	90.2	Very high	87.2	Confident	109 Å²	109	68.9 Å²	68.9	58%	0.583	33%	0.329	S	S	*	.	H	α-helix	trans	-64.9	-26.7	176.6	-58.7	-26	0	0	0	113.3	R929 K935	R929-D931 PolarHBondContact O-N 3.19Å; R929-D931 VanDerWaalsContact O-N 3.07Å; D931-K935 VanDerWaalsContact O-CD 3.28Å; D931-K935 WeakPolarHBondContact O-CD 3.31Å; D931-K935 WeakPolarHBondContact O-CE 3.44Å; D931-K935 WeakPolarHBondContact O-CG 3.48Å; D931-K935 PolarHBondContact O-N 3.39Å
932	N	88.9	Confident	87.3	Confident	28 Å²	28	73.1 Å²	73.1	15%	0.15	36%	0.356	C	S	.	.	H	α-helix	trans	-90.2	-28.8	178	-66.8	-30.9	0	0	0	112	R929 N930 K935 L936 V982 E986	R929-N932 WeakPolarHBondContact O-CA 3.45Å; R929-N932 WeakPolarHBondContact O-CB 3.2Å; R929-N932 PolarHBondContact O-N 3.43Å; N930-N932 PolarHBondContact O-N 3.34Å; N932-K935 PolarHBondContact OD1-NZ 2.9Å; N932-L936 PolarHBondContact O-N 3.44Å; N932-V982 HydrophobicContact CB-CG1 3.52Å; N932-E986 PolarHBondContact ND2-OE1 3.04Å
933	I	89.9	Confident	87.6	Confident	31 Å²	31	71.5 Å²	71.5	16%	0.159	35%	0.346	C	S	.	.	H	α-helix	trans	-61.4	-51.4	166.9	-59.2	172.6	0	0	0	109.4	P928 R929 N930 K935 L936 E937	P928-I933 HydrophobicContact CG-CD1 4.1Å; P928-I933 HydrophobicContact CG-CG1 3.9Å; R929-I933 PolarHBondContact O-N 3.45Å; R929-I933 VanDerWaalsContact O-N 3.12Å; N930-I933 PolarHBondContact O-N 3.5Å; I933-K935 VanDerWaalsContact C-N 3.33Å; I933-K935 PolarHBondContact O-N 3.06Å; I933-L936 WeakPolarHBondContact O-CA 3.38Å; I933-L936 WeakPolarHBondContact O-CB 3.4Å; I933-L936 PolarHBondContact O-N 3.38Å; I933-E937 HydrophobicContact CG2-CG 4.32Å; I933-E937 PolarHBondContact O-N 3.16Å
934	K	91.2	Very high	87.9	Confident	120 Å²	120	72.3 Å²	72.3	52%	0.522	35%	0.346	S	S	.	.	H	α-helix	trans	-55.2	-43.9	176.8	-73.6	177.2	177.2	-176.6	0	113.5	N930 L936 E937 D938	N930-K934 WeakPolarHBondContact O-CG 3.34Å; N930-K934 PolarHBondContact O-N 3.2Å; K934-L936 PolarHBondContact O-N 3.41Å; K934-L936 VanDerWaalsContact O-N 3.08Å; K934-E937 WeakPolarHBondContact CA-OE2 3.48Å; K934-E937 PolarHBondContact O-N 2.89Å; K934-E937 VanDerWaalsContact O-N 3.13Å; K934-D938 WeakPolarHBondContact O-CB 3.43Å; K934-D938 PolarHBondContact O-N 2.88Å
935	K	89	Confident	87.9	Confident	93 Å²	93	72.2 Å²	72.2	40%	0.404	35%	0.346	S	S	.	.	H	α-helix	trans	-62.2	-15	174.9	-71.9	165.3	-154.9	158.6	0	114.5	D931 N932 I933	D931-K935 VanDerWaalsContact O-CD 3.28Å; D931-K935 WeakPolarHBondContact O-CD 3.31Å; D931-K935 WeakPolarHBondContact O-CE 3.44Å; D931-K935 WeakPolarHBondContact O-CG 3.48Å; D931-K935 PolarHBondContact O-N 3.39Å; N932-K935 PolarHBondContact OD1-NZ 2.9Å; I933-K935 VanDerWaalsContact C-N 3.33Å; I933-K935 PolarHBondContact O-N 3.06Å
936	L	90.8	Very high	88.1	Confident	8 Å²	8	71.3 Å²	71.3	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-94	-43.2	171.4	-179.3	60.8	0	0	0	110.9	N932 I933 K934 D938 M939 I940 T978 V982 A1017 I1021	N932-L936 PolarHBondContact O-N 3.44Å; I933-L936 WeakPolarHBondContact O-CA 3.38Å; I933-L936 WeakPolarHBondContact O-CB 3.4Å; I933-L936 PolarHBondContact O-N 3.38Å; K934-L936 PolarHBondContact O-N 3.41Å; K934-L936 VanDerWaalsContact O-N 3.08Å; L936-D938 PolarHBondContact O-N 3.48Å; L936-M939 WeakPolarHBondContact O-CA 3.36Å; L936-M939 VanDerWaalsContact O-CB 3.28Å; L936-M939 WeakPolarHBondContact O-CB 3.38Å; L936-M939 PolarHBondContact O-N 3.03Å; L936-I940 HydrophobicContact CD1-CG2 4.14Å; L936-I940 WeakPolarHBondContact O-CG1 3.43Å; L936-I940 PolarHBondContact O-N 2.95Å; L936-T978 HydrophobicContact CD2-CG2 3.4Å; L936-V982 HydrophobicContact CD2-CG2 3.73Å; L936-A1017 HydrophobicContact CD1-CB 4.17Å; L936-I1021 HydrophobicContact CD1-CB 4.15Å; L936-I1021 HydrophobicContact CD1-CG2 4.11Å; L936-I1021 HydrophobicContact CD2-CG2 4.4Å
937	E	90	Very high	87.4	Confident	99 Å²	99	68.1 Å²	68.1	46%	0.463	32%	0.324	S	S	.	.	H	α-helix	trans	-52.5	-54.4	171.5	-64.3	171.5	146.3	0	0	110.4	I933 K934 M939 I940 E941	I933-E937 HydrophobicContact CG2-CG 4.32Å; I933-E937 PolarHBondContact O-N 3.16Å; K934-E937 WeakPolarHBondContact CA-OE2 3.48Å; K934-E937 PolarHBondContact O-N 2.89Å; K934-E937 VanDerWaalsContact O-N 3.13Å; E937-M939 PolarHBondContact O-N 3.38Å; E937-I940 WeakPolarHBondContact O-CG1 3.44Å; E937-I940 PolarHBondContact O-N 2.87Å; E937-I940 VanDerWaalsContact O-N 3.14Å; E937-E941 WeakPolarHBondContact O-CB 3.16Å; E937-E941 PolarHBondContact O-N 3.22Å
938	D	91.3	Very high	86.5	Confident	123 Å²	123	64.7 Å²	64.7	66%	0.658	33%	0.332	S	S	*	.	H	α-helix	trans	-53.7	-24.3	173.2	-66.4	-30.3	0	0	0	113.7	K934 L936	K934-D938 WeakPolarHBondContact O-CB 3.43Å; K934-D938 PolarHBondContact O-N 2.88Å; L936-D938 PolarHBondContact O-N 3.48Å
939	M	89.9	Confident	85.3	Confident	10 Å²	10	68.9 Å²	68.9	5%	0.049	36%	0.361	C	S	.	.	H	α-helix	trans	-89.5	-34.9	-177.9	-165.7	-172.7	-43	0	0	112.6	W736 L936 E937 D1020 I1021	W736-M939 HydrophobicContact CH2-CG 4.35Å; W736-M939 HydrophobicContact CH2-SD 4.43Å; W736-M939 HydrophobicContact CZ2-CG 4.2Å; W736-M939 HydrophobicContact CZ2-SD 3.83Å; L936-M939 WeakPolarHBondContact O-CA 3.36Å; L936-M939 VanDerWaalsContact O-CB 3.28Å; L936-M939 WeakPolarHBondContact O-CB 3.38Å; L936-M939 PolarHBondContact O-N 3.03Å; E937-M939 PolarHBondContact O-N 3.38Å; M939-D1020 HydrophobicContact SD-CB 4.12Å; M939-I1021 HydrophobicContact CE-CB 4.36Å; M939-I1021 HydrophobicContact CE-CD1 4.02Å
940	I	90.6	Very high	84.3	Confident	12 Å²	12	65.1 Å²	65.1	6%	0.062	35%	0.349	C	S	.	.	H	α-helix	trans	-90.7	-22.5	-179	63.5	168.7	0	0	0	113.1	L936 E937 P942 F943 R944 I966 L971 A1017	L936-I940 HydrophobicContact CD1-CG2 4.14Å; L936-I940 WeakPolarHBondContact O-CG1 3.43Å; L936-I940 PolarHBondContact O-N 2.95Å; E937-I940 WeakPolarHBondContact O-CG1 3.44Å; E937-I940 PolarHBondContact O-N 2.87Å; E937-I940 VanDerWaalsContact O-N 3.14Å; I940-P942 VanDerWaalsContact C-CD 3.42Å; I940-F943 WeakPolarHBondContact O-CA 3.29Å; I940-F943 WeakPolarHBondContact O-CB 3.49Å; I940-F943 PolarHBondContact O-N 3.23Å; I940-R944 PolarHBondContact O-N 2.9Å; I940-I966 HydrophobicContact CB-CD1 4Å; I940-I966 HydrophobicContact CG2-CD1 4.11Å; I940-L971 HydrophobicContact CD1-CD1 4Å; I940-L971 HydrophobicContact CD1-CD2 3.64Å; I940-A1017 HydrophobicContact CG2-CB 3.58Å
941	E	89.2	Confident	83.5	Confident	83 Å²	83	61.4 Å²	61.4	39%	0.388	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-49.7	-41.7	-173.3	-172.3	60.4	-159.2	0	0	115.1	E937 F943 R944 H946	E937-E941 WeakPolarHBondContact O-CB 3.16Å; E937-E941 PolarHBondContact O-N 3.22Å; E941-F943 PolarHBondContact O-N 3.01Å; E941-F943 VanDerWaalsContact O-N 3.12Å; E941-R944 PolarHBondContact O-N 2.88Å; E941-R944 WeakPolarHBondContact OE2-CD 3.45Å; E941-R944 IonicContact OE2-CZ 2.83Å; E941-R944 IonicContact OE2-NE 2.74Å; E941-R944 IonicContact OE2-NH1 3.71Å; E941-R944 PolarHBondContact OE2-NH1 3.3Å; E941-H946 IonicContact OE1-CD2 2.72Å; E941-H946 IonicContact OE1-CE1 2.61Å; E941-H946 PolarHBondContact OE1-CE1 3.5Å; E941-H946 VanDerWaalsContact OE1-CE1 3.27Å; E941-H946 IonicContact OE1-NE2 3.14Å; E941-H946 PolarHBondContact OE1-NE2 3.13Å; E941-H946 IonicContact OE2-CE1 2.69Å; E941-H946 IonicContact OE2-NE2 3.51Å
942	P	88.1	Confident	82.3	Confident	91 Å²	91	66.7 Å²	66.7	59%	0.591	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-64	-17.1	176.1	-21.5	34.3	0	0	0	114.9	I940	I940-P942 VanDerWaalsContact C-CD 3.42Å
943	F	87.1	Confident	81.3	Confident	24 Å²	24	72.2 Å²	72.2	11%	0.105	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-107.4	2.3	-173.2	-50.4	-78	0	0	0	113	W736 R737 I940 E941 W964 K965 I966 F1013	W736-F943 HydrophobicContact CH2-CE2 4.41Å; W736-F943 HydrophobicContact CZ3-CD2 4.32Å; W736-F943 HydrophobicContact CZ3-CE2 4.01Å; W736-F943 HydrophobicContact CZ3-CZ 4.31Å; R737-F943 HydrophobicContact CB-CZ 4.24Å; R737-F943 HydrophobicContact CG-CE2 3.92Å; R737-F943 HydrophobicContact CG-CZ 3.93Å; I940-F943 WeakPolarHBondContact O-CA 3.29Å; I940-F943 WeakPolarHBondContact O-CB 3.49Å; I940-F943 PolarHBondContact O-N 3.23Å; E941-F943 PolarHBondContact O-N 3.01Å; E941-F943 VanDerWaalsContact O-N 3.12Å; F943-W964 HydrophobicContact CD1-CZ3 4.35Å; F943-K965 CarbonylContact O-C 3.55Å; F943-K965 VanDerWaalsContact O-CA 3.3Å; F943-K965 WeakPolarHBondContact O-CA 3.43Å; F943-K965 VanDerWaalsContact O-CB 3.28Å; F943-K965 WeakPolarHBondContact O-CB 3.29Å; F943-K965 WeakPolarHBondContact O-CG 3.15Å; F943-I966 HydrophobicContact CB-CD1 4.21Å; F943-I966 HydrophobicContact CB-CG1 4.49Å; F943-I966 PolarHBondContact O-N 3.03Å; F943-F1013 HydrophobicContact CB-CB 4.45Å; F943-F1013 HydrophobicContact CB-CD1 4.41Å; F943-F1013 AromaticContact CD1-CD1 3.4Å; F943-F1013 HydrophobicContact CD1-CD1 3.4Å; F943-F1013 VanDerWaalsContact CD1-CD1 3.4Å; F943-F1013 AromaticContact CD1-CE1 3.62Å; F943-F1013 HydrophobicContact CD1-CE1 3.62Å; F943-F1013 HydrophobicContact CD1-CG 4.29Å; F943-F1013 AromaticContact CE1-CD1 3.79Å; F943-F1013 HydrophobicContact CE1-CD1 3.79Å; F943-F1013 AromaticContact CE1-CE1 3.66Å; F943-F1013 HydrophobicContact CE1-CE1 3.66Å; F943-F1013 AromaticContact CG-CD1 3.89Å; F943-F1013 HydrophobicContact CG-CD1 3.89Å
944	R	86.6	Confident	80.2	Confident	64 Å²	64	76.9 Å²	76.9	24%	0.242	40%	0.401	C	S	.	.	B	Isolated β-bridge	trans	-83.2	152.2	179	-68.9	175.6	69.9	-170.6	6.5	112.7	I940 E941 I966 D968 L971	I940-R944 PolarHBondContact O-N 2.9Å; E941-R944 PolarHBondContact O-N 2.88Å; E941-R944 WeakPolarHBondContact OE2-CD 3.45Å; E941-R944 IonicContact OE2-CZ 2.83Å; E941-R944 IonicContact OE2-NE 2.74Å; E941-R944 IonicContact OE2-NH1 3.71Å; E941-R944 PolarHBondContact OE2-NH1 3.3Å; R944-I966 WeakPolarHBondContact CA-O 3.41Å; R944-I966 HydrophobicContact CG-CB 4.47Å; R944-D968 IonicContact CZ-OD1 3.27Å; R944-D968 IonicContact NE-OD1 3.9Å; R944-D968 IonicContact NH2-OD1 3.87Å; R944-D968 PolarHBondContact NH2-OD1 2.68Å; R944-L971 HydrophobicContact CG-CD1 4.29Å
