G4LUH0_SCHMA Loading...

Smp_010250

AlphaFold DB , UniProt , Accession G4LUH0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 810 aa.

						>G4LUH0_SCHMA|G4LUH0
MSTNELGPGLKDISLDMMVMQANTMKLSNQDASRSNDSKDEPCSIHESSSIDRHSSDESSPGVKIIEDQCPEKMTISELAEDDVSRALIQRKQPLMELVSSEEGYVRRLKLVKDFYIPAVNAPTTAQSNAENNMGVSSSLPHSDSHASPPVAPEDLAARWRIIWGNWIQLYEWHSAFLEKLVSVVDSDPDRIPKLFIDSRARLRSIYSKYCENHRKAALIAEQYRDFFEELRIFIGDKEDVVSHLMQPVQRIMRYQLPIAEILKYTQRACSPDLLLWKKTLEIMKEIPKDTQLILEAARIDGFPGVITALGNILLRSDLLVATTTREQLLETVTAYKMALQNVNSGVFSETNTSLNKIPHIGRSGVNTGAPLSTDTSATPYSSSVTPNNLGLPPVEGCNSVISEGNELFTGNLKFVESRLFLFEQMLLVTEEVKPKRRVTTSDTFSQSTYQFKAAINVNKMRYESHWYNCTLSSGHINSEAATIDHLLCSGYSPDDLRFAILDQTPGKDFVYVIDPITCSNREAWVVQLRDIQHMQHEFLLALQDPRKFNTSARDEGWAKDSLTHEPTSTFSTDQSVRTDAQLSISISPCNQASQQPHKKWPSFTMKRPVRLGSNSSSIGTKEIGTGKQSSGSRPIIPLKSGSQDRPVCLARSLSAERQFSNRENLVDSNFRTGDDVCDPSVYRKSSQSANSSLKLTNQSVSSKPSDNILQNETTPHLKGGLLKKRNAFVNFFSRGKPKLRGKHHQGQHHLVVPSGLQAKLEENEAVSDCSFPNSNDHVCNSEVNLGDNPIISTDNIPSIKPDALQYTTE
					

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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	27.3	Very low	29.8	Very low	246 Å²	246	145.5 Å²	145.5	100%	1.212	84%	0.837	S	S	*	*				0	126.5	0	-80.9	-177.1	156	0	0	108.8
2	S	27.4	Very low	29.9	Very low	111 Å²	111	145.3 Å²	145.3	78%	0.776	83%	0.831	S	S	*	*			trans	18.3	106.7	174.5	-65.1	0	0	0	0	121.2
3	T	29.5	Very low	30.4	Very low	118 Å²	118	138.2 Å²	138.2	72%	0.724	79%	0.788	S	S	*	*				34	118.9	123.3	60.5	0	0	0	0	118.8
4	N	32.2	Very low	31.3	Very low	168 Å²	168	132.4 Å²	132.4	90%	0.898	76%	0.761	S	S	*	*				-140.3	127.4	128.9	-94.5	-26.2	0	0	0	109.6
5	E	28.5	Very low	32.5	Very low	188 Å²	188	126.6 Å²	126.6	88%	0.879	73%	0.726	S	S	*	*			trans	-70	136.7	-177.2	-54.8	-151.6	132.5	0	0	111.6
6	L	34	Very low	33.1	Very low	174 Å²	174	123.1 Å²	123.1	91%	0.911	70%	0.704	S	S	*	*			trans	-125.9	102.7	159.9	-87.9	158.4	0	0	0	106.3
7	G	30.4	Very low	33.8	Very low	63 Å²	63	120.6 Å²	120.6	65%	0.649	69%	0.686	S	S	*	*			trans	-64.3	163.3	172.3	0	0	0	0	0	112.1	G9	G7-G9 PolarHBondContact O-N 3.28Å
8	P	30	Very low	34.3	Very low	145 Å²	145	117.4 Å²	117.4	94%	0.942	67%	0.665	S	S	*	*	S	Bend	trans	-78.3	110.4	-172.1	31.9	-30.5	0	0	0	109.4
9	G	28.3	Very low	35.3	Very low	68 Å²	68	113.4 Å²	113.4	70%	0.701	64%	0.643	S	S	*	*			trans	-158.3	15.7	-176.8	0	0	0	0	0	115.9	G7	G7-G9 PolarHBondContact O-N 3.28Å
10	L	29.9	Very low	35.6	Very low	145 Å²	145	113.7 Å²	113.7	76%	0.759	64%	0.64	S	S	*	*			trans	-115.8	69.4	176.3	-77.6	168.6	0	0	0	110	I13	L10-I13 HydrophobicContact CD1-CD1 4.47Å; L10-I13 HydrophobicContact CD2-CD1 3.82Å; L10-I13 HydrophobicContact CD2-CG1 4.33Å
11	K	30.2	Very low	35.8	Very low	174 Å²	174	112.3 Å²	112.3	76%	0.757	63%	0.629	S	S	*	*			trans	-85.9	135.3	154	-65.8	179.6	179.1	-179.6	0	106.1
12	D	31.4	Very low	36.4	Very low	143 Å²	143	102.4 Å²	102.4	77%	0.765	59%	0.586	S	S	*	*			trans	79.8	68.1	173	-47.2	-31.6	0	0	0	117.2
13	I	35.8	Very low	36.9	Very low	53 Å²	53	101.8 Å²	101.8	27%	0.272	57%	0.574	S	S	.	*			trans	-111.2	108.2	154.5	-64.4	171.5	0	0	0	106.9	L10 L15 M17 M18	L10-I13 HydrophobicContact CD1-CD1 4.47Å; L10-I13 HydrophobicContact CD2-CD1 3.82Å; L10-I13 HydrophobicContact CD2-CG1 4.33Å; I13-L15 PolarHBondContact O-N 3.32Å; I13-M17 HydrophobicContact CB-CE 4.03Å; I13-M17 HydrophobicContact CG1-CE 3.74Å; I13-M17 HydrophobicContact CG2-CB 4.05Å; I13-M17 HydrophobicContact CG2-CE 3.79Å; I13-M18 HydrophobicContact CG2-CB 3.97Å; I13-M18 HydrophobicContact CG2-CG 4.16Å
14	S	42.9	Very low	37.5	Very low	58 Å²	58	100 Å²	100	41%	0.406	56%	0.563	S	S	.	*			trans	-50.4	134.3	166.7	175.2	0	0	0	0	108.7	D16 M17 M18	S14-D16 PolarHBondContact O-N 3.19Å; S14-D16 PolarHBondContact OG-N 3.06Å; S14-M17 WeakPolarHBondContact O-CA 3.23Å; S14-M17 WeakPolarHBondContact O-CB 3.15Å; S14-M17 PolarHBondContact O-N 3.47Å; S14-M18 PolarHBondContact O-N 3.45Å
15	L	50.5	Low	38	Very low	45 Å²	45	98.6 Å²	98.6	24%	0.236	55%	0.553	C	S	.	*	H	α-helix	trans	-48.6	-35	177.3	-169.4	70.2	0	0	0	111.3	I13 M17 M18 V19 M246 V249 L295	I13-L15 PolarHBondContact O-N 3.32Å; L15-M17 VanDerWaalsContact C-N 3.33Å; L15-M17 PolarHBondContact O-N 3.1Å; L15-M18 PolarHBondContact O-N 3.48Å; L15-V19 WeakPolarHBondContact O-CG2 3.1Å; L15-V19 PolarHBondContact O-N 3.14Å; L15-M246 HydrophobicContact CD1-SD 4.13Å; L15-V249 HydrophobicContact CD1-CG1 4.13Å; L15-L295 HydrophobicContact CD2-CD1 3.94Å
16	D	41.6	Very low	38.7	Very low	71 Å²	71	95.3 Å²	95.3	38%	0.38	54%	0.536	S	S	.	.	H	α-helix	trans	-63.4	-34.7	175.4	-63.1	-34.6	0	0	0	113.4	S14 M20	S14-D16 PolarHBondContact O-N 3.19Å; S14-D16 PolarHBondContact OG-N 3.06Å; D16-M20 WeakPolarHBondContact O-CB 3.27Å; D16-M20 WeakPolarHBondContact O-CG 3.38Å; D16-M20 PolarHBondContact O-N 2.9Å
17	M	45.5	Very low	38.8	Very low	81 Å²	81	94.3 Å²	94.3	40%	0.399	53%	0.53	S	S	.	.	H	α-helix	trans	-75.3	-32.4	177.6	-163.5	172.1	71.2	0	0	111.7	I13 S14 L15 M20 Q21	I13-M17 HydrophobicContact CB-CE 4.03Å; I13-M17 HydrophobicContact CG1-CE 3.74Å; I13-M17 HydrophobicContact CG2-CB 4.05Å; I13-M17 HydrophobicContact CG2-CE 3.79Å; S14-M17 WeakPolarHBondContact O-CA 3.23Å; S14-M17 WeakPolarHBondContact O-CB 3.15Å; S14-M17 PolarHBondContact O-N 3.47Å; L15-M17 VanDerWaalsContact C-N 3.33Å; L15-M17 PolarHBondContact O-N 3.1Å; M17-M20 PolarHBondContact O-N 3.11Å; M17-Q21 WeakPolarHBondContact O-CB 3.42Å; M17-Q21 WeakPolarHBondContact O-CG 3.47Å; M17-Q21 PolarHBondContact O-N 3.25Å
18	M	43	Very low	38.9	Very low	62 Å²	62	95.7 Å²	95.7	31%	0.305	53%	0.53	S	S	.	.	H	α-helix	trans	-69	-38	173.1	-134.7	179.7	-158.7	0	0	111.4	I13 S14 L15 Q21 A22 Q250	I13-M18 HydrophobicContact CG2-CB 3.97Å; I13-M18 HydrophobicContact CG2-CG 4.16Å; S14-M18 PolarHBondContact O-N 3.45Å; L15-M18 PolarHBondContact O-N 3.48Å; M18-Q21 PolarHBondContact O-N 3.22Å; M18-A22 WeakPolarHBondContact O-CB 3.44Å; M18-A22 PolarHBondContact O-N 3.3Å; M18-Q250 HydrophobicContact SD-CG 4.41Å
19	V	51.6	Low	39.1	Very low	41 Å²	41	95.8 Å²	95.8	25%	0.248	52%	0.523	C	S	.	.	H	α-helix	trans	-66.9	-41.1	173.5	174.2	0	0	0	0	111.5	L15 N23 M253	L15-V19 WeakPolarHBondContact O-CG2 3.1Å; L15-V19 PolarHBondContact O-N 3.14Å; V19-N23 PolarHBondContact O-N 3.05Å; V19-N23 PolarHBondContact O-ND2 3.42Å; V19-M253 HydrophobicContact CG2-CE 3.33Å; V19-M253 HydrophobicContact CG2-SD 3.97Å
20	M	42.3	Very low	39.5	Very low	119 Å²	119	101.2 Å²	101.2	59%	0.586	53%	0.53	S	S	*	.	H	α-helix	trans	-67	-40	174.4	-79.9	-165	-91.9	0	0	112.5	D16 M17 N23 T24	D16-M20 WeakPolarHBondContact O-CB 3.27Å; D16-M20 WeakPolarHBondContact O-CG 3.38Å; D16-M20 PolarHBondContact O-N 2.9Å; M17-M20 PolarHBondContact O-N 3.11Å; M20-N23 PolarHBondContact O-N 3.38Å; M20-T24 WeakPolarHBondContact O-CB 3.35Å; M20-T24 VanDerWaalsContact O-CG2 3.28Å; M20-T24 WeakPolarHBondContact O-CG2 3.5Å; M20-T24 PolarHBondContact O-N 2.97Å; M20-T24 PolarHBondContact O-OG1 2.96Å
21	Q	39.9	Very low	39.5	Very low	85 Å²	85	102 Å²	102	40%	0.397	53%	0.534	S	S	.	.	H	α-helix	trans	-65.5	-40.1	177	-78.4	-180	-1.6	0	0	112.4	M17 M18 N23 T24 M25	M17-Q21 WeakPolarHBondContact O-CB 3.42Å; M17-Q21 WeakPolarHBondContact O-CG 3.47Å; M17-Q21 PolarHBondContact O-N 3.25Å; M18-Q21 PolarHBondContact O-N 3.22Å; Q21-N23 VanDerWaalsContact C-N 3.26Å; Q21-N23 PolarHBondContact O-N 3.38Å; Q21-T24 WeakPolarHBondContact CA-OG1 3.46Å; Q21-T24 PolarHBondContact O-N 3.38Å; Q21-T24 PolarHBondContact O-OG1 2.57Å; Q21-M25 WeakPolarHBondContact O-CB 3.26Å; Q21-M25 WeakPolarHBondContact O-CG 3.5Å; Q21-M25 PolarHBondContact O-N 3.2Å
22	A	38.9	Very low	39.5	Very low	38 Å²	38	97.5 Å²	97.5	31%	0.314	53%	0.53	S	S	.	.	H	α-helix	trans	-62.5	-32.8	175.5	0	0	0	0	0	112.8	M18	M18-A22 WeakPolarHBondContact O-CB 3.44Å; M18-A22 PolarHBondContact O-N 3.3Å
23	N	38.2	Very low	39.5	Very low	98 Å²	98	95.9 Å²	95.9	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-86.6	-26.7	177.9	-69.5	-34.1	0	0	0	113.7	V19 M20 Q21	V19-N23 PolarHBondContact O-N 3.05Å; V19-N23 PolarHBondContact O-ND2 3.42Å; M20-N23 PolarHBondContact O-N 3.38Å; Q21-N23 VanDerWaalsContact C-N 3.26Å; Q21-N23 PolarHBondContact O-N 3.38Å
24	T	43.2	Very low	39.3	Very low	80 Å²	80	105.7 Å²	105.7	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-88.3	-23.7	-178.3	49.7	0	0	0	0	113.8	M20 Q21 K26 L27	M20-T24 WeakPolarHBondContact O-CB 3.35Å; M20-T24 VanDerWaalsContact O-CG2 3.28Å; M20-T24 WeakPolarHBondContact O-CG2 3.5Å; M20-T24 PolarHBondContact O-N 2.97Å; M20-T24 PolarHBondContact O-OG1 2.96Å; Q21-T24 WeakPolarHBondContact CA-OG1 3.46Å; Q21-T24 PolarHBondContact O-N 3.38Å; Q21-T24 PolarHBondContact O-OG1 2.57Å; T24-K26 PolarHBondContact O-N 3.47Å; T24-L27 PolarHBondContact O-N 3.06Å
25	M	41.3	Very low	38.7	Very low	140 Å²	140	107.9 Å²	107.9	69%	0.69	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	2.2	178	-80.4	-173.4	156.2	0	0	115.4	Q21	Q21-M25 WeakPolarHBondContact O-CB 3.26Å; Q21-M25 WeakPolarHBondContact O-CG 3.5Å; Q21-M25 PolarHBondContact O-N 3.2Å
26	K	43	Very low	38	Very low	119 Å²	119	112.8 Å²	112.8	52%	0.517	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.6	0.7	176	-100.7	179.8	176.3	-178.3	0	116	T24 E261	T24-K26 PolarHBondContact O-N 3.47Å; K26-E261 VanDerWaalsContact CE-OE1 3.32Å; K26-E261 WeakPolarHBondContact CE-OE1 3.24Å; K26-E261 IonicContact NZ-OE1 3.94Å; K26-E261 PolarHBondContact NZ-OE1 3.27Å
27	L	36.3	Very low	37.7	Very low	153 Å²	153	116.7 Å²	116.7	80%	0.801	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-5.7	178.7	-78.9	159.3	0	0	0	114.3	T24	T24-L27 PolarHBondContact O-N 3.06Å
28	S	33.7	Very low	37.3	Very low	92 Å²	92	117.3 Å²	117.3	64%	0.643	64%	0.638	S	S	*	*	S	Bend	trans	-106.5	11.8	-173.3	65.6	0	0	0	0	115.6
29	N	34.9	Very low	37	Very low	147 Å²	147	123 Å²	123	79%	0.786	66%	0.661	S	S	*	*	S	Bend	trans	-120.6	21.1	-175.4	-84.5	-17.6	0	0	0	114.5
30	Q	35	Very low	36.3	Very low	182 Å²	182	127.9 Å²	127.9	85%	0.85	69%	0.686	S	S	*	*	S	Bend	trans	-112.2	-6.1	177.9	-104.1	176.7	-3.9	0	0	116.4
31	D	31	Very low	36.2	Very low	160 Å²	160	130.8 Å²	130.8	86%	0.856	70%	0.698	S	S	*	*	S	Bend	trans	-125.8	62.5	-177.3	-65.7	-45.3	0	0	0	112.6
32	A	30.3	Very low	36.1	Very low	80 Å²	80	131.2 Å²	131.2	66%	0.661	71%	0.708	S	S	*	*			trans	-162	49	175.3	0	0	0	0	0	115.3
33	S	31.2	Very low	35.7	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	74%	0.736	S	S	*	*			trans	-167.4	95	163.3	52.7	0	0	0	0	112.9
34	R	32	Very low	35.4	Very low	260 Å²	260	135.1 Å²	135.1	98%	0.981	74%	0.739	S	S	*	*			trans	175.9	90.7	140.9	-96.3	164.9	-170.8	-161.9	2.9	109.3
35	S	30.3	Very low	34.8	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	75%	0.749	S	S	*	*			trans	-125.4	119.7	158	57	0	0	0	0	106.6
36	N	34.9	Very low	34.5	Very low	149 Å²	149	138.3 Å²	138.3	80%	0.797	75%	0.75	S	S	*	*			trans	174.3	138.3	131.7	-83.9	-6.3	0	0	0	111.3
37	D	34.8	Very low	33.9	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	76%	0.76	S	S	*	*			trans	70.1	133.6	162	-66.8	-26.8	0	0	0	119.5
38	S	37.8	Very low	33.8	Very low	93 Å²	93	137.4 Å²	137.4	65%	0.65	75%	0.754	S	S	*	*			cis	-177.6	137	-18.6	50.9	0	0	0	0	105.9
39	K	37	Very low	33.9	Very low	182 Å²	182	138.2 Å²	138.2	79%	0.791	76%	0.759	S	S	*	*			trans	86.2	120.8	147.1	-77	-178.4	179.2	-178.9	0	122.2
40	D	37.3	Very low	34	Very low	144 Å²	144	135.6 Å²	135.6	77%	0.77	75%	0.752	S	S	*	*			trans	78	132.7	142.4	-47.8	-22.6	0	0	0	118.3
41	E	38.4	Very low	34.1	Very low	180 Å²	180	134.1 Å²	134.1	84%	0.841	75%	0.749	S	S	*	*			cis	-168.1	157.1	-29.1	-132.2	-114.2	144.2	0	0	104.4
42	P	38.4	Very low	34.3	Very low	94 Å²	94	132 Å²	132	61%	0.61	74%	0.737	S	S	*	*			trans	-115.5	167.6	-158.7	39.3	-27.5	0	0	0	115
43	C	31.3	Very low	34.7	Very low	131 Å²	131	137.3 Å²	137.3	89%	0.885	74%	0.74	S	S	*	*			trans	157.6	153.2	150.2	-90.3	0	0	0	0	109.8
44	S	31.5	Very low	35.1	Very low	86 Å²	86	139.9 Å²	139.9	60%	0.601	74%	0.74	S	S	*	*			cis	175.9	127	-6.3	147.2	0	0	0	0	107.1
45	I	31.2	Very low	35.3	Very low	137 Å²	137	132.5 Å²	132.5	70%	0.703	73%	0.728	S	S	*	*			trans	57.6	141	132.1	-39.4	171.7	0	0	0	122
46	H	34.9	Very low	35.6	Very low	151 Å²	151	131.6 Å²	131.6	70%	0.699	72%	0.722	S	S	*	*			trans	105.2	105.8	154.4	-75.9	-70	0	0	0	116.3
47	E	29.8	Very low	35.7	Very low	158 Å²	158	131.2 Å²	131.2	74%	0.738	72%	0.72	S	S	*	*				78.4	115.6	72	-90.3	-169.6	153.2	0	0	115.5
48	S	34.8	Very low	35.7	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	72%	0.721	S	S	*	*			trans	76.5	109.9	133	-52.1	0	0	0	0	120
49	S	34.8	Very low	35.5	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	73%	0.725	S	S	*	*				144	147	94.8	67.5	0	0	0	0	115.4
50	S	36.6	Very low	35.5	Very low	92 Å²	92	130.1 Å²	130.1	64%	0.643	73%	0.727	S	S	*	*			trans	87.6	107	144.4	-52.8	0	0	0	0	118.6
51	I	37.3	Very low	35.5	Very low	151 Å²	151	129.1 Å²	129.1	77%	0.774	73%	0.729	S	S	*	*				77.7	126.6	89.1	-71.4	162.2	0	0	0	109.8
52	D	36.5	Very low	35.1	Very low	116 Å²	116	123.8 Å²	123.8	62%	0.62	72%	0.722	S	S	*	*			cis	-174.1	164.9	21.7	-131.9	-7.2	0	0	0	110.2
53	R	38.4	Very low	34.9	Very low	192 Å²	192	125.6 Å²	125.6	73%	0.725	73%	0.731	S	S	*	*			trans	93.8	116.5	139.9	-74.2	165.8	-161.1	-151.4	0.5	124.4
54	H	39	Very low	35.2	Very low	163 Å²	163	128.3 Å²	128.3	76%	0.755	73%	0.728	S	S	*	*			trans	74.1	111.3	136.6	-65.9	-52.2	0	0	0	119.2
55	S	36.2	Very low	35.3	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	74%	0.738	S	S	*	*				72.7	128	85.9	-162.4	0	0	0	0	110.9
56	S	37.2	Very low	35.9	Very low	84 Å²	84	132.8 Å²	132.8	59%	0.587	74%	0.743	S	S	*	*			cis	-170.3	174.2	10.5	25.6	0	0	0	0	108.2
57	D	36.5	Very low	35.8	Very low	140 Å²	140	133.1 Å²	133.1	75%	0.749	75%	0.745	S	S	*	*			trans	92.6	103.8	152.4	-55.1	-32.9	0	0	0	120.6
58	E	34	Very low	36	Very low	180 Å²	180	133.3 Å²	133.3	84%	0.841	75%	0.751	S	S	*	*				69.5	140	121	-77.4	-118.1	114.4	0	0	122.5
59	S	34.8	Very low	36	Very low	106 Å²	106	136.9 Å²	136.9	74%	0.741	76%	0.757	S	S	*	*			trans	89.4	105.5	154.9	74.4	0	0	0	0	118.9
60	S	36.6	Very low	35.8	Very low	120 Å²	120	137.1 Å²	137.1	84%	0.839	76%	0.758	S	S	*	*			trans	-58.8	147	153.4	-83.8	0	0	0	0	110.3
61	P	37.7	Very low	35.8	Very low	122 Å²	122	139.2 Å²	139.2	79%	0.792	77%	0.769	S	S	*	*				-150	146.7	93.5	34.5	-15.7	0	0	0	115.5
62	G	30.1	Very low	35.8	Very low	68 Å²	68	140.6 Å²	140.6	70%	0.701	77%	0.772	S	S	*	*			trans	66	136.7	131.1	0	0	0	0	0	121.8
63	V	33.5	Very low	35.7	Very low	132 Å²	132	144.7 Å²	144.7	80%	0.8	78%	0.784	S	S	*	*			trans	84.3	108.3	148.8	-146.1	0	0	0	0	116.5
64	K	38.8	Very low	35.5	Very low	189 Å²	189	143.7 Å²	143.7	82%	0.822	79%	0.79	S	S	*	*				176.9	119	97.8	-88.7	178	-172.8	178	0	111.7
65	I	33.5	Very low	35.7	Very low	157 Å²	157	140 Å²	140	81%	0.805	78%	0.779	S	S	*	*			trans	-57.5	128.4	165.1	-63.8	160.6	0	0	0	108.6	E67	I65-E67 HydrophobicContact CG2-CG 4.47Å
66	I	42	Very low	36.3	Very low	160 Å²	160	141.9 Å²	141.9	82%	0.821	78%	0.78	S	S	*	*			trans	-129.5	106.2	155.2	-63.9	-179.1	0	0	0	105.9
67	E	33	Very low	37.2	Very low	158 Å²	158	142 Å²	142	74%	0.738	78%	0.78	S	S	*	*			trans	-58.1	129.2	162.8	-76.3	169.3	127.3	0	0	109.1	I65	I65-E67 HydrophobicContact CG2-CG 4.47Å
68	D	35.3	Very low	37.9	Very low	162 Å²	162	140.9 Å²	140.9	87%	0.866	77%	0.771	S	S	*	*			trans	-130.6	123	151.3	-146.8	-0.7	0	0	0	108.4
69	Q	33.3	Very low	39	Very low	169 Å²	169	137 Å²	137	79%	0.79	76%	0.755	S	S	*	*			trans	-80.8	131.7	-171.1	-71	174.1	11.6	0	0	110.5
70	C	31.8	Very low	40.5	Very low	114 Å²	114	134.4 Å²	134.4	77%	0.77	74%	0.74	S	S	*	*			trans	-132.1	141.8	149	-105.2	0	0	0	0	108.1	E72	C70-E72 PolarHBondContact O-N 3.14Å
71	P	36.1	Very low	42.3	Very low	136 Å²	136	134.7 Å²	134.7	88%	0.883	73%	0.728	S	S	*	*			trans	-75.2	98.2	-160.9	30.3	-33.3	0	0	0	111.5
72	E	37.6	Very low	44.6	Very low	179 Å²	179	132.9 Å²	132.9	84%	0.836	71%	0.712	S	S	*	*			trans	-87.5	122.1	167.7	-84.2	-174.8	148.2	0	0	111	C70	C70-E72 PolarHBondContact O-N 3.14Å
73	K	33.7	Very low	47.4	Very low	202 Å²	202	134 Å²	134	88%	0.878	70%	0.702	S	S	*	*			trans	150.4	70.6	139.4	-85.5	177	174.8	177	0	112.5
74	M	35.3	Very low	50.1	Low	171 Å²	171	130.1 Å²	130.1	84%	0.842	68%	0.678	S	S	*	*	S	Bend	trans	-166.3	151.5	150.3	-115.1	160.3	168.9	0	0	106.6