945	L	81.6	Confident	78.9	Confident	7 Å²	7	71.9 Å²	71.9	4%	0.037	38%	0.382	C	S	.	.			trans	-88.2	-27.1	176.1	-146.4	92.3	0	0	0	113.4	E947 K950 I958 Q959 K965 I966	L945-E947 HydrophobicContact CB-CG 4.15Å; L945-E947 HydrophobicContact CD2-CG 3.54Å; L945-E947 HydrophobicContact CG-CG 4.4Å; L945-K950 PolarHBondContact O-NZ 3.36Å; L945-I958 HydrophobicContact CD1-CG2 3.97Å; L945-I958 HydrophobicContact CD2-CB 4.45Å; L945-I958 HydrophobicContact CD2-CG2 4.13Å; L945-I958 HydrophobicContact CG-CG2 3.93Å; L945-Q959 HydrophobicContact CD2-CB 3.98Å; L945-K965 HydrophobicContact CB-CB 4.48Å; L945-K965 HydrophobicContact CD1-CB 3.57Å; L945-K965 HydrophobicContact CD1-CD 3.9Å; L945-K965 HydrophobicContact CD1-CG 4.31Å; L945-I966 PolarHBondContact N-O 2.9Å
946	H	79.4	Confident	77.9	Confident	60 Å²	60	69.6 Å²	69.6	28%	0.278	38%	0.38	S	S	.	.			trans	50.8	64.7	-171.3	-70.1	-68.8	0	0	0	112.2	E941 S949 K950 D968	E941-H946 IonicContact OE1-CD2 2.72Å; E941-H946 IonicContact OE1-CE1 2.61Å; E941-H946 PolarHBondContact OE1-CE1 3.5Å; E941-H946 VanDerWaalsContact OE1-CE1 3.27Å; E941-H946 IonicContact OE1-NE2 3.14Å; E941-H946 PolarHBondContact OE1-NE2 3.13Å; E941-H946 IonicContact OE2-CE1 2.69Å; E941-H946 IonicContact OE2-NE2 3.51Å; H946-S949 PolarHBondContact O-OG 2.84Å; H946-K950 WeakPolarHBondContact O-CE 3.37Å; H946-K950 PolarHBondContact O-NZ 3.44Å; H946-D968 VanDerWaalsContact CA-OD2 3.26Å; H946-D968 WeakPolarHBondContact CA-OD2 3.31Å
947	E	69.5	Low	77.1	Confident	33 Å²	33	71 Å²	71	15%	0.154	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-70.8	-43.1	-178.2	-73	170.2	160.3	0	0	111.3	L945 S949 K950 A955 Q959 T967 D968	L945-E947 HydrophobicContact CB-CG 4.15Å; L945-E947 HydrophobicContact CD2-CG 3.54Å; L945-E947 HydrophobicContact CG-CG 4.4Å; E947-S949 PolarHBondContact O-N 2.76Å; E947-K950 PolarHBondContact O-N 2.9Å; E947-A955 HydrophobicContact CB-CB 4.48Å; E947-A955 HydrophobicContact CG-CB 4.38Å; E947-Q959 PolarHBondContact OE1-NE2 2.93Å; E947-T967 VanDerWaalsContact OE1-CG2 3.3Å; E947-T967 WeakPolarHBondContact OE1-CG2 3.37Å; E947-T967 WeakPolarHBondContact OE2-CB 2.92Å; E947-D968 PolarHBondContact N-OD2 3.3Å
948	G	64.7	Low	76.2	Confident	79 Å²	79	68.6 Å²	68.6	81%	0.814	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-64.2	-7.1	-177	0	0	0	0	0	115.3
949	S	64.8	Low	75.4	Confident	92 Å²	92	66.9 Å²	66.9	64%	0.643	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-97.8	0.3	175.9	64.1	0	0	0	0	114.3	H946 E947	H946-S949 PolarHBondContact O-OG 2.84Å; E947-S949 PolarHBondContact O-N 2.76Å
950	K	68.7	Low	74.7	Confident	84 Å²	84	74.9 Å²	74.9	37%	0.365	41%	0.41	S	S	.	.	S	Bend	trans	-132.2	161	-167.7	-64.6	165.6	-166.3	157.3	0	112.8	L945 H946 E947 I958	L945-K950 PolarHBondContact O-NZ 3.36Å; H946-K950 WeakPolarHBondContact O-CE 3.37Å; H946-K950 PolarHBondContact O-NZ 3.44Å; E947-K950 PolarHBondContact O-N 2.9Å; K950-I958 HydrophobicContact CD-CD1 3.87Å
951	G	71.3	Confident	74.2	Confident	39 Å²	39	80.1 Å²	80.1	40%	0.402	43%	0.434	S	S	.	.			trans	-66.7	145.5	174.8	0	0	0	0	0	112.3	D953 Q954 A955	G951-D953 VanDerWaalsContact C-N 3.31Å; G951-D953 PolarHBondContact O-N 2.74Å; G951-Q954 WeakPolarHBondContact O-CA 3.5Å; G951-Q954 WeakPolarHBondContact O-CB 3.31Å; G951-Q954 PolarHBondContact O-N 2.95Å; G951-A955 PolarHBondContact O-N 2.85Å
952	R	66.4	Low	73.7	Confident	221 Å²	221	80.2 Å²	80.2	83%	0.834	43%	0.431	S	S	*	.	H	α-helix	trans	-52.8	-43.2	-171.5	-167.6	175.6	-173.3	168	2	113.9	A955 A956	R952-A955 PolarHBondContact O-N 3.32Å; R952-A956 PolarHBondContact O-N 3.19Å
953	D	67.4	Low	73.1	Confident	143 Å²	143	80.6 Å²	80.6	77%	0.765	43%	0.434	S	S	*	.	H	α-helix	trans	-74.2	-30.7	-179.2	-50.5	-56.9	0	0	0	112.5	G951 G957	G951-D953 VanDerWaalsContact C-N 3.31Å; G951-D953 PolarHBondContact O-N 2.74Å; D953-G957 PolarHBondContact O-N 2.74Å
954	Q	66.6	Low	72.6	Confident	130 Å²	130	82 Å²	82	61%	0.607	44%	0.438	S	S	*	.	H	α-helix	trans	-71.7	-40.6	173.7	-65.1	177.5	-8.8	0	0	111.1	G951 G957 I958	G951-Q954 WeakPolarHBondContact O-CA 3.5Å; G951-Q954 WeakPolarHBondContact O-CB 3.31Å; G951-Q954 PolarHBondContact O-N 2.95Å; Q954-G957 PolarHBondContact O-N 3.09Å; Q954-I958 WeakPolarHBondContact O-CD1 3.3Å; Q954-I958 VanDerWaalsContact O-CG1 3.26Å; Q954-I958 WeakPolarHBondContact O-CG1 3.39Å; Q954-I958 PolarHBondContact O-N 2.8Å
955	A	64.2	Low	72.5	Confident	14 Å²	14	81.3 Å²	81.3	12%	0.116	44%	0.437	C	S	.	.	H	α-helix	trans	-59	-48.7	172.9	0	0	0	0	0	111	E947 G951 R952 G957 I958 Q959	E947-A955 HydrophobicContact CB-CB 4.48Å; E947-A955 HydrophobicContact CG-CB 4.38Å; G951-A955 PolarHBondContact O-N 2.85Å; R952-A955 PolarHBondContact O-N 3.32Å; A955-G957 VanDerWaalsContact C-N 3.28Å; A955-G957 PolarHBondContact O-N 3.23Å; A955-I958 PolarHBondContact O-N 2.71Å; A955-Q959 VanDerWaalsContact O-CB 3.25Å; A955-Q959 WeakPolarHBondContact O-CB 3.42Å; A955-Q959 PolarHBondContact O-N 2.87Å
956	A	68.4	Low	72.7	Confident	45 Å²	45	81 Å²	81	37%	0.372	44%	0.435	S	S	.	.	H	α-helix	trans	-63.2	-29	176.6	0	0	0	0	0	113.9	R952 K960	R952-A956 PolarHBondContact O-N 3.19Å; A956-K960 WeakPolarHBondContact O-CG 3.42Å; A956-K960 PolarHBondContact O-N 2.9Å
957	G	73	Confident	72.9	Confident	39 Å²	39	79.3 Å²	79.3	40%	0.402	43%	0.429	S	S	.	.	H	α-helix	trans	-69.1	-53.6	171	0	0	0	0	0	112.5	D953 Q954 A955 Q959 K960 E961	D953-G957 PolarHBondContact O-N 2.74Å; Q954-G957 PolarHBondContact O-N 3.09Å; A955-G957 VanDerWaalsContact C-N 3.28Å; A955-G957 PolarHBondContact O-N 3.23Å; G957-Q959 VanDerWaalsContact C-N 3.27Å; G957-Q959 PolarHBondContact O-N 3.18Å; G957-K960 WeakPolarHBondContact O-CB 3.49Å; G957-K960 PolarHBondContact O-N 2.87Å; G957-K960 VanDerWaalsContact O-N 3.1Å; G957-E961 PolarHBondContact O-N 3.07Å; G957-E961 VanDerWaalsContact O-N 3.11Å
958	I	71.8	Confident	73.6	Confident	47 Å²	47	79.3 Å²	79.3	24%	0.241	43%	0.431	C	S	.	.	H	α-helix	trans	-64.8	-32.3	-178.1	-62.5	163.8	0	0	0	111.2	L945 K950 Q954 A955 E961 Y962	L945-I958 HydrophobicContact CD1-CG2 3.97Å; L945-I958 HydrophobicContact CD2-CB 4.45Å; L945-I958 HydrophobicContact CD2-CG2 4.13Å; L945-I958 HydrophobicContact CG-CG2 3.93Å; K950-I958 HydrophobicContact CD-CD1 3.87Å; Q954-I958 WeakPolarHBondContact O-CD1 3.3Å; Q954-I958 VanDerWaalsContact O-CG1 3.26Å; Q954-I958 WeakPolarHBondContact O-CG1 3.39Å; Q954-I958 PolarHBondContact O-N 2.8Å; A955-I958 PolarHBondContact O-N 2.71Å; I958-E961 PolarHBondContact O-N 2.98Å; I958-Y962 HydrophobicContact CG2-CD2 4.09Å; I958-Y962 PolarHBondContact O-N 3.04Å
959	Q	74.6	Confident	74.4	Confident	88 Å²	88	78.2 Å²	78.2	41%	0.411	41%	0.414	S	S	.	.	H	α-helix	trans	-67.8	-33.3	175.1	-169.1	-176	68.7	0	0	112.3	L945 E947 A955 G957 Y962 P963	L945-Q959 HydrophobicContact CD2-CB 3.98Å; E947-Q959 PolarHBondContact OE1-NE2 2.93Å; A955-Q959 VanDerWaalsContact O-CB 3.25Å; A955-Q959 WeakPolarHBondContact O-CB 3.42Å; A955-Q959 PolarHBondContact O-N 2.87Å; G957-Q959 VanDerWaalsContact C-N 3.27Å; G957-Q959 PolarHBondContact O-N 3.18Å; Q959-Y962 CarbonylContact O-C 3.58Å; Q959-P963 WeakPolarHBondContact O-CA 3.44Å
960	K	75.7	Confident	75.3	Confident	178 Å²	178	74.7 Å²	74.7	77%	0.774	39%	0.387	S	S	*	.	H	α-helix	trans	-73.6	-30.2	172.2	-74.2	175.4	178.4	179.6	0	112.9	A956 G957	A956-K960 WeakPolarHBondContact O-CG 3.42Å; A956-K960 PolarHBondContact O-N 2.9Å; G957-K960 WeakPolarHBondContact O-CB 3.49Å; G957-K960 PolarHBondContact O-N 2.87Å; G957-K960 VanDerWaalsContact O-N 3.1Å
961	E	78.6	Confident	76	Confident	121 Å²	121	72.1 Å²	72.1	57%	0.565	38%	0.377	S	S	*	.	H	α-helix	trans	-75.9	-37.3	176.8	-168.1	178.9	-164	0	0	112.1	G957 I958	G957-E961 PolarHBondContact O-N 3.07Å; G957-E961 VanDerWaalsContact O-N 3.11Å; I958-E961 PolarHBondContact O-N 2.98Å
962	Y	78.4	Confident	76.7	Confident	85 Å²	85	74 Å²	74	33%	0.333	38%	0.384	S	S	.	.			trans	-129.6	62.9	-177.3	-56.2	-68.5	0	0	0	113.3	I958 Q959 W964 K965	I958-Y962 HydrophobicContact CG2-CD2 4.09Å; I958-Y962 PolarHBondContact O-N 3.04Å; Q959-Y962 CarbonylContact O-C 3.58Å; Y962-W964 AromaticContact CD1-CZ2 3.74Å; Y962-W964 HydrophobicContact CD1-CZ2 3.74Å; Y962-W964 AromaticContact CD1-NE1 3.88Å; Y962-W964 HydrophobicContact CE1-CZ2 4.47Å; Y962-W964 HydrophobicContact CG-CZ2 4.48Å; Y962-W964 PolarHBondContact O-N 3.32Å; Y962-K965 HydrophobicContact CG-CD 4.3Å; Y962-K965 PolarHBondContact O-N 3.36Å
963	P	76.7	Confident	77.6	Confident	99 Å²	99	67.7 Å²	67.7	64%	0.643	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-9.2	-175.6	28.7	-37.3	0	0	0	114.7	Q959	Q959-P963 WeakPolarHBondContact O-CA 3.44Å
964	W	77.3	Confident	78.4	Confident	53 Å²	53	62.9 Å²	62.9	20%	0.201	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-13.1	175.7	52.9	-94.5	0	0	0	113.5	T741 F943 Y962 S1011 F1013	T741-W964 HydrophobicContact CG2-CD2 3.92Å; T741-W964 HydrophobicContact CG2-CE3 4.14Å; T741-W964 HydrophobicContact CG2-CG 4.45Å; T741-W964 HydrophobicContact CG2-CH2 4.2Å; T741-W964 HydrophobicContact CG2-CZ2 3.99Å; T741-W964 HydrophobicContact CG2-CZ3 4.28Å; F943-W964 HydrophobicContact CD1-CZ3 4.35Å; Y962-W964 AromaticContact CD1-CZ2 3.74Å; Y962-W964 HydrophobicContact CD1-CZ2 3.74Å; Y962-W964 AromaticContact CD1-NE1 3.88Å; Y962-W964 HydrophobicContact CE1-CZ2 4.47Å; Y962-W964 HydrophobicContact CG-CZ2 4.48Å; Y962-W964 PolarHBondContact O-N 3.32Å; W964-S1011 PolarHBondContact O-OG 3.42Å; W964-F1013 HydrophobicContact CB-CD2 4.31Å; W964-F1013 HydrophobicContact CB-CE2 4.12Å; W964-F1013 HydrophobicContact CD2-CE2 4.34Å; W964-F1013 HydrophobicContact CE3-CD2 4.07Å; W964-F1013 AromaticContact CE3-CE2 3.76Å; W964-F1013 HydrophobicContact CE3-CE2 3.76Å; W964-F1013 HydrophobicContact CE3-CZ 4.13Å; W964-F1013 WeakPolarHBondContact O-CD2 3.38Å
965	K	83.1	Confident	79.4	Confident	50 Å²	50	61 Å²	61	22%	0.217	34%	0.338	C	S	.	.	S	Bend	trans	-76.4	150	178.9	-77.3	-174.1	174.6	-178.4	0	111.8	F943 L945 Y962	F943-K965 CarbonylContact O-C 3.55Å; F943-K965 VanDerWaalsContact O-CA 3.3Å; F943-K965 WeakPolarHBondContact O-CA 3.43Å; F943-K965 VanDerWaalsContact O-CB 3.28Å; F943-K965 WeakPolarHBondContact O-CB 3.29Å; F943-K965 WeakPolarHBondContact O-CG 3.15Å; L945-K965 HydrophobicContact CB-CB 4.48Å; L945-K965 HydrophobicContact CD1-CB 3.57Å; L945-K965 HydrophobicContact CD1-CD 3.9Å; L945-K965 HydrophobicContact CD1-CG 4.31Å; Y962-K965 HydrophobicContact CG-CD 4.3Å; Y962-K965 PolarHBondContact O-N 3.36Å
966	I	85.7	Confident	80.3	Confident	1 Å²	1	65.9 Å²	65.9	1%	0.005	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-75.4	130.3	-178	-55.5	172.4	0	0	0	109.1	I940 F943 R944 L945 L971 F1013 L1014	I940-I966 HydrophobicContact CB-CD1 4Å; I940-I966 HydrophobicContact CG2-CD1 4.11Å; F943-I966 HydrophobicContact CB-CD1 4.21Å; F943-I966 HydrophobicContact CB-CG1 4.49Å; F943-I966 PolarHBondContact O-N 3.03Å; R944-I966 WeakPolarHBondContact CA-O 3.41Å; R944-I966 HydrophobicContact CG-CB 4.47Å; L945-I966 PolarHBondContact N-O 2.9Å; I966-L971 HydrophobicContact CG2-CD1 3.8Å; I966-L971 HydrophobicContact CG2-CD2 3.86Å; I966-L971 HydrophobicContact CG2-CG 3.58Å; I966-F1013 HydrophobicContact CD1-CB 4.23Å; I966-F1013 HydrophobicContact CG1-CB 4.17Å; I966-L1014 HydrophobicContact CD1-CB 3.99Å; I966-L1014 HydrophobicContact CD1-CD1 4.41Å; I966-L1014 HydrophobicContact CG1-CB 4.12Å; I966-L1014 HydrophobicContact CG2-CB 4.44Å
967	T	85	Confident	81.1	Confident	24 Å²	24	66.9 Å²	66.9	15%	0.147	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-93.7	154.2	-179.7	66.4	0	0	0	0	111.4	E947 A969 E970 L971	E947-T967 VanDerWaalsContact OE1-CG2 3.3Å; E947-T967 WeakPolarHBondContact OE1-CG2 3.37Å; E947-T967 WeakPolarHBondContact OE2-CB 2.92Å; T967-A969 VanDerWaalsContact C-N 3.3Å; T967-E970 PolarHBondContact N-OE2 3.26Å; T967-E970 PolarHBondContact O-N 3.01Å; T967-E970 WeakPolarHBondContact OG1-CB 3.47Å; T967-E970 PolarHBondContact OG1-N 3.44Å; T967-E970 VanDerWaalsContact OG1-N 3.13Å; T967-L971 PolarHBondContact O-N 2.92Å; T967-L971 VanDerWaalsContact O-N 3.14Å
968	D	82.9	Confident	81.8	Confident	34 Å²	34	65.8 Å²	65.8	18%	0.182	34%	0.34	C	S	.	.	H	α-helix	trans	-75	-26.5	179.5	-60.3	-56.8	0	0	0	111.3	R944 H946 E947 S972	R944-D968 IonicContact CZ-OD1 3.27Å; R944-D968 IonicContact NE-OD1 3.9Å; R944-D968 IonicContact NH2-OD1 3.87Å; R944-D968 PolarHBondContact NH2-OD1 2.68Å; H946-D968 VanDerWaalsContact CA-OD2 3.26Å; H946-D968 WeakPolarHBondContact CA-OD2 3.31Å; E947-D968 PolarHBondContact N-OD2 3.3Å; D968-S972 PolarHBondContact O-N 3.12Å; D968-S972 VanDerWaalsContact O-N 3.14Å; D968-S972 PolarHBondContact O-OG 3.01Å
969	A	82	Confident	82.6	Confident	56 Å²	56	65.2 Å²	65.2	46%	0.463	34%	0.336	S	S	.	.	H	α-helix	trans	-66.1	-39	170.5	0	0	0	0	0	112.6	T967 S972 S973	T967-A969 VanDerWaalsContact C-N 3.3Å; A969-S972 WeakPolarHBondContact CA-OG 3.5Å; A969-S972 PolarHBondContact O-OG 3.37Å; A969-S972 VanDerWaalsContact O-OG 3.09Å; A969-S973 VanDerWaalsContact O-CB 3.25Å; A969-S973 WeakPolarHBondContact O-CB 3.35Å; A969-S973 PolarHBondContact O-N 3.34Å; A969-S973 PolarHBondContact O-OG 3.49Å
970	E	83.3	Confident	83.3	Confident	17 Å²	17	62.4 Å²	62.4	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-66	-47.2	174.1	174.9	-168.8	-175.7	0	0	111.8	T967 S972 S973 F974 S1011 L1014	T967-E970 PolarHBondContact N-OE2 3.26Å; T967-E970 PolarHBondContact O-N 3.01Å; T967-E970 WeakPolarHBondContact OG1-CB 3.47Å; T967-E970 PolarHBondContact OG1-N 3.44Å; T967-E970 VanDerWaalsContact OG1-N 3.13Å; E970-S972 VanDerWaalsContact C-N 3.34Å; E970-S972 PolarHBondContact O-N 3.43Å; E970-S973 PolarHBondContact O-N 3.29Å; E970-F974 HydrophobicContact CG-CD2 4.07Å; E970-F974 HydrophobicContact CG-CE2 4.42Å; E970-F974 WeakPolarHBondContact O-CD2 3.38Å; E970-F974 PolarHBondContact O-N 2.77Å; E970-S1011 WeakPolarHBondContact OE1-CB 3.4Å; E970-S1011 PolarHBondContact OE1-N 3.19Å; E970-L1014 HydrophobicContact CG-CD2 3.77Å; E970-L1014 WeakPolarHBondContact OE1-CB 3.38Å; E970-L1014 VanDerWaalsContact OE1-CD2 3.27Å; E970-L1014 WeakPolarHBondContact OE1-CD2 3.41Å
971	L	84.5	Confident	84	Confident	30 Å²	30	54.5 Å²	54.5	16%	0.157	29%	0.289	C	S	.	.	H	α-helix	trans	-60.8	-41.8	-179.9	-75.6	168.8	0	0	0	112.5	I940 R944 I966 T967 F974 E975 L1014	I940-L971 HydrophobicContact CD1-CD1 4Å; I940-L971 HydrophobicContact CD1-CD2 3.64Å; R944-L971 HydrophobicContact CG-CD1 4.29Å; I966-L971 HydrophobicContact CG2-CD1 3.8Å; I966-L971 HydrophobicContact CG2-CD2 3.86Å; I966-L971 HydrophobicContact CG2-CG 3.58Å; T967-L971 PolarHBondContact O-N 2.92Å; T967-L971 VanDerWaalsContact O-N 3.14Å; L971-F974 CarbonylContact O-C 3.46Å; L971-E975 PolarHBondContact O-N 3.42Å; L971-L1014 HydrophobicContact CD2-CD1 3.86Å; L971-L1014 HydrophobicContact CD2-CD2 4.24Å
972	S	84.6	Confident	84.6	Confident	79 Å²	79	48.9 Å²	48.9	55%	0.552	26%	0.263	S	S	*	.	H	α-helix	trans	-69.3	-40	174.3	46.8	0	0	0	0	112.3	D968 A969 E970 F974 E975	D968-S972 PolarHBondContact O-N 3.12Å; D968-S972 VanDerWaalsContact O-N 3.14Å; D968-S972 PolarHBondContact O-OG 3.01Å; A969-S972 WeakPolarHBondContact CA-OG 3.5Å; A969-S972 PolarHBondContact O-OG 3.37Å; A969-S972 VanDerWaalsContact O-OG 3.09Å; E970-S972 VanDerWaalsContact C-N 3.34Å; E970-S972 PolarHBondContact O-N 3.43Å; S972-F974 PolarHBondContact O-N 2.95Å; S972-E975 PolarHBondContact O-N 3.34Å
973	S	85.4	Confident	85.3	Confident	89 Å²	89	46 Å²	46	62%	0.622	25%	0.252	S	S	*	.	H	α-helix	trans	-64.6	-24.2	176.6	-60.9	0	0	0	0	114	A969 E970	A969-S973 VanDerWaalsContact O-CB 3.25Å; A969-S973 WeakPolarHBondContact O-CB 3.35Å; A969-S973 PolarHBondContact O-N 3.34Å; A969-S973 PolarHBondContact O-OG 3.49Å; E970-S973 PolarHBondContact O-N 3.29Å
974	F	85.6	Confident	86	Confident	42 Å²	42	41.6 Å²	41.6	18%	0.184	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.6	24.4	-179.6	-60.1	-65.3	0	0	0	114	E970 L971 S972 E976 K977 T978 S1009 I1010 W1018	E970-F974 HydrophobicContact CG-CD2 4.07Å; E970-F974 HydrophobicContact CG-CE2 4.42Å; E970-F974 WeakPolarHBondContact O-CD2 3.38Å; E970-F974 PolarHBondContact O-N 2.77Å; L971-F974 CarbonylContact O-C 3.46Å; S972-F974 PolarHBondContact O-N 2.95Å; F974-E976 VanDerWaalsContact C-N 3.33Å; F974-E976 PolarHBondContact O-N 3.23Å; F974-K977 HydrophobicContact CD1-CD 4.09Å; F974-K977 PolarHBondContact O-N 3.49Å; F974-T978 WeakPolarHBondContact O-CB 3.17Å; F974-T978 PolarHBondContact O-N 2.76Å; F974-T978 PolarHBondContact O-OG1 3.43Å; F974-S1009 WeakPolarHBondContact CE2-O 3.38Å; F974-I1010 HydrophobicContact CD2-CD1 4.5Å; F974-I1010 HydrophobicContact CD2-CG1 3.82Å; F974-I1010 HydrophobicContact CE1-CD1 4.32Å; F974-I1010 HydrophobicContact CE1-CG1 4.41Å; F974-I1010 HydrophobicContact CE2-CD1 4.21Å; F974-I1010 HydrophobicContact CE2-CG1 3.45Å; F974-I1010 VanDerWaalsContact CE2-CG1 3.45Å; F974-I1010 HydrophobicContact CG-CG1 4.46Å; F974-I1010 HydrophobicContact CZ-CD1 4.11Å; F974-I1010 HydrophobicContact CZ-CG1 3.77Å; F974-W1018 HydrophobicContact CB-CH2 4.06Å; F974-W1018 HydrophobicContact CB-CZ2 3.78Å; F974-W1018 HydrophobicContact CG-CH2 4.22Å; F974-W1018 HydrophobicContact CG-CZ2 4.39Å
975	E	86.3	Confident	86.7	Confident	90 Å²	90	39.4 Å²	39.4	42%	0.421	22%	0.215	S	C	.	.	H	α-helix	trans	-53.5	-48.9	179.1	-171.5	-165.4	134.9	0	0	111.2	K927 L971 S972 K977 T978 H979	K927-E975 IonicContact NZ-OE1 3.36Å; L971-E975 PolarHBondContact O-N 3.42Å; S972-E975 PolarHBondContact O-N 3.34Å; E975-K977 PolarHBondContact O-N 3.36Å; E975-T978 WeakPolarHBondContact O-CB 3.35Å; E975-T978 PolarHBondContact O-N 2.98Å; E975-H979 VanDerWaalsContact CG-CE1 3.48Å; E975-H979 WeakPolarHBondContact CG-CE1 3.45Å; E975-H979 PolarHBondContact O-N 2.99Å; E975-H979 PolarHBondContact O-ND1 3.33Å; E975-H979 IonicContact OE1-CE1 2.84Å; E975-H979 PolarHBondContact OE1-CE1 3Å; E975-H979 IonicContact OE1-ND1 2.72Å; E975-H979 PolarHBondContact OE1-ND1 3.48Å
976	E	83.7	Confident	87.2	Confident	117 Å²	117	37.8 Å²	37.8	55%	0.547	21%	0.208	S	C	.	.	H	α-helix	trans	-63.9	-43.7	-178.2	-57.6	-166.2	128.8	0	0	112.8	H49 F974 T978 H979 L980	H49-E976 IonicContact CE1-OE1 2.69Å; H49-E976 IonicContact CE1-OE2 3.67Å; H49-E976 PolarHBondContact CE1-OE2 2.86Å; H49-E976 IonicContact CG-OE2 3.6Å; H49-E976 VanDerWaalsContact ND1-CD 3.33Å; H49-E976 IonicContact ND1-OE1 3.54Å; H49-E976 IonicContact ND1-OE2 3.49Å; H49-E976 PolarHBondContact ND1-OE2 3.47Å; F974-E976 VanDerWaalsContact C-N 3.33Å; F974-E976 PolarHBondContact O-N 3.23Å; E976-T978 VanDerWaalsContact C-N 3.27Å; E976-T978 PolarHBondContact O-N 2.65Å; E976-H979 PolarHBondContact O-N 3.18Å; E976-L980 WeakPolarHBondContact O-CB 3.48Å; E976-L980 PolarHBondContact O-N 2.91Å
977	K	84	Confident	87.5	Confident	65 Å²	65	37.8 Å²	37.8	28%	0.283	21%	0.208	S	C	.	.	H	α-helix	trans	-64.9	-34.6	176.3	-70.1	-165.8	-179	-176.1	0	112.1	F974 E975 L980 Q981 W1018	F974-K977 HydrophobicContact CD1-CD 4.09Å; F974-K977 PolarHBondContact O-N 3.49Å; E975-K977 PolarHBondContact O-N 3.36Å; K977-L980 WeakPolarHBondContact O-CB 3.41Å; K977-L980 PolarHBondContact O-N 3.22Å; K977-Q981 WeakPolarHBondContact O-CG 3.47Å; K977-Q981 PolarHBondContact O-N 3.13Å; K977-Q981 PolarHBondContact O-NE2 2.87Å; K977-W1018 HydrophobicContact CB-CH2 4.06Å; K977-W1018 HydrophobicContact CB-CZ2 4.17Å; K977-W1018 HydrophobicContact CD-CH2 4.31Å