75	T	42.4	Very low	52.6	Low	85 Å²	85	124 Å²	124	52%	0.521	66%	0.659	S	S	.	*	S	Bend	trans	74.9	39.7	167.9	49	0	0	0	0	121.5	L79	T75-L79 VanDerWaalsContact O-CD1 3.26Å; T75-L79 WeakPolarHBondContact O-CD1 3.47Å
76	I	49.8	Very low	55.4	Low	146 Å²	146	122 Å²	122	75%	0.749	64%	0.641	S	S	*	*	S	Bend	trans	-115.2	-34.5	158.2	-61.9	177.3	0	0	0	111.9
77	S	54.6	Low	57.8	Low	85 Å²	85	114.5 Å²	114.5	59%	0.594	60%	0.604	S	S	*	*	H	α-helix	trans	-72.3	-41.3	176.8	-156.8	0	0	0	0	112.8	L79 A80 E81	S77-L79 PolarHBondContact O-N 3.46Å; S77-A80 PolarHBondContact O-N 3.28Å; S77-E81 PolarHBondContact O-N 2.94Å
78	E	51.9	Low	60.7	Low	118 Å²	118	110.3 Å²	110.3	55%	0.551	59%	0.586	S	S	*	*	H	α-helix	trans	-64.6	-37.2	179.4	-79.4	173	150.9	0	0	112.6	A80 E81 D82	E78-A80 VanDerWaalsContact C-N 3.27Å; E78-A80 PolarHBondContact O-N 3.08Å; E78-E81 PolarHBondContact O-N 3.43Å; E78-D82 WeakPolarHBondContact O-CB 3.49Å; E78-D82 PolarHBondContact O-N 3.1Å; E78-D82 VanDerWaalsContact O-N 3.07Å
79	L	56.9	Low	63.4	Low	97 Å²	97	108.7 Å²	108.7	51%	0.508	58%	0.576	S	S	.	*	H	α-helix	trans	-64.9	-33	177.6	-65.9	177.3	0	0	0	112.1	T75 S77 D83	T75-L79 VanDerWaalsContact O-CD1 3.26Å; T75-L79 WeakPolarHBondContact O-CD1 3.47Å; S77-L79 PolarHBondContact O-N 3.46Å; L79-D83 PolarHBondContact O-N 3.39Å
80	A	67.6	Low	66.4	Low	53 Å²	53	104.7 Å²	104.7	44%	0.438	56%	0.557	S	S	.	*	H	α-helix	trans	-74.7	-40.8	178.1	0	0	0	0	0	112.5	S77 E78 D82 D83 V84	S77-A80 PolarHBondContact O-N 3.28Å; E78-A80 VanDerWaalsContact C-N 3.27Å; E78-A80 PolarHBondContact O-N 3.08Å; A80-D82 VanDerWaalsContact C-N 3.32Å; A80-D82 PolarHBondContact O-N 3Å; A80-D83 PolarHBondContact O-N 2.96Å; A80-V84 WeakPolarHBondContact O-CG2 3.27Å; A80-V84 PolarHBondContact O-N 3.28Å; A80-V84 VanDerWaalsContact O-N 3.08Å
81	E	73.9	Confident	69.4	Low	125 Å²	125	100 Å²	100	58%	0.584	52%	0.523	S	S	*	.	H	α-helix	trans	-64.3	-38.2	175.7	-71.7	-180	-170.1	0	0	112	S77 E78 V84 S85	S77-E81 PolarHBondContact O-N 2.94Å; E78-E81 PolarHBondContact O-N 3.43Å; E81-V84 PolarHBondContact O-N 3.4Å; E81-S85 WeakPolarHBondContact O-CB 3.46Å; E81-S85 PolarHBondContact O-N 2.95Å; E81-S85 PolarHBondContact O-OG 2.54Å
82	D	85.4	Confident	72.2	Confident	85 Å²	85	99.3 Å²	99.3	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-41.4	173.4	-91.3	-1.8	0	0	0	112.3	E78 A80 S85 R86	E78-D82 WeakPolarHBondContact O-CB 3.49Å; E78-D82 PolarHBondContact O-N 3.1Å; E78-D82 VanDerWaalsContact O-N 3.07Å; A80-D82 VanDerWaalsContact C-N 3.32Å; A80-D82 PolarHBondContact O-N 3Å; D82-S85 PolarHBondContact O-N 2.83Å; D82-R86 WeakPolarHBondContact O-CB 3.49Å; D82-R86 VanDerWaalsContact O-CG 3.26Å; D82-R86 WeakPolarHBondContact O-CG 3.23Å; D82-R86 PolarHBondContact O-N 3.17Å; D82-R86 IonicContact OD2-NH1 3.61Å
83	D	88.5	Confident	75	Confident	90 Å²	90	97.2 Å²	97.2	48%	0.481	50%	0.497	S	S	.	.	H	α-helix	trans	-66.8	-42.2	177.2	-89.7	-30.5	0	0	0	112.8	L79 A80 R86 A87	L79-D83 PolarHBondContact O-N 3.39Å; A80-D83 PolarHBondContact O-N 2.96Å; D83-R86 VanDerWaalsContact CG-NH2 3.26Å; D83-R86 PolarHBondContact O-N 3.34Å; D83-R86 IonicContact OD1-CZ 3.85Å; D83-R86 VanDerWaalsContact OD1-CZ 3.3Å; D83-R86 IonicContact OD1-NE 3.68Å; D83-R86 PolarHBondContact OD1-NE 3.15Å; D83-R86 IonicContact OD1-NH2 3.98Å; D83-R86 PolarHBondContact OD1-NH2 3.16Å; D83-R86 IonicContact OD2-NH2 3.53Å; D83-A87 WeakPolarHBondContact O-CB 3.36Å; D83-A87 PolarHBondContact O-N 3.02Å
84	V	90.4	Very high	78	Confident	51 Å²	51	88 Å²	88	31%	0.309	46%	0.457	S	S	.	.	H	α-helix	trans	-61.2	-47.2	174.9	172.5	0	0	0	0	110.3	A80 E81 R86 A87 L88 A269	A80-V84 WeakPolarHBondContact O-CG2 3.27Å; A80-V84 PolarHBondContact O-N 3.28Å; A80-V84 VanDerWaalsContact O-N 3.08Å; E81-V84 PolarHBondContact O-N 3.4Å; V84-R86 PolarHBondContact O-N 3.11Å; V84-A87 WeakPolarHBondContact O-CB 3.38Å; V84-A87 PolarHBondContact O-N 2.81Å; V84-A87 VanDerWaalsContact O-N 3.17Å; V84-L88 HydrophobicContact CG1-CD1 4.21Å; V84-L88 WeakPolarHBondContact O-CG 3.29Å; V84-L88 PolarHBondContact O-N 3.2Å; V84-A269 HydrophobicContact CG1-CB 4.23Å
85	S	90.8	Very high	81	Confident	60 Å²	60	80.2 Å²	80.2	42%	0.42	42%	0.419	S	S	.	.	H	α-helix	trans	-61.1	-45.3	178.4	-61.7	0	0	0	0	111.8	E81 D82 A87 L88 I89	E81-S85 WeakPolarHBondContact O-CB 3.46Å; E81-S85 PolarHBondContact O-N 2.95Å; E81-S85 PolarHBondContact O-OG 2.54Å; D82-S85 PolarHBondContact O-N 2.83Å; S85-A87 VanDerWaalsContact C-N 3.33Å; S85-A87 PolarHBondContact O-N 2.6Å; S85-L88 PolarHBondContact O-N 2.99Å; S85-I89 VanDerWaalsContact O-CG1 3.31Å; S85-I89 WeakPolarHBondContact O-CG1 3.29Å; S85-I89 PolarHBondContact O-N 3.43Å
86	R	93.3	Very high	83.6	Confident	115 Å²	115	79.6 Å²	79.6	43%	0.434	41%	0.411	S	S	.	.	H	α-helix	trans	-57.9	-44.3	173.3	-78	-173	-72	-96.9	7.5	111.9	D82 D83 V84 I89 Q90	D82-R86 WeakPolarHBondContact O-CB 3.49Å; D82-R86 VanDerWaalsContact O-CG 3.26Å; D82-R86 WeakPolarHBondContact O-CG 3.23Å; D82-R86 PolarHBondContact O-N 3.17Å; D82-R86 IonicContact OD2-NH1 3.61Å; D83-R86 VanDerWaalsContact CG-NH2 3.26Å; D83-R86 PolarHBondContact O-N 3.34Å; D83-R86 IonicContact OD1-CZ 3.85Å; D83-R86 VanDerWaalsContact OD1-CZ 3.3Å; D83-R86 IonicContact OD1-NE 3.68Å; D83-R86 PolarHBondContact OD1-NE 3.15Å; D83-R86 IonicContact OD1-NH2 3.98Å; D83-R86 PolarHBondContact OD1-NH2 3.16Å; D83-R86 IonicContact OD2-NH2 3.53Å; V84-R86 PolarHBondContact O-N 3.11Å; R86-I89 PolarHBondContact O-N 2.86Å; R86-Q90 VanDerWaalsContact O-CG 3.29Å; R86-Q90 WeakPolarHBondContact O-CG 3.37Å; R86-Q90 PolarHBondContact O-N 2.87Å
87	A	93.1	Very high	85.9	Confident	3 Å²	3	77.4 Å²	77.4	3%	0.025	40%	0.398	C	S	.	.	H	α-helix	trans	-64.4	-41.7	179.3	0	0	0	0	0	112.1	D83 V84 S85 Q90 R91 R268 A269	D83-A87 WeakPolarHBondContact O-CB 3.36Å; D83-A87 PolarHBondContact O-N 3.02Å; V84-A87 WeakPolarHBondContact O-CB 3.38Å; V84-A87 PolarHBondContact O-N 2.81Å; V84-A87 VanDerWaalsContact O-N 3.17Å; S85-A87 VanDerWaalsContact C-N 3.33Å; S85-A87 PolarHBondContact O-N 2.6Å; A87-Q90 PolarHBondContact O-N 3.12Å; A87-R91 WeakPolarHBondContact O-CB 3.49Å; A87-R91 PolarHBondContact O-N 3.48Å; A87-R268 HydrophobicContact CB-CB 3.69Å; A87-A269 HydrophobicContact CB-CB 3.97Å
88	L	92.1	Very high	87.9	Confident	70 Å²	70	73.4 Å²	73.4	37%	0.366	37%	0.37	S	S	.	.	H	α-helix	trans	-66.6	-38.4	176.7	-69.3	176.9	0	0	0	112.5	V84 S85 Q90 R91 K92 A269	V84-L88 HydrophobicContact CG1-CD1 4.21Å; V84-L88 WeakPolarHBondContact O-CG 3.29Å; V84-L88 PolarHBondContact O-N 3.2Å; S85-L88 PolarHBondContact O-N 2.99Å; L88-Q90 VanDerWaalsContact C-N 3.34Å; L88-R91 WeakPolarHBondContact O-CB 3.39Å; L88-R91 PolarHBondContact O-N 3.07Å; L88-K92 PolarHBondContact O-N 3.47Å; L88-A269 HydrophobicContact CD2-CB 3.72Å; L88-A269 HydrophobicContact CG-CB 3.9Å
89	I	93.4	Very high	90.1	Very high	129 Å²	129	68.3 Å²	68.3	66%	0.662	35%	0.347	S	S	*	.	H	α-helix	trans	-62.1	-44.4	173	-68	165.3	0	0	0	110.3	S85 R86 R91 K92	S85-I89 VanDerWaalsContact O-CG1 3.31Å; S85-I89 WeakPolarHBondContact O-CG1 3.29Å; S85-I89 PolarHBondContact O-N 3.43Å; R86-I89 PolarHBondContact O-N 2.86Å; I89-R91 VanDerWaalsContact C-N 3.3Å; I89-R91 PolarHBondContact O-N 3.47Å; I89-K92 WeakPolarHBondContact O-CB 3.25Å; I89-K92 PolarHBondContact O-N 2.97Å
90	Q	94.9	Very high	92.1	Very high	85 Å²	85	66.7 Å²	66.7	40%	0.397	34%	0.343	S	S	.	.	H	α-helix	trans	-65.7	-31.7	176.8	-70.7	174.9	-9.5	0	0	112.7	R86 A87 L88 K92 P94 Y265	R86-Q90 VanDerWaalsContact O-CG 3.29Å; R86-Q90 WeakPolarHBondContact O-CG 3.37Å; R86-Q90 PolarHBondContact O-N 2.87Å; A87-Q90 PolarHBondContact O-N 3.12Å; L88-Q90 VanDerWaalsContact C-N 3.34Å; Q90-K92 PolarHBondContact O-N 3.32Å; Q90-P94 VanDerWaalsContact O-CD 3.31Å; Q90-P94 WeakPolarHBondContact O-CD 3.15Å; Q90-Y265 HydrophobicContact CB-CD1 3.5Å; Q90-Y265 VanDerWaalsContact CB-CD1 3.5Å; Q90-Y265 HydrophobicContact CB-CD2 4.46Å; Q90-Y265 HydrophobicContact CB-CE1 3.46Å; Q90-Y265 VanDerWaalsContact CB-CE1 3.46Å; Q90-Y265 HydrophobicContact CB-CE2 4.42Å; Q90-Y265 HydrophobicContact CB-CG 4.03Å; Q90-Y265 HydrophobicContact CG-CE1 4.17Å
91	R	95.4	Very high	93.5	Very high	14 Å²	14	65.8 Å²	65.8	5%	0.053	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-27.9	175.2	-169.7	174.1	74.4	160.4	2	112.7	A87 L88 I89 Q93 P94 L95 D190 I262 T266	A87-R91 WeakPolarHBondContact O-CB 3.49Å; A87-R91 PolarHBondContact O-N 3.48Å; L88-R91 WeakPolarHBondContact O-CB 3.39Å; L88-R91 PolarHBondContact O-N 3.07Å; I89-R91 VanDerWaalsContact C-N 3.3Å; I89-R91 PolarHBondContact O-N 3.47Å; R91-Q93 VanDerWaalsContact C-N 3.34Å; R91-Q93 PolarHBondContact O-N 3.15Å; R91-P94 VanDerWaalsContact O-CD 3.23Å; R91-P94 WeakPolarHBondContact O-CD 3.32Å; R91-P94 WeakPolarHBondContact O-CG 3.34Å; R91-L95 HydrophobicContact CG-CD1 4.03Å; R91-L95 WeakPolarHBondContact O-CG 3.44Å; R91-L95 PolarHBondContact O-N 2.76Å; R91-D190 IonicContact CZ-OD1 3.36Å; R91-D190 IonicContact CZ-OD2 2.57Å; R91-D190 IonicContact NH1-OD1 2.66Å; R91-D190 PolarHBondContact NH1-OD1 3.49Å; R91-D190 IonicContact NH1-OD2 3.82Å; R91-D190 IonicContact NH2-OD1 3.5Å; R91-D190 PolarHBondContact NH2-OD1 3.15Å; R91-D190 IonicContact NH2-OD2 3.1Å; R91-D190 PolarHBondContact NH2-OD2 3.42Å; R91-I262 HydrophobicContact CG-CG2 4.02Å; R91-T266 VanDerWaalsContact CD-OG1 3.29Å; R91-T266 WeakPolarHBondContact CD-OG1 3.37Å
92	K	95.5	Very high	94.7	Very high	122 Å²	122	59.9 Å²	59.9	53%	0.53	31%	0.306	S	S	.	.	H	α-helix	trans	-61.8	-38.9	-177.3	-169.8	171.3	-176.1	169.8	0	112.8	L88 I89 Q90 L95 M96	L88-K92 PolarHBondContact O-N 3.47Å; I89-K92 WeakPolarHBondContact O-CB 3.25Å; I89-K92 PolarHBondContact O-N 2.97Å; Q90-K92 PolarHBondContact O-N 3.32Å; K92-L95 WeakPolarHBondContact O-CB 3.45Å; K92-L95 PolarHBondContact O-N 3.02Å; K92-M96 HydrophobicContact CG-CG 4.24Å; K92-M96 WeakPolarHBondContact O-CG 3.36Å; K92-M96 PolarHBondContact O-N 3.38Å
93	Q	96.3	Very high	95.3	Very high	135 Å²	135	59.9 Å²	59.9	63%	0.631	30%	0.304	S	S	*	.	H	α-helix	trans	-60.9	-53.9	-176.9	-176.6	61.8	21.3	0	0	113.6	R91 L95 M96 E97	R91-Q93 VanDerWaalsContact C-N 3.34Å; R91-Q93 PolarHBondContact O-N 3.15Å; Q93-L95 VanDerWaalsContact C-N 3.27Å; Q93-L95 PolarHBondContact O-N 2.65Å; Q93-M96 PolarHBondContact O-N 3.1Å; Q93-E97 PolarHBondContact O-N 3.07Å
94	P	97.3	Very high	95.7	Very high	8 Å²	8	56 Å²	56	5%	0.052	28%	0.284	C	S	.	.	H	α-helix	trans	-69.3	-23.3	178.8	28.8	-37.7	0	0	0	113.4	Q90 R91 L98 E261 I262 Y265	Q90-P94 VanDerWaalsContact O-CD 3.31Å; Q90-P94 WeakPolarHBondContact O-CD 3.15Å; R91-P94 VanDerWaalsContact O-CD 3.23Å; R91-P94 WeakPolarHBondContact O-CD 3.32Å; R91-P94 WeakPolarHBondContact O-CG 3.34Å; P94-L98 PolarHBondContact O-N 3.21Å; P94-E261 HydrophobicContact CB-CB 3.84Å; P94-E261 HydrophobicContact CG-CB 4.17Å; P94-I262 HydrophobicContact CB-CG1 3.86Å; P94-I262 HydrophobicContact CG-CG1 3.83Å; P94-Y265 HydrophobicContact CG-CD2 4.21Å; P94-Y265 HydrophobicContact CG-CE2 4.39Å
95	L	97.5	Very high	96.1	Very high	8 Å²	8	53.6 Å²	53.6	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-49.7	167.9	-76.8	167.7	0	0	0	111.1	R91 K92 Q93 E97 L98 V99 V185 P189 I192 I262 W277	R91-L95 HydrophobicContact CG-CD1 4.03Å; R91-L95 WeakPolarHBondContact O-CG 3.44Å; R91-L95 PolarHBondContact O-N 2.76Å; K92-L95 WeakPolarHBondContact O-CB 3.45Å; K92-L95 PolarHBondContact O-N 3.02Å; Q93-L95 VanDerWaalsContact C-N 3.27Å; Q93-L95 PolarHBondContact O-N 2.65Å; L95-E97 VanDerWaalsContact C-N 3.31Å; L95-E97 PolarHBondContact O-N 3.35Å; L95-L98 WeakPolarHBondContact O-CB 3.27Å; L95-L98 PolarHBondContact O-N 3.11Å; L95-L98 VanDerWaalsContact O-N 3.15Å; L95-V99 WeakPolarHBondContact O-CG2 3.38Å; L95-V99 PolarHBondContact O-N 2.99Å; L95-V99 VanDerWaalsContact O-N 3.11Å; L95-V185 HydrophobicContact CB-CG2 4.12Å; L95-P189 HydrophobicContact CD1-CB 3.81Å; L95-P189 HydrophobicContact CD2-CB 4.42Å; L95-I192 HydrophobicContact CD2-CD1 3.55Å; L95-I262 HydrophobicContact CD2-CD1 3.71Å; L95-I262 HydrophobicContact CD2-CG1 4.22Å; L95-I262 HydrophobicContact CD2-CG2 4.46Å; L95-I262 HydrophobicContact CG-CD1 4.09Å; L95-I262 HydrophobicContact CG-CG1 4.12Å; L95-W277 HydrophobicContact CD2-CH2 4.22Å; L95-W277 HydrophobicContact CD2-CZ2 4.43Å
96	M	97	Very high	96.5	Very high	73 Å²	73	51.4 Å²	51.4	36%	0.36	25%	0.254	S	S	.	.	H	α-helix	trans	-65.6	-33.6	177.7	-64.3	-49.6	-62.1	0	0	112.6	K92 Q93 V99 S100 V185	K92-M96 HydrophobicContact CG-CG 4.24Å; K92-M96 WeakPolarHBondContact O-CG 3.36Å; K92-M96 PolarHBondContact O-N 3.38Å; Q93-M96 PolarHBondContact O-N 3.1Å; M96-V99 PolarHBondContact O-N 2.91Å; M96-S100 VanDerWaalsContact O-CB 3.32Å; M96-S100 WeakPolarHBondContact O-CB 3.29Å; M96-S100 PolarHBondContact O-N 2.88Å; M96-S100 PolarHBondContact O-OG 2.87Å; M96-V185 HydrophobicContact SD-CG2 4.32Å
97	E	97.4	Very high	96.7	Very high	99 Å²	99	52.6 Å²	52.6	46%	0.463	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-42.5	171.7	-172.3	-175.5	158.6	0	0	111.6	Q93 L95 V99 S100 S101	Q93-E97 PolarHBondContact O-N 3.07Å; L95-E97 VanDerWaalsContact C-N 3.31Å; L95-E97 PolarHBondContact O-N 3.35Å; E97-V99 PolarHBondContact O-N 2.87Å; E97-S100 WeakPolarHBondContact CA-OG 3.36Å; E97-S100 PolarHBondContact O-OG 3.24Å; E97-S101 WeakPolarHBondContact O-CB 3.49Å; E97-S101 PolarHBondContact O-N 3.45Å; E97-S101 PolarHBondContact O-OG 2.68Å
98	L	97.8	Very high	96.9	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-59	-47.9	175.7	177.8	63.4	0	0	0	111.2	P94 L95 S101 E102 L181 I192 F196 Y255 P258 I262	P94-L98 PolarHBondContact O-N 3.21Å; L95-L98 WeakPolarHBondContact O-CB 3.27Å; L95-L98 PolarHBondContact O-N 3.11Å; L95-L98 VanDerWaalsContact O-N 3.15Å; L98-S101 PolarHBondContact O-OG 2.99Å; L98-E102 WeakPolarHBondContact O-CB 3.31Å; L98-E102 PolarHBondContact O-N 3.08Å; L98-E102 VanDerWaalsContact O-N 3.08Å; L98-L181 HydrophobicContact CD2-CD1 4.22Å; L98-L181 HydrophobicContact CG-CD2 4.19Å; L98-I192 HydrophobicContact CD2-CG2 4.3Å; L98-F196 HydrophobicContact CD1-CZ 4.27Å; L98-F196 HydrophobicContact CD2-CE2 4.02Å; L98-F196 HydrophobicContact CD2-CZ 4.2Å; L98-Y255 HydrophobicContact CD1-CD1 4.08Å; L98-Y255 HydrophobicContact CD1-CE1 4.37Å; L98-P258 HydrophobicContact CB-CB 4.23Å; L98-P258 HydrophobicContact CB-CG 4.35Å; L98-P258 HydrophobicContact CD1-CG 3.97Å; L98-I262 HydrophobicContact CD2-CD1 4.39Å
99	V	98.1	Very high	97.2	Very high	12 Å²	12	53.4 Å²	53.4	7%	0.073	26%	0.256	C	S	.	.	H	α-helix	trans	-65.8	-53.2	179.9	-176.4	0	0	0	0	111.9	L95 M96 E97 S101 E102 E103 L178 L181 V182 V185	L95-V99 WeakPolarHBondContact O-CG2 3.38Å; L95-V99 PolarHBondContact O-N 2.99Å; L95-V99 VanDerWaalsContact O-N 3.11Å; M96-V99 PolarHBondContact O-N 2.91Å; E97-V99 PolarHBondContact O-N 2.87Å; V99-S101 VanDerWaalsContact C-N 3.29Å; V99-S101 PolarHBondContact O-N 3.07Å; V99-E102 WeakPolarHBondContact O-CB 3.35Å; V99-E102 PolarHBondContact O-N 2.95Å; V99-E102 VanDerWaalsContact O-N 3.09Å; V99-E103 PolarHBondContact O-N 3.49Å; V99-L178 HydrophobicContact CG1-CD1 4.44Å; V99-L181 HydrophobicContact CB-CD2 4.37Å; V99-L181 HydrophobicContact CG2-CD2 3.92Å; V99-L181 HydrophobicContact CG2-CG 3.86Å; V99-V182 HydrophobicContact CG1-CG2 3.73Å; V99-V185 HydrophobicContact CG2-CB 3.96Å; V99-V185 HydrophobicContact CG2-CG1 4.1Å; V99-V185 HydrophobicContact CG2-CG2 3.74Å
100	S	97.7	Very high	97.5	Very high	62 Å²	62	51.4 Å²	51.4	43%	0.434	24%	0.243	S	C	.	.	H	α-helix	trans	-62.6	-35.8	-178.1	57.4	0	0	0	0	112.6	M96 E97 G104	M96-S100 VanDerWaalsContact O-CB 3.32Å; M96-S100 WeakPolarHBondContact O-CB 3.29Å; M96-S100 PolarHBondContact O-N 2.88Å; M96-S100 PolarHBondContact O-OG 2.87Å; E97-S100 WeakPolarHBondContact CA-OG 3.36Å; E97-S100 PolarHBondContact O-OG 3.24Å; S100-G104 PolarHBondContact O-N 2.94Å
101	S	97.7	Very high	97.6	Very high	35 Å²	35	49.7 Å²	49.7	25%	0.245	24%	0.236	C	C	.	.	H	α-helix	trans	-71.2	-32.2	175.1	70.8	0	0	0	0	112.9	E97 L98 V99 Y105 R251	E97-S101 WeakPolarHBondContact O-CB 3.49Å; E97-S101 PolarHBondContact O-N 3.45Å; E97-S101 PolarHBondContact O-OG 2.68Å; L98-S101 PolarHBondContact O-OG 2.99Å; V99-S101 VanDerWaalsContact C-N 3.29Å; V99-S101 PolarHBondContact O-N 3.07Å; S101-Y105 WeakPolarHBondContact O-CB 3.37Å; S101-Y105 PolarHBondContact O-N 2.72Å; S101-Y105 VanDerWaalsContact O-N 3.11Å; S101-R251 PolarHBondContact OG-NH1 3.44Å; S101-R251 PolarHBondContact OG-NH2 3.34Å