978	T	87.8	Confident	87.8	Confident	17 Å²	17	36.6 Å²	36.6	10%	0.104	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-49.1	176.7	-58.3	0	0	0	0	110.3	L936 F974 E975 E976 L980 Q981 V982 W1018	L936-T978 HydrophobicContact CD2-CG2 3.4Å; F974-T978 WeakPolarHBondContact O-CB 3.17Å; F974-T978 PolarHBondContact O-N 2.76Å; F974-T978 PolarHBondContact O-OG1 3.43Å; E975-T978 WeakPolarHBondContact O-CB 3.35Å; E975-T978 PolarHBondContact O-N 2.98Å; E976-T978 VanDerWaalsContact C-N 3.27Å; E976-T978 PolarHBondContact O-N 2.65Å; T978-L980 VanDerWaalsContact C-N 3.31Å; T978-L980 PolarHBondContact O-N 2.99Å; T978-Q981 PolarHBondContact O-N 3.44Å; T978-V982 PolarHBondContact O-N 3.31Å; T978-W1018 PolarHBondContact OG1-NE1 3.23Å
979	H	90.3	Very high	88.2	Confident	34 Å²	34	37.6 Å²	37.6	16%	0.157	21%	0.205	C	C	.	.	H	α-helix	trans	-58.7	-40	173	-75.8	139.3	0	0	0	112.8	P928 E975 E976 Q981 V982 R983	P928-H979 HydrophobicContact CG-CB 4.03Å; E975-H979 VanDerWaalsContact CG-CE1 3.48Å; E975-H979 WeakPolarHBondContact CG-CE1 3.45Å; E975-H979 PolarHBondContact O-N 2.99Å; E975-H979 PolarHBondContact O-ND1 3.33Å; E975-H979 IonicContact OE1-CE1 2.84Å; E975-H979 PolarHBondContact OE1-CE1 3Å; E975-H979 IonicContact OE1-ND1 2.72Å; E975-H979 PolarHBondContact OE1-ND1 3.48Å; E976-H979 PolarHBondContact O-N 3.18Å; H979-Q981 PolarHBondContact O-N 3.1Å; H979-V982 PolarHBondContact O-N 3.24Å; H979-R983 WeakPolarHBondContact O-CB 3.35Å; H979-R983 PolarHBondContact O-N 2.97Å
980	L	88.9	Confident	88.7	Confident	30 Å²	30	40.9 Å²	40.9	16%	0.157	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-42.8	174.8	175.8	63	0	0	0	112.5	I924 E976 K977 T978 V982 R983 L984	I924-L980 HydrophobicContact CG2-CD1 3.29Å; E976-L980 WeakPolarHBondContact O-CB 3.48Å; E976-L980 PolarHBondContact O-N 2.91Å; K977-L980 WeakPolarHBondContact O-CB 3.41Å; K977-L980 PolarHBondContact O-N 3.22Å; T978-L980 VanDerWaalsContact C-N 3.31Å; T978-L980 PolarHBondContact O-N 2.99Å; L980-V982 VanDerWaalsContact C-N 3.32Å; L980-V982 PolarHBondContact O-N 3.04Å; L980-R983 PolarHBondContact O-N 3.47Å; L980-L984 HydrophobicContact CD1-CD1 4.03Å; L980-L984 HydrophobicContact CD1-CG 4.04Å; L980-L984 HydrophobicContact CG-CD1 4.04Å; L980-L984 HydrophobicContact CG-CG 4.46Å; L980-L984 WeakPolarHBondContact O-CB 3.48Å; L980-L984 VanDerWaalsContact O-CG 3.27Å; L980-L984 WeakPolarHBondContact O-CG 3.43Å; L980-L984 PolarHBondContact O-N 2.74Å
981	Q	90.4	Very high	89.1	Confident	11 Å²	11	43 Å²	43	5%	0.051	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-36.7	178.6	-57.3	-33.3	-67.6	0	0	112.2	K977 T978 H979 N985 W1018 I1021	K977-Q981 WeakPolarHBondContact O-CG 3.47Å; K977-Q981 PolarHBondContact O-N 3.13Å; K977-Q981 PolarHBondContact O-NE2 2.87Å; T978-Q981 PolarHBondContact O-N 3.44Å; H979-Q981 PolarHBondContact O-N 3.1Å; Q981-N985 PolarHBondContact O-N 3.34Å; Q981-W1018 HydrophobicContact CG-CB 3.95Å; Q981-W1018 HydrophobicContact CG-CD2 4.29Å; Q981-W1018 HydrophobicContact CG-CG 3.91Å; Q981-I1021 HydrophobicContact CB-CG2 4.24Å
982	V	91.7	Very high	89.5	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.018	21%	0.213	C	C	.	.	H	α-helix	trans	-68.1	-45	175.4	-175.4	0	0	0	0	110.5	P928 N932 L936 T978 H979 L980 L984 N985 E986 I1021	P928-V982 HydrophobicContact CB-CB 3.92Å; P928-V982 HydrophobicContact CB-CG1 3.63Å; P928-V982 HydrophobicContact CG-CB 3.98Å; P928-V982 HydrophobicContact CG-CG1 4.08Å; N932-V982 HydrophobicContact CB-CG1 3.52Å; L936-V982 HydrophobicContact CD2-CG2 3.73Å; T978-V982 PolarHBondContact O-N 3.31Å; H979-V982 PolarHBondContact O-N 3.24Å; L980-V982 VanDerWaalsContact C-N 3.32Å; L980-V982 PolarHBondContact O-N 3.04Å; V982-L984 PolarHBondContact O-N 2.81Å; V982-N985 PolarHBondContact O-N 3.42Å; V982-E986 PolarHBondContact O-N 3.24Å; V982-I1021 HydrophobicContact CG2-CG1 4.19Å; V982-I1021 HydrophobicContact CG2-CG2 4.47Å
983	R	91.8	Very high	89.8	Confident	25 Å²	25	44.1 Å²	44.1	9%	0.094	21%	0.214	C	C	.	.	H	α-helix	trans	-63.1	-41.4	178.6	-176.1	62.8	-170.5	145.9	3.3	111.9	D923 I926 P928 H979 L980 N985 E986 L987	D923-R983 PolarHBondContact O-NE 3.49Å; D923-R983 IonicContact OD2-CZ 2.74Å; D923-R983 IonicContact OD2-NH2 3.74Å; D923-R983 PolarHBondContact OD2-NH2 3.09Å; I926-R983 VanDerWaalsContact O-CD 3.3Å; I926-R983 WeakPolarHBondContact O-CD 3.44Å; I926-R983 WeakPolarHBondContact O-CG 3.41Å; P928-R983 HydrophobicContact CB-CB 4.23Å; H979-R983 WeakPolarHBondContact O-CB 3.35Å; H979-R983 PolarHBondContact O-N 2.97Å; L980-R983 PolarHBondContact O-N 3.47Å; R983-N985 VanDerWaalsContact C-N 3.32Å; R983-N985 PolarHBondContact O-N 2.93Å; R983-E986 IonicContact CZ-OE2 2.64Å; R983-E986 IonicContact NH1-OE2 2.85Å; R983-E986 PolarHBondContact NH1-OE2 3.02Å; R983-E986 WeakPolarHBondContact O-CB 3.38Å; R983-E986 PolarHBondContact O-N 3.46Å; R983-L987 HydrophobicContact CG-CD1 4.16Å; R983-L987 WeakPolarHBondContact O-CG 3.37Å; R983-L987 PolarHBondContact O-N 3.46Å; R983-L987 VanDerWaalsContact O-N 3.15Å
984	L	91.1	Very high	90.1	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-61.5	-37.3	174.2	-73.1	171.9	0	0	0	112.3	L861 I924 L980 V982 E986 L987 L988 L1022	L861-L984 HydrophobicContact CD1-CD1 3.92Å; L861-L984 HydrophobicContact CD1-CD2 3.93Å; I924-L984 HydrophobicContact CG2-CD2 4.46Å; L980-L984 HydrophobicContact CD1-CD1 4.03Å; L980-L984 HydrophobicContact CD1-CG 4.04Å; L980-L984 HydrophobicContact CG-CD1 4.04Å; L980-L984 HydrophobicContact CG-CG 4.46Å; L980-L984 WeakPolarHBondContact O-CB 3.48Å; L980-L984 VanDerWaalsContact O-CG 3.27Å; L980-L984 WeakPolarHBondContact O-CG 3.43Å; L980-L984 PolarHBondContact O-N 2.74Å; V982-L984 PolarHBondContact O-N 2.81Å; L984-E986 PolarHBondContact O-N 3.33Å; L984-L987 PolarHBondContact O-N 3.07Å; L984-L988 WeakPolarHBondContact O-CB 3.21Å; L984-L988 VanDerWaalsContact O-CD1 3.32Å; L984-L988 WeakPolarHBondContact O-CD1 3.36Å; L984-L988 WeakPolarHBondContact O-CG 3.48Å; L984-L988 PolarHBondContact O-N 3.12Å; L984-L1022 HydrophobicContact CB-CD1 3.53Å; L984-L1022 HydrophobicContact CD1-CD1 4.18Å
985	N	93.1	Very high	90.4	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-38.3	174.5	-174.3	-104.2	0	0	0	112.5	Q981 V982 R983 L988 Q989 I1021 L1022 K1024	Q981-N985 PolarHBondContact O-N 3.34Å; V982-N985 PolarHBondContact O-N 3.42Å; R983-N985 VanDerWaalsContact C-N 3.32Å; R983-N985 PolarHBondContact O-N 2.93Å; N985-L988 PolarHBondContact O-N 3.39Å; N985-Q989 WeakPolarHBondContact O-CB 3.34Å; N985-Q989 WeakPolarHBondContact O-CG 3.4Å; N985-Q989 PolarHBondContact O-N 3.18Å; N985-Q989 PolarHBondContact OD1-NE2 3.35Å; N985-I1021 WeakPolarHBondContact CB-O 3.21Å; N985-I1021 PolarHBondContact ND2-O 2.73Å; N985-I1021 VanDerWaalsContact ND2-O 3.15Å; N985-L1022 PolarHBondContact ND2-O 3.38Å; N985-K1024 PolarHBondContact ND2-N 2.81Å; N985-K1024 PolarHBondContact ND2-O 3.47Å
986	E	92.3	Very high	90.7	Very high	16 Å²	16	40 Å²	40	8%	0.075	20%	0.198	C	C	.	.	H	α-helix	trans	-59.9	-48.5	174.9	-63.3	178.6	162.8	0	0	111.2	R929 N932 V982 R983 L984 Q989 E990	R929-E986 VanDerWaalsContact CB-OE1 3.3Å; R929-E986 WeakPolarHBondContact CB-OE1 3.07Å; R929-E986 VanDerWaalsContact CG-OE1 3.31Å; R929-E986 WeakPolarHBondContact CG-OE1 3.35Å; R929-E986 PolarHBondContact N-OE1 3.16Å; N932-E986 PolarHBondContact ND2-OE1 3.04Å; V982-E986 PolarHBondContact O-N 3.24Å; R983-E986 IonicContact CZ-OE2 2.64Å; R983-E986 IonicContact NH1-OE2 2.85Å; R983-E986 PolarHBondContact NH1-OE2 3.02Å; R983-E986 WeakPolarHBondContact O-CB 3.38Å; R983-E986 PolarHBondContact O-N 3.46Å; L984-E986 PolarHBondContact O-N 3.33Å; E986-Q989 PolarHBondContact O-N 2.78Å; E986-E990 PolarHBondContact O-N 3.22Å
987	L	91.8	Very high	91.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-38.3	-179.7	-66.2	166.3	0	0	0	112.7	W859 V921 D923 I924 R983 L984 E990 H991	W859-L987 HydrophobicContact CH2-CB 3.91Å; W859-L987 HydrophobicContact CZ3-CB 4.33Å; V921-L987 HydrophobicContact CG1-CD1 4.01Å; V921-L987 HydrophobicContact CG1-CD2 4.28Å; D923-L987 WeakPolarHBondContact OD1-CD2 3.35Å; D923-L987 WeakPolarHBondContact OD2-CD2 3.41Å; I924-L987 HydrophobicContact CG1-CD1 4.12Å; R983-L987 HydrophobicContact CG-CD1 4.16Å; R983-L987 WeakPolarHBondContact O-CG 3.37Å; R983-L987 PolarHBondContact O-N 3.46Å; R983-L987 VanDerWaalsContact O-N 3.15Å; L984-L987 PolarHBondContact O-N 3.07Å; L987-E990 PolarHBondContact O-N 2.97Å; L987-H991 PolarHBondContact O-CD2 3.48Å; L987-H991 PolarHBondContact O-N 2.93Å
988	L	92.7	Very high	91.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64	-40.1	172.7	-74.2	161.1	0	0	0	111.9	W859 L984 N985 E990 S992 I998 L1000 L1022 L1026	W859-L988 HydrophobicContact CD2-CD2 3.75Å; W859-L988 HydrophobicContact CE3-CD2 4.44Å; W859-L988 HydrophobicContact CG-CD2 3.89Å; W859-L988 HydrophobicContact CZ2-CD2 4.07Å; W859-L988 HydrophobicContact CZ2-CG 4.47Å; L984-L988 WeakPolarHBondContact O-CB 3.21Å; L984-L988 VanDerWaalsContact O-CD1 3.32Å; L984-L988 WeakPolarHBondContact O-CD1 3.36Å; L984-L988 WeakPolarHBondContact O-CG 3.48Å; L984-L988 PolarHBondContact O-N 3.12Å; N985-L988 PolarHBondContact O-N 3.39Å; L988-E990 VanDerWaalsContact C-N 3.34Å; L988-S992 WeakPolarHBondContact O-CA 3.34Å; L988-S992 WeakPolarHBondContact O-CB 3.28Å; L988-S992 PolarHBondContact O-N 3.05Å; L988-I998 HydrophobicContact CD2-CG2 4.04Å; L988-L1000 HydrophobicContact CD1-CD2 3.74Å; L988-L1022 HydrophobicContact CD1-CD1 4.06Å; L988-L1026 HydrophobicContact CB-CD1 3.71Å; L988-L1026 HydrophobicContact CB-CD2 3.83Å; L988-L1026 HydrophobicContact CB-CG 4.42Å; L988-L1026 HydrophobicContact CD1-CD1 3.96Å; L988-L1026 HydrophobicContact CG-CD1 4.3Å
989	Q	91.9	Very high	92.1	Very high	55 Å²	55	30.5 Å²	30.5	26%	0.257	15%	0.154	S	C	.	.	H	α-helix	trans	-70.4	-28.9	175.8	-76.1	-165.8	55.6	0	0	112.8	N985 E986 K993 L1026	N985-Q989 WeakPolarHBondContact O-CB 3.34Å; N985-Q989 WeakPolarHBondContact O-CG 3.4Å; N985-Q989 PolarHBondContact O-N 3.18Å; N985-Q989 PolarHBondContact OD1-NE2 3.35Å; E986-Q989 PolarHBondContact O-N 2.78Å; Q989-K993 VanDerWaalsContact O-CB 3.32Å; Q989-K993 WeakPolarHBondContact O-CB 3.41Å; Q989-L1026 HydrophobicContact CB-CD2 4.43Å; Q989-L1026 HydrophobicContact CG-CD2 3.77Å
990	E	91.5	Very high	92.4	Very high	125 Å²	125	28.9 Å²	28.9	58%	0.584	15%	0.147	S	C	*	.	H	α-helix	trans	-75	-52.3	177.7	-172	159.7	165.6	0	0	111.9	E986 L987 L988	E986-E990 PolarHBondContact O-N 3.22Å; L987-E990 PolarHBondContact O-N 2.97Å; L988-E990 VanDerWaalsContact C-N 3.34Å
991	H	91.7	Very high	92.5	Very high	62 Å²	62	27.6 Å²	27.6	29%	0.287	14%	0.14	S	C	.	.	H	α-helix	trans	-94.2	-28.5	-171.8	-57.5	-54	0	0	0	115.5	W859 R887 F889 L987	W859-H991 HydrophobicContact CZ2-CB 4.23Å; R887-H991 PolarHBondContact NH2-O 2.67Å; F889-H991 HydrophobicContact CE1-CB 3.66Å; F889-H991 HydrophobicContact CZ-CB 3.96Å; L987-H991 PolarHBondContact O-CD2 3.48Å; L987-H991 PolarHBondContact O-N 2.93Å
992	S	93.8	Very high	92.5	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-115.5	4.3	-166.4	-72.3	0	0	0	0	115.6	D857 W859 L988 S994 A995	D857-S992 WeakPolarHBondContact CB-OG 3.19Å; D857-S992 WeakPolarHBondContact OD2-CA 3.45Å; D857-S992 VanDerWaalsContact OD2-CB 3.24Å; D857-S992 WeakPolarHBondContact OD2-CB 3.11Å; D857-S992 PolarHBondContact OD2-OG 3.27Å; W859-S992 PolarHBondContact NE1-OG 3.05Å; L988-S992 WeakPolarHBondContact O-CA 3.34Å; L988-S992 WeakPolarHBondContact O-CB 3.28Å; L988-S992 PolarHBondContact O-N 3.05Å; S992-S994 PolarHBondContact O-N 2.99Å; S992-A995 VanDerWaalsContact O-CB 3.25Å; S992-A995 WeakPolarHBondContact O-CB 3.42Å; S992-A995 PolarHBondContact O-N 3.2Å
993	K	90.9	Very high	92.3	Very high	132 Å²	132	27.5 Å²	27.5	57%	0.574	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-18	-179	-171.8	167.8	-172.5	163.9	0	115.7	Q989 P1027	Q989-K993 VanDerWaalsContact O-CB 3.32Å; Q989-K993 WeakPolarHBondContact O-CB 3.41Å; K993-P1027 VanDerWaalsContact O-CG 3.29Å; K993-P1027 WeakPolarHBondContact O-CG 3.33Å
994	S	90.4	Very high	91.8	Very high	101 Å²	101	28 Å²	28	71%	0.706	14%	0.144	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.7	3.4	176.6	56.5	0	0	0	0	114.6	S992	S992-S994 PolarHBondContact O-N 2.99Å
995	A	92.2	Very high	91.2	Very high	8 Å²	8	27.8 Å²	27.8	7%	0.066	14%	0.144	C	C	.	.			trans	-69.1	152.2	-178.7	0	0	0	0	0	113.1	D857 S992 I998 P1027	D857-A995 HydrophobicContact CB-CB 4.23Å; S992-A995 VanDerWaalsContact O-CB 3.25Å; S992-A995 WeakPolarHBondContact O-CB 3.42Å; S992-A995 PolarHBondContact O-N 3.2Å; A995-I998 HydrophobicContact CB-CG1 4.01Å; A995-P1027 WeakPolarHBondContact O-CB 3.25Å
996	N	92.3	Very high	90.3	Very high	24 Å²	24	31.1 Å²	31.1	13%	0.128	16%	0.156	C	C	.	.	S	Bend	trans	-80.1	-27.4	172.3	-66	118.5	0	0	0	113	G854 T855 W881	G854-N996 VanDerWaalsContact CA-OD1 3.23Å; G854-N996 WeakPolarHBondContact CA-OD1 3.5Å; T855-N996 PolarHBondContact N-OD1 3.48Å; T855-N996 PolarHBondContact O-N 2.83Å; W881-N996 HydrophobicContact CZ3-CB 4.16Å
997	L	94.4	Very high	89.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	132.3	176	177.4	67.8	0	0	0	107.7	I856 D857 L875 W881 V999 P1028 M1030	I856-L997 WeakPolarHBondContact CA-O 3.49Å; I856-L997 HydrophobicContact CG1-CB 4.46Å; I856-L997 HydrophobicContact CG2-CB 4.36Å; I856-L997 HydrophobicContact CG2-CD2 4.34Å; D857-L997 PolarHBondContact N-O 2.74Å; L875-L997 HydrophobicContact CD1-CD2 3.51Å; W881-L997 HydrophobicContact CH2-CB 3.86Å; W881-L997 HydrophobicContact CH2-CD2 4.05Å; W881-L997 HydrophobicContact CH2-CG 4.49Å; W881-L997 HydrophobicContact CZ3-CB 3.91Å; W881-L997 HydrophobicContact CZ3-CD2 4.45Å; L997-V999 HydrophobicContact CD2-CG2 4.1Å; L997-V999 HydrophobicContact CG-CG2 4.18Å; L997-P1028 WeakPolarHBondContact CA-O 3.33Å; L997-M1030 HydrophobicContact CD1-CB 4.43Å
998	I	96	Very high	88.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.5	167.1	-55.9	174.1	0	0	0	107.9	D857 L988 A995 L1026 P1027 P1028 I1029 M1030	D857-I998 CarbonylContact O-C 3.42Å; D857-I998 WeakPolarHBondContact O-CA 3.38Å; L988-I998 HydrophobicContact CD2-CG2 4.04Å; A995-I998 HydrophobicContact CB-CG1 4.01Å; I998-L1026 HydrophobicContact CD1-CB 4.24Å; I998-L1026 HydrophobicContact CD1-CD1 4.32Å; I998-L1026 HydrophobicContact CD1-CD2 4.27Å; I998-P1027 HydrophobicContact CD1-CG 4.49Å; I998-P1028 PolarHBondContact N-O 2.99Å; I998-I1029 HydrophobicContact CB-CB 4.1Å; I998-I1029 HydrophobicContact CB-CD1 3.97Å; I998-I1029 HydrophobicContact CB-CG1 3.85Å; I998-I1029 HydrophobicContact CD1-CD1 4.48Å; I998-I1029 HydrophobicContact CG2-CD1 3.68Å; I998-I1029 HydrophobicContact CG2-CG1 3.94Å; I998-I1029 WeakPolarHBondContact O-CA 3.36Å; I998-M1030 PolarHBondContact O-N 3.41Å
999	V	95.9	Very high	87.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.8	171.1	-174.4	0	0	0	0	107	I856 D857 V858 W859 T868 P872 L997 M1030 V1032	I856-V999 HydrophobicContact CG2-CG2 4.16Å; D857-V999 PolarHBondContact O-N 3.2Å; V858-V999 CarbonylContact C-O 3.52Å; V858-V999 WeakPolarHBondContact CA-O 3.38Å; V858-V999 HydrophobicContact CG1-CB 4.35Å; V858-V999 HydrophobicContact CG2-CB 4.44Å; W859-V999 PolarHBondContact N-O 3.14Å; T868-V999 HydrophobicContact CG2-CG1 4.32Å; P872-V999 HydrophobicContact CB-CG2 4.13Å; P872-V999 HydrophobicContact CG-CG2 4.31Å; L997-V999 HydrophobicContact CD2-CG2 4.1Å; L997-V999 HydrophobicContact CG-CG2 4.18Å; V999-M1030 WeakPolarHBondContact CA-O 3.04Å; V999-M1030 HydrophobicContact CG1-CE 3.99Å; V999-M1030 HydrophobicContact CG2-CE 4.1Å; V999-V1032 HydrophobicContact CG1-CG2 3.58Å
1000	L	94.7	Very high	87.1	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	136.1	-170.8	172.2	62.1	0	0	0	110	W859 L861 L988 L1002 L1022 I1029 M1030 L1031 V1032	W859-L1000 HydrophobicContact CB-CB 4.39Å; W859-L1000 HydrophobicContact CB-CD1 3.49Å; W859-L1000 VanDerWaalsContact CB-CD1 3.49Å; W859-L1000 HydrophobicContact CG-CD1 4.3Å; L861-L1000 HydrophobicContact CD1-CD1 3.74Å; L861-L1000 HydrophobicContact CG-CD1 4.34Å; L988-L1000 HydrophobicContact CD1-CD2 3.74Å; L1000-L1002 PolarHBondContact O-N 3.05Å; L1000-L1022 HydrophobicContact CD2-CD1 4.16Å; L1000-L1022 HydrophobicContact CD2-CD2 3.93Å; L1000-L1022 HydrophobicContact CD2-CG 3.97Å; L1000-I1029 HydrophobicContact CB-CD1 4.21Å; L1000-I1029 HydrophobicContact CB-CG1 4.49Å; L1000-I1029 HydrophobicContact CD2-CD1 3.93Å; L1000-M1030 PolarHBondContact N-O 2.91Å; L1000-L1031 HydrophobicContact CB-CD2 4.23Å; L1000-L1031 HydrophobicContact CD2-CD2 3.82Å; L1000-L1031 HydrophobicContact CG-CD2 4.03Å; L1000-L1031 CarbonylContact O-C 3.57Å; L1000-L1031 VanDerWaalsContact O-CA 3.3Å; L1000-L1031 WeakPolarHBondContact O-CA 3.44Å; L1000-V1032 PolarHBondContact O-N 2.74Å
1001	S	91.4	Very high	86.9	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.014	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	121.6	172.4	-57.9	0	0	0	0	110.9	W859 L861 V1032	W859-S1001 PolarHBondContact O-N 3.41Å; W859-S1001 VanDerWaalsContact O-N 3.12Å; W859-S1001 PolarHBondContact O-OG 2.75Å; L861-S1001 PolarHBondContact N-OG 3.14Å; S1001-V1032 CarbonylContact C-O 3.56Å; S1001-V1032 WeakPolarHBondContact CA-O 3.47Å
1002	L	90.6	Very high	86.8	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-67.5	123.1	178.5	176.1	68.3	0	0	0	109.7	F755 T761 L1000 L1019 L1031 V1032 R1033	F755-L1002 HydrophobicContact CZ-CD2 3.93Å; T761-L1002 HydrophobicContact CG2-CD2 4.23Å; L1000-L1002 PolarHBondContact O-N 3.05Å; L1002-L1019 HydrophobicContact CD1-CD1 4.34Å; L1002-L1019 HydrophobicContact CD1-CD2 3.68Å; L1002-L1031 HydrophobicContact CB-CB 4.08Å; L1002-L1031 HydrophobicContact CD1-CB 3.83Å; L1002-L1031 HydrophobicContact CD1-CD1 3.89Å; L1002-L1031 HydrophobicContact CD1-CG 4.31Å; L1002-L1031 HydrophobicContact CG-CB 4.48Å; L1002-V1032 PolarHBondContact N-O 2.69Å; L1002-R1033 HydrophobicContact CB-CB 4.21Å; L1002-R1033 HydrophobicContact CD2-CB 4.26Å
1003	P	87.4	Confident	86.6	Confident	13 Å²	13	33.1 Å²	33.1	8%	0.084	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-67.2	143.4	170.6	29.2	-35.9	0	0	0	110.3	Y1015 L1019 L1022	P1003-Y1015 WeakPolarHBondContact O-CE2 3.27Å; P1003-Y1015 PolarHBondContact O-OH 3.03Å; P1003-L1019 HydrophobicContact CG-CD2 3.87Å; P1003-L1022 HydrophobicContact CG-CD2 4.02Å
1004	I	80.8	Confident	86.5	Confident	34 Å²	34	26.9 Å²	26.9	17%	0.174	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-101.8	129.8	176.9	-68.6	-172.7	0	0	0	110.2	L77 F755 R1033	L77-I1004 HydrophobicContact CD1-CD1 3.9Å; F755-I1004 HydrophobicContact CE2-CD1 4.29Å; F755-I1004 HydrophobicContact CE2-CG1 4.16Å; F755-I1004 HydrophobicContact CZ-CD1 4.27Å; F755-I1004 HydrophobicContact CZ-CG1 4.17Å; I1004-R1033 HydrophobicContact CD1-CG 4.11Å; I1004-R1033 VanDerWaalsContact CD1-CZ 3.44Å
1005	A	79.3	Confident	86.6	Confident	3 Å²	3	22.2 Å²	22.2	3%	0.025	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-88.8	149.4	158.7	0	0	0	0	0	110.3	H752 I1010 Y1015	H752-A1005 PolarHBondContact CE1-O 3.09Å; A1005-I1010 HydrophobicContact CB-CB 4.17Å; A1005-I1010 HydrophobicContact CB-CD1 3.75Å; A1005-I1010 HydrophobicContact CB-CG2 4.2Å; A1005-Y1015 HydrophobicContact CB-CD1 4.21Å; A1005-Y1015 HydrophobicContact CB-CD2 3.51Å; A1005-Y1015 HydrophobicContact CB-CE2 3.94Å; A1005-Y1015 HydrophobicContact CB-CG 3.66Å