102	E	98.4	Very high	97.7	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-68.6	-45.5	173.1	-172.1	67.1	-164.1	0	0	110.7	L98 V99 G104 Y105 V106 H174 F177 L178 L181 R251 Y255	L98-E102 WeakPolarHBondContact O-CB 3.31Å; L98-E102 PolarHBondContact O-N 3.08Å; L98-E102 VanDerWaalsContact O-N 3.08Å; V99-E102 WeakPolarHBondContact O-CB 3.35Å; V99-E102 PolarHBondContact O-N 2.95Å; V99-E102 VanDerWaalsContact O-N 3.09Å; E102-G104 VanDerWaalsContact C-N 3.34Å; E102-G104 PolarHBondContact O-N 2.92Å; E102-Y105 WeakPolarHBondContact O-CB 3.13Å; E102-Y105 PolarHBondContact O-N 3Å; E102-Y105 VanDerWaalsContact O-N 3.08Å; E102-V106 WeakPolarHBondContact O-CG2 3.43Å; E102-V106 PolarHBondContact O-N 3.09Å; E102-H174 IonicContact OE1-CE1 3.6Å; E102-H174 IonicContact OE1-CG 3.02Å; E102-H174 IonicContact OE1-ND1 2.75Å; E102-H174 PolarHBondContact OE1-ND1 3.37Å; E102-F177 HydrophobicContact CG-CD1 4.3Å; E102-L178 HydrophobicContact CB-CD1 4.01Å; E102-L178 HydrophobicContact CG-CB 4.06Å; E102-L178 HydrophobicContact CG-CD1 3.89Å; E102-L181 HydrophobicContact CB-CD2 4.21Å; E102-L181 HydrophobicContact CG-CD2 4.42Å; E102-R251 VanDerWaalsContact CA-NH2 3.26Å; E102-R251 VanDerWaalsContact N-NH2 3.2Å; E102-R251 IonicContact OE2-CZ 2.77Å; E102-R251 VanDerWaalsContact OE2-CZ 3.26Å; E102-R251 IonicContact OE2-NE 2.76Å; E102-R251 PolarHBondContact OE2-NE 3.31Å; E102-R251 VanDerWaalsContact OE2-NE 3.12Å; E102-R251 IonicContact OE2-NH2 3.12Å; E102-R251 PolarHBondContact OE2-NH2 3.38Å; E102-Y255 PolarHBondContact OE1-OH 3.28Å; E102-Y255 WeakPolarHBondContact OE2-CE1 3.46Å; E102-Y255 PolarHBondContact OE2-OH 3.36Å
103	E	98.5	Very high	97.7	Very high	86 Å²	86	46.3 Å²	46.3	40%	0.402	22%	0.222	S	C	.	.	H	α-helix	trans	-59.3	-45.6	176.7	-163.7	-150.7	123.7	0	0	111.6	V99 Y105 V106 R107 L178	V99-E103 PolarHBondContact O-N 3.49Å; E103-Y105 VanDerWaalsContact C-N 3.28Å; E103-Y105 PolarHBondContact O-N 2.75Å; E103-V106 PolarHBondContact O-N 3.04Å; E103-R107 WeakPolarHBondContact O-CG 3.25Å; E103-R107 PolarHBondContact O-N 3.44Å; E103-R107 IonicContact OE1-CZ 3.75Å; E103-R107 VanDerWaalsContact OE1-CZ 3.3Å; E103-R107 IonicContact OE1-NE 3.53Å; E103-R107 PolarHBondContact OE1-NE 2.95Å; E103-R107 IonicContact OE1-NH2 2.64Å; E103-R107 PolarHBondContact OE1-NH2 3.27Å; E103-L178 HydrophobicContact CB-CD1 4.14Å; E103-L178 HydrophobicContact CB-CD2 4.17Å; E103-L178 HydrophobicContact CG-CD2 4.12Å
104	G	98	Very high	97.8	Very high	7 Å²	7	43 Å²	43	7%	0.072	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-35.8	174.5	0	0	0	0	0	113.2	S100 E102 R108	S100-G104 PolarHBondContact O-N 2.94Å; E102-G104 VanDerWaalsContact C-N 3.34Å; E102-G104 PolarHBondContact O-N 2.92Å; G104-R108 WeakPolarHBondContact O-CG 3.19Å; G104-R108 PolarHBondContact O-N 3.05Å; G104-R108 PolarHBondContact O-NH1 2.99Å
105	Y	98.4	Very high	97.7	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-71.2	-46.1	176.8	176.7	-118.3	0	0	0	112.3	S101 E102 E103 R107 R108 L109 H174 Y207 Q247 P248 R251	S101-Y105 WeakPolarHBondContact O-CB 3.37Å; S101-Y105 PolarHBondContact O-N 2.72Å; S101-Y105 VanDerWaalsContact O-N 3.11Å; E102-Y105 WeakPolarHBondContact O-CB 3.13Å; E102-Y105 PolarHBondContact O-N 3Å; E102-Y105 VanDerWaalsContact O-N 3.08Å; E103-Y105 VanDerWaalsContact C-N 3.28Å; E103-Y105 PolarHBondContact O-N 2.75Å; Y105-R107 VanDerWaalsContact C-N 3.28Å; Y105-R107 PolarHBondContact O-N 3.21Å; Y105-R108 PolarHBondContact O-N 3.19Å; Y105-R108 VanDerWaalsContact O-N 3.1Å; Y105-L109 HydrophobicContact CD1-CD1 4.13Å; Y105-L109 HydrophobicContact CD2-CG 4.39Å; Y105-L109 HydrophobicContact CE1-CD1 3.56Å; Y105-L109 HydrophobicContact CE1-CG 4.16Å; Y105-L109 HydrophobicContact CE2-CD1 4.26Å; Y105-L109 HydrophobicContact CE2-CD2 3.94Å; Y105-L109 HydrophobicContact CE2-CG 3.98Å; Y105-L109 PolarHBondContact O-N 2.93Å; Y105-H174 AromaticContact CD1-ND1 3.85Å; Y105-H174 HydrophobicContact CE1-CB 4.43Å; Y105-H174 AromaticContact CE1-CD2 3.62Å; Y105-H174 AromaticContact CE1-CE1 3.57Å; Y105-H174 AromaticContact CE1-CG 3.63Å; Y105-H174 AromaticContact CE1-ND1 3.58Å; Y105-H174 AromaticContact CE1-NE2 3.6Å; Y105-Y207 PolarHBondContact OH-OH 3.2Å; Y105-Q247 HydrophobicContact CE2-CB 4.09Å; Y105-P248 VanDerWaalsContact OH-CA 3.31Å; Y105-P248 WeakPolarHBondContact OH-CA 3.34Å; Y105-P248 WeakPolarHBondContact OH-CB 3.33Å; Y105-P248 WeakPolarHBondContact OH-CG 3.4Å; Y105-R251 HydrophobicContact CD1-CB 4.39Å; Y105-R251 HydrophobicContact CD1-CG 3.7Å; Y105-R251 HydrophobicContact CD2-CB 4.16Å; Y105-R251 HydrophobicContact CD2-CG 4.25Å; Y105-R251 HydrophobicContact CE1-CB 4.09Å; Y105-R251 HydrophobicContact CE1-CG 3.66Å; Y105-R251 HydrophobicContact CE2-CB 3.85Å; Y105-R251 HydrophobicContact CE2-CG 4.23Å; Y105-R251 HydrophobicContact CG-CB 4.41Å; Y105-R251 HydrophobicContact CG-CG 3.98Å
106	V	98.6	Very high	97.6	Very high	14 Å²	14	47.9 Å²	47.9	9%	0.085	23%	0.228	C	C	.	.	H	α-helix	trans	-58.4	-40.5	175	171.7	0	0	0	0	111.2	E102 E103 R108 L109 K110 Y171 H174 L178	E102-V106 WeakPolarHBondContact O-CG2 3.43Å; E102-V106 PolarHBondContact O-N 3.09Å; E103-V106 PolarHBondContact O-N 3.04Å; V106-R108 VanDerWaalsContact C-N 3.33Å; V106-R108 PolarHBondContact O-N 3.24Å; V106-L109 PolarHBondContact O-N 3.05Å; V106-K110 WeakPolarHBondContact O-CB 3.3Å; V106-K110 PolarHBondContact O-N 3.44Å; V106-Y171 HydrophobicContact CG1-CE2 4.09Å; V106-H174 HydrophobicContact CG2-CB 3.82Å; V106-L178 HydrophobicContact CB-CD2 4.11Å; V106-L178 HydrophobicContact CG1-CD2 4.34Å; V106-L178 HydrophobicContact CG2-CB 4.23Å; V106-L178 HydrophobicContact CG2-CD2 4Å
107	R	98.2	Very high	97.5	Very high	139 Å²	139	45.7 Å²	45.7	53%	0.525	22%	0.218	S	C	.	.	H	α-helix	trans	-58.8	-40.8	175.2	-78.9	-172.4	-95.4	119.2	-8	112.8	E103 Y105 K110 L111	E103-R107 WeakPolarHBondContact O-CG 3.25Å; E103-R107 PolarHBondContact O-N 3.44Å; E103-R107 IonicContact OE1-CZ 3.75Å; E103-R107 VanDerWaalsContact OE1-CZ 3.3Å; E103-R107 IonicContact OE1-NE 3.53Å; E103-R107 PolarHBondContact OE1-NE 2.95Å; E103-R107 IonicContact OE1-NH2 2.64Å; E103-R107 PolarHBondContact OE1-NH2 3.27Å; Y105-R107 VanDerWaalsContact C-N 3.28Å; Y105-R107 PolarHBondContact O-N 3.21Å; R107-K110 PolarHBondContact O-N 2.98Å; R107-L111 PolarHBondContact O-N 3.4Å
108	R	97.6	Very high	97.3	Very high	91 Å²	91	43.6 Å²	43.6	34%	0.343	21%	0.213	S	C	.	.	H	α-helix	trans	-72.4	-41	177.8	-66.9	-176.2	-61.8	-99	-4.2	112.3	G104 Y105 V106 K110 L111 V112 Q247	G104-R108 WeakPolarHBondContact O-CG 3.19Å; G104-R108 PolarHBondContact O-N 3.05Å; G104-R108 PolarHBondContact O-NH1 2.99Å; Y105-R108 PolarHBondContact O-N 3.19Å; Y105-R108 VanDerWaalsContact O-N 3.1Å; V106-R108 VanDerWaalsContact C-N 3.33Å; V106-R108 PolarHBondContact O-N 3.24Å; R108-K110 VanDerWaalsContact C-N 3.28Å; R108-K110 PolarHBondContact O-N 2.9Å; R108-L111 PolarHBondContact O-N 3.09Å; R108-V112 PolarHBondContact O-N 3.25Å; R108-Q247 VanDerWaalsContact CD-NE2 3.32Å
109	L	98.3	Very high	97	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.3	-41.6	171.7	-68.1	-175.5	0	0	0	112.1	Y105 V106 V112 K113 W167 L170 Y171 H174 P248	Y105-L109 HydrophobicContact CD1-CD1 4.13Å; Y105-L109 HydrophobicContact CD2-CG 4.39Å; Y105-L109 HydrophobicContact CE1-CD1 3.56Å; Y105-L109 HydrophobicContact CE1-CG 4.16Å; Y105-L109 HydrophobicContact CE2-CD1 4.26Å; Y105-L109 HydrophobicContact CE2-CD2 3.94Å; Y105-L109 HydrophobicContact CE2-CG 3.98Å; Y105-L109 PolarHBondContact O-N 2.93Å; V106-L109 PolarHBondContact O-N 3.05Å; L109-V112 PolarHBondContact O-N 2.9Å; L109-K113 PolarHBondContact O-N 3.26Å; L109-W167 HydrophobicContact CD2-CD2 4.41Å; L109-W167 HydrophobicContact CD2-CH2 3.94Å; L109-W167 HydrophobicContact CD2-CZ2 3.41Å; L109-W167 VanDerWaalsContact CD2-CZ2 3.41Å; L109-W167 PolarHBondContact O-NE1 2.84Å; L109-L170 HydrophobicContact CD1-CB 4.4Å; L109-Y171 HydrophobicContact CB-CD2 3.91Å; L109-H174 HydrophobicContact CD1-CB 4.13Å; L109-P248 HydrophobicContact CD2-CG 4.39Å
110	K	98.2	Very high	96.3	Very high	87 Å²	87	46.1 Å²	46.1	38%	0.378	23%	0.231	S	C	.	.	H	α-helix	trans	-62.9	-44.9	176.9	-172.3	171.1	170.7	51.9	0	112	V106 R107 R108 V112 K113 D114 Y171	V106-K110 WeakPolarHBondContact O-CB 3.3Å; V106-K110 PolarHBondContact O-N 3.44Å; R107-K110 PolarHBondContact O-N 2.98Å; R108-K110 VanDerWaalsContact C-N 3.28Å; R108-K110 PolarHBondContact O-N 2.9Å; K110-V112 VanDerWaalsContact C-N 3.31Å; K110-V112 PolarHBondContact O-N 2.97Å; K110-K113 WeakPolarHBondContact O-CB 3.3Å; K110-K113 PolarHBondContact O-N 3.07Å; K110-K113 VanDerWaalsContact O-N 3.14Å; K110-D114 VanDerWaalsContact CE-OD2 3.31Å; K110-D114 WeakPolarHBondContact CE-OD2 3.26Å; K110-D114 VanDerWaalsContact CG-OD2 3.22Å; K110-D114 WeakPolarHBondContact CG-OD2 3.47Å; K110-D114 IonicContact NZ-OD1 3.12Å; K110-D114 IonicContact NZ-OD2 2.65Å; K110-D114 PolarHBondContact NZ-OD2 2.9Å; K110-D114 WeakPolarHBondContact O-CB 3.31Å; K110-D114 PolarHBondContact O-N 2.93Å; K110-Y171 HydrophobicContact CB-CD2 4.19Å; K110-Y171 HydrophobicContact CB-CE2 3.57Å; K110-Y171 HydrophobicContact CD-CE2 4.41Å; K110-Y171 HydrophobicContact CG-CE2 4.01Å
111	L	97.7	Very high	95.1	Very high	49 Å²	49	48.2 Å²	48.2	26%	0.257	24%	0.238	S	C	.	.	H	α-helix	trans	-55.5	-48	177.9	-177.8	154.6	0	0	0	111.1	R107 R108 K113 D114 F115 Y116	R107-L111 PolarHBondContact O-N 3.4Å; R108-L111 PolarHBondContact O-N 3.09Å; L111-K113 PolarHBondContact O-N 2.88Å; L111-D114 PolarHBondContact O-N 2.85Å; L111-F115 HydrophobicContact CG-CD2 4.17Å; L111-F115 WeakPolarHBondContact O-CB 2.76Å; L111-F115 WeakPolarHBondContact O-CD2 3.13Å; L111-F115 PolarHBondContact O-N 2.88Å; L111-Y116 HydrophobicContact CD2-CD2 3.97Å; L111-Y116 HydrophobicContact CD2-CE2 3.68Å
112	V	97.3	Very high	92.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-63.3	-43.9	176.7	171.9	0	0	0	0	111.6	R108 L109 K110 D114 Y116 I117 W164 W167 H244	R108-V112 PolarHBondContact O-N 3.25Å; L109-V112 PolarHBondContact O-N 2.9Å; K110-V112 VanDerWaalsContact C-N 3.31Å; K110-V112 PolarHBondContact O-N 2.97Å; V112-D114 PolarHBondContact O-N 3.33Å; V112-Y116 HydrophobicContact CG2-CD2 4.35Å; V112-Y116 WeakPolarHBondContact O-CB 3.4Å; V112-Y116 PolarHBondContact O-N 2.93Å; V112-I117 HydrophobicContact CG1-CG1 4.31Å; V112-I117 PolarHBondContact O-N 3.49Å; V112-W164 HydrophobicContact CG1-CD2 4.38Å; V112-W164 HydrophobicContact CG1-CE3 3.55Å; V112-W164 HydrophobicContact CG1-CH2 3.74Å; V112-W164 HydrophobicContact CG1-CZ3 3.19Å; V112-W167 HydrophobicContact CB-CH2 4.35Å; V112-W167 HydrophobicContact CB-CZ2 3.42Å; V112-W167 VanDerWaalsContact CB-CZ2 3.42Å; V112-W167 HydrophobicContact CG1-CD2 3.94Å; V112-W167 HydrophobicContact CG1-CG 4.37Å; V112-W167 HydrophobicContact CG1-CH2 4.26Å; V112-W167 HydrophobicContact CG1-CZ2 3.58Å; V112-W167 HydrophobicContact CG2-CH2 4.07Å; V112-W167 HydrophobicContact CG2-CZ2 3.5Å; V112-W167 VanDerWaalsContact CG2-CZ2 3.5Å; V112-H244 HydrophobicContact CG2-CB 3.9Å
113	K	96.7	Very high	89.9	Confident	65 Å²	65	54.4 Å²	54.4	28%	0.283	28%	0.282	S	S	.	.	I	π-helix	trans	-59.1	-44.6	177.1	170.8	-176.5	168.9	-176	0	112.6	L109 K110 L111 P118 I168 Y171	L109-K113 PolarHBondContact O-N 3.26Å; K110-K113 WeakPolarHBondContact O-CB 3.3Å; K110-K113 PolarHBondContact O-N 3.07Å; K110-K113 VanDerWaalsContact O-N 3.14Å; L111-K113 PolarHBondContact O-N 2.88Å; K113-P118 VanDerWaalsContact O-CD 3.3Å; K113-P118 WeakPolarHBondContact O-CD 3.34Å; K113-I168 HydrophobicContact CB-CD1 4.19Å; K113-I168 HydrophobicContact CD-CD1 4.01Å; K113-I168 HydrophobicContact CG-CD1 3.66Å; K113-Y171 HydrophobicContact CD-CD1 3.35Å; K113-Y171 HydrophobicContact CD-CE1 3.5Å; K113-Y171 VanDerWaalsContact CD-CE1 3.5Å; K113-Y171 HydrophobicContact CD-CG 4.02Å
114	D	96.6	Very high	87.1	Confident	64 Å²	64	56.6 Å²	56.6	34%	0.342	30%	0.302	S	S	.	.	I	π-helix	trans	-85.2	-28.8	-169.3	-67.6	-7.6	0	0	0	111.8	K110 L111 V112	K110-D114 VanDerWaalsContact CE-OD2 3.31Å; K110-D114 WeakPolarHBondContact CE-OD2 3.26Å; K110-D114 VanDerWaalsContact CG-OD2 3.22Å; K110-D114 WeakPolarHBondContact CG-OD2 3.47Å; K110-D114 IonicContact NZ-OD1 3.12Å; K110-D114 IonicContact NZ-OD2 2.65Å; K110-D114 PolarHBondContact NZ-OD2 2.9Å; K110-D114 WeakPolarHBondContact O-CB 3.31Å; K110-D114 PolarHBondContact O-N 2.93Å; L111-D114 PolarHBondContact O-N 2.85Å; V112-D114 PolarHBondContact O-N 3.33Å
115	F	95.5	Very high	84	Confident	119 Å²	119	62.1 Å²	62.1	52%	0.522	33%	0.334	S	S	.	.	I	π-helix	trans	-116	-46.2	-174.2	-61.4	-73.6	0	0	0	114.7	L111 I235	L111-F115 HydrophobicContact CG-CD2 4.17Å; L111-F115 WeakPolarHBondContact O-CB 2.76Å; L111-F115 WeakPolarHBondContact O-CD2 3.13Å; L111-F115 PolarHBondContact O-N 2.88Å; F115-I235 HydrophobicContact CB-CD1 3.87Å; F115-I235 HydrophobicContact CB-CG1 4.17Å; F115-I235 HydrophobicContact CB-CG2 3.86Å; F115-I235 HydrophobicContact CD2-CG2 4.5Å; F115-I235 HydrophobicContact CG-CG2 4.06Å
116	Y	95.6	Very high	81	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	37%	0.371	C	S	.	.	I	π-helix	trans	-78.4	-51.7	-177.2	-77.1	-99	0	0	0	111.4	L111 V112 A119 W160 W164 L231 I235 D237	L111-Y116 HydrophobicContact CD2-CD2 3.97Å; L111-Y116 HydrophobicContact CD2-CE2 3.68Å; V112-Y116 HydrophobicContact CG2-CD2 4.35Å; V112-Y116 WeakPolarHBondContact O-CB 3.4Å; V112-Y116 PolarHBondContact O-N 2.93Å; Y116-A119 VanDerWaalsContact O-CB 3.22Å; Y116-A119 WeakPolarHBondContact O-CB 3.23Å; Y116-A119 PolarHBondContact O-N 3.37Å; Y116-W160 VanDerWaalsContact O-CZ2 3.29Å; Y116-W160 WeakPolarHBondContact O-CZ2 3.45Å; Y116-W164 HydrophobicContact CD1-CH2 4.08Å; Y116-W164 HydrophobicContact CD1-CZ2 4.27Å; Y116-W164 HydrophobicContact CG-CH2 4.07Å; Y116-W164 HydrophobicContact CG-CZ2 4.31Å; Y116-L231 HydrophobicContact CD1-CD2 3.77Å; Y116-L231 HydrophobicContact CD1-CG 4.29Å; Y116-L231 HydrophobicContact CE1-CD2 4.2Å; Y116-L231 HydrophobicContact CE1-CG 4.32Å; Y116-I235 HydrophobicContact CD1-CD1 4.15Å; Y116-I235 HydrophobicContact CD2-CD1 3.72Å; Y116-I235 HydrophobicContact CE1-CD1 4.14Å; Y116-I235 HydrophobicContact CE2-CD1 3.73Å; Y116-I235 HydrophobicContact CG-CD1 3.96Å; Y116-D237 HydrophobicContact CE2-CB 4.46Å; Y116-D237 VanDerWaalsContact CE2-OD2 3.25Å; Y116-D237 WeakPolarHBondContact CE2-OD2 3.41Å; Y116-D237 PolarHBondContact OH-OD2 2.97Å
117	I	94.7	Very high	78	Confident	27 Å²	27	74.3 Å²	74.3	14%	0.138	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-55.8	-43.5	-176.3	-65	-176.1	0	0	0	112.9	V112 A119 W160 W164 W167 I168	V112-I117 HydrophobicContact CG1-CG1 4.31Å; V112-I117 PolarHBondContact O-N 3.49Å; I117-A119 VanDerWaalsContact C-N 3.3Å; I117-A119 PolarHBondContact O-N 3.11Å; I117-W160 PolarHBondContact O-NE1 3.19Å; I117-W164 HydrophobicContact CD1-CB 4.12Å; I117-W164 HydrophobicContact CD1-CD2 4.41Å; I117-W164 HydrophobicContact CD1-CG 4.12Å; I117-W164 HydrophobicContact CG1-CB 4.23Å; I117-W164 HydrophobicContact CG1-CD2 3.78Å; I117-W164 HydrophobicContact CG1-CE3 4.37Å; I117-W164 HydrophobicContact CG1-CG 3.68Å; I117-W167 HydrophobicContact CD1-CB 4.17Å; I117-W167 HydrophobicContact CD1-CG 4.15Å; I117-I168 HydrophobicContact CD1-CD1 3.61Å; I117-I168 HydrophobicContact CD1-CG1 4.24Å
118	P	93.7	Very high	74.9	Confident	56 Å²	56	72.3 Å²	72.3	36%	0.364	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-75.4	-12.6	-179.7	-18.2	35	0	0	0	114.4	K113 V120 N121 A122	K113-P118 VanDerWaalsContact O-CD 3.3Å; K113-P118 WeakPolarHBondContact O-CD 3.34Å; P118-V120 PolarHBondContact O-N 2.83Å; P118-V120 VanDerWaalsContact O-N 3.08Å; P118-N121 PolarHBondContact O-N 3.2Å; P118-N121 VanDerWaalsContact O-N 3.09Å; P118-A122 PolarHBondContact O-N 2.87Å
119	A	91.1	Very high	71.7	Confident	32 Å²	32	75.7 Å²	75.7	26%	0.264	44%	0.439	S	S	.	.	G	3₁₀ helix	trans	-56.9	-31.4	-169.5	0	0	0	0	0	114.4	Y116 I117 W160 L231	Y116-A119 VanDerWaalsContact O-CB 3.22Å; Y116-A119 WeakPolarHBondContact O-CB 3.23Å; Y116-A119 PolarHBondContact O-N 3.37Å; I117-A119 VanDerWaalsContact C-N 3.3Å; I117-A119 PolarHBondContact O-N 3.11Å; A119-W160 HydrophobicContact CB-CZ2 4.29Å; A119-L231 HydrophobicContact CB-CD1 3.9Å; A119-L231 HydrophobicContact CB-CD2 3.94Å