1006	R	73.4	Confident	86.6	Confident	78 Å²	78	21.8 Å²	21.8	29%	0.294	13%	0.133	S	C	.	.	P	Polyproline II helix	trans	-88.5	129	171.3	-75.5	-177.1	179.1	150.7	0.9	110.1	L80 G1008 S1009 I1010	L80-R1006 PolarHBondContact O-NE 2.95Å; R1006-G1008 PolarHBondContact O-N 2.74Å; R1006-S1009 WeakPolarHBondContact CB-OG 3.41Å; R1006-S1009 WeakPolarHBondContact O-CB 3.29Å; R1006-S1009 PolarHBondContact O-N 3.22Å; R1006-I1010 PolarHBondContact O-N 2.85Å
1007	K	74.6	Confident	86.6	Confident	85 Å²	85	20.7 Å²	20.7	37%	0.37	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	127.4	177.7	-159.5	175.6	-160.1	171.4	0	109.2	H81 H752 D753 D756 S1009	H81-K1007 VanDerWaalsContact CE1-CD 3.45Å; H81-K1007 WeakPolarHBondContact CE1-CD 3.38Å; H81-K1007 WeakPolarHBondContact NE2-CB 3.29Å; H752-K1007 HydrophobicContact CB-CD 4.07Å; H752-K1007 HydrophobicContact CB-CG 4.47Å; D753-K1007 IonicContact OD1-NZ 3.34Å; D756-K1007 IonicContact OD2-NZ 2.71Å; D756-K1007 PolarHBondContact OD2-NZ 3.36Å; K1007-S1009 PolarHBondContact O-N 2.87Å; K1007-S1009 VanDerWaalsContact O-N 3.12Å
1008	G	70.6	Confident	86.5	Confident	84 Å²	84	20.9 Å²	20.9	87%	0.866	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.6	-1.3	-178.4	0	0	0	0	0	116.6	R1006	R1006-G1008 PolarHBondContact O-N 2.74Å
1009	S	75.4	Confident	86.3	Confident	62 Å²	62	20.9 Å²	20.9	43%	0.434	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-23.3	170	-51.8	0	0	0	0	112.9	F974 R1006 K1007	F974-S1009 WeakPolarHBondContact CE2-O 3.38Å; R1006-S1009 WeakPolarHBondContact CB-OG 3.41Å; R1006-S1009 WeakPolarHBondContact O-CB 3.29Å; R1006-S1009 PolarHBondContact O-N 3.22Å; K1007-S1009 PolarHBondContact O-N 2.87Å; K1007-S1009 VanDerWaalsContact O-N 3.12Å
1010	I	82.6	Confident	86.2	Confident	18 Å²	18	21.1 Å²	21.1	9%	0.092	13%	0.129	C	C	.	.	S	Bend	trans	-136	140.4	-175.9	-68	156.4	0	0	0	107.3	F974 A1005 R1006 L1014 W1018	F974-I1010 HydrophobicContact CD2-CD1 4.5Å; F974-I1010 HydrophobicContact CD2-CG1 3.82Å; F974-I1010 HydrophobicContact CE1-CD1 4.32Å; F974-I1010 HydrophobicContact CE1-CG1 4.41Å; F974-I1010 HydrophobicContact CE2-CD1 4.21Å; F974-I1010 HydrophobicContact CE2-CG1 3.45Å; F974-I1010 VanDerWaalsContact CE2-CG1 3.45Å; F974-I1010 HydrophobicContact CG-CG1 4.46Å; F974-I1010 HydrophobicContact CZ-CD1 4.11Å; F974-I1010 HydrophobicContact CZ-CG1 3.77Å; A1005-I1010 HydrophobicContact CB-CB 4.17Å; A1005-I1010 HydrophobicContact CB-CD1 3.75Å; A1005-I1010 HydrophobicContact CB-CG2 4.2Å; R1006-I1010 PolarHBondContact O-N 2.85Å; I1010-L1014 HydrophobicContact CG2-CB 4.17Å; I1010-L1014 HydrophobicContact CG2-CD2 4.37Å; I1010-L1014 HydrophobicContact CG2-CG 4.41Å; I1010-W1018 HydrophobicContact CD1-CH2 3.66Å; I1010-W1018 HydrophobicContact CD1-CZ3 3.76Å; I1010-W1018 HydrophobicContact CG1-CH2 4.28Å
1011	S	86.7	Confident	86.1	Confident	17 Å²	17	21.3 Å²	21.3	12%	0.119	13%	0.13	C	C	.	.			trans	-68.4	141.1	174.3	168.2	0	0	0	0	111.6	W964 E970 F1013 L1014 Y1015	W964-S1011 PolarHBondContact O-OG 3.42Å; E970-S1011 WeakPolarHBondContact OE1-CB 3.4Å; E970-S1011 PolarHBondContact OE1-N 3.19Å; S1011-F1013 PolarHBondContact O-N 2.97Å; S1011-F1013 VanDerWaalsContact O-N 3.09Å; S1011-F1013 PolarHBondContact OG-N 3.09Å; S1011-L1014 PolarHBondContact O-N 3.15Å; S1011-Y1015 PolarHBondContact O-N 2.91Å
1012	D	89	Confident	86.2	Confident	31 Å²	31	21.3 Å²	21.3	17%	0.166	13%	0.13	C	C	.	.	H	α-helix	trans	-49.7	-35.9	172.6	-58.3	-47.2	0	0	0	112	Q745 V748 M1016	Q745-D1012 HydrophobicContact CG-CB 4.49Å; Q745-D1012 VanDerWaalsContact CG-OD2 3.29Å; Q745-D1012 WeakPolarHBondContact CG-OD2 3.49Å; Q745-D1012 PolarHBondContact NE2-OD2 3.26Å; V748-D1012 HydrophobicContact CB-CB 4.06Å; V748-D1012 WeakPolarHBondContact CB-OD1 3.44Å; V748-D1012 HydrophobicContact CG1-CB 4.27Å; V748-D1012 WeakPolarHBondContact CG1-OD1 3.47Å; V748-D1012 HydrophobicContact CG2-CB 4.01Å; D1012-M1016 WeakPolarHBondContact O-CB 3.4Å; D1012-M1016 WeakPolarHBondContact O-CG 3.28Å; D1012-M1016 PolarHBondContact O-N 3.13Å
1013	F	89.8	Confident	86.3	Confident	3 Å²	3	21.3 Å²	21.3	1%	0.013	13%	0.13	C	C	.	.	H	α-helix	trans	-75.9	-36.9	-179.6	-76.5	-94.7	0	0	0	113	W736 T741 V744 F943 W964 I966 S1011 A1017	W736-F1013 HydrophobicContact CE3-CD1 4.15Å; W736-F1013 HydrophobicContact CZ3-CD1 4.06Å; T741-F1013 HydrophobicContact CG2-CZ 4.12Å; V744-F1013 HydrophobicContact CB-CE1 4.44Å; V744-F1013 HydrophobicContact CB-CE2 4.36Å; V744-F1013 HydrophobicContact CB-CZ 3.98Å; V744-F1013 HydrophobicContact CG1-CE1 4.25Å; V744-F1013 HydrophobicContact CG1-CE2 4.24Å; V744-F1013 HydrophobicContact CG1-CZ 4.07Å; V744-F1013 HydrophobicContact CG2-CE1 4.25Å; V744-F1013 HydrophobicContact CG2-CZ 4.1Å; F943-F1013 HydrophobicContact CB-CB 4.45Å; F943-F1013 HydrophobicContact CB-CD1 4.41Å; F943-F1013 AromaticContact CD1-CD1 3.4Å; F943-F1013 HydrophobicContact CD1-CD1 3.4Å; F943-F1013 VanDerWaalsContact CD1-CD1 3.4Å; F943-F1013 AromaticContact CD1-CE1 3.62Å; F943-F1013 HydrophobicContact CD1-CE1 3.62Å; F943-F1013 HydrophobicContact CD1-CG 4.29Å; F943-F1013 AromaticContact CE1-CD1 3.79Å; F943-F1013 HydrophobicContact CE1-CD1 3.79Å; F943-F1013 AromaticContact CE1-CE1 3.66Å; F943-F1013 HydrophobicContact CE1-CE1 3.66Å; F943-F1013 AromaticContact CG-CD1 3.89Å; F943-F1013 HydrophobicContact CG-CD1 3.89Å; W964-F1013 HydrophobicContact CB-CD2 4.31Å; W964-F1013 HydrophobicContact CB-CE2 4.12Å; W964-F1013 HydrophobicContact CD2-CE2 4.34Å; W964-F1013 HydrophobicContact CE3-CD2 4.07Å; W964-F1013 AromaticContact CE3-CE2 3.76Å; W964-F1013 HydrophobicContact CE3-CE2 3.76Å; W964-F1013 HydrophobicContact CE3-CZ 4.13Å; W964-F1013 WeakPolarHBondContact O-CD2 3.38Å; I966-F1013 HydrophobicContact CD1-CB 4.23Å; I966-F1013 HydrophobicContact CG1-CB 4.17Å; S1011-F1013 PolarHBondContact O-N 2.97Å; S1011-F1013 VanDerWaalsContact O-N 3.09Å; S1011-F1013 PolarHBondContact OG-N 3.09Å; F1013-A1017 WeakPolarHBondContact O-CB 3.41Å; F1013-A1017 PolarHBondContact O-N 3.15Å
1014	L	90	Very high	86.4	Confident	0 Å²	0	23 Å²	23	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-69	-42	174.8	-177.6	58.6	0	0	0	110.7	I966 E970 L971 I1010 S1011 A1017 W1018	I966-L1014 HydrophobicContact CD1-CB 3.99Å; I966-L1014 HydrophobicContact CD1-CD1 4.41Å; I966-L1014 HydrophobicContact CG1-CB 4.12Å; I966-L1014 HydrophobicContact CG2-CB 4.44Å; E970-L1014 HydrophobicContact CG-CD2 3.77Å; E970-L1014 WeakPolarHBondContact OE1-CB 3.38Å; E970-L1014 VanDerWaalsContact OE1-CD2 3.27Å; E970-L1014 WeakPolarHBondContact OE1-CD2 3.41Å; L971-L1014 HydrophobicContact CD2-CD1 3.86Å; L971-L1014 HydrophobicContact CD2-CD2 4.24Å; I1010-L1014 HydrophobicContact CG2-CB 4.17Å; I1010-L1014 HydrophobicContact CG2-CD2 4.37Å; I1010-L1014 HydrophobicContact CG2-CG 4.41Å; S1011-L1014 PolarHBondContact O-N 3.15Å; L1014-A1017 WeakPolarHBondContact O-CB 3.35Å; L1014-A1017 PolarHBondContact O-N 3.46Å; L1014-W1018 HydrophobicContact CD2-CZ2 4.05Å; L1014-W1018 HydrophobicContact CG-CZ2 4.19Å; L1014-W1018 PolarHBondContact O-N 3.14Å
1015	Y	90.9	Very high	86.7	Confident	3 Å²	3	26.1 Å²	26.1	1%	0.012	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-41	175.5	179.5	-129.6	0	0	0	112.3	V748 L751 P1003 A1005 S1011 A1017 W1018 L1019	V748-Y1015 HydrophobicContact CG1-CD1 3.7Å; V748-Y1015 HydrophobicContact CG1-CE1 4.19Å; V748-Y1015 HydrophobicContact CG2-CD1 4.16Å; L751-Y1015 HydrophobicContact CD1-CE1 3.94Å; P1003-Y1015 WeakPolarHBondContact O-CE2 3.27Å; P1003-Y1015 PolarHBondContact O-OH 3.03Å; A1005-Y1015 HydrophobicContact CB-CD1 4.21Å; A1005-Y1015 HydrophobicContact CB-CD2 3.51Å; A1005-Y1015 HydrophobicContact CB-CE2 3.94Å; A1005-Y1015 HydrophobicContact CB-CG 3.66Å; S1011-Y1015 PolarHBondContact O-N 2.91Å; Y1015-A1017 VanDerWaalsContact C-N 3.35Å; Y1015-A1017 PolarHBondContact O-N 2.98Å; Y1015-W1018 HydrophobicContact CD2-CE3 4.31Å; Y1015-W1018 WeakPolarHBondContact O-CB 3.4Å; Y1015-W1018 PolarHBondContact O-N 3.32Å; Y1015-L1019 HydrophobicContact CD2-CG 4.35Å; Y1015-L1019 HydrophobicContact CE1-CD1 4.09Å; Y1015-L1019 HydrophobicContact CE2-CD1 4.11Å; Y1015-L1019 HydrophobicContact CE2-CD2 4.1Å; Y1015-L1019 HydrophobicContact CE2-CG 4.06Å; Y1015-L1019 WeakPolarHBondContact O-CG 3.48Å; Y1015-L1019 PolarHBondContact O-N 2.96Å
1016	M	92.4	Very high	87.3	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-34.7	172.8	-78.8	-60.5	-58.6	0	0	113.1	F732 K733 W736 V744 Y747 V748 D1012 L1019 D1020	F732-M1016 HydrophobicContact CE2-CE 3.82Å; F732-M1016 HydrophobicContact CZ-CE 3.9Å; K733-M1016 HydrophobicContact CB-CE 4.35Å; W736-M1016 HydrophobicContact CB-CE 3.9Å; W736-M1016 HydrophobicContact CD2-CB 4.04Å; W736-M1016 HydrophobicContact CE3-CB 4.09Å; W736-M1016 HydrophobicContact CG-CB 4.4Å; W736-M1016 HydrophobicContact CG-CE 3.84Å; V744-M1016 HydrophobicContact CG1-CG 4.07Å; Y747-M1016 HydrophobicContact CD1-CE 4.3Å; Y747-M1016 HydrophobicContact CD1-SD 3.71Å; Y747-M1016 HydrophobicContact CE1-CE 4.16Å; Y747-M1016 HydrophobicContact CE1-SD 3.73Å; V748-M1016 HydrophobicContact CG2-CG 3.6Å; V748-M1016 HydrophobicContact CG2-SD 4.07Å; D1012-M1016 WeakPolarHBondContact O-CB 3.4Å; D1012-M1016 WeakPolarHBondContact O-CG 3.28Å; D1012-M1016 PolarHBondContact O-N 3.13Å; M1016-L1019 PolarHBondContact O-N 2.97Å; M1016-L1019 HydrophobicContact SD-CD1 4.49Å; M1016-D1020 WeakPolarHBondContact O-CB 3.4Å; M1016-D1020 PolarHBondContact O-N 3.3Å
1017	A	92.2	Very high	88.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.3	-42.4	173.1	0	0	0	0	0	112	W736 L936 I940 F1013 L1014 Y1015 D1020 I1021	W736-A1017 HydrophobicContact CH2-CB 3.88Å; W736-A1017 HydrophobicContact CZ2-CB 4.27Å; L936-A1017 HydrophobicContact CD1-CB 4.17Å; I940-A1017 HydrophobicContact CG2-CB 3.58Å; F1013-A1017 WeakPolarHBondContact O-CB 3.41Å; F1013-A1017 PolarHBondContact O-N 3.15Å; L1014-A1017 WeakPolarHBondContact O-CB 3.35Å; L1014-A1017 PolarHBondContact O-N 3.46Å; Y1015-A1017 VanDerWaalsContact C-N 3.35Å; Y1015-A1017 PolarHBondContact O-N 2.98Å; A1017-D1020 PolarHBondContact O-N 3.44Å; A1017-I1021 WeakPolarHBondContact O-CG2 3.41Å; A1017-I1021 PolarHBondContact O-N 2.76Å
1018	W	92.5	Very high	89	Confident	5 Å²	5	20.1 Å²	20.1	2%	0.019	13%	0.133	C	C	.	.	H	α-helix	trans	-57.1	-48.1	172	-75	0	0	0	0	112.2	F974 K977 T978 Q981 I1010 L1014 Y1015 I1021 L1022	F974-W1018 HydrophobicContact CB-CH2 4.06Å; F974-W1018 HydrophobicContact CB-CZ2 3.78Å; F974-W1018 HydrophobicContact CG-CH2 4.22Å; F974-W1018 HydrophobicContact CG-CZ2 4.39Å; K977-W1018 HydrophobicContact CB-CH2 4.06Å; K977-W1018 HydrophobicContact CB-CZ2 4.17Å; K977-W1018 HydrophobicContact CD-CH2 4.31Å; T978-W1018 PolarHBondContact OG1-NE1 3.23Å; Q981-W1018 HydrophobicContact CG-CB 3.95Å; Q981-W1018 HydrophobicContact CG-CD2 4.29Å; Q981-W1018 HydrophobicContact CG-CG 3.91Å; I1010-W1018 HydrophobicContact CD1-CH2 3.66Å; I1010-W1018 HydrophobicContact CD1-CZ3 3.76Å; I1010-W1018 HydrophobicContact CG1-CH2 4.28Å; L1014-W1018 HydrophobicContact CD2-CZ2 4.05Å; L1014-W1018 HydrophobicContact CG-CZ2 4.19Å; L1014-W1018 PolarHBondContact O-N 3.14Å; Y1015-W1018 HydrophobicContact CD2-CE3 4.31Å; Y1015-W1018 WeakPolarHBondContact O-CB 3.4Å; Y1015-W1018 PolarHBondContact O-N 3.32Å; W1018-I1021 WeakPolarHBondContact O-CG2 3.3Å; W1018-L1022 WeakPolarHBondContact O-CB 3.36Å; W1018-L1022 PolarHBondContact O-N 3.13Å
1019	L	93.2	Very high	90.2	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.7	-35.5	177.7	-63.2	-176.1	0	0	0	112.4	F732 L751 L1002 P1003 Y1015 M1016 T1023 L1031	F732-L1019 HydrophobicContact CE2-CB 3.84Å; F732-L1019 HydrophobicContact CZ-CB 4.49Å; L751-L1019 HydrophobicContact CD1-CD1 4.48Å; L1002-L1019 HydrophobicContact CD1-CD1 4.34Å; L1002-L1019 HydrophobicContact CD1-CD2 3.68Å; P1003-L1019 HydrophobicContact CG-CD2 3.87Å; Y1015-L1019 HydrophobicContact CD2-CG 4.35Å; Y1015-L1019 HydrophobicContact CE1-CD1 4.09Å; Y1015-L1019 HydrophobicContact CE2-CD1 4.11Å; Y1015-L1019 HydrophobicContact CE2-CD2 4.1Å; Y1015-L1019 HydrophobicContact CE2-CG 4.06Å; Y1015-L1019 WeakPolarHBondContact O-CG 3.48Å; Y1015-L1019 PolarHBondContact O-N 2.96Å; M1016-L1019 PolarHBondContact O-N 2.97Å; M1016-L1019 HydrophobicContact SD-CD1 4.49Å; L1019-T1023 PolarHBondContact O-N 3.08Å; L1019-T1023 PolarHBondContact O-OG1 2.88Å; L1019-L1031 HydrophobicContact CD2-CD1 4.17Å
1020	D	93	Very high	91.1	Very high	4 Å²	4	13.3 Å²	13.3	2%	0.021	7%	0.071	C	C	.	.	H	α-helix	trans	-67.4	-48.3	176.8	-162.8	-6.9	0	0	0	111.4	F732 W736 R737 R765 M939 M1016 A1017 T1023 K1024	F732-D1020 HydrophobicContact CZ-CB 4.03Å; W736-D1020 HydrophobicContact CZ2-CB 4.08Å; W736-D1020 PolarHBondContact NE1-OD2 3.49Å; R737-D1020 IonicContact CZ-OD2 3.63Å; R737-D1020 IonicContact NE-OD2 3.57Å; R737-D1020 IonicContact NH2-OD2 3.71Å; R737-D1020 PolarHBondContact NH2-OD2 3.09Å; R765-D1020 IonicContact CZ-OD1 3.49Å; R765-D1020 VanDerWaalsContact CZ-OD1 3.29Å; R765-D1020 PolarHBondContact NH1-O 2.82Å; R765-D1020 IonicContact NH1-OD1 2.73Å; R765-D1020 PolarHBondContact NH1-OD1 2.94Å; R765-D1020 IonicContact NH2-OD1 3.53Å; R765-D1020 PolarHBondContact NH2-OD1 3.02Å; M939-D1020 HydrophobicContact SD-CB 4.12Å; M1016-D1020 WeakPolarHBondContact O-CB 3.4Å; M1016-D1020 PolarHBondContact O-N 3.3Å; A1017-D1020 PolarHBondContact O-N 3.44Å; D1020-T1023 PolarHBondContact O-N 3.04Å; D1020-K1024 WeakPolarHBondContact O-CB 3.3Å; D1020-K1024 PolarHBondContact O-N 2.96Å
1021	I	92.9	Very high	91.7	Very high	5 Å²	5	12.5 Å²	12.5	3%	0.026	7%	0.067	C	C	.	.	H	α-helix	trans	-68.3	-42.7	-179.1	-164.2	59.8	0	0	0	112.2	L936 M939 Q981 V982 N985 A1017 W1018 T1023 K1024	L936-I1021 HydrophobicContact CD1-CB 4.15Å; L936-I1021 HydrophobicContact CD1-CG2 4.11Å; L936-I1021 HydrophobicContact CD2-CG2 4.4Å; M939-I1021 HydrophobicContact CE-CB 4.36Å; M939-I1021 HydrophobicContact CE-CD1 4.02Å; Q981-I1021 HydrophobicContact CB-CG2 4.24Å; V982-I1021 HydrophobicContact CG2-CG1 4.19Å; V982-I1021 HydrophobicContact CG2-CG2 4.47Å; N985-I1021 WeakPolarHBondContact CB-O 3.21Å; N985-I1021 PolarHBondContact ND2-O 2.73Å; N985-I1021 VanDerWaalsContact ND2-O 3.15Å; A1017-I1021 WeakPolarHBondContact O-CG2 3.41Å; A1017-I1021 PolarHBondContact O-N 2.76Å; W1018-I1021 WeakPolarHBondContact O-CG2 3.3Å; I1021-T1023 PolarHBondContact O-N 2.77Å; I1021-K1024 HydrophobicContact CD1-CD 3.89Å; I1021-K1024 WeakPolarHBondContact O-CB 3.45Å; I1021-K1024 PolarHBondContact O-N 3.37Å
1022	L	92.6	Very high	92.1	Very high	2 Å²	2	11.7 Å²	11.7	1%	0.01	6%	0.061	C	C	.	.	H	α-helix	trans	-56	-40.4	178.4	178.3	64.5	0	0	0	112	L984 N985 L988 L1000 P1003 W1018 L1031	L984-L1022 HydrophobicContact CB-CD1 3.53Å; L984-L1022 HydrophobicContact CD1-CD1 4.18Å; N985-L1022 PolarHBondContact ND2-O 3.38Å; L988-L1022 HydrophobicContact CD1-CD1 4.06Å; L1000-L1022 HydrophobicContact CD2-CD1 4.16Å; L1000-L1022 HydrophobicContact CD2-CD2 3.93Å; L1000-L1022 HydrophobicContact CD2-CG 3.97Å; P1003-L1022 HydrophobicContact CG-CD2 4.02Å; W1018-L1022 WeakPolarHBondContact O-CB 3.36Å; W1018-L1022 PolarHBondContact O-N 3.13Å; L1022-L1031 HydrophobicContact CD2-CD2 4.2Å
1023	T	92.6	Very high	92.2	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	18.2	-172.9	63	0	0	0	0	114	R765 L1019 D1020 I1021 I1029 L1031	R765-T1023 WeakPolarHBondContact CD-O 3.45Å; R765-T1023 WeakPolarHBondContact CD-OG1 3.28Å; R765-T1023 PolarHBondContact NE-O 2.95Å; R765-T1023 PolarHBondContact NH1-O 2.84Å; R765-T1023 PolarHBondContact NH1-OG1 2.88Å; L1019-T1023 PolarHBondContact O-N 3.08Å; L1019-T1023 PolarHBondContact O-OG1 2.88Å; D1020-T1023 PolarHBondContact O-N 3.04Å; I1021-T1023 PolarHBondContact O-N 2.77Å; T1023-I1029 HydrophobicContact CG2-CD1 4.04Å; T1023-I1029 HydrophobicContact CG2-CG1 4.49Å; T1023-I1029 HydrophobicContact CG2-CG2 4.12Å; T1023-L1031 HydrophobicContact CG2-CD1 3.92Å; T1023-L1031 HydrophobicContact CG2-CD2 3.82Å; T1023-L1031 HydrophobicContact CG2-CG 4.04Å
1024	K	89.4	Confident	92	Very high	48 Å²	48	10.2 Å²	10.2	21%	0.209	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	139.4	-178.6	-160.6	178.1	174.1	179	0	112.5	N985 D1020 I1021 L1026	N985-K1024 PolarHBondContact ND2-N 2.81Å; N985-K1024 PolarHBondContact ND2-O 3.47Å; D1020-K1024 WeakPolarHBondContact O-CB 3.3Å; D1020-K1024 PolarHBondContact O-N 2.96Å; I1021-K1024 HydrophobicContact CD1-CD 3.89Å; I1021-K1024 WeakPolarHBondContact O-CB 3.45Å; I1021-K1024 PolarHBondContact O-N 3.37Å; K1024-L1026 PolarHBondContact O-N 3.12Å; K1024-L1026 VanDerWaalsContact O-N 3.12Å
1025	D	88.6	Confident	91.6	Very high	100 Å²	100	11.7 Å²	11.7	54%	0.535	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	21.1	171.6	-56.2	-36	0	0	0	116.8
1026	L	90.8	Very high	90.7	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.01	7%	0.066	C	C	.	.	P	Polyproline II helix	trans	-96.8	165.5	179	-68.5	173.5	0	0	0	113.5	N767 L988 Q989 I998 K1024 I1029	N767-L1026 VanDerWaalsContact CG-O 3.31Å; N767-L1026 PolarHBondContact ND2-O 2.85Å; N767-L1026 PolarHBondContact OD1-O 2.86Å; L988-L1026 HydrophobicContact CB-CD1 3.71Å; L988-L1026 HydrophobicContact CB-CD2 3.83Å; L988-L1026 HydrophobicContact CB-CG 4.42Å; L988-L1026 HydrophobicContact CD1-CD1 3.96Å; L988-L1026 HydrophobicContact CG-CD1 4.3Å; Q989-L1026 HydrophobicContact CB-CD2 4.43Å; Q989-L1026 HydrophobicContact CG-CD2 3.77Å; I998-L1026 HydrophobicContact CD1-CB 4.24Å; I998-L1026 HydrophobicContact CD1-CD1 4.32Å; I998-L1026 HydrophobicContact CD1-CD2 4.27Å; K1024-L1026 PolarHBondContact O-N 3.12Å; K1024-L1026 VanDerWaalsContact O-N 3.12Å; L1026-I1029 HydrophobicContact CD1-CD1 3.88Å
1027	P	90.9	Very high	90.1	Very high	21 Å²	21	17.6 Å²	17.6	14%	0.136	9%	0.088	C	C	.	.	S	Bend	trans	-55.4	171.9	161.2	-25	35.6	0	0	0	113.1	K993 A995 I998 I1029	K993-P1027 VanDerWaalsContact O-CG 3.29Å; K993-P1027 WeakPolarHBondContact O-CG 3.33Å; A995-P1027 WeakPolarHBondContact O-CB 3.25Å; I998-P1027 HydrophobicContact CD1-CG 4.49Å; P1027-I1029 PolarHBondContact O-N 3.45Å; P1027-I1029 VanDerWaalsContact O-N 3.17Å
1028	P	93.6	Very high	89.3	Confident	18 Å²	18	19.2 Å²	19.2	12%	0.117	10%	0.099	C	C	.	.	S	Bend	trans	-50.3	125.1	175.6	-27	35.9	0	0	0	111.6	M766 F847 L997 I998	M766-P1028 HydrophobicContact CE-CG 4.35Å; M766-P1028 HydrophobicContact CG-CB 4.23Å; F847-P1028 HydrophobicContact CZ-CB 4.02Å; L997-P1028 WeakPolarHBondContact CA-O 3.33Å; I998-P1028 PolarHBondContact N-O 2.99Å
1029	I	94.4	Very high	88.7	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.01	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	133.8	-170.8	-176.2	161	0	0	0	110.2	R765 I998 L1000 T1023 L1026 P1027	R765-I1029 HydrophobicContact CB-CG2 3.89Å; R765-I1029 PolarHBondContact N-O 3.07Å; R765-I1029 PolarHBondContact O-N 3.1Å; R765-I1029 VanDerWaalsContact O-N 3.15Å; I998-I1029 HydrophobicContact CB-CB 4.1Å; I998-I1029 HydrophobicContact CB-CD1 3.97Å; I998-I1029 HydrophobicContact CB-CG1 3.85Å; I998-I1029 HydrophobicContact CD1-CD1 4.48Å; I998-I1029 HydrophobicContact CG2-CD1 3.68Å; I998-I1029 HydrophobicContact CG2-CG1 3.94Å; I998-I1029 WeakPolarHBondContact O-CA 3.36Å; L1000-I1029 HydrophobicContact CB-CD1 4.21Å; L1000-I1029 HydrophobicContact CB-CG1 4.49Å; L1000-I1029 HydrophobicContact CD2-CD1 3.93Å; T1023-I1029 HydrophobicContact CG2-CD1 4.04Å; T1023-I1029 HydrophobicContact CG2-CG1 4.49Å; T1023-I1029 HydrophobicContact CG2-CG2 4.12Å; L1026-I1029 HydrophobicContact CD1-CD1 3.88Å; P1027-I1029 PolarHBondContact O-N 3.45Å; P1027-I1029 VanDerWaalsContact O-N 3.17Å