120	V	84.4	Confident	68.7	Low	33 Å²	33	80.7 Å²	80.7	20%	0.2	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-17.1	180	-178.6	0	0	0	0	112.8	P118 A152 A157 W160 F227	P118-V120 PolarHBondContact O-N 2.83Å; P118-V120 VanDerWaalsContact O-N 3.08Å; V120-A152 HydrophobicContact CB-CB 4.38Å; V120-A152 HydrophobicContact CG1-CB 3.98Å; V120-A152 HydrophobicContact CG2-CB 3.47Å; V120-A152 VanDerWaalsContact CG2-CB 3.47Å; V120-A157 HydrophobicContact CG1-CB 3.61Å; V120-W160 HydrophobicContact CB-CD2 3.74Å; V120-W160 HydrophobicContact CB-CE3 4.23Å; V120-W160 HydrophobicContact CB-CG 3.99Å; V120-W160 HydrophobicContact CB-CZ2 4.15Å; V120-W160 HydrophobicContact CG1-CD2 4.37Å; V120-W160 HydrophobicContact CG1-CG 4.36Å; V120-W160 HydrophobicContact CG2-CD2 3.58Å; V120-W160 HydrophobicContact CG2-CE3 3.62Å; V120-W160 HydrophobicContact CG2-CG 4.34Å; V120-W160 HydrophobicContact CG2-CH2 3.55Å; V120-W160 HydrophobicContact CG2-CZ2 3.5Å; V120-W160 VanDerWaalsContact CG2-CZ2 3.5Å; V120-W160 HydrophobicContact CG2-CZ3 3.6Å; V120-F227 HydrophobicContact CG2-CZ 4.24Å
121	N	70.9	Confident	65.8	Low	106 Å²	106	84.9 Å²	84.9	57%	0.567	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.9	177.4	-67.8	-23	0	0	0	112.7	P118 P123	P118-N121 PolarHBondContact O-N 3.2Å; P118-N121 VanDerWaalsContact O-N 3.09Å; N121-P123 WeakPolarHBondContact O-CD 3.49Å; N121-P123 VanDerWaalsContact O-N 3.12Å
122	A	50.4	Low	63.1	Low	59 Å²	59	89.7 Å²	89.7	49%	0.488	53%	0.527	S	S	.	.	S	Bend	trans	-63.7	112.5	174.9	0	0	0	0	0	108.2	P118 T124	P118-A122 PolarHBondContact O-N 2.87Å; A122-T124 PolarHBondContact O-N 2.9Å
123	P	38	Very low	60.3	Low	106 Å²	106	97.8 Å²	97.8	69%	0.688	57%	0.571	S	S	*	*			trans	-58	121.4	178.3	22.8	-30.5	0	0	0	107.4	N121 T125	N121-P123 WeakPolarHBondContact O-CD 3.49Å; N121-P123 VanDerWaalsContact O-N 3.12Å; P123-T125 PolarHBondContact O-N 2.84Å
124	T	38.4	Very low	57.5	Low	132 Å²	132	103.8 Å²	103.8	81%	0.81	60%	0.602	S	S	*	*			trans	-70.8	52.8	171.2	-23.6	0	0	0	0	109	A122	A122-T124 PolarHBondContact O-N 2.9Å
125	T	32.9	Very low	54.7	Low	124 Å²	124	104 Å²	104	76%	0.761	62%	0.619	S	S	*	*			trans	-109.9	63.1	179.6	-43.8	0	0	0	0	107.9	P123	P123-T125 PolarHBondContact O-N 2.84Å
126	A	35.5	Very low	52	Low	95 Å²	95	104.8 Å²	104.8	79%	0.785	63%	0.633	S	S	*	*	S	Bend	trans	-143.7	9.7	167.8	0	0	0	0	0	112.7
127	Q	35.8	Very low	49.4	Very low	177 Å²	177	110 Å²	110	83%	0.827	67%	0.67	S	S	*	*	S	Bend	trans	-122.4	58.8	176.9	-67.7	-176.4	2	0	0	110.6
128	S	33.3	Very low	46.6	Very low	97 Å²	97	113.5 Å²	113.5	68%	0.678	70%	0.697	S	S	*	*	S	Bend	trans	-176.6	129.4	150.9	40.2	0	0	0	0	107.1
129	N	31.6	Very low	44	Very low	161 Å²	161	115.6 Å²	115.6	86%	0.861	71%	0.713	S	S	*	*			trans	82.5	67.8	171.4	-43.2	-23.9	0	0	0	116.1
130	A	34.1	Very low	41.6	Very low	106 Å²	106	122 Å²	122	88%	0.876	74%	0.742	S	S	*	*			trans	-141.7	59.4	152.8	0	0	0	0	0	109.9
131	E	38.2	Very low	39.4	Very low	174 Å²	174	124.4 Å²	124.4	81%	0.813	76%	0.758	S	S	*	*			trans	-93.8	133.7	156.6	-70.2	-177.8	164.8	0	0	107.4
132	N	39.7	Very low	37.8	Very low	150 Å²	150	127.5 Å²	127.5	80%	0.802	77%	0.769	S	S	*	*			trans	81.4	81.8	174.1	-47.1	-37.9	0	0	0	117
133	N	38.8	Very low	37.1	Very low	171 Å²	171	129.1 Å²	129.1	91%	0.914	78%	0.777	S	S	*	*				-165.2	137.6	112.4	-113.1	-21.7	0	0	0	113.5
134	M	39.2	Very low	37	Very low	190 Å²	190	131.3 Å²	131.3	94%	0.936	78%	0.783	S	S	*	*			trans	-98.7	132.2	-168.2	-161.6	171.3	-75.3	0	0	108.1
135	G	36.8	Very low	37.5	Very low	69 Å²	69	130.3 Å²	130.3	71%	0.711	78%	0.781	S	S	*	*			trans	170.9	80.5	175.1	0	0	0	0	0	118.7
136	V	39.8	Very low	38.3	Very low	135 Å²	135	134.3 Å²	134.3	82%	0.818	79%	0.791	S	S	*	*			trans	72.6	107.4	139.5	-169.6	0	0	0	0	119.6
137	S	39.4	Very low	39.9	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	78%	0.778	S	S	*	*				39.8	131.4	129.5	-47.4	0	0	0	0	119.2
138	S	37.4	Very low	41.9	Very low	102 Å²	102	129 Å²	129	71%	0.713	77%	0.772	S	S	*	*			cis	-177.1	143.3	49.5	44.5	0	0	0	0	112.6
139	S	37.3	Very low	44.2	Very low	100 Å²	100	128 Å²	128	70%	0.699	76%	0.762	S	S	*	*			trans	60	135.7	148.1	57.2	0	0	0	0	119.6
140	L	41.1	Very low	46.9	Very low	165 Å²	165	121.3 Å²	121.3	86%	0.864	73%	0.728	S	S	*	*			cis	-172.7	171.6	11.5	-105	158.3	0	0	0	105.5
141	P	39	Very low	49.6	Very low	85 Å²	85	122.7 Å²	122.7	55%	0.552	73%	0.725	S	S	*	*			trans	-120.1	172.7	-135.1	36.7	-18.3	0	0	0	113.8
142	H	37.1	Very low	52.1	Low	170 Å²	170	115.4 Å²	115.4	79%	0.787	70%	0.695	S	S	*	*			trans	166.6	119.9	130.2	-83.2	-34.7	0	0	0	112.7
143	S	36.4	Very low	54.6	Low	94 Å²	94	110.9 Å²	110.9	66%	0.657	67%	0.673	S	S	*	*			trans	75.4	108.2	136.6	-41.5	0	0	0	0	120.3
144	D	35.7	Very low	57.1	Low	151 Å²	151	110.8 Å²	110.8	81%	0.807	67%	0.667	S	S	*	*			trans	83.7	117.9	135.4	-53.1	-26.7	0	0	0	119.6
145	S	47.6	Very low	59.6	Low	112 Å²	112	106.8 Å²	106.8	78%	0.783	65%	0.65	S	S	*	*			trans	87.8	70.4	166	-31.1	0	0	0	0	116.2	A147	S145-A147 PolarHBondContact O-N 2.81Å
146	H	51	Low	62.3	Low	208 Å²	208	103.5 Å²	103.5	96%	0.963	62%	0.616	S	S	*	*			trans	-71.3	69.1	154.7	-73.7	-71.2	0	0	0	109.7
147	A	68	Low	64.8	Low	61 Å²	61	99 Å²	99	50%	0.504	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-73.8	127.5	166.7	0	0	0	0	0	107.8	S145 F234	S145-A147 PolarHBondContact O-N 2.81Å; A147-F234 HydrophobicContact CB-CD2 4.25Å; A147-F234 VanDerWaalsContact O-CE2 3.28Å; A147-F234 WeakPolarHBondContact O-CE2 3.5Å
148	S	78.4	Confident	67.3	Low	100 Å²	100	98 Å²	98	70%	0.699	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-67.9	148.8	166.5	51.3	0	0	0	0	109.5
149	P	82.5	Confident	70	Confident	74 Å²	74	96.4 Å²	96.4	48%	0.481	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-56.8	140.9	171.3	24.8	-33.3	0	0	0	109.8	V151 F234	P149-V151 PolarHBondContact O-N 2.82Å; P149-F234 HydrophobicContact CB-CD1 4.36Å; P149-F234 HydrophobicContact CB-CE1 3.84Å; P149-F234 HydrophobicContact CB-CE2 4.43Å; P149-F234 HydrophobicContact CB-CZ 3.88Å
150	P	87.7	Confident	72.7	Confident	22 Å²	22	91.9 Å²	91.9	14%	0.143	54%	0.537	C	S	.	.	P	Polyproline II helix	trans	-62.7	137.2	177.4	26.1	-32.9	0	0	0	109.9	F227 E230 L231	P150-F227 HydrophobicContact CB-CD2 4.24Å; P150-F227 HydrophobicContact CB-CE2 4.06Å; P150-F227 HydrophobicContact CG-CE2 4.19Å; P150-E230 HydrophobicContact CB-CB 4.1Å; P150-E230 HydrophobicContact CG-CB 4.36Å; P150-L231 HydrophobicContact CG-CB 3.89Å; P150-L231 HydrophobicContact CG-CD1 3.95Å
151	V	89.8	Confident	75.2	Confident	134 Å²	134	94.5 Å²	94.5	81%	0.812	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-84	123.8	179.5	-178.8	0	0	0	0	108.7	P149	P149-V151 PolarHBondContact O-N 2.82Å
152	A	90.6	Very high	77.8	Confident	22 Å²	22	93.6 Å²	93.6	18%	0.182	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-70.8	137	179.1	0	0	0	0	0	111.6	V120 L156 F227	V120-A152 HydrophobicContact CB-CB 4.38Å; V120-A152 HydrophobicContact CG1-CB 3.98Å; V120-A152 HydrophobicContact CG2-CB 3.47Å; V120-A152 VanDerWaalsContact CG2-CB 3.47Å; A152-L156 HydrophobicContact CB-CD2 4.44Å; A152-F227 VanDerWaalsContact CA-CE2 3.42Å; A152-F227 HydrophobicContact CB-CD2 4.47Å; A152-F227 HydrophobicContact CB-CE1 4.5Å; A152-F227 HydrophobicContact CB-CE2 3.74Å; A152-F227 HydrophobicContact CB-CZ 3.75Å
153	P	92.3	Very high	80.7	Confident	54 Å²	54	85.5 Å²	85.5	35%	0.351	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-54.8	142.6	167.3	-25.7	34.9	0	0	0	111.5	D155 L156 A157 Y224	P153-D155 VanDerWaalsContact C-N 3.29Å; P153-D155 PolarHBondContact O-N 2.95Å; P153-L156 HydrophobicContact CB-CB 4.27Å; P153-L156 WeakPolarHBondContact O-CA 3.44Å; P153-L156 WeakPolarHBondContact O-CB 3.33Å; P153-L156 PolarHBondContact O-N 3.43Å; P153-A157 PolarHBondContact O-N 3.26Å; P153-Y224 HydrophobicContact CB-CD1 4.49Å; P153-Y224 HydrophobicContact CB-CE1 4.06Å; P153-Y224 HydrophobicContact CG-CD1 4.08Å; P153-Y224 HydrophobicContact CG-CE1 4.13Å
154	E	91.6	Very high	83.5	Confident	169 Å²	169	81.5 Å²	81.5	79%	0.79	46%	0.459	S	S	*	.	H	α-helix	trans	-56.7	-41.9	-176.3	-169.8	172.6	-177	0	0	112.4	L156 A157 A158	E154-L156 VanDerWaalsContact C-N 3.25Å; E154-L156 PolarHBondContact O-N 2.93Å; E154-A157 WeakPolarHBondContact O-CB 2.95Å; E154-A157 PolarHBondContact O-N 3.33Å; E154-A157 VanDerWaalsContact O-N 3.16Å; E154-A158 PolarHBondContact O-N 3.41Å
155	D	92.5	Very high	86.4	Confident	106 Å²	106	76.5 Å²	76.5	57%	0.567	44%	0.442	S	S	*	.	H	α-helix	trans	-60.4	-31.8	174.9	-63.4	-8.6	0	0	0	113.7	P153 R159 Y224	P153-D155 VanDerWaalsContact C-N 3.29Å; P153-D155 PolarHBondContact O-N 2.95Å; D155-R159 PolarHBondContact O-NE 3.45Å; D155-Y224 VanDerWaalsContact CB-OH 3.25Å; D155-Y224 WeakPolarHBondContact CB-OH 3.49Å
156	L	93.7	Very high	88.7	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	41%	0.412	C	S	.	.	H	α-helix	trans	-78.7	-41.3	176.5	177.8	61.1	0	0	0	110.2	A152 P153 E154 A158 R159 W160 I163 I220 Y224 F227 F228	A152-L156 HydrophobicContact CB-CD2 4.44Å; P153-L156 HydrophobicContact CB-CB 4.27Å; P153-L156 WeakPolarHBondContact O-CA 3.44Å; P153-L156 WeakPolarHBondContact O-CB 3.33Å; P153-L156 PolarHBondContact O-N 3.43Å; E154-L156 VanDerWaalsContact C-N 3.25Å; E154-L156 PolarHBondContact O-N 2.93Å; L156-A158 VanDerWaalsContact C-N 3.32Å; L156-A158 PolarHBondContact O-N 2.99Å; L156-R159 CarbonylContact O-C 3.41Å; L156-R159 PolarHBondContact O-N 3.08Å; L156-W160 HydrophobicContact CD1-CE3 4.21Å; L156-W160 HydrophobicContact CD1-CZ3 4.26Å; L156-W160 HydrophobicContact CD2-CE3 4.5Å; L156-W160 HydrophobicContact CD2-CZ3 4Å; L156-W160 HydrophobicContact CG-CE3 3.99Å; L156-W160 HydrophobicContact CG-CZ3 3.99Å; L156-W160 PolarHBondContact O-N 2.85Å; L156-I163 HydrophobicContact CD1-CD1 3.47Å; L156-I163 VanDerWaalsContact CD1-CD1 3.47Å; L156-I220 HydrophobicContact CD1-CG2 3.79Å; L156-Y224 HydrophobicContact CB-CD1 4.11Å; L156-Y224 HydrophobicContact CB-CD2 4.36Å; L156-Y224 HydrophobicContact CB-CE1 4.06Å; L156-Y224 HydrophobicContact CB-CE2 4.31Å; L156-Y224 HydrophobicContact CB-CG 4.26Å; L156-Y224 HydrophobicContact CD1-CD2 3.77Å; L156-Y224 HydrophobicContact CD1-CE2 4.25Å; L156-Y224 HydrophobicContact CD1-CG 4.02Å; L156-Y224 HydrophobicContact CD2-CD1 4.19Å; L156-Y224 HydrophobicContact CD2-CG 3.99Å; L156-Y224 HydrophobicContact CG-CD2 4.45Å; L156-Y224 HydrophobicContact CG-CG 4.32Å; L156-F227 HydrophobicContact CD2-CB 4.43Å; L156-F227 HydrophobicContact CD2-CD1 3.27Å; L156-F227 HydrophobicContact CD2-CE1 3.57Å; L156-F227 HydrophobicContact CD2-CG 3.83Å; L156-F227 HydrophobicContact CD2-CZ 4.33Å; L156-F228 HydrophobicContact CD1-CE2 4.31Å; L156-F228 HydrophobicContact CD1-CZ 4.38Å; L156-F228 HydrophobicContact CD2-CE2 4.42Å
157	A	92.3	Very high	91	Very high	41 Å²	41	62.5 Å²	62.5	34%	0.339	37%	0.366	S	S	.	.	H	α-helix	trans	-59.8	-42.3	176.5	0	0	0	0	0	111.8	V120 P153 E154 R159 W160	V120-A157 HydrophobicContact CG1-CB 3.61Å; P153-A157 PolarHBondContact O-N 3.26Å; E154-A157 WeakPolarHBondContact O-CB 2.95Å; E154-A157 PolarHBondContact O-N 3.33Å; E154-A157 VanDerWaalsContact O-N 3.16Å; A157-R159 PolarHBondContact O-N 3.14Å; A157-W160 VanDerWaalsContact O-CB 3.3Å; A157-W160 WeakPolarHBondContact O-CB 3.37Å; A157-W160 PolarHBondContact O-N 2.61Å
158	A	91.6	Very high	92.4	Very high	88 Å²	88	62.5 Å²	62.5	73%	0.727	36%	0.357	S	S	*	.	H	α-helix	trans	-61.3	-28.5	174.7	0	0	0	0	0	113.3	E154 L156	E154-A158 PolarHBondContact O-N 3.41Å; L156-A158 VanDerWaalsContact C-N 3.32Å; L156-A158 PolarHBondContact O-N 2.99Å
159	R	92.9	Very high	93.3	Very high	69 Å²	69	60.2 Å²	60.2	26%	0.26	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	5.2	-179.3	-66.3	-174.6	-75.2	170.7	-13.1	113.7	D155 L156 A157 R161 I162 I220 Y224	D155-R159 PolarHBondContact O-NE 3.45Å; L156-R159 CarbonylContact O-C 3.41Å; L156-R159 PolarHBondContact O-N 3.08Å; A157-R159 PolarHBondContact O-N 3.14Å; R159-R161 VanDerWaalsContact C-N 3.29Å; R159-R161 PolarHBondContact O-N 2.94Å; R159-I162 HydrophobicContact CB-CD1 4.22Å; R159-I162 HydrophobicContact CG-CD1 4.17Å; R159-I162 VanDerWaalsContact O-CB 3.3Å; R159-I162 WeakPolarHBondContact O-CB 3.45Å; R159-I162 PolarHBondContact O-N 3.4Å; R159-I220 HydrophobicContact CB-CD1 4.28Å; R159-Y224 PolarHBondContact NH2-OH 3.41Å
160	W	94.3	Very high	94.1	Very high	5 Å²	5	56.7 Å²	56.7	2%	0.019	31%	0.312	C	S	.	.	H	α-helix	trans	-57.2	-40	-171.5	-163.9	-114.9	0	0	0	113.4	Y116 I117 A119 V120 L156 A157 I162 I163 W164 F227 F228 L231	Y116-W160 VanDerWaalsContact O-CZ2 3.29Å; Y116-W160 WeakPolarHBondContact O-CZ2 3.45Å; I117-W160 PolarHBondContact O-NE1 3.19Å; A119-W160 HydrophobicContact CB-CZ2 4.29Å; V120-W160 HydrophobicContact CB-CD2 3.74Å; V120-W160 HydrophobicContact CB-CE3 4.23Å; V120-W160 HydrophobicContact CB-CG 3.99Å; V120-W160 HydrophobicContact CB-CZ2 4.15Å; V120-W160 HydrophobicContact CG1-CD2 4.37Å; V120-W160 HydrophobicContact CG1-CG 4.36Å; V120-W160 HydrophobicContact CG2-CD2 3.58Å; V120-W160 HydrophobicContact CG2-CE3 3.62Å; V120-W160 HydrophobicContact CG2-CG 4.34Å; V120-W160 HydrophobicContact CG2-CH2 3.55Å; V120-W160 HydrophobicContact CG2-CZ2 3.5Å; V120-W160 VanDerWaalsContact CG2-CZ2 3.5Å; V120-W160 HydrophobicContact CG2-CZ3 3.6Å; L156-W160 HydrophobicContact CD1-CE3 4.21Å; L156-W160 HydrophobicContact CD1-CZ3 4.26Å; L156-W160 HydrophobicContact CD2-CE3 4.5Å; L156-W160 HydrophobicContact CD2-CZ3 4Å; L156-W160 HydrophobicContact CG-CE3 3.99Å; L156-W160 HydrophobicContact CG-CZ3 3.99Å; L156-W160 PolarHBondContact O-N 2.85Å; A157-W160 VanDerWaalsContact O-CB 3.3Å; A157-W160 WeakPolarHBondContact O-CB 3.37Å; A157-W160 PolarHBondContact O-N 2.61Å; W160-I162 VanDerWaalsContact C-N 3.27Å; W160-I162 PolarHBondContact O-N 3.48Å; W160-I163 HydrophobicContact CE3-CD1 3.88Å; W160-I163 HydrophobicContact CZ3-CD1 4.13Å; W160-I163 PolarHBondContact O-N 3.24Å; W160-W164 AromaticContact CE2-NE1 3.43Å; W160-W164 HydrophobicContact CZ2-CZ2 4.36Å; W160-W164 AromaticContact CZ2-NE1 3.62Å; W160-W164 AromaticContact NE1-CD1 3.94Å; W160-W164 AromaticContact NE1-NE1 3.55Å; W160-F227 AromaticContact CH2-CE1 3.8Å; W160-F227 HydrophobicContact CH2-CE1 3.8Å; W160-F227 HydrophobicContact CH2-CZ 4.27Å; W160-F227 AromaticContact CZ3-CE1 3.76Å; W160-F227 HydrophobicContact CZ3-CE1 3.76Å; W160-F227 HydrophobicContact CZ3-CZ 4.37Å; W160-F228 AromaticContact CH2-CE1 3.8Å; W160-F228 HydrophobicContact CH2-CE1 3.8Å; W160-F228 HydrophobicContact CH2-CZ 4.18Å; W160-F228 AromaticContact CZ3-CE1 3.92Å; W160-F228 HydrophobicContact CZ3-CE1 3.92Å; W160-F228 AromaticContact CZ3-CZ 3.81Å; W160-F228 HydrophobicContact CZ3-CZ 3.81Å; W160-L231 HydrophobicContact CH2-CD2 4.32Å
161	R	94.3	Very high	94.6	Very high	219 Å²	219	57.1 Å²	57.1	83%	0.826	31%	0.311	S	S	*	.	H	α-helix	trans	-64.2	-29.4	176.8	-65.4	-175.2	-179.8	-171.3	-0.1	113.1	R159 G165	R159-R161 VanDerWaalsContact C-N 3.29Å; R159-R161 PolarHBondContact O-N 2.94Å; R161-G165 PolarHBondContact O-N 2.93Å
162	I	94.5	Very high	95	Very high	66 Å²	66	56 Å²	56	34%	0.338	30%	0.297	S	S	.	.	H	α-helix	trans	-69.8	-36.3	-179.6	-56.8	175.9	0	0	0	110.5	R159 W160 W164 N213 K216 I220	R159-I162 HydrophobicContact CB-CD1 4.22Å; R159-I162 HydrophobicContact CG-CD1 4.17Å; R159-I162 VanDerWaalsContact O-CB 3.3Å; R159-I162 WeakPolarHBondContact O-CB 3.45Å; R159-I162 PolarHBondContact O-N 3.4Å; W160-I162 VanDerWaalsContact C-N 3.27Å; W160-I162 PolarHBondContact O-N 3.48Å; I162-W164 VanDerWaalsContact C-N 3.34Å; I162-W164 PolarHBondContact O-N 3.45Å; I162-N213 PolarHBondContact O-ND2 3Å; I162-N213 PolarHBondContact O-OD1 3.44Å; I162-K216 HydrophobicContact CG2-CB 4.09Å; I162-I220 HydrophobicContact CB-CD1 4.03Å; I162-I220 HydrophobicContact CG2-CD1 3.71Å
163	I	96	Very high	95.4	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-44.9	-178.9	-63.6	163.8	0	0	0	110.6	L156 W160 A217 I220 F228 L245	L156-I163 HydrophobicContact CD1-CD1 3.47Å; L156-I163 VanDerWaalsContact CD1-CD1 3.47Å; W160-I163 HydrophobicContact CE3-CD1 3.88Å; W160-I163 HydrophobicContact CZ3-CD1 4.13Å; W160-I163 PolarHBondContact O-N 3.24Å; I163-A217 WeakPolarHBondContact O-CB 3.2Å; I163-I220 HydrophobicContact CD1-CG2 3.67Å; I163-I220 HydrophobicContact CG1-CB 4.13Å; I163-I220 HydrophobicContact CG1-CD1 4.44Å; I163-I220 HydrophobicContact CG1-CG2 3.71Å; I163-F228 HydrophobicContact CD1-CE2 4.29Å; I163-F228 HydrophobicContact CD1-CZ 3.68Å; I163-F228 HydrophobicContact CG2-CZ 4.48Å; I163-L245 HydrophobicContact CG2-CD1 4.42Å; I163-L245 HydrophobicContact CG2-CD2 4.43Å
164	W	96.2	Very high	95.7	Very high	11 Å²	11	54.3 Å²	54.3	4%	0.042	28%	0.279	C	S	.	.	H	α-helix	trans	-90	-25.6	-174.5	-53.5	115.4	0	0	0	113.5	V112 Y116 I117 W160 I162 N166 W167 V241 L245	V112-W164 HydrophobicContact CG1-CD2 4.38Å; V112-W164 HydrophobicContact CG1-CE3 3.55Å; V112-W164 HydrophobicContact CG1-CH2 3.74Å; V112-W164 HydrophobicContact CG1-CZ3 3.19Å; Y116-W164 HydrophobicContact CD1-CH2 4.08Å; Y116-W164 HydrophobicContact CD1-CZ2 4.27Å; Y116-W164 HydrophobicContact CG-CH2 4.07Å; Y116-W164 HydrophobicContact CG-CZ2 4.31Å; I117-W164 HydrophobicContact CD1-CB 4.12Å; I117-W164 HydrophobicContact CD1-CD2 4.41Å; I117-W164 HydrophobicContact CD1-CG 4.12Å; I117-W164 HydrophobicContact CG1-CB 4.23Å; I117-W164 HydrophobicContact CG1-CD2 3.78Å; I117-W164 HydrophobicContact CG1-CE3 4.37Å; I117-W164 HydrophobicContact CG1-CG 3.68Å; W160-W164 AromaticContact CE2-NE1 3.43Å; W160-W164 HydrophobicContact CZ2-CZ2 4.36Å; W160-W164 AromaticContact CZ2-NE1 3.62Å; W160-W164 AromaticContact NE1-CD1 3.94Å; W160-W164 AromaticContact NE1-NE1 3.55Å; I162-W164 VanDerWaalsContact C-N 3.34Å; I162-W164 PolarHBondContact O-N 3.45Å; W164-N166 PolarHBondContact O-N 3.34Å; W164-N166 VanDerWaalsContact O-N 3.12Å; W164-W167 HydrophobicContact CB-CB 4.24Å; W164-W167 HydrophobicContact CE3-CD2 4.41Å; W164-W167 HydrophobicContact CE3-CE3 4.28Å; W164-W167 WeakPolarHBondContact O-CB 3.39Å; W164-W167 PolarHBondContact O-N 2.99Å; W164-V241 HydrophobicContact CH2-CG2 3.85Å; W164-L245 HydrophobicContact CE3-CD2 4.24Å; W164-L245 HydrophobicContact CZ3-CD2 4.06Å
165	G	96	Very high	96	Very high	45 Å²	45	47.2 Å²	47.2	46%	0.464	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	-119.9	176	0	0	0	0	0	112.5	R161	R161-G165 PolarHBondContact O-N 2.93Å
166	N	97.3	Very high	96.3	Very high	26 Å²	26	44.1 Å²	44.1	14%	0.139	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	26.6	177.5	72.6	-37.5	0	0	0	114.3	W164 I168 Q169 L170 I206 Y210	W164-N166 PolarHBondContact O-N 3.34Å; W164-N166 VanDerWaalsContact O-N 3.12Å; N166-I168 VanDerWaalsContact C-N 3.3Å; N166-I168 PolarHBondContact O-N 2.8Å; N166-Q169 HydrophobicContact CB-CB 4.36Å; N166-Q169 WeakPolarHBondContact O-CB 3.49Å; N166-Q169 PolarHBondContact O-N 2.86Å; N166-L170 PolarHBondContact O-N 3.44Å; N166-L170 VanDerWaalsContact O-N 3.13Å; N166-I206 PolarHBondContact ND2-O 3.04Å; N166-Y210 VanDerWaalsContact OD1-CA 3.24Å; N166-Y210 WeakPolarHBondContact OD1-CA 3.45Å; N166-Y210 WeakPolarHBondContact OD1-CB 3.31Å; N166-Y210 PolarHBondContact OD1-N 3.25Å
167	W	98.1	Very high	96.5	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-52.1	-43.4	-179	-168.3	-83	0	0	0	113.8	L109 V112 I117 W164 Q169 L170 Y171 Y210 H244 L245 P248	L109-W167 HydrophobicContact CD2-CD2 4.41Å; L109-W167 HydrophobicContact CD2-CH2 3.94Å; L109-W167 HydrophobicContact CD2-CZ2 3.41Å; L109-W167 VanDerWaalsContact CD2-CZ2 3.41Å; L109-W167 PolarHBondContact O-NE1 2.84Å; V112-W167 HydrophobicContact CB-CH2 4.35Å; V112-W167 HydrophobicContact CB-CZ2 3.42Å; V112-W167 VanDerWaalsContact CB-CZ2 3.42Å; V112-W167 HydrophobicContact CG1-CD2 3.94Å; V112-W167 HydrophobicContact CG1-CG 4.37Å; V112-W167 HydrophobicContact CG1-CH2 4.26Å; V112-W167 HydrophobicContact CG1-CZ2 3.58Å; V112-W167 HydrophobicContact CG2-CH2 4.07Å; V112-W167 HydrophobicContact CG2-CZ2 3.5Å; V112-W167 VanDerWaalsContact CG2-CZ2 3.5Å; I117-W167 HydrophobicContact CD1-CB 4.17Å; I117-W167 HydrophobicContact CD1-CG 4.15Å; W164-W167 HydrophobicContact CB-CB 4.24Å; W164-W167 HydrophobicContact CE3-CD2 4.41Å; W164-W167 HydrophobicContact CE3-CE3 4.28Å; W164-W167 WeakPolarHBondContact O-CB 3.39Å; W164-W167 PolarHBondContact O-N 2.99Å; W167-Q169 VanDerWaalsContact C-N 3.3Å; W167-Q169 PolarHBondContact O-N 3.25Å; W167-L170 WeakPolarHBondContact O-CB 3.4Å; W167-L170 PolarHBondContact O-N 3.37Å; W167-L170 VanDerWaalsContact O-N 3.16Å; W167-Y171 PolarHBondContact O-N 3.37Å; W167-Y210 AromaticContact CE3-CE2 3.86Å; W167-Y210 HydrophobicContact CE3-CE2 3.86Å; W167-Y210 HydrophobicContact CZ3-CE2 4.17Å; W167-Y210 WeakPolarHBondContact CZ3-OH 3.34Å; W167-H244 HydrophobicContact CH2-CB 4.34Å; W167-H244 WeakPolarHBondContact CH2-O 3.4Å; W167-L245 HydrophobicContact CZ3-CD2 4.25Å; W167-P248 HydrophobicContact CH2-CG 4.49Å; W167-P248 HydrophobicContact CZ3-CG 4.18Å
168	I	97.7	Very high	96.8	Very high	60 Å²	60	43.8 Å²	43.8	31%	0.308	23%	0.229	S	C	.	.	H	α-helix	trans	-60.9	-41.9	179.4	-59	-58.9	0	0	0	111.2	K113 I117 N166 L170 Y171 E172	K113-I168 HydrophobicContact CB-CD1 4.19Å; K113-I168 HydrophobicContact CD-CD1 4.01Å; K113-I168 HydrophobicContact CG-CD1 3.66Å; I117-I168 HydrophobicContact CD1-CD1 3.61Å; I117-I168 HydrophobicContact CD1-CG1 4.24Å; N166-I168 VanDerWaalsContact C-N 3.3Å; N166-I168 PolarHBondContact O-N 2.8Å; I168-L170 VanDerWaalsContact C-N 3.34Å; I168-L170 PolarHBondContact O-N 2.92Å; I168-Y171 PolarHBondContact O-N 3.06Å; I168-E172 HydrophobicContact CG2-CG 4.29Å; I168-E172 WeakPolarHBondContact CG2-OE1 3.35Å; I168-E172 WeakPolarHBondContact O-CG 3.36Å; I168-E172 PolarHBondContact O-N 2.92Å
169	Q	98	Very high	97.1	Very high	52 Å²	52	46.3 Å²	46.3	24%	0.243	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-35	177.3	176.9	170.6	84.8	0	0	112.4	N166 W167 W173 R202 I206	N166-Q169 HydrophobicContact CB-CB 4.36Å; N166-Q169 WeakPolarHBondContact O-CB 3.49Å; N166-Q169 PolarHBondContact O-N 2.86Å; W167-Q169 VanDerWaalsContact C-N 3.3Å; W167-Q169 PolarHBondContact O-N 3.25Å; Q169-W173 VanDerWaalsContact O-CB 3.29Å; Q169-W173 WeakPolarHBondContact O-CB 3.49Å; Q169-W173 PolarHBondContact O-N 3.06Å; Q169-W173 VanDerWaalsContact O-N 3.17Å; Q169-R202 VanDerWaalsContact CD-NH2 3.33Å; Q169-I206 HydrophobicContact CG-CD1 3.89Å; Q169-I206 HydrophobicContact CG-CG1 3.93Å; Q169-I206 HydrophobicContact CG-CG2 4.35Å
170	L	98.2	Very high	97.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.3	-53.5	169.8	-83.4	164	0	0	0	110.1	L109 N166 W167 I168 E172 W173 H174 I206 Y207 Y210 P248	L109-L170 HydrophobicContact CD1-CB 4.4Å; N166-L170 PolarHBondContact O-N 3.44Å; N166-L170 VanDerWaalsContact O-N 3.13Å; W167-L170 WeakPolarHBondContact O-CB 3.4Å; W167-L170 PolarHBondContact O-N 3.37Å; W167-L170 VanDerWaalsContact O-N 3.16Å; I168-L170 VanDerWaalsContact C-N 3.34Å; I168-L170 PolarHBondContact O-N 2.92Å; L170-E172 PolarHBondContact O-N 2.87Å; L170-W173 PolarHBondContact O-N 3.17Å; L170-H174 WeakPolarHBondContact O-CB 3.46Å; L170-H174 PolarHBondContact O-CD2 3.05Å; L170-H174 PolarHBondContact O-N 2.92Å; L170-I206 HydrophobicContact CB-CG2 4.41Å; L170-I206 HydrophobicContact CD2-CG2 3.42Å; L170-I206 VanDerWaalsContact CD2-CG2 3.42Å; L170-I206 HydrophobicContact CG-CG2 3.56Å; L170-Y207 HydrophobicContact CD2-CD2 4.24Å; L170-Y207 HydrophobicContact CD2-CE1 4.16Å; L170-Y207 HydrophobicContact CD2-CE2 3.84Å; L170-Y210 HydrophobicContact CD1-CD1 4.47Å; L170-Y210 HydrophobicContact CD1-CD2 3.35Å; L170-Y210 HydrophobicContact CD1-CE2 3.9Å; L170-Y210 HydrophobicContact CD1-CG 3.67Å; L170-P248 HydrophobicContact CD1-CB 4.02Å; L170-P248 HydrophobicContact CD1-CG 3.98Å
171	Y	98.6	Very high	97.4	Very high	31 Å²	31	48.4 Å²	48.4	12%	0.122	24%	0.237	C	C	.	.	H	α-helix	trans	-56.2	-49.6	-178.8	169.2	-103.9	0	0	0	112.8	V106 L109 K110 K113 W167 I168 W173 H174 S175	V106-Y171 HydrophobicContact CG1-CE2 4.09Å; L109-Y171 HydrophobicContact CB-CD2 3.91Å; K110-Y171 HydrophobicContact CB-CD2 4.19Å; K110-Y171 HydrophobicContact CB-CE2 3.57Å; K110-Y171 HydrophobicContact CD-CE2 4.41Å; K110-Y171 HydrophobicContact CG-CE2 4.01Å; K113-Y171 HydrophobicContact CD-CD1 3.35Å; K113-Y171 HydrophobicContact CD-CE1 3.5Å; K113-Y171 VanDerWaalsContact CD-CE1 3.5Å; K113-Y171 HydrophobicContact CD-CG 4.02Å; W167-Y171 PolarHBondContact O-N 3.37Å; I168-Y171 PolarHBondContact O-N 3.06Å; Y171-W173 PolarHBondContact O-N 3.24Å; Y171-H174 PolarHBondContact O-N 3.36Å; Y171-S175 WeakPolarHBondContact CE2-OG 3.44Å; Y171-S175 VanDerWaalsContact O-CB 3.32Å; Y171-S175 WeakPolarHBondContact O-CB 3.2Å; Y171-S175 PolarHBondContact O-N 3.39Å; Y171-S175 PolarHBondContact O-OG 3.24Å
172	E	98.5	Very high	97.6	Very high	112 Å²	112	41.7 Å²	41.7	52%	0.523	22%	0.22	S	C	.	.	H	α-helix	trans	-62.1	-45.2	-179.6	-72.5	171.2	172.9	0	0	111.8	I168 L170 S175 A176	I168-E172 HydrophobicContact CG2-CG 4.29Å; I168-E172 WeakPolarHBondContact CG2-OE1 3.35Å; I168-E172 WeakPolarHBondContact O-CG 3.36Å; I168-E172 PolarHBondContact O-N 2.92Å; L170-E172 PolarHBondContact O-N 2.87Å; E172-S175 PolarHBondContact O-N 3.18Å; E172-A176 PolarHBondContact O-N 3.26Å
173	W	98.3	Very high	97.6	Very high	39 Å²	39	42.2 Å²	42.2	15%	0.148	23%	0.23	C	C	.	.	H	α-helix	trans	-64.5	-46.1	179.6	-175.9	85.6	0	0	0	111.6	Q169 L170 Y171 A176 F177 L203 I206	Q169-W173 VanDerWaalsContact O-CB 3.29Å; Q169-W173 WeakPolarHBondContact O-CB 3.49Å; Q169-W173 PolarHBondContact O-N 3.06Å; Q169-W173 VanDerWaalsContact O-N 3.17Å; L170-W173 PolarHBondContact O-N 3.17Å; Y171-W173 PolarHBondContact O-N 3.24Å; W173-A176 PolarHBondContact O-N 3.12Å; W173-F177 HydrophobicContact CE3-CB 4.32Å; W173-F177 HydrophobicContact CH2-CB 3.94Å; W173-F177 HydrophobicContact CH2-CD1 4.21Å; W173-F177 AromaticContact CH2-CD2 3.72Å; W173-F177 HydrophobicContact CH2-CD2 3.72Å; W173-F177 HydrophobicContact CH2-CE2 4.29Å; W173-F177 AromaticContact CH2-CG 3.68Å; W173-F177 HydrophobicContact CH2-CG 3.68Å; W173-F177 HydrophobicContact CZ2-CB 4.3Å; W173-F177 AromaticContact CZ2-CD2 3.99Å; W173-F177 HydrophobicContact CZ2-CD2 3.99Å; W173-F177 HydrophobicContact CZ2-CG 4.25Å; W173-F177 HydrophobicContact CZ3-CB 3.96Å; W173-F177 HydrophobicContact CZ3-CD1 4.35Å; W173-F177 HydrophobicContact CZ3-CG 4.02Å; W173-F177 WeakPolarHBondContact O-CB 3.32Å; W173-F177 PolarHBondContact O-N 3.38Å; W173-L203 HydrophobicContact CE3-CD1 4.26Å; W173-L203 HydrophobicContact CH2-CD1 3.61Å; W173-L203 HydrophobicContact CZ2-CB 4.48Å; W173-L203 HydrophobicContact CZ2-CD1 4.21Å; W173-L203 HydrophobicContact CZ3-CD1 3.63Å; W173-I206 HydrophobicContact CB-CD1 3.64Å; W173-I206 HydrophobicContact CD2-CD1 4.37Å; W173-I206 HydrophobicContact CG-CD1 3.62Å
174	H	98.7	Very high	97.7	Very high	1 Å²	1	43 Å²	43	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-67.9	-35.3	179.6	-80.4	-77.7	0	0	0	112.5	E102 Y105 V106 L109 L170 Y171 F177 L178 Y207 Y255	E102-H174 IonicContact OE1-CE1 3.6Å; E102-H174 IonicContact OE1-CG 3.02Å; E102-H174 IonicContact OE1-ND1 2.75Å; E102-H174 PolarHBondContact OE1-ND1 3.37Å; Y105-H174 AromaticContact CD1-ND1 3.85Å; Y105-H174 HydrophobicContact CE1-CB 4.43Å; Y105-H174 AromaticContact CE1-CD2 3.62Å; Y105-H174 AromaticContact CE1-CE1 3.57Å; Y105-H174 AromaticContact CE1-CG 3.63Å; Y105-H174 AromaticContact CE1-ND1 3.58Å; Y105-H174 AromaticContact CE1-NE2 3.6Å; V106-H174 HydrophobicContact CG2-CB 3.82Å; L109-H174 HydrophobicContact CD1-CB 4.13Å; L170-H174 WeakPolarHBondContact O-CB 3.46Å; L170-H174 PolarHBondContact O-CD2 3.05Å; L170-H174 PolarHBondContact O-N 2.92Å; Y171-H174 PolarHBondContact O-N 3.36Å; H174-F177 PolarHBondContact O-N 3.41Å; H174-L178 WeakPolarHBondContact O-CB 3.43Å; H174-L178 PolarHBondContact O-N 3.12Å; H174-Y207 AromaticContact CE1-CZ 3.99Å; H174-Y207 PolarHBondContact CE1-OH 3.26Å; H174-Y207 AromaticContact NE2-CE2 3.38Å; H174-Y207 WeakPolarHBondContact NE2-CE2 3.49Å; H174-Y207 AromaticContact NE2-CZ 3.41Å; H174-Y207 PolarHBondContact NE2-OH 2.82Å; H174-Y255 PolarHBondContact CE1-OH 3.05Å; H174-Y255 PolarHBondContact ND1-OH 3.44Å
175	S	98.5	Very high	97.6	Very high	20 Å²	20	43 Å²	43	14%	0.14	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-49.1	174	-58	0	0	0	0	111	Y171 E172 F177 L178 E179	Y171-S175 WeakPolarHBondContact CE2-OG 3.44Å; Y171-S175 VanDerWaalsContact O-CB 3.32Å; Y171-S175 WeakPolarHBondContact O-CB 3.2Å; Y171-S175 PolarHBondContact O-N 3.39Å; Y171-S175 PolarHBondContact O-OG 3.24Å; E172-S175 PolarHBondContact O-N 3.18Å; S175-F177 VanDerWaalsContact C-N 3.31Å; S175-F177 PolarHBondContact O-N 3.47Å; S175-L178 PolarHBondContact O-N 3.3Å; S175-E179 WeakPolarHBondContact O-CG 3.45Å; S175-E179 PolarHBondContact O-N 3.08Å; S175-E179 VanDerWaalsContact O-N 3.1Å
176	A	98.2	Very high	97.5	Very high	41 Å²	41	46.6 Å²	46.6	34%	0.339	24%	0.244	S	C	.	.	H	α-helix	trans	-66.1	-31.7	176.6	0	0	0	0	0	113.1	E172 W173 K180	E172-A176 PolarHBondContact O-N 3.26Å; W173-A176 PolarHBondContact O-N 3.12Å; A176-K180 WeakPolarHBondContact O-CG 3.46Å; A176-K180 PolarHBondContact O-N 3.42Å
177	F	98.1	Very high	97.2	Very high	10 Å²	10	49.8 Å²	49.8	4%	0.044	27%	0.269	C	S	.	.	H	α-helix	trans	-69.5	-42.7	175	-177.2	-103.5	0	0	0	111.6	E102 W173 H174 S175 K180 L181 L195 F196	E102-F177 HydrophobicContact CG-CD1 4.3Å; W173-F177 HydrophobicContact CE3-CB 4.32Å; W173-F177 HydrophobicContact CH2-CB 3.94Å; W173-F177 HydrophobicContact CH2-CD1 4.21Å; W173-F177 AromaticContact CH2-CD2 3.72Å; W173-F177 HydrophobicContact CH2-CD2 3.72Å; W173-F177 HydrophobicContact CH2-CE2 4.29Å; W173-F177 AromaticContact CH2-CG 3.68Å; W173-F177 HydrophobicContact CH2-CG 3.68Å; W173-F177 HydrophobicContact CZ2-CB 4.3Å; W173-F177 AromaticContact CZ2-CD2 3.99Å; W173-F177 HydrophobicContact CZ2-CD2 3.99Å; W173-F177 HydrophobicContact CZ2-CG 4.25Å; W173-F177 HydrophobicContact CZ3-CB 3.96Å; W173-F177 HydrophobicContact CZ3-CD1 4.35Å; W173-F177 HydrophobicContact CZ3-CG 4.02Å; W173-F177 WeakPolarHBondContact O-CB 3.32Å; W173-F177 PolarHBondContact O-N 3.38Å; H174-F177 PolarHBondContact O-N 3.41Å; S175-F177 VanDerWaalsContact C-N 3.31Å; S175-F177 PolarHBondContact O-N 3.47Å; F177-K180 PolarHBondContact O-N 3.07Å; F177-L181 HydrophobicContact CE1-CD2 4.39Å; F177-L181 WeakPolarHBondContact O-CB 3.32Å; F177-L181 PolarHBondContact O-N 3.49Å; F177-L195 HydrophobicContact CE2-CB 4.1Å; F177-F196 HydrophobicContact CE1-CE1 4.15Å; F177-F196 HydrophobicContact CE1-CZ 4.07Å; F177-F196 HydrophobicContact CE2-CD1 4.48Å; F177-F196 HydrophobicContact CE2-CE1 4.46Å; F177-F196 AromaticContact CZ-CD1 4Å; F177-F196 HydrophobicContact CZ-CD1 4Å; F177-F196 HydrophobicContact CZ-CD2 4.39Å; F177-F196 AromaticContact CZ-CE1 3.59Å; F177-F196 HydrophobicContact CZ-CE1 3.59Å; F177-F196 AromaticContact CZ-CE2 3.99Å; F177-F196 HydrophobicContact CZ-CE2 3.99Å; F177-F196 HydrophobicContact CZ-CG 4.41Å; F177-F196 AromaticContact CZ-CZ 3.58Å; F177-F196 HydrophobicContact CZ-CZ 3.58Å
178	L	98.3	Very high	97	Very high	23 Å²	23	52.3 Å²	52.3	12%	0.12	28%	0.282	C	S	.	.	H	α-helix	trans	-60.5	-45.3	176.2	176.5	64.1	0	0	0	111.8	V99 E102 E103 V106 H174 S175 K180 L181 V182	V99-L178 HydrophobicContact CG1-CD1 4.44Å; E102-L178 HydrophobicContact CB-CD1 4.01Å; E102-L178 HydrophobicContact CG-CB 4.06Å; E102-L178 HydrophobicContact CG-CD1 3.89Å; E103-L178 HydrophobicContact CB-CD1 4.14Å; E103-L178 HydrophobicContact CB-CD2 4.17Å; E103-L178 HydrophobicContact CG-CD2 4.12Å; V106-L178 HydrophobicContact CB-CD2 4.11Å; V106-L178 HydrophobicContact CG1-CD2 4.34Å; V106-L178 HydrophobicContact CG2-CB 4.23Å; V106-L178 HydrophobicContact CG2-CD2 4Å; H174-L178 WeakPolarHBondContact O-CB 3.43Å; H174-L178 PolarHBondContact O-N 3.12Å; S175-L178 PolarHBondContact O-N 3.3Å; L178-K180 VanDerWaalsContact C-N 3.32Å; L178-K180 PolarHBondContact O-N 3.07Å; L178-L181 PolarHBondContact O-N 3.4Å; L178-L181 VanDerWaalsContact O-N 3.14Å; L178-V182 HydrophobicContact CD1-CG2 3.88Å; L178-V182 HydrophobicContact CG-CG2 4.31Å; L178-V182 WeakPolarHBondContact O-CG2 3.49Å; L178-V182 PolarHBondContact O-N 3.24Å
179	E	97.8	Very high	96.8	Very high	142 Å²	142	50.6 Å²	50.6	66%	0.664	28%	0.275	S	S	*	.	H	α-helix	trans	-55.4	-47.7	176.4	-73.9	174.4	-176	0	0	111.6	S175 S183	S175-E179 WeakPolarHBondContact O-CG 3.45Å; S175-E179 PolarHBondContact O-N 3.08Å; S175-E179 VanDerWaalsContact O-N 3.1Å; E179-S183 WeakPolarHBondContact O-CB 3.34Å; E179-S183 PolarHBondContact O-N 3.14Å