1030	M	95.6	Very high	87.9	Confident	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	110.1	177.7	-174.2	176.7	73.2	0	0	108.5	L651 F655 L762 V763 L871 L997 I998 V999 L1000 V1032	L651-M1030 HydrophobicContact CD2-SD 4.35Å; F655-M1030 HydrophobicContact CE1-CE 4.36Å; F655-M1030 HydrophobicContact CE2-CE 4.43Å; F655-M1030 HydrophobicContact CE2-SD 3.87Å; F655-M1030 HydrophobicContact CZ-CE 3.66Å; F655-M1030 HydrophobicContact CZ-SD 3.61Å; L762-M1030 HydrophobicContact CD1-SD 4.42Å; L762-M1030 HydrophobicContact CD2-SD 4.44Å; V763-M1030 WeakPolarHBondContact O-CA 3.46Å; L871-M1030 HydrophobicContact CB-CE 4.31Å; L871-M1030 HydrophobicContact CD1-CE 4.13Å; L997-M1030 HydrophobicContact CD1-CB 4.43Å; I998-M1030 PolarHBondContact O-N 3.41Å; V999-M1030 WeakPolarHBondContact CA-O 3.04Å; V999-M1030 HydrophobicContact CG1-CE 3.99Å; V999-M1030 HydrophobicContact CG2-CE 4.1Å; L1000-M1030 PolarHBondContact N-O 2.91Å; M1030-V1032 HydrophobicContact CE-CG2 3.7Å; M1030-V1032 HydrophobicContact CG-CG2 4.1Å
1031	L	95.3	Very high	86.9	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.005	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	134.9	170.1	-62.9	163.8	0	0	0	108.6	L762 V763 L1000 L1002 L1019 L1022 T1023	L762-L1031 WeakPolarHBondContact CA-O 3.37Å; V763-L1031 HydrophobicContact CB-CB 4.2Å; V763-L1031 HydrophobicContact CB-CD1 4.35Å; V763-L1031 PolarHBondContact N-O 2.78Å; V763-L1031 PolarHBondContact O-N 3.3Å; L1000-L1031 HydrophobicContact CB-CD2 4.23Å; L1000-L1031 HydrophobicContact CD2-CD2 3.82Å; L1000-L1031 HydrophobicContact CG-CD2 4.03Å; L1000-L1031 CarbonylContact O-C 3.57Å; L1000-L1031 VanDerWaalsContact O-CA 3.3Å; L1000-L1031 WeakPolarHBondContact O-CA 3.44Å; L1002-L1031 HydrophobicContact CB-CB 4.08Å; L1002-L1031 HydrophobicContact CD1-CB 3.83Å; L1002-L1031 HydrophobicContact CD1-CD1 3.89Å; L1002-L1031 HydrophobicContact CD1-CG 4.31Å; L1002-L1031 HydrophobicContact CG-CB 4.48Å; L1019-L1031 HydrophobicContact CD2-CD1 4.17Å; L1022-L1031 HydrophobicContact CD2-CD2 4.2Å; T1023-L1031 HydrophobicContact CG2-CD1 3.92Å; T1023-L1031 HydrophobicContact CG2-CD2 3.82Å; T1023-L1031 HydrophobicContact CG2-CG 4.04Å
1032	V	94.1	Very high	85.6	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.8	-173.5	-176.9	0	0	0	0	111.2	T761 L762 L867 L871 V999 L1000 S1001 L1002 M1030	T761-V1032 WeakPolarHBondContact O-CA 3.25Å; L762-V1032 HydrophobicContact CD2-CB 4.11Å; L762-V1032 HydrophobicContact CD2-CG1 3.75Å; L762-V1032 HydrophobicContact CD2-CG2 3.74Å; L867-V1032 HydrophobicContact CB-CG1 4.47Å; L867-V1032 HydrophobicContact CD2-CG1 4.26Å; L867-V1032 HydrophobicContact CG-CG1 4.19Å; L871-V1032 HydrophobicContact CD1-CG1 4.32Å; V999-V1032 HydrophobicContact CG1-CG2 3.58Å; L1000-V1032 PolarHBondContact O-N 2.74Å; S1001-V1032 CarbonylContact C-O 3.56Å; S1001-V1032 WeakPolarHBondContact CA-O 3.47Å; L1002-V1032 PolarHBondContact N-O 2.69Å; M1030-V1032 HydrophobicContact CE-CG2 3.7Å; M1030-V1032 HydrophobicContact CG-CG2 4.1Å
1033	R	90.4	Very high	83.6	Confident	3 Å²	3	29.5 Å²	29.5	1%	0.011	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	116.7	161	-167.7	75.5	179	-150.1	-4.6	108.9	D53 F755 G760 T761 L1002 I1004 H1036	D53-R1033 IonicContact OD1-CZ 3Å; D53-R1033 VanDerWaalsContact OD1-CZ 3.26Å; D53-R1033 IonicContact OD1-NH1 3.68Å; D53-R1033 PolarHBondContact OD1-NH1 3.09Å; D53-R1033 IonicContact OD1-NH2 2.75Å; D53-R1033 PolarHBondContact OD1-NH2 3.07Å; F755-R1033 HydrophobicContact CE1-CB 4.01Å; F755-R1033 HydrophobicContact CE1-CG 4.04Å; F755-R1033 HydrophobicContact CZ-CB 4.44Å; F755-R1033 HydrophobicContact CZ-CG 4.49Å; G760-R1033 CarbonylContact C-O 3.46Å; G760-R1033 VanDerWaalsContact CA-O 3.24Å; G760-R1033 WeakPolarHBondContact CA-O 3.26Å; T761-R1033 PolarHBondContact N-O 3.48Å; T761-R1033 PolarHBondContact O-N 3.27Å; L1002-R1033 HydrophobicContact CB-CB 4.21Å; L1002-R1033 HydrophobicContact CD2-CB 4.26Å; I1004-R1033 HydrophobicContact CD1-CG 4.11Å; I1004-R1033 VanDerWaalsContact CD1-CZ 3.44Å; R1033-H1036 PolarHBondContact NE-CE1 3.05Å; R1033-H1036 PolarHBondContact NE-NE2 2.88Å; R1033-H1036 VanDerWaalsContact NE-NE2 3.11Å; R1033-H1036 PolarHBondContact NH2-CE1 2.97Å; R1033-H1036 PolarHBondContact NH2-NE2 3.34Å
1034	G	85.7	Confident	81.2	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.01	19%	0.193	C	C	.	.			trans	-74.7	158.6	163.6	0	0	0	0	0	112.2	D864 H1036	D864-G1034 CarbonylContact O-C 3.26Å; D864-G1034 VanDerWaalsContact O-CA 3.27Å; D864-G1034 WeakPolarHBondContact O-CA 3.46Å; D864-G1034 PolarHBondContact OD2-N 3.02Å; G1034-H1036 PolarHBondContact O-N 3.32Å
1035	N	81.4	Confident	80.8	Confident	30 Å²	30	35.6 Å²	35.6	16%	0.16	19%	0.192	C	C	.	.			trans	-77.4	26.2	-177.8	64.8	-3	0	0	0	114.2	E758 K1037	E758-N1035 HydrophobicContact CB-CB 4.43Å; E758-N1035 WeakPolarHBondContact O-CB 3.4Å; E758-N1035 PolarHBondContact O-ND2 3.03Å; N1035-K1037 PolarHBondContact O-N 3.29Å; N1035-K1037 WeakPolarHBondContact OD1-CB 3.48Å; N1035-K1037 PolarHBondContact OD1-N 2.91Å
1036	H	73.1	Confident	80.4	Confident	23 Å²	23	32.2 Å²	32.2	11%	0.106	17%	0.174	C	C	.	.	S	Bend	trans	56.5	-3.1	-176.5	-59.4	-73.2	0	0	0	117.4	R74 D863 R1033 G1034	R74-H1036 PolarHBondContact NH1-O 3.25Å; D863-H1036 PolarHBondContact O-CE1 2.81Å; D863-H1036 PolarHBondContact O-ND1 3.45Å; R1033-H1036 PolarHBondContact NE-CE1 3.05Å; R1033-H1036 PolarHBondContact NE-NE2 2.88Å; R1033-H1036 VanDerWaalsContact NE-NE2 3.11Å; R1033-H1036 PolarHBondContact NH2-CE1 2.97Å; R1033-H1036 PolarHBondContact NH2-NE2 3.34Å; G1034-H1036 PolarHBondContact O-N 3.32Å
1037	K	79.1	Confident	79.8	Confident	105 Å²	105	33.8 Å²	33.8	46%	0.457	18%	0.183	S	C	.	.	S	Bend	trans	-74.3	131.5	166.4	-60.4	179.9	-177	179.6	0	108.2	E758 N1035 V1039	E758-K1037 WeakPolarHBondContact OE1-CE 3.26Å; E758-K1037 IonicContact OE1-NZ 3.39Å; E758-K1037 PolarHBondContact OE1-NZ 2.95Å; E758-K1037 IonicContact OE2-NZ 3.11Å; E758-K1037 PolarHBondContact OE2-NZ 3.11Å; N1035-K1037 PolarHBondContact O-N 3.29Å; N1035-K1037 WeakPolarHBondContact OD1-CB 3.48Å; N1035-K1037 PolarHBondContact OD1-N 2.91Å; K1037-V1039 PolarHBondContact O-N 3.4Å
1038	S	76.6	Confident	79.1	Confident	33 Å²	33	34.6 Å²	34.6	23%	0.231	19%	0.186	C	C	.	.			trans	-66.6	119.7	-175.2	-63.4	0	0	0	0	110.9	F60 R74 V628 G865	F60-S1038 PolarHBondContact O-OG 3.03Å; R74-S1038 PolarHBondContact NH1-OG 2.96Å; V628-S1038 VanDerWaalsContact CG1-O 3.27Å; V628-S1038 WeakPolarHBondContact CG1-O 3.47Å; V628-S1038 WeakPolarHBondContact CG2-O 3.33Å; G865-S1038 WeakPolarHBondContact O-CA 3.49Å
1039	V	79	Confident	78.2	Confident	13 Å²	13	35.6 Å²	35.6	8%	0.079	19%	0.19	C	C	.	.	S	Bend	trans	-97.6	-3.3	174.7	-58.6	0	0	0	0	112.7	F631 G865 L867 L870 K1037	F631-V1039 HydrophobicContact CD1-CB 3.74Å; F631-V1039 HydrophobicContact CD1-CG1 3.88Å; F631-V1039 HydrophobicContact CD2-CB 4.43Å; F631-V1039 HydrophobicContact CD2-CG1 3.81Å; F631-V1039 HydrophobicContact CE1-CB 3.9Å; F631-V1039 HydrophobicContact CE1-CG1 3.75Å; F631-V1039 HydrophobicContact CE2-CG1 3.67Å; F631-V1039 HydrophobicContact CG-CB 4.03Å; F631-V1039 HydrophobicContact CG-CG1 3.92Å; F631-V1039 HydrophobicContact CZ-CB 4.32Å; F631-V1039 HydrophobicContact CZ-CG1 3.64Å; G865-V1039 PolarHBondContact O-N 3.12Å; L867-V1039 HydrophobicContact CB-CG2 4.15Å; L867-V1039 HydrophobicContact CD1-CG2 4.44Å; L870-V1039 HydrophobicContact CB-CG2 4.23Å; L870-V1039 HydrophobicContact CD2-CB 3.93Å; L870-V1039 HydrophobicContact CD2-CG2 3.74Å; K1037-V1039 PolarHBondContact O-N 3.4Å
1040	L	77.3	Confident	77.2	Confident	23 Å²	23	37.9 Å²	37.9	12%	0.12	20%	0.202	C	C	.	.			trans	-123.4	146.8	172	-69.2	173.5	0	0	0	109.7	Y61 L869 L870 F911 I913	Y61-L1040 HydrophobicContact CD1-CB 4.45Å; Y61-L1040 WeakPolarHBondContact CD1-O 3.45Å; Y61-L1040 HydrophobicContact CE1-CB 4.35Å; L869-L1040 HydrophobicContact CB-CD1 4.16Å; L870-L1040 HydrophobicContact CB-CD2 4.4Å; L870-L1040 HydrophobicContact CB-CG 4.44Å; L870-L1040 HydrophobicContact CD1-CD2 4.03Å; F911-L1040 HydrophobicContact CD1-CB 4.22Å; F911-L1040 HydrophobicContact CD2-CD1 4.25Å; F911-L1040 HydrophobicContact CE1-CB 3.84Å; F911-L1040 HydrophobicContact CE2-CD1 4.26Å; F911-L1040 HydrophobicContact CG-CD1 4.49Å; F911-L1040 HydrophobicContact CZ-CB 4.04Å; I913-L1040 HydrophobicContact CD1-CD1 4.36Å
1041	T	72	Confident	75.8	Confident	38 Å²	38	40.6 Å²	40.6	23%	0.233	22%	0.217	C	C	.	.			trans	-148.1	149.6	167.8	-179.3	0	0	0	0	108.8	V628 K629 Y1043	V628-T1041 HydrophobicContact CB-CG2 4Å; V628-T1041 HydrophobicContact CG1-CG2 3.78Å; K629-T1041 HydrophobicContact CG-CG2 4.34Å; T1041-Y1043 PolarHBondContact OG1-N 3.2Å
1042	F	64.1	Low	74.3	Confident	52 Å²	52	43.6 Å²	43.6	23%	0.228	23%	0.233	C	C	.	.	S	Bend	trans	-103.2	0.5	174.5	60.5	-93.6	0	0	0	113.2	I58 Y61 R62 K910 F911	I58-F1042 HydrophobicContact CG1-CE1 4.09Å; I58-F1042 HydrophobicContact CG1-CZ 4.27Å; Y61-F1042 WeakPolarHBondContact O-CE1 3.44Å; R62-F1042 HydrophobicContact CG-CZ 4.48Å; K910-F1042 HydrophobicContact CB-CB 4.06Å; K910-F1042 HydrophobicContact CB-CG 4.31Å; F911-F1042 HydrophobicContact CD1-CB 4.25Å; F911-F1042 HydrophobicContact CE1-CB 4.33Å; F911-F1042 HydrophobicContact CE1-CD1 4.04Å
1043	Y	51.5	Low	72.7	Confident	107 Å²	107	47.3 Å²	47.3	42%	0.42	25%	0.252	S	S	.	.			trans	-92.8	148.2	174	-72.7	-79.1	0	0	0	112.3	N63 T1041	N63-Y1043 HydrophobicContact CB-CD2 3.94Å; N63-Y1043 HydrophobicContact CB-CG 4.08Å; T1041-Y1043 PolarHBondContact OG1-N 3.2Å
1044	S	42.2	Very low	71.1	Confident	139 Å²	139	51.3 Å²	51.3	97%	0.972	27%	0.274	S	S	*	.			trans	-90.3	0	173.1	59.7	0	0	0	0	111.1	K629	K629-S1044 VanDerWaalsContact CE-OXT 3.23Å; K629-S1044 WeakPolarHBondContact CE-OXT 3.5Å; K629-S1044 PolarHBondContact NZ-OXT 2.99Å

Retrieved 1,044 of 1,044 residues in 3366.8 ms (Link to these results)

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