180	K	97.3	Very high	96.6	Very high	118 Å²	118	49.6 Å²	49.6	51%	0.513	27%	0.271	S	S	.	.	H	α-helix	trans	-62.8	-44	176.2	-68.6	173.7	-175.1	178.4	0	111.6	A176 F177 L178 S183 V184 L195	A176-K180 WeakPolarHBondContact O-CG 3.46Å; A176-K180 PolarHBondContact O-N 3.42Å; F177-K180 PolarHBondContact O-N 3.07Å; L178-K180 VanDerWaalsContact C-N 3.32Å; L178-K180 PolarHBondContact O-N 3.07Å; K180-S183 PolarHBondContact O-N 2.92Å; K180-S183 PolarHBondContact O-OG 3.34Å; K180-V184 WeakPolarHBondContact O-CG2 3.39Å; K180-V184 PolarHBondContact O-N 3.36Å; K180-L195 HydrophobicContact CB-CD1 4.08Å; K180-L195 HydrophobicContact CB-CD2 4.31Å; K180-L195 HydrophobicContact CD-CD2 4.34Å
181	L	97.2	Very high	96.4	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-47.2	-178.5	-175.8	65.9	0	0	0	111.7	L98 V99 E102 F177 L178 S183 V184 V185 I192	L98-L181 HydrophobicContact CD2-CD1 4.22Å; L98-L181 HydrophobicContact CG-CD2 4.19Å; V99-L181 HydrophobicContact CB-CD2 4.37Å; V99-L181 HydrophobicContact CG2-CD2 3.92Å; V99-L181 HydrophobicContact CG2-CG 3.86Å; E102-L181 HydrophobicContact CB-CD2 4.21Å; E102-L181 HydrophobicContact CG-CD2 4.42Å; F177-L181 HydrophobicContact CE1-CD2 4.39Å; F177-L181 WeakPolarHBondContact O-CB 3.32Å; F177-L181 PolarHBondContact O-N 3.49Å; L178-L181 PolarHBondContact O-N 3.4Å; L178-L181 VanDerWaalsContact O-N 3.14Å; L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 3.44Å; L181-V184 WeakPolarHBondContact O-CG2 3.36Å; L181-V184 PolarHBondContact O-N 3.39Å; L181-V185 WeakPolarHBondContact O-CB 3.42Å; L181-V185 PolarHBondContact O-N 3.44Å; L181-I192 HydrophobicContact CD1-CD1 4Å; L181-I192 HydrophobicContact CD1-CG1 4Å; L181-I192 HydrophobicContact CD1-CG2 3.94Å
182	V	97.4	Very high	96.4	Very high	78 Å²	78	55.5 Å²	55.5	47%	0.473	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-38.1	175.9	173.6	0	0	0	0	110.8	V99 L178 V184	V99-V182 HydrophobicContact CG1-CG2 3.73Å; L178-V182 HydrophobicContact CD1-CG2 3.88Å; L178-V182 HydrophobicContact CG-CG2 4.31Å; L178-V182 WeakPolarHBondContact O-CG2 3.49Å; L178-V182 PolarHBondContact O-N 3.24Å; V182-V184 VanDerWaalsContact C-N 3.25Å; V182-V184 PolarHBondContact O-N 3.32Å
183	S	96.2	Very high	96.3	Very high	77 Å²	77	50.2 Å²	50.2	54%	0.538	27%	0.269	S	S	.	.	H	α-helix	trans	-66.4	-23.1	-179.9	76.9	0	0	0	0	114.5	E179 K180 L181 S187	E179-S183 WeakPolarHBondContact O-CB 3.34Å; E179-S183 PolarHBondContact O-N 3.14Å; K180-S183 PolarHBondContact O-N 2.92Å; K180-S183 PolarHBondContact O-OG 3.34Å; L181-S183 VanDerWaalsContact C-N 3.29Å; L181-S183 PolarHBondContact O-N 3.44Å; S183-S187 PolarHBondContact O-OG 3.33Å; S183-S187 VanDerWaalsContact O-OG 3.13Å
184	V	96.3	Very high	96.2	Very high	17 Å²	17	54.1 Å²	54.1	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-110.7	-20.7	-175.5	-58.8	0	0	0	0	114	K180 L181 V182 D186 S187 D188 R191 I192 L195	K180-V184 WeakPolarHBondContact O-CG2 3.39Å; K180-V184 PolarHBondContact O-N 3.36Å; L181-V184 WeakPolarHBondContact O-CG2 3.36Å; L181-V184 PolarHBondContact O-N 3.39Å; V182-V184 VanDerWaalsContact C-N 3.25Å; V182-V184 PolarHBondContact O-N 3.32Å; V184-D186 VanDerWaalsContact C-N 3.32Å; V184-D186 PolarHBondContact O-N 2.96Å; V184-S187 PolarHBondContact O-N 3.2Å; V184-D188 CarbonylContact O-C 3Å; V184-D188 WeakPolarHBondContact O-CA 3.11Å; V184-D188 PolarHBondContact O-N 3.35Å; V184-R191 HydrophobicContact CG1-CB 4.49Å; V184-I192 HydrophobicContact CG2-CD1 4.34Å; V184-I192 HydrophobicContact CG2-CG1 3.51Å; V184-L195 HydrophobicContact CG2-CD1 3.87Å
185	V	95.8	Very high	96.2	Very high	11 Å²	11	56 Å²	56	7%	0.067	30%	0.296	C	S	.	.	H	α-helix	trans	-60.4	-38.8	-170.9	67.6	0	0	0	0	113.5	L95 M96 V99 L181 I192	L95-V185 HydrophobicContact CB-CG2 4.12Å; M96-V185 HydrophobicContact SD-CG2 4.32Å; V99-V185 HydrophobicContact CG2-CB 3.96Å; V99-V185 HydrophobicContact CG2-CG1 4.1Å; V99-V185 HydrophobicContact CG2-CG2 3.74Å; L181-V185 WeakPolarHBondContact O-CB 3.42Å; L181-V185 PolarHBondContact O-N 3.44Å; V185-I192 HydrophobicContact CB-CD1 4.41Å; V185-I192 HydrophobicContact CG2-CD1 4.39Å
186	D	92	Very high	96.1	Very high	119 Å²	119	55 Å²	55	64%	0.636	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-33.3	180	-71.6	-45.7	0	0	0	112.6	V184	V184-D186 VanDerWaalsContact C-N 3.32Å; V184-D186 PolarHBondContact O-N 2.96Å
187	S	93	Very high	96.1	Very high	94 Å²	94	54.3 Å²	54.3	66%	0.657	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-43.8	-174.8	65.5	0	0	0	0	113.7	S183 V184	S183-S187 PolarHBondContact O-OG 3.33Å; S183-S187 VanDerWaalsContact O-OG 3.13Å; V184-S187 PolarHBondContact O-N 3.2Å
188	D	93.6	Very high	96.1	Very high	53 Å²	53	59.3 Å²	59.3	28%	0.283	31%	0.307	S	S	.	.			trans	-154.8	73.5	-173.9	-169.9	-6.9	0	0	0	110.1	V184 D190 R191	V184-D188 CarbonylContact O-C 3Å; V184-D188 WeakPolarHBondContact O-CA 3.11Å; V184-D188 PolarHBondContact O-N 3.35Å; D188-D190 PolarHBondContact O-N 2.75Å; D188-D190 VanDerWaalsContact O-N 3.1Å; D188-D190 PolarHBondContact OD1-N 3.4Å; D188-R191 HydrophobicContact CB-CG 4.3Å; D188-R191 PolarHBondContact O-N 2.97Å; D188-R191 VanDerWaalsContact O-N 3.1Å; D188-R191 WeakPolarHBondContact OD2-CD 3.29Å; D188-R191 VanDerWaalsContact OD2-CG 3.27Å; D188-R191 WeakPolarHBondContact OD2-CG 3.44Å; D188-R191 IonicContact OD2-CZ 3.66Å; D188-R191 IonicContact OD2-NE 2.65Å; D188-R191 PolarHBondContact OD2-NE 3.1Å; D188-R191 IonicContact OD2-NH2 3.65Å
189	P	93.7	Very high	96	Very high	24 Å²	24	58.9 Å²	58.9	16%	0.156	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-60.8	-20.4	-177.5	23.4	-34.4	0	0	0	113.2	L95 R191 I192	L95-P189 HydrophobicContact CD1-CB 3.81Å; L95-P189 HydrophobicContact CD2-CB 4.42Å; P189-R191 PolarHBondContact O-N 2.81Å; P189-I192 HydrophobicContact CB-CD1 4.37Å; P189-I192 WeakPolarHBondContact O-CB 3.32Å; P189-I192 WeakPolarHBondContact O-CG1 3.43Å; P189-I192 PolarHBondContact O-N 3.37Å
190	D	92.9	Very high	95.9	Very high	31 Å²	31	56 Å²	56	17%	0.166	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-76.7	-7.7	-179.8	-68.8	-54.2	0	0	0	113.1	R91 D188 P193 D273	R91-D190 IonicContact CZ-OD1 3.36Å; R91-D190 IonicContact CZ-OD2 2.57Å; R91-D190 IonicContact NH1-OD1 2.66Å; R91-D190 PolarHBondContact NH1-OD1 3.49Å; R91-D190 IonicContact NH1-OD2 3.82Å; R91-D190 IonicContact NH2-OD1 3.5Å; R91-D190 PolarHBondContact NH2-OD1 3.15Å; R91-D190 IonicContact NH2-OD2 3.1Å; R91-D190 PolarHBondContact NH2-OD2 3.42Å; D188-D190 PolarHBondContact O-N 2.75Å; D188-D190 VanDerWaalsContact O-N 3.1Å; D188-D190 PolarHBondContact OD1-N 3.4Å; D190-P193 WeakPolarHBondContact O-CD 3.36Å; D190-D273 HydrophobicContact CB-CB 4.24Å; D190-D273 WeakPolarHBondContact CB-OD2 3.4Å
191	R	95.1	Very high	95.8	Very high	156 Å²	156	54 Å²	54	59%	0.589	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-80.7	-19.7	166.5	-72.7	-179.8	-173.8	-155.6	0.5	114.8	V184 D188 P189 P193 K194 L195	V184-R191 HydrophobicContact CG1-CB 4.49Å; D188-R191 HydrophobicContact CB-CG 4.3Å; D188-R191 PolarHBondContact O-N 2.97Å; D188-R191 VanDerWaalsContact O-N 3.1Å; D188-R191 WeakPolarHBondContact OD2-CD 3.29Å; D188-R191 VanDerWaalsContact OD2-CG 3.27Å; D188-R191 WeakPolarHBondContact OD2-CG 3.44Å; D188-R191 IonicContact OD2-CZ 3.66Å; D188-R191 IonicContact OD2-NE 2.65Å; D188-R191 PolarHBondContact OD2-NE 3.1Å; D188-R191 IonicContact OD2-NH2 3.65Å; P189-R191 PolarHBondContact O-N 2.81Å; R191-P193 VanDerWaalsContact C-CD 3.44Å; R191-K194 WeakPolarHBondContact O-CB 3.38Å; R191-K194 PolarHBondContact O-N 3.08Å; R191-L195 PolarHBondContact O-N 3.04Å
192	I	97.2	Very high	95.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-55	-43.8	-177.3	-66.3	169.9	0	0	0	112.7	L95 L98 L181 V184 V185 P189 K194 L195 F196 W277	L95-I192 HydrophobicContact CD2-CD1 3.55Å; L98-I192 HydrophobicContact CD2-CG2 4.3Å; L181-I192 HydrophobicContact CD1-CD1 4Å; L181-I192 HydrophobicContact CD1-CG1 4Å; L181-I192 HydrophobicContact CD1-CG2 3.94Å; V184-I192 HydrophobicContact CG2-CD1 4.34Å; V184-I192 HydrophobicContact CG2-CG1 3.51Å; V185-I192 HydrophobicContact CB-CD1 4.41Å; V185-I192 HydrophobicContact CG2-CD1 4.39Å; P189-I192 HydrophobicContact CB-CD1 4.37Å; P189-I192 WeakPolarHBondContact O-CB 3.32Å; P189-I192 WeakPolarHBondContact O-CG1 3.43Å; P189-I192 PolarHBondContact O-N 3.37Å; I192-K194 PolarHBondContact O-N 2.82Å; I192-L195 WeakPolarHBondContact O-CB 3.44Å; I192-L195 PolarHBondContact O-N 2.97Å; I192-L195 VanDerWaalsContact O-N 3.08Å; I192-F196 HydrophobicContact CG2-CD2 4Å; I192-F196 HydrophobicContact CG2-CE2 3.78Å; I192-F196 PolarHBondContact O-N 2.62Å; I192-W277 HydrophobicContact CB-CH2 3.95Å; I192-W277 HydrophobicContact CB-CZ2 4.2Å; I192-W277 HydrophobicContact CG2-CH2 3.78Å; I192-W277 HydrophobicContact CG2-CZ3 4.48Å
193	P	97.4	Very high	95.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-54.9	-39.1	176.4	-31.7	41.1	0	0	0	113.6	D190 R191 L195 F196 I197 L276 W277 T280	D190-P193 WeakPolarHBondContact O-CD 3.36Å; R191-P193 VanDerWaalsContact C-CD 3.44Å; P193-L195 VanDerWaalsContact C-N 3.34Å; P193-L195 PolarHBondContact O-N 2.66Å; P193-F196 PolarHBondContact O-N 3.06Å; P193-I197 WeakPolarHBondContact O-CD1 3.04Å; P193-I197 VanDerWaalsContact O-CG1 3.32Å; P193-I197 WeakPolarHBondContact O-CG1 3.29Å; P193-I197 PolarHBondContact O-N 3.09Å; P193-L276 HydrophobicContact CB-CB 3.95Å; P193-L276 HydrophobicContact CB-CD2 3.62Å; P193-L276 HydrophobicContact CB-CG 3.45Å; P193-L276 VanDerWaalsContact CB-CG 3.45Å; P193-L276 HydrophobicContact CG-CD2 4.38Å; P193-L276 HydrophobicContact CG-CG 4.44Å; P193-W277 HydrophobicContact CB-CD2 4.46Å; P193-W277 HydrophobicContact CG-CD2 3.33Å; P193-W277 HydrophobicContact CG-CE3 3.8Å; P193-W277 HydrophobicContact CG-CG 3.67Å; P193-W277 HydrophobicContact CG-CH2 3.96Å; P193-W277 HydrophobicContact CG-CZ2 3.53Å; P193-W277 HydrophobicContact CG-CZ3 4.09Å; P193-T280 VanDerWaalsContact CA-OG1 3.32Å; P193-T280 WeakPolarHBondContact CA-OG1 3.49Å; P193-T280 VanDerWaalsContact CB-OG1 3.3Å; P193-T280 WeakPolarHBondContact CB-OG1 3.44Å; P193-T280 PolarHBondContact O-OG1 2.96Å
194	K	96.5	Very high	95.6	Very high	122 Å²	122	53 Å²	53	53%	0.53	27%	0.27	S	S	.	.	H	α-helix	trans	-64	-39.3	178.3	-172.7	167.8	-178.6	167.7	0	111.6	R191 I192 F196 I197 D198 L276	R191-K194 WeakPolarHBondContact O-CB 3.38Å; R191-K194 PolarHBondContact O-N 3.08Å; I192-K194 PolarHBondContact O-N 2.82Å; K194-F196 VanDerWaalsContact C-N 3.29Å; K194-F196 PolarHBondContact O-N 3.2Å; K194-I197 PolarHBondContact O-N 3.44Å; K194-D198 WeakPolarHBondContact CG-OD2 3.1Å; K194-D198 WeakPolarHBondContact O-CB 3.38Å; K194-D198 VanDerWaalsContact O-CG 3.26Å; K194-D198 PolarHBondContact O-N 2.81Å; K194-L276 HydrophobicContact CB-CD2 4.27Å
195	L	97.2	Very high	95.6	Very high	39 Å²	39	54.4 Å²	54.4	20%	0.204	28%	0.281	C	S	.	.	H	α-helix	trans	-58	-41.1	175.7	-61.6	177.9	0	0	0	112	F177 K180 V184 R191 I192 P193 S199	F177-L195 HydrophobicContact CE2-CB 4.1Å; K180-L195 HydrophobicContact CB-CD1 4.08Å; K180-L195 HydrophobicContact CB-CD2 4.31Å; K180-L195 HydrophobicContact CD-CD2 4.34Å; V184-L195 HydrophobicContact CG2-CD1 3.87Å; R191-L195 PolarHBondContact O-N 3.04Å; I192-L195 WeakPolarHBondContact O-CB 3.44Å; I192-L195 PolarHBondContact O-N 2.97Å; I192-L195 VanDerWaalsContact O-N 3.08Å; P193-L195 VanDerWaalsContact C-N 3.34Å; P193-L195 PolarHBondContact O-N 2.66Å; L195-S199 VanDerWaalsContact O-CB 3.27Å; L195-S199 WeakPolarHBondContact O-CB 3.27Å; L195-S199 PolarHBondContact O-N 2.94Å; L195-S199 PolarHBondContact O-OG 3.08Å
196	F	97.8	Very high	95.7	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-71.4	-42.8	176.5	-79.6	-71.4	0	0	0	112.9	L98 F177 I192 P193 K194 S199 R200 Y255 I259 T280 M284	L98-F196 HydrophobicContact CD1-CZ 4.27Å; L98-F196 HydrophobicContact CD2-CE2 4.02Å; L98-F196 HydrophobicContact CD2-CZ 4.2Å; F177-F196 HydrophobicContact CE1-CE1 4.15Å; F177-F196 HydrophobicContact CE1-CZ 4.07Å; F177-F196 HydrophobicContact CE2-CD1 4.48Å; F177-F196 HydrophobicContact CE2-CE1 4.46Å; F177-F196 AromaticContact CZ-CD1 4Å; F177-F196 HydrophobicContact CZ-CD1 4Å; F177-F196 HydrophobicContact CZ-CD2 4.39Å; F177-F196 AromaticContact CZ-CE1 3.59Å; F177-F196 HydrophobicContact CZ-CE1 3.59Å; F177-F196 AromaticContact CZ-CE2 3.99Å; F177-F196 HydrophobicContact CZ-CE2 3.99Å; F177-F196 HydrophobicContact CZ-CG 4.41Å; F177-F196 AromaticContact CZ-CZ 3.58Å; F177-F196 HydrophobicContact CZ-CZ 3.58Å; I192-F196 HydrophobicContact CG2-CD2 4Å; I192-F196 HydrophobicContact CG2-CE2 3.78Å; I192-F196 PolarHBondContact O-N 2.62Å; P193-F196 PolarHBondContact O-N 3.06Å; K194-F196 VanDerWaalsContact C-N 3.29Å; K194-F196 PolarHBondContact O-N 3.2Å; F196-S199 WeakPolarHBondContact CA-OG 3.27Å; F196-S199 PolarHBondContact O-N 3.15Å; F196-S199 PolarHBondContact O-OG 2.83Å; F196-S199 VanDerWaalsContact O-OG 3.14Å; F196-R200 PolarHBondContact O-N 3.13Å; F196-R200 VanDerWaalsContact O-N 3.12Å; F196-Y255 AromaticContact CE1-CD1 3.97Å; F196-Y255 HydrophobicContact CE1-CD1 3.97Å; F196-Y255 HydrophobicContact CE1-CE1 4.26Å; F196-Y255 HydrophobicContact CE1-CG 4.38Å; F196-Y255 HydrophobicContact CZ-CD1 4.11Å; F196-Y255 HydrophobicContact CZ-CE1 4.43Å; F196-I259 HydrophobicContact CD2-CD1 4.35Å; F196-I259 HydrophobicContact CE1-CD1 4.26Å; F196-I259 HydrophobicContact CE2-CD1 3.95Å; F196-I259 HydrophobicContact CZ-CD1 3.88Å; F196-T280 HydrophobicContact CB-CG2 3.56Å; F196-T280 HydrophobicContact CD2-CG2 3.82Å; F196-T280 HydrophobicContact CG-CG2 3.83Å; F196-M284 HydrophobicContact CB-CE 4.06Å; F196-M284 HydrophobicContact CD1-CE 3.33Å; F196-M284 HydrophobicContact CD1-CG 4.4Å; F196-M284 HydrophobicContact CD1-SD 3.81Å; F196-M284 HydrophobicContact CE1-CE 4.1Å; F196-M284 HydrophobicContact CE1-SD 3.99Å; F196-M284 HydrophobicContact CG-CE 4.07Å
197	I	97.6	Very high	95.9	Very high	27 Å²	27	48.3 Å²	48.3	14%	0.138	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-46.6	-179.5	-70.3	161.6	0	0	0	110.7	P193 K194 S199 R200 L276 K279 I283	P193-I197 WeakPolarHBondContact O-CD1 3.04Å; P193-I197 VanDerWaalsContact O-CG1 3.32Å; P193-I197 WeakPolarHBondContact O-CG1 3.29Å; P193-I197 PolarHBondContact O-N 3.09Å; K194-I197 PolarHBondContact O-N 3.44Å; I197-S199 VanDerWaalsContact C-N 3.26Å; I197-S199 PolarHBondContact O-N 3.2Å; I197-R200 WeakPolarHBondContact O-CB 3.13Å; I197-R200 PolarHBondContact O-N 2.91Å; I197-L276 HydrophobicContact CD1-CD1 3.24Å; I197-L276 HydrophobicContact CD1-CG 3.69Å; I197-K279 HydrophobicContact CD1-CB 4.31Å; I197-K279 HydrophobicContact CD1-CD 3.93Å; I197-K279 HydrophobicContact CD1-CG 4.1Å; I197-K279 HydrophobicContact CG1-CD 4.38Å; I197-K279 HydrophobicContact CG1-CG 4.31Å; I197-I283 HydrophobicContact CB-CD1 4.3Å; I197-I283 HydrophobicContact CG1-CD1 3.74Å; I197-I283 HydrophobicContact CG2-CD1 4.47Å
198	D	96.8	Very high	96.1	Very high	114 Å²	114	44.4 Å²	44.4	61%	0.61	22%	0.221	S	C	*	.	H	α-helix	trans	-68	-28.7	-178.9	-67.9	-11.4	0	0	0	111.6	K194	K194-D198 WeakPolarHBondContact CG-OD2 3.1Å; K194-D198 WeakPolarHBondContact O-CB 3.38Å; K194-D198 VanDerWaalsContact O-CG 3.26Å; K194-D198 PolarHBondContact O-N 2.81Å
199	S	96.2	Very high	96.2	Very high	15 Å²	15	45.9 Å²	45.9	11%	0.105	23%	0.225	C	C	.	.	H	α-helix	trans	-88.8	-6.6	179.3	61.6	0	0	0	0	115.3	L195 F196 I197 A201 R202 L203	L195-S199 VanDerWaalsContact O-CB 3.27Å; L195-S199 WeakPolarHBondContact O-CB 3.27Å; L195-S199 PolarHBondContact O-N 2.94Å; L195-S199 PolarHBondContact O-OG 3.08Å; F196-S199 WeakPolarHBondContact CA-OG 3.27Å; F196-S199 PolarHBondContact O-N 3.15Å; F196-S199 PolarHBondContact O-OG 2.83Å; F196-S199 VanDerWaalsContact O-OG 3.14Å; I197-S199 VanDerWaalsContact C-N 3.26Å; I197-S199 PolarHBondContact O-N 3.2Å; S199-A201 PolarHBondContact O-N 3.02Å; S199-A201 VanDerWaalsContact O-N 3.17Å; S199-R202 PolarHBondContact O-N 3.02Å; S199-L203 WeakPolarHBondContact O-CB 3.34Å; S199-L203 PolarHBondContact O-N 2.83Å
200	R	96.6	Very high	96.4	Very high	82 Å²	82	44.9 Å²	44.9	31%	0.309	22%	0.218	S	C	.	.	H	α-helix	trans	-43.3	-54.4	-176.1	174.8	178.5	-178.9	-162.7	-3.7	113.9	F196 I197 R202 L203 R204 I283 E286 I287	F196-R200 PolarHBondContact O-N 3.13Å; F196-R200 VanDerWaalsContact O-N 3.12Å; I197-R200 WeakPolarHBondContact O-CB 3.13Å; I197-R200 PolarHBondContact O-N 2.91Å; R200-R202 VanDerWaalsContact C-N 3.34Å; R200-R202 PolarHBondContact O-N 2.85Å; R200-L203 PolarHBondContact O-N 2.85Å; R200-R204 WeakPolarHBondContact O-CB 3.09Å; R200-R204 PolarHBondContact O-N 3.17Å; R200-I283 HydrophobicContact CB-CG2 3.95Å; R200-I283 HydrophobicContact CG-CG2 3.6Å; R200-E286 IonicContact CZ-OE1 3.24Å; R200-E286 IonicContact CZ-OE2 3.89Å; R200-E286 VanDerWaalsContact CZ-OE2 3.32Å; R200-E286 IonicContact NE-OE2 2.74Å; R200-E286 IonicContact NH2-OE1 3.64Å; R200-E286 PolarHBondContact NH2-OE1 3.49Å; R200-E286 IonicContact NH2-OE2 2.71Å; R200-E286 PolarHBondContact NH2-OE2 3.38Å; R200-I287 HydrophobicContact CG-CD1 4.44Å
201	A	95	Very high	96.6	Very high	75 Å²	75	43.4 Å²	43.4	62%	0.62	21%	0.21	S	C	*	.	H	α-helix	trans	-65.1	-39.2	-175.7	0	0	0	0	0	112.1	S199 S205	S199-A201 PolarHBondContact O-N 3.02Å; S199-A201 VanDerWaalsContact O-N 3.17Å; A201-S205 WeakPolarHBondContact O-CB 3.13Å; A201-S205 PolarHBondContact O-N 2.93Å
202	R	95.8	Very high	96.5	Very high	109 Å²	109	37.1 Å²	37.1	41%	0.411	19%	0.187	S	C	.	.	H	α-helix	trans	-71.2	-45	179.1	-174.5	60.2	174.1	173.4	5.5	111.2	Q169 S199 R200 S205 I206	Q169-R202 VanDerWaalsContact CD-NH2 3.33Å; S199-R202 PolarHBondContact O-N 3.02Å; R200-R202 VanDerWaalsContact C-N 3.34Å; R200-R202 PolarHBondContact O-N 2.85Å; R202-S205 PolarHBondContact O-N 3.15Å; R202-I206 HydrophobicContact CG-CD1 3.91Å; R202-I206 HydrophobicContact CG-CG1 4.42Å; R202-I206 WeakPolarHBondContact O-CG1 3.5Å; R202-I206 PolarHBondContact O-N 2.88Å
203	L	96.2	Very high	96.5	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-51.5	177.3	-173.7	66.4	0	0	0	110.1	W173 S199 R200 S205 I206 Y207 I252 M284 I287	W173-L203 HydrophobicContact CE3-CD1 4.26Å; W173-L203 HydrophobicContact CH2-CD1 3.61Å; W173-L203 HydrophobicContact CZ2-CB 4.48Å; W173-L203 HydrophobicContact CZ2-CD1 4.21Å; W173-L203 HydrophobicContact CZ3-CD1 3.63Å; S199-L203 WeakPolarHBondContact O-CB 3.34Å; S199-L203 PolarHBondContact O-N 2.83Å; R200-L203 PolarHBondContact O-N 2.85Å; L203-S205 PolarHBondContact O-N 3.1Å; L203-I206 PolarHBondContact O-N 2.76Å; L203-Y207 HydrophobicContact CD1-CD2 3.55Å; L203-Y207 HydrophobicContact CD1-CE2 3.31Å; L203-Y207 HydrophobicContact CG-CD2 4.12Å; L203-Y207 HydrophobicContact CG-CE2 4.31Å; L203-Y207 WeakPolarHBondContact O-CB 3.25Å; L203-Y207 VanDerWaalsContact O-CD2 3.31Å; L203-Y207 WeakPolarHBondContact O-CD2 3.41Å; L203-Y207 PolarHBondContact O-N 2.82Å; L203-Y207 VanDerWaalsContact O-N 3.1Å; L203-I252 HydrophobicContact CD1-CD1 4.14Å; L203-I252 HydrophobicContact CD2-CD1 3.85Å; L203-I252 HydrophobicContact CG-CD1 3.87Å; L203-M284 HydrophobicContact CD2-CE 3.59Å; L203-M284 HydrophobicContact CD2-SD 4.09Å; L203-I287 HydrophobicContact CB-CD1 4.3Å; L203-I287 HydrophobicContact CD2-CD1 3.75Å; L203-I287 HydrophobicContact CG-CD1 4.16Å
204	R	95.7	Very high	96.3	Very high	25 Å²	25	38.9 Å²	38.9	9%	0.094	20%	0.196	C	C	.	.	H	α-helix	trans	-53.1	-52.2	173.8	-178.5	178.6	-72.4	151.3	-4.9	111.7	R200 I206 Y207 S208 E286 I287 D290 N312	R200-R204 WeakPolarHBondContact O-CB 3.09Å; R200-R204 PolarHBondContact O-N 3.17Å; R204-I206 PolarHBondContact O-N 3.19Å; R204-Y207 PolarHBondContact O-N 2.79Å; R204-S208 WeakPolarHBondContact O-CB 3.28Å; R204-S208 PolarHBondContact O-N 3.1Å; R204-S208 PolarHBondContact O-OG 2.99Å; R204-E286 IonicContact CZ-OE1 3.64Å; R204-E286 IonicContact NH1-OE1 3.91Å; R204-E286 IonicContact NH2-OE1 3.01Å; R204-E286 PolarHBondContact NH2-OE1 2.98Å; R204-E286 IonicContact NH2-OE2 3.58Å; R204-I287 HydrophobicContact CB-CG1 4.49Å; R204-I287 HydrophobicContact CB-CG2 4.48Å; R204-D290 IonicContact CZ-OD2 3.79Å; R204-D290 IonicContact NE-OD2 3.58Å; R204-D290 PolarHBondContact NE-OD2 3.02Å; R204-D290 IonicContact NH2-OD2 2.69Å; R204-D290 PolarHBondContact NH2-OD2 3.03Å; R204-N312 VanDerWaalsContact CD-OD1 3.28Å; R204-N312 WeakPolarHBondContact CD-OD1 3.5Å
205	S	95.3	Very high	95.9	Very high	46 Å²	46	35 Å²	35	32%	0.322	18%	0.178	S	C	.	.	H	α-helix	trans	-60.1	-45.6	-176.9	-175.9	0	0	0	0	113.7	A201 R202 L203 K209	A201-S205 WeakPolarHBondContact O-CB 3.13Å; A201-S205 PolarHBondContact O-N 2.93Å; R202-S205 PolarHBondContact O-N 3.15Å; L203-S205 PolarHBondContact O-N 3.1Å; S205-K209 WeakPolarHBondContact O-CG 3.29Å; S205-K209 PolarHBondContact O-N 3.42Å
206	I	97	Very high	95.7	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-66.5	-44.2	-178.9	-65.3	174.4	0	0	0	110.4	N166 Q169 L170 W173 R202 L203 R204 K209 Y210	N166-I206 PolarHBondContact ND2-O 3.04Å; Q169-I206 HydrophobicContact CG-CD1 3.89Å; Q169-I206 HydrophobicContact CG-CG1 3.93Å; Q169-I206 HydrophobicContact CG-CG2 4.35Å; L170-I206 HydrophobicContact CB-CG2 4.41Å; L170-I206 HydrophobicContact CD2-CG2 3.42Å; L170-I206 VanDerWaalsContact CD2-CG2 3.42Å; L170-I206 HydrophobicContact CG-CG2 3.56Å; W173-I206 HydrophobicContact CB-CD1 3.64Å; W173-I206 HydrophobicContact CD2-CD1 4.37Å; W173-I206 HydrophobicContact CG-CD1 3.62Å; R202-I206 HydrophobicContact CG-CD1 3.91Å; R202-I206 HydrophobicContact CG-CG1 4.42Å; R202-I206 WeakPolarHBondContact O-CG1 3.5Å; R202-I206 PolarHBondContact O-N 2.88Å; L203-I206 PolarHBondContact O-N 2.76Å; R204-I206 PolarHBondContact O-N 3.19Å; I206-K209 PolarHBondContact O-N 2.92Å; I206-Y210 PolarHBondContact O-N 3.43Å; I206-Y210 VanDerWaalsContact O-N 3.08Å
207	Y	97.8	Very high	95.6	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-71.3	-38.6	-178.2	-85.4	-87.1	0	0	0	113.1	Y105 L170 H174 L203 R204 K209 Y210 C211 P248 I252	Y105-Y207 PolarHBondContact OH-OH 3.2Å; L170-Y207 HydrophobicContact CD2-CD2 4.24Å; L170-Y207 HydrophobicContact CD2-CE1 4.16Å; L170-Y207 HydrophobicContact CD2-CE2 3.84Å; H174-Y207 AromaticContact CE1-CZ 3.99Å; H174-Y207 PolarHBondContact CE1-OH 3.26Å; H174-Y207 AromaticContact NE2-CE2 3.38Å; H174-Y207 WeakPolarHBondContact NE2-CE2 3.49Å; H174-Y207 AromaticContact NE2-CZ 3.41Å; H174-Y207 PolarHBondContact NE2-OH 2.82Å; L203-Y207 HydrophobicContact CD1-CD2 3.55Å; L203-Y207 HydrophobicContact CD1-CE2 3.31Å; L203-Y207 HydrophobicContact CG-CD2 4.12Å; L203-Y207 HydrophobicContact CG-CE2 4.31Å; L203-Y207 WeakPolarHBondContact O-CB 3.25Å; L203-Y207 VanDerWaalsContact O-CD2 3.31Å; L203-Y207 WeakPolarHBondContact O-CD2 3.41Å; L203-Y207 PolarHBondContact O-N 2.82Å; L203-Y207 VanDerWaalsContact O-N 3.1Å; R204-Y207 PolarHBondContact O-N 2.79Å; Y207-K209 PolarHBondContact O-N 2.72Å; Y207-Y210 PolarHBondContact O-N 3.03Å; Y207-C211 WeakPolarHBondContact O-CB 3.36Å; Y207-C211 PolarHBondContact O-N 3.43Å; Y207-C211 PolarHBondContact O-SG 2.9Å; Y207-P248 HydrophobicContact CE1-CB 3.93Å; Y207-P248 WeakPolarHBondContact CE1-O 3.45Å; Y207-I252 HydrophobicContact CD1-CB 3.59Å; Y207-I252 HydrophobicContact CD1-CD1 4.44Å; Y207-I252 HydrophobicContact CD1-CG1 4.07Å; Y207-I252 HydrophobicContact CD1-CG2 3.81Å; Y207-I252 HydrophobicContact CD2-CD1 4.03Å; Y207-I252 HydrophobicContact CD2-CG1 4.48Å; Y207-I252 HydrophobicContact CE1-CB 3.59Å; Y207-I252 HydrophobicContact CE1-CG1 4.4Å; Y207-I252 HydrophobicContact CE1-CG2 4.07Å; Y207-I252 HydrophobicContact CE2-CD1 4.17Å; Y207-I252 HydrophobicContact CG-CB 4.12Å; Y207-I252 HydrophobicContact CG-CD1 4.15Å; Y207-I252 HydrophobicContact CG-CG1 4.1Å
208	S	95.9	Very high	95.3	Very high	12 Å²	12	37.5 Å²	37.5	8%	0.084	19%	0.187	C	C	.	.	H	α-helix	trans	-60.7	-45	174	-59.8	0	0	0	0	111.2	R204 Y210 C211 E212 I294 T308	R204-S208 WeakPolarHBondContact O-CB 3.28Å; R204-S208 PolarHBondContact O-N 3.1Å; R204-S208 PolarHBondContact O-OG 2.99Å; S208-Y210 VanDerWaalsContact C-N 3.34Å; S208-Y210 PolarHBondContact O-N 3.27Å; S208-C211 PolarHBondContact O-N 3.06Å; S208-E212 PolarHBondContact O-N 3.41Å; S208-I294 WeakPolarHBondContact O-CG2 3.22Å; S208-T308 WeakPolarHBondContact O-CG2 3.45Å
209	K	96.1	Very high	95.1	Very high	85 Å²	85	35.9 Å²	35.9	37%	0.37	18%	0.178	S	C	.	.	H	α-helix	trans	-61.1	-42.4	176.4	-73.6	176.4	-177.1	-177.8	0	112.6	S205 I206 Y207 C211 N213 T308	S205-K209 WeakPolarHBondContact O-CG 3.29Å; S205-K209 PolarHBondContact O-N 3.42Å; I206-K209 PolarHBondContact O-N 2.92Å; Y207-K209 PolarHBondContact O-N 2.72Å; K209-C211 VanDerWaalsContact C-N 3.34Å; K209-N213 PolarHBondContact O-N 3.11Å; K209-T308 HydrophobicContact CG-CG2 4.49Å
210	Y	97.9	Very high	95	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-61.1	-46.2	176.8	-176	-97.9	0	0	0	111.2	N166 W167 L170 I206 Y207 S208 N213 H214 L245 P248 V249	N166-Y210 VanDerWaalsContact OD1-CA 3.24Å; N166-Y210 WeakPolarHBondContact OD1-CA 3.45Å; N166-Y210 WeakPolarHBondContact OD1-CB 3.31Å; N166-Y210 PolarHBondContact OD1-N 3.25Å; W167-Y210 AromaticContact CE3-CE2 3.86Å; W167-Y210 HydrophobicContact CE3-CE2 3.86Å; W167-Y210 HydrophobicContact CZ3-CE2 4.17Å; W167-Y210 WeakPolarHBondContact CZ3-OH 3.34Å; L170-Y210 HydrophobicContact CD1-CD1 4.47Å; L170-Y210 HydrophobicContact CD1-CD2 3.35Å; L170-Y210 HydrophobicContact CD1-CE2 3.9Å; L170-Y210 HydrophobicContact CD1-CG 3.67Å; I206-Y210 PolarHBondContact O-N 3.43Å; I206-Y210 VanDerWaalsContact O-N 3.08Å; Y207-Y210 PolarHBondContact O-N 3.03Å; S208-Y210 VanDerWaalsContact C-N 3.34Å; S208-Y210 PolarHBondContact O-N 3.27Å; Y210-N213 CarbonylContact O-C 3.6Å; Y210-N213 PolarHBondContact O-N 3.23Å; Y210-H214 HydrophobicContact CE1-CB 4.38Å; Y210-H214 WeakPolarHBondContact O-CB 3.35Å; Y210-H214 PolarHBondContact O-N 3.42Å; Y210-L245 VanDerWaalsContact OH-C 3.3Å; Y210-L245 WeakPolarHBondContact OH-CA 3.29Å; Y210-L245 PolarHBondContact OH-O 3.45Å; Y210-P248 HydrophobicContact CD1-CB 3.76Å; Y210-P248 HydrophobicContact CD1-CG 4.23Å; Y210-P248 HydrophobicContact CE1-CB 3.59Å; Y210-P248 HydrophobicContact CE1-CG 3.66Å; Y210-P248 HydrophobicContact CE2-CG 4.13Å; Y210-P248 HydrophobicContact CG-CB 4.36Å; Y210-V249 HydrophobicContact CD1-CG2 4.44Å; Y210-V249 HydrophobicContact CE1-CG2 4.17Å
211	C	96.4	Very high	94.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-70.6	-33.9	-176.9	-68.2	0	0	0	0	113.5	Y207 S208 K209 N213 H214 T291 I294 L295	Y207-C211 WeakPolarHBondContact O-CB 3.36Å; Y207-C211 PolarHBondContact O-N 3.43Å; Y207-C211 PolarHBondContact O-SG 2.9Å; S208-C211 PolarHBondContact O-N 3.06Å; K209-C211 VanDerWaalsContact C-N 3.34Å; C211-N213 PolarHBondContact O-N 2.74Å; C211-H214 PolarHBondContact O-N 2.99Å; C211-T291 HydrophobicContact CB-CG2 3.93Å; C211-T291 WeakPolarHBondContact SG-CG2 3.43Å; C211-I294 HydrophobicContact CB-CG2 4.17Å; C211-L295 HydrophobicContact CB-CD2 3.73Å; C211-L295 HydrophobicContact CB-CG 3.87Å
212	E	95	Very high	94.7	Very high	24 Å²	24	32.2 Å²	32.2	11%	0.112	15%	0.15	C	C	.	.	H	α-helix	trans	-57.5	-40.1	170.2	-179.7	179.8	179.7	0	0	111.5	S208 I294 V306 I307 T308	S208-E212 PolarHBondContact O-N 3.41Å; E212-I294 HydrophobicContact CB-CG2 4.11Å; E212-V306 WeakPolarHBondContact OE1-CG1 3.24Å; E212-V306 WeakPolarHBondContact OE2-CG1 3.32Å; E212-I307 HydrophobicContact CG-CB 4.28Å; E212-I307 PolarHBondContact OE1-N 3.14Å; E212-T308 HydrophobicContact CB-CG2 4.08Å; E212-T308 VanDerWaalsContact OE2-CB 3.25Å; E212-T308 WeakPolarHBondContact OE2-CB 3.13Å; E212-T308 WeakPolarHBondContact OE2-CG2 3.33Å; E212-T308 PolarHBondContact OE2-N 3.42Å; E212-T308 PolarHBondContact OE2-OG1 2.89Å
213	N	95.4	Very high	94.6	Very high	27 Å²	27	32.9 Å²	32.9	14%	0.144	16%	0.158	C	C	.	.	H	α-helix	trans	-83.9	-25.4	179.9	-174	65.5	0	0	0	113.8	I162 K209 Y210 C211 R215 K216 A217	I162-N213 PolarHBondContact O-ND2 3Å; I162-N213 PolarHBondContact O-OD1 3.44Å; K209-N213 PolarHBondContact O-N 3.11Å; Y210-N213 CarbonylContact O-C 3.6Å; Y210-N213 PolarHBondContact O-N 3.23Å; C211-N213 PolarHBondContact O-N 2.74Å; N213-R215 VanDerWaalsContact C-N 3.33Å; N213-R215 PolarHBondContact O-N 3.29Å; N213-K216 WeakPolarHBondContact O-CB 3.49Å; N213-K216 PolarHBondContact O-N 2.91Å; N213-A217 PolarHBondContact O-N 3.42Å
214	H	94.4	Very high	94.5	Very high	11 Å²	11	34.3 Å²	34.3	5%	0.051	16%	0.164	C	C	.	.	H	α-helix	trans	-54.6	-41.9	-170	178.5	66.8	0	0	0	113.6	Y210 C211 K216 A217 A218 L245 M246 L295	Y210-H214 HydrophobicContact CE1-CB 4.38Å; Y210-H214 WeakPolarHBondContact O-CB 3.35Å; Y210-H214 PolarHBondContact O-N 3.42Å; C211-H214 PolarHBondContact O-N 2.99Å; H214-K216 VanDerWaalsContact C-N 3.33Å; H214-K216 PolarHBondContact O-N 3.34Å; H214-A217 PolarHBondContact O-N 3.26Å; H214-A218 WeakPolarHBondContact O-CB 3.31Å; H214-A218 PolarHBondContact O-N 2.93Å; H214-L245 PolarHBondContact CE1-O 3.13Å; H214-L245 PolarHBondContact ND1-O 3.16Å; H214-M246 VanDerWaalsContact NE2-CE 3.25Å; H214-M246 WeakPolarHBondContact NE2-CE 3.22Å; H214-L295 HydrophobicContact CB-CD2 4.38Å
215	R	88.5	Confident	94.4	Very high	41 Å²	41	38.8 Å²	38.8	16%	0.155	18%	0.18	C	C	.	.	H	α-helix	trans	-57.7	-45	176.1	173.3	175.1	146.4	150.8	-12.5	111.5	N213 L219 R299 D301 T449	N213-R215 VanDerWaalsContact C-N 3.33Å; N213-R215 PolarHBondContact O-N 3.29Å; R215-L219 HydrophobicContact CG-CD1 4.04Å; R215-L219 VanDerWaalsContact O-CG 3.25Å; R215-L219 WeakPolarHBondContact O-CG 3.49Å; R215-L219 PolarHBondContact O-N 3.45Å; R215-L219 VanDerWaalsContact O-N 3.09Å; R215-R299 VanDerWaalsContact NH1-CB 3.34Å; R215-D301 IonicContact NH2-OD1 2.73Å; R215-D301 PolarHBondContact NH2-OD1 2.87Å; R215-D301 VanDerWaalsContact NH2-OD1 3.1Å; R215-D301 IonicContact NH2-OD2 2.75Å; R215-T449 PolarHBondContact NH1-OG1 3.25Å; R215-T449 PolarHBondContact NH2-OG1 3.34Å
216	K	92	Very high	94.4	Very high	113 Å²	113	42.6 Å²	42.6	49%	0.491	20%	0.197	S	C	.	.	H	α-helix	trans	-65.8	-45.2	179.5	-59.9	173.9	-172.9	170.9	0	110.9	I162 N213 H214 L219 I220	I162-K216 HydrophobicContact CG2-CB 4.09Å; N213-K216 WeakPolarHBondContact O-CB 3.49Å; N213-K216 PolarHBondContact O-N 2.91Å; H214-K216 VanDerWaalsContact C-N 3.33Å; H214-K216 PolarHBondContact O-N 3.34Å; K216-L219 PolarHBondContact O-N 2.89Å; K216-I220 VanDerWaalsContact O-CG1 3.32Å; K216-I220 WeakPolarHBondContact O-CG1 3.23Å; K216-I220 PolarHBondContact O-N 3.41Å; K216-I220 VanDerWaalsContact O-N 3.07Å
217	A	95.4	Very high	94.3	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.008	20%	0.2	C	C	.	.	H	α-helix	trans	-60.1	-46.4	177.7	0	0	0	0	0	112.2	I163 N213 H214 I220 A221 L245	I163-A217 WeakPolarHBondContact O-CB 3.2Å; N213-A217 PolarHBondContact O-N 3.42Å; H214-A217 PolarHBondContact O-N 3.26Å; A217-I220 PolarHBondContact O-N 2.88Å; A217-A221 WeakPolarHBondContact O-CB 3.24Å; A217-A221 PolarHBondContact O-N 3.21Å; A217-L245 HydrophobicContact CB-CD1 4.23Å; A217-L245 HydrophobicContact CB-CD2 4.32Å
218	A	92.9	Very high	94.2	Very high	3 Å²	3	43.4 Å²	43.4	3%	0.025	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-41.6	178.6	0	0	0	0	0	112.5	H214 A221 E222 F445	H214-A218 WeakPolarHBondContact O-CB 3.31Å; H214-A218 PolarHBondContact O-N 2.93Å; A218-A221 PolarHBondContact O-N 3.42Å; A218-E222 PolarHBondContact O-N 3.1Å; A218-F445 HydrophobicContact CB-CE1 4.16Å; A218-F445 HydrophobicContact CB-CE2 4.15Å; A218-F445 HydrophobicContact CB-CZ 3.59Å
219	L	91.6	Very high	94.2	Very high	81 Å²	81	46 Å²	46	42%	0.424	21%	0.211	S	C	.	.	H	α-helix	trans	-62.6	-43.5	176.3	-73.3	168.8	0	0	0	112.2	R215 K216 Q223 F445	R215-L219 HydrophobicContact CG-CD1 4.04Å; R215-L219 VanDerWaalsContact O-CG 3.25Å; R215-L219 WeakPolarHBondContact O-CG 3.49Å; R215-L219 PolarHBondContact O-N 3.45Å; R215-L219 VanDerWaalsContact O-N 3.09Å; K216-L219 PolarHBondContact O-N 2.89Å; L219-Q223 WeakPolarHBondContact O-CB 3.43Å; L219-Q223 PolarHBondContact O-N 3.3Å; L219-F445 HydrophobicContact CD2-CB 3.89Å; L219-F445 HydrophobicContact CD2-CD1 4.37Å; L219-F445 HydrophobicContact CD2-CG 4.16Å
220	I	94.1	Very high	94.2	Very high	11 Å²	11	47.4 Å²	47.4	6%	0.056	22%	0.219	C	C	.	.	H	α-helix	trans	-66.9	-42.8	176.9	-63.1	164.6	0	0	0	110.2	L156 R159 I162 I163 K216 A217 E222 Q223 Y224	L156-I220 HydrophobicContact CD1-CG2 3.79Å; R159-I220 HydrophobicContact CB-CD1 4.28Å; I162-I220 HydrophobicContact CB-CD1 4.03Å; I162-I220 HydrophobicContact CG2-CD1 3.71Å; I163-I220 HydrophobicContact CD1-CG2 3.67Å; I163-I220 HydrophobicContact CG1-CB 4.13Å; I163-I220 HydrophobicContact CG1-CD1 4.44Å; I163-I220 HydrophobicContact CG1-CG2 3.71Å; K216-I220 VanDerWaalsContact O-CG1 3.32Å; K216-I220 WeakPolarHBondContact O-CG1 3.23Å; K216-I220 PolarHBondContact O-N 3.41Å; K216-I220 VanDerWaalsContact O-N 3.07Å; A217-I220 PolarHBondContact O-N 2.88Å; I220-E222 VanDerWaalsContact C-N 3.33Å; I220-E222 PolarHBondContact O-N 2.96Å; I220-Q223 PolarHBondContact O-N 2.85Å; I220-Y224 HydrophobicContact CG2-CD2 4.08Å; I220-Y224 HydrophobicContact CG2-CE2 4.38Å; I220-Y224 WeakPolarHBondContact O-CD2 3.3Å; I220-Y224 PolarHBondContact O-N 3.02Å; I220-Y224 VanDerWaalsContact O-N 3.12Å
221	A	94	Very high	94.1	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.6	-41.3	179.1	0	0	0	0	0	112.5	A217 A218 Y224 R225 F228 V241 V242 L245	A217-A221 WeakPolarHBondContact O-CB 3.24Å; A217-A221 PolarHBondContact O-N 3.21Å; A218-A221 PolarHBondContact O-N 3.42Å; A221-Y224 CarbonylContact O-C 3.47Å; A221-Y224 PolarHBondContact O-N 2.98Å; A221-R225 PolarHBondContact O-N 3.16Å; A221-F228 HydrophobicContact CB-CE2 4.35Å; A221-V241 HydrophobicContact CB-CG1 4Å; A221-V242 HydrophobicContact CB-CG2 4.11Å; A221-L245 HydrophobicContact CB-CD1 3.84Å
222	E	91.9	Very high	94	Very high	84 Å²	84	50.2 Å²	50.2	39%	0.393	23%	0.23	S	C	.	.	H	α-helix	trans	-70.7	-37.2	175.9	-166.2	64.6	-148.8	0	0	111.9	A218 I220 Y224 R225	A218-E222 PolarHBondContact O-N 3.1Å; I220-E222 VanDerWaalsContact C-N 3.33Å; I220-E222 PolarHBondContact O-N 2.96Å; E222-Y224 PolarHBondContact O-N 3.45Å; E222-R225 WeakPolarHBondContact O-CB 3.47Å; E222-R225 PolarHBondContact O-N 2.91Å; E222-R225 IonicContact OE1-CZ 2.82Å; E222-R225 IonicContact OE1-NH1 2.72Å; E222-R225 PolarHBondContact OE1-NH1 3.32Å
223	Q	93.2	Very high	94.1	Very high	122 Å²	122	54.4 Å²	54.4	57%	0.57	25%	0.252	S	S	*	.	H	α-helix	trans	-59.6	-35.2	176.3	-175.6	179.2	19.7	0	0	112.3	L219 I220	L219-Q223 WeakPolarHBondContact O-CB 3.43Å; L219-Q223 PolarHBondContact O-N 3.3Å; I220-Q223 PolarHBondContact O-N 2.85Å
224	Y	94.5	Very high	94	Very high	31 Å²	31	57.6 Å²	57.6	12%	0.122	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	34.8	-179.3	-64.5	-85.8	0	0	0	112.5	P153 D155 L156 R159 I220 A221 E222 D226 F227 F228	P153-Y224 HydrophobicContact CB-CD1 4.49Å; P153-Y224 HydrophobicContact CB-CE1 4.06Å; P153-Y224 HydrophobicContact CG-CD1 4.08Å; P153-Y224 HydrophobicContact CG-CE1 4.13Å; D155-Y224 VanDerWaalsContact CB-OH 3.25Å; D155-Y224 WeakPolarHBondContact CB-OH 3.49Å; L156-Y224 HydrophobicContact CB-CD1 4.11Å; L156-Y224 HydrophobicContact CB-CD2 4.36Å; L156-Y224 HydrophobicContact CB-CE1 4.06Å; L156-Y224 HydrophobicContact CB-CE2 4.31Å; L156-Y224 HydrophobicContact CB-CG 4.26Å; L156-Y224 HydrophobicContact CD1-CD2 3.77Å; L156-Y224 HydrophobicContact CD1-CE2 4.25Å; L156-Y224 HydrophobicContact CD1-CG 4.02Å; L156-Y224 HydrophobicContact CD2-CD1 4.19Å; L156-Y224 HydrophobicContact CD2-CG 3.99Å; L156-Y224 HydrophobicContact CG-CD2 4.45Å; L156-Y224 HydrophobicContact CG-CG 4.32Å; R159-Y224 PolarHBondContact NH2-OH 3.41Å; I220-Y224 HydrophobicContact CG2-CD2 4.08Å; I220-Y224 HydrophobicContact CG2-CE2 4.38Å; I220-Y224 WeakPolarHBondContact O-CD2 3.3Å; I220-Y224 PolarHBondContact O-N 3.02Å; I220-Y224 VanDerWaalsContact O-N 3.12Å; A221-Y224 CarbonylContact O-C 3.47Å; A221-Y224 PolarHBondContact O-N 2.98Å; E222-Y224 PolarHBondContact O-N 3.45Å; Y224-D226 PolarHBondContact O-N 3.32Å; Y224-F227 PolarHBondContact O-N 3Å; Y224-F228 VanDerWaalsContact O-CD2 3.29Å; Y224-F228 WeakPolarHBondContact O-CD2 3.29Å; Y224-F228 PolarHBondContact O-N 3.43Å; Y224-F228 VanDerWaalsContact O-N 3.16Å
225	R	93.8	Very high	94	Very high	118 Å²	118	58.9 Å²	58.9	45%	0.445	27%	0.272	S	S	.	.	H	α-helix	trans	-51.4	-42.6	-176.7	-175.8	-177.3	-176.7	144.9	5.1	113.1	A221 E222 F228 E229	A221-R225 PolarHBondContact O-N 3.16Å; E222-R225 WeakPolarHBondContact O-CB 3.47Å; E222-R225 PolarHBondContact O-N 2.91Å; E222-R225 IonicContact OE1-CZ 2.82Å; E222-R225 IonicContact OE1-NH1 2.72Å; E222-R225 PolarHBondContact OE1-NH1 3.32Å; R225-F228 PolarHBondContact O-N 3.19Å; R225-E229 WeakPolarHBondContact O-CB 3.34Å; R225-E229 PolarHBondContact O-N 3.2Å
226	D	94.7	Very high	94.2	Very high	126 Å²	126	59.8 Å²	59.8	67%	0.674	29%	0.294	S	S	*	.	H	α-helix	trans	-63.6	-45.6	-177.4	-62.1	-25.8	0	0	0	111.9	Y224 F228 E229 E230	Y224-D226 PolarHBondContact O-N 3.32Å; D226-F228 VanDerWaalsContact C-N 3.34Å; D226-F228 PolarHBondContact O-N 3.47Å; D226-E229 WeakPolarHBondContact O-CB 3.38Å; D226-E229 PolarHBondContact O-N 2.87Å; D226-E230 PolarHBondContact O-N 3.19Å
227	F	95.5	Very high	94.4	Very high	16 Å²	16	55.6 Å²	55.6	7%	0.07	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-43.7	174.9	166.4	-93.7	0	0	0	111.8	V120 P150 A152 L156 W160 Y224 E229 E230 L231	V120-F227 HydrophobicContact CG2-CZ 4.24Å; P150-F227 HydrophobicContact CB-CD2 4.24Å; P150-F227 HydrophobicContact CB-CE2 4.06Å; P150-F227 HydrophobicContact CG-CE2 4.19Å; A152-F227 VanDerWaalsContact CA-CE2 3.42Å; A152-F227 HydrophobicContact CB-CD2 4.47Å; A152-F227 HydrophobicContact CB-CE1 4.5Å; A152-F227 HydrophobicContact CB-CE2 3.74Å; A152-F227 HydrophobicContact CB-CZ 3.75Å; L156-F227 HydrophobicContact CD2-CB 4.43Å; L156-F227 HydrophobicContact CD2-CD1 3.27Å; L156-F227 HydrophobicContact CD2-CE1 3.57Å; L156-F227 HydrophobicContact CD2-CG 3.83Å; L156-F227 HydrophobicContact CD2-CZ 4.33Å; W160-F227 AromaticContact CH2-CE1 3.8Å; W160-F227 HydrophobicContact CH2-CE1 3.8Å; W160-F227 HydrophobicContact CH2-CZ 4.27Å; W160-F227 AromaticContact CZ3-CE1 3.76Å; W160-F227 HydrophobicContact CZ3-CE1 3.76Å; W160-F227 HydrophobicContact CZ3-CZ 4.37Å; Y224-F227 PolarHBondContact O-N 3Å; F227-E229 VanDerWaalsContact C-N 3.32Å; F227-E229 PolarHBondContact O-N 3.25Å; F227-E230 PolarHBondContact O-N 3.2Å; F227-L231 HydrophobicContact CE1-CD2 4.06Å; F227-L231 HydrophobicContact CZ-CD2 4.18Å; F227-L231 WeakPolarHBondContact O-CB 3.28Å; F227-L231 PolarHBondContact O-N 3.22Å
228	F	95.8	Very high	94.3	Very high	4 Å²	4	65 Å²	65	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-69.4	-30.5	179.3	-77.5	-67.1	0	0	0	113	L156 W160 I163 A221 Y224 R225 D226 L231 R232 V241	L156-F228 HydrophobicContact CD1-CE2 4.31Å; L156-F228 HydrophobicContact CD1-CZ 4.38Å; L156-F228 HydrophobicContact CD2-CE2 4.42Å; W160-F228 AromaticContact CH2-CE1 3.8Å; W160-F228 HydrophobicContact CH2-CE1 3.8Å; W160-F228 HydrophobicContact CH2-CZ 4.18Å; W160-F228 AromaticContact CZ3-CE1 3.92Å; W160-F228 HydrophobicContact CZ3-CE1 3.92Å; W160-F228 AromaticContact CZ3-CZ 3.81Å; W160-F228 HydrophobicContact CZ3-CZ 3.81Å; I163-F228 HydrophobicContact CD1-CE2 4.29Å; I163-F228 HydrophobicContact CD1-CZ 3.68Å; I163-F228 HydrophobicContact CG2-CZ 4.48Å; A221-F228 HydrophobicContact CB-CE2 4.35Å; Y224-F228 VanDerWaalsContact O-CD2 3.29Å; Y224-F228 WeakPolarHBondContact O-CD2 3.29Å; Y224-F228 PolarHBondContact O-N 3.43Å; Y224-F228 VanDerWaalsContact O-N 3.16Å; R225-F228 PolarHBondContact O-N 3.19Å; D226-F228 VanDerWaalsContact C-N 3.34Å; D226-F228 PolarHBondContact O-N 3.47Å; F228-L231 HydrophobicContact CD1-CD2 4.45Å; F228-R232 VanDerWaalsContact O-CB 3.3Å; F228-R232 WeakPolarHBondContact O-CB 3.34Å; F228-R232 PolarHBondContact O-N 3.23Å; F228-V241 HydrophobicContact CB-CB 4.15Å; F228-V241 HydrophobicContact CB-CG1 3.55Å; F228-V241 HydrophobicContact CD1-CB 3.85Å; F228-V241 HydrophobicContact CD1-CG1 3.87Å; F228-V241 HydrophobicContact CD1-CG2 3.78Å; F228-V241 HydrophobicContact CD2-CG1 3.96Å; F228-V241 HydrophobicContact CE1-CB 4.47Å; F228-V241 HydrophobicContact CE1-CG2 3.9Å; F228-V241 HydrophobicContact CG-CB 4.04Å; F228-V241 HydrophobicContact CG-CG1 3.53Å; F228-V241 HydrophobicContact CG-CG2 4.3Å
229	E	95.5	Very high	94.4	Very high	65 Å²	65	68.5 Å²	68.5	30%	0.304	33%	0.334	S	S	.	.	H	α-helix	trans	-67.2	-44.8	173.1	-179.6	60.3	-152.3	0	0	111	R225 D226 F227 L231 R232 I233	R225-E229 WeakPolarHBondContact O-CB 3.34Å; R225-E229 PolarHBondContact O-N 3.2Å; D226-E229 WeakPolarHBondContact O-CB 3.38Å; D226-E229 PolarHBondContact O-N 2.87Å; F227-E229 VanDerWaalsContact C-N 3.32Å; F227-E229 PolarHBondContact O-N 3.25Å; E229-L231 PolarHBondContact O-N 2.91Å; E229-R232 VanDerWaalsContact CD-CZ 3.45Å; E229-R232 VanDerWaalsContact CD-NH2 3.34Å; E229-R232 PolarHBondContact O-N 3.29Å; E229-R232 IonicContact OE1-CZ 2.82Å; E229-R232 IonicContact OE1-NE 3.53Å; E229-R232 IonicContact OE1-NH1 3.79Å; E229-R232 PolarHBondContact OE1-NH1 3.48Å; E229-R232 IonicContact OE1-NH2 3.08Å; E229-R232 PolarHBondContact OE1-NH2 2.84Å; E229-R232 IonicContact OE2-CZ 2.94Å; E229-R232 IonicContact OE2-NE 3.26Å; E229-R232 IonicContact OE2-NH1 2.8Å; E229-R232 PolarHBondContact OE2-NH1 2.88Å; E229-R232 IonicContact OE2-NH2 2.72Å; E229-R232 PolarHBondContact OE2-NH2 3.36Å; E229-I233 HydrophobicContact CG-CD1 4.38Å; E229-I233 VanDerWaalsContact O-CG1 3.32Å; E229-I233 WeakPolarHBondContact O-CG1 3.34Å; E229-I233 PolarHBondContact O-N 3.16Å
230	E	95.6	Very high	94.5	Very high	115 Å²	115	67.3 Å²	67.3	54%	0.537	33%	0.327	S	S	.	.	H	α-helix	trans	-60.7	-44.3	172.8	-70.7	178.2	-166.7	0	0	111.8	P150 D226 F227 R232 I233 F234	P150-E230 HydrophobicContact CB-CB 4.1Å; P150-E230 HydrophobicContact CG-CB 4.36Å; D226-E230 PolarHBondContact O-N 3.19Å; F227-E230 PolarHBondContact O-N 3.2Å; E230-R232 PolarHBondContact O-N 3.31Å; E230-I233 PolarHBondContact O-N 3.04Å; E230-F234 WeakPolarHBondContact O-CB 3.31Å; E230-F234 PolarHBondContact O-N 3.35Å
231	L	95.4	Very high	94.6	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.016	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-40.6	177.8	-177	60.2	0	0	0	111.8	Y116 A119 P150 W160 F227 F228 E229 I233 F234 I235	Y116-L231 HydrophobicContact CD1-CD2 3.77Å; Y116-L231 HydrophobicContact CD1-CG 4.29Å; Y116-L231 HydrophobicContact CE1-CD2 4.2Å; Y116-L231 HydrophobicContact CE1-CG 4.32Å; A119-L231 HydrophobicContact CB-CD1 3.9Å; A119-L231 HydrophobicContact CB-CD2 3.94Å; P150-L231 HydrophobicContact CG-CB 3.89Å; P150-L231 HydrophobicContact CG-CD1 3.95Å; W160-L231 HydrophobicContact CH2-CD2 4.32Å; F227-L231 HydrophobicContact CE1-CD2 4.06Å; F227-L231 HydrophobicContact CZ-CD2 4.18Å; F227-L231 WeakPolarHBondContact O-CB 3.28Å; F227-L231 PolarHBondContact O-N 3.22Å; F228-L231 HydrophobicContact CD1-CD2 4.45Å; E229-L231 PolarHBondContact O-N 2.91Å; L231-I233 PolarHBondContact O-N 2.99Å; L231-F234 HydrophobicContact CD1-CD1 4.38Å; L231-F234 PolarHBondContact O-N 2.99Å; L231-I235 HydrophobicContact CD1-CD1 3.8Å; L231-I235 HydrophobicContact CD1-CG1 4.17Å; L231-I235 HydrophobicContact CD2-CD1 4.47Å; L231-I235 HydrophobicContact CG-CD1 3.76Å; L231-I235 HydrophobicContact CG-CG1 4.49Å; L231-I235 VanDerWaalsContact O-CG1 3.31Å; L231-I235 WeakPolarHBondContact O-CG1 3.48Å; L231-I235 PolarHBondContact O-N 2.83Å
232	R	96	Very high	94.6	Very high	59 Å²	59	69 Å²	69	22%	0.223	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-46.5	175.2	-172.4	-165.1	78.8	-161.5	3.7	111.2	F228 E229 E230 I235 G236 D237 E239	F228-R232 VanDerWaalsContact O-CB 3.3Å; F228-R232 WeakPolarHBondContact O-CB 3.34Å; F228-R232 PolarHBondContact O-N 3.23Å; E229-R232 VanDerWaalsContact CD-CZ 3.45Å; E229-R232 VanDerWaalsContact CD-NH2 3.34Å; E229-R232 PolarHBondContact O-N 3.29Å; E229-R232 IonicContact OE1-CZ 2.82Å; E229-R232 IonicContact OE1-NE 3.53Å; E229-R232 IonicContact OE1-NH1 3.79Å; E229-R232 PolarHBondContact OE1-NH1 3.48Å; E229-R232 IonicContact OE1-NH2 3.08Å; E229-R232 PolarHBondContact OE1-NH2 2.84Å; E229-R232 IonicContact OE2-CZ 2.94Å; E229-R232 IonicContact OE2-NE 3.26Å; E229-R232 IonicContact OE2-NH1 2.8Å; E229-R232 PolarHBondContact OE2-NH1 2.88Å; E229-R232 IonicContact OE2-NH2 2.72Å; E229-R232 PolarHBondContact OE2-NH2 3.36Å; E230-R232 PolarHBondContact O-N 3.31Å; R232-I235 PolarHBondContact O-N 2.99Å; R232-G236 PolarHBondContact O-N 2.93Å; R232-D237 HydrophobicContact CG-CB 3.91Å; R232-D237 WeakPolarHBondContact CG-O 3.45Å; R232-D237 PolarHBondContact O-N 3.3Å; R232-E239 VanDerWaalsContact CD-O 3.25Å; R232-E239 WeakPolarHBondContact CD-O 3.34Å; R232-E239 WeakPolarHBondContact CG-O 3.48Å
233	I	95.6	Very high	94.8	Very high	111 Å²	111	67.5 Å²	67.5	57%	0.569	34%	0.337	S	S	*	.	H	α-helix	trans	-62.4	-45	177.9	-66.8	165.6	0	0	0	110.3	E229 E230 L231 I235 G236	E229-I233 HydrophobicContact CG-CD1 4.38Å; E229-I233 VanDerWaalsContact O-CG1 3.32Å; E229-I233 WeakPolarHBondContact O-CG1 3.34Å; E229-I233 PolarHBondContact O-N 3.16Å; E230-I233 PolarHBondContact O-N 3.04Å; L231-I233 PolarHBondContact O-N 2.99Å; I233-I235 PolarHBondContact O-N 3.05Å; I233-G236 PolarHBondContact O-N 2.9Å; I233-G236 VanDerWaalsContact O-N 3.1Å
234	F	93.7	Very high	95	Very high	94 Å²	94	61.8 Å²	61.8	41%	0.412	31%	0.31	S	S	.	.	H	α-helix	trans	-61.1	-42.2	178.3	175	-102.5	0	0	0	112.9	A147 P149 E230 L231 G236	A147-F234 HydrophobicContact CB-CD2 4.25Å; A147-F234 VanDerWaalsContact O-CE2 3.28Å; A147-F234 WeakPolarHBondContact O-CE2 3.5Å; P149-F234 HydrophobicContact CB-CD1 4.36Å; P149-F234 HydrophobicContact CB-CE1 3.84Å; P149-F234 HydrophobicContact CB-CE2 4.43Å; P149-F234 HydrophobicContact CB-CZ 3.88Å; E230-F234 WeakPolarHBondContact O-CB 3.31Å; E230-F234 PolarHBondContact O-N 3.35Å; L231-F234 HydrophobicContact CD1-CD1 4.38Å; L231-F234 PolarHBondContact O-N 2.99Å; F234-G236 PolarHBondContact O-N 2.94Å
235	I	93.6	Very high	95.1	Very high	39 Å²	39	60.4 Å²	60.4	20%	0.2	31%	0.305	C	S	.	.	H	α-helix	trans	-72.7	-19.4	176.9	-64.4	167.5	0	0	0	111.6	F115 Y116 L231 R232 I233 D237	F115-I235 HydrophobicContact CB-CD1 3.87Å; F115-I235 HydrophobicContact CB-CG1 4.17Å; F115-I235 HydrophobicContact CB-CG2 3.86Å; F115-I235 HydrophobicContact CD2-CG2 4.5Å; F115-I235 HydrophobicContact CG-CG2 4.06Å; Y116-I235 HydrophobicContact CD1-CD1 4.15Å; Y116-I235 HydrophobicContact CD2-CD1 3.72Å; Y116-I235 HydrophobicContact CE1-CD1 4.14Å; Y116-I235 HydrophobicContact CE2-CD1 3.73Å; Y116-I235 HydrophobicContact CG-CD1 3.96Å; L231-I235 HydrophobicContact CD1-CD1 3.8Å; L231-I235 HydrophobicContact CD1-CG1 4.17Å; L231-I235 HydrophobicContact CD2-CD1 4.47Å; L231-I235 HydrophobicContact CG-CD1 3.76Å; L231-I235 HydrophobicContact CG-CG1 4.49Å; L231-I235 VanDerWaalsContact O-CG1 3.31Å; L231-I235 WeakPolarHBondContact O-CG1 3.48Å; L231-I235 PolarHBondContact O-N 2.83Å; R232-I235 PolarHBondContact O-N 2.99Å; I233-I235 PolarHBondContact O-N 3.05Å; I235-D237 VanDerWaalsContact C-N 3.33Å; I235-D237 HydrophobicContact CB-CB 4.49Å; I235-D237 HydrophobicContact CG2-CB 4.18Å
236	G	94.6	Very high	95.2	Very high	60 Å²	60	56.8 Å²	56.8	62%	0.619	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	26.5	-173.5	0	0	0	0	0	112.9	R232 I233 F234	R232-G236 PolarHBondContact O-N 2.93Å; I233-G236 PolarHBondContact O-N 2.9Å; I233-G236 VanDerWaalsContact O-N 3.1Å; F234-G236 PolarHBondContact O-N 2.94Å
237	D	94.9	Very high	95.3	Very high	24 Å²	24	51.2 Å²	51.2	13%	0.128	26%	0.263	C	S	.	.			trans	-83.3	145.8	-177.6	-170.3	9.7	0	0	0	111.7	Y116 R232 I235 E239 H244	Y116-D237 HydrophobicContact CE2-CB 4.46Å; Y116-D237 VanDerWaalsContact CE2-OD2 3.25Å; Y116-D237 WeakPolarHBondContact CE2-OD2 3.41Å; Y116-D237 PolarHBondContact OH-OD2 2.97Å; R232-D237 HydrophobicContact CG-CB 3.91Å; R232-D237 WeakPolarHBondContact CG-O 3.45Å; R232-D237 PolarHBondContact O-N 3.3Å; I235-D237 VanDerWaalsContact C-N 3.33Å; I235-D237 HydrophobicContact CB-CB 4.49Å; I235-D237 HydrophobicContact CG2-CB 4.18Å; D237-E239 PolarHBondContact OD1-N 2.96Å; D237-H244 IonicContact OD1-NE2 3.95Å; D237-H244 IonicContact OD2-CD2 3.47Å; D237-H244 IonicContact OD2-CE1 3Å; D237-H244 IonicContact OD2-NE2 3.8Å; D237-H244 PolarHBondContact OD2-NE2 3.2Å
238	K	94.4	Very high	95.5	Very high	199 Å²	199	50.4 Å²	50.4	87%	0.865	26%	0.26	S	S	*	.	S	Bend	trans	-92.8	-26.3	-176.2	-62.6	-175.8	-178.2	-177.3	0	112.9
239	E	94	Very high	95.5	Very high	77 Å²	77	50.3 Å²	50.3	36%	0.36	26%	0.259	S	S	.	.	S	Bend	trans	-100	143.8	179.6	-68.3	-177.3	-164.7	0	0	109.5	R232 D237 Q247	R232-E239 VanDerWaalsContact CD-O 3.25Å; R232-E239 WeakPolarHBondContact CD-O 3.34Å; R232-E239 WeakPolarHBondContact CG-O 3.48Å; D237-E239 PolarHBondContact OD1-N 2.96Å; E239-Q247 PolarHBondContact OE2-NE2 3.26Å
240	D	94.9	Very high	95.6	Very high	55 Å²	55	49.5 Å²	49.5	29%	0.294	26%	0.256	S	S	.	.			trans	-76.1	164.3	174.1	63.8	14.6	0	0	0	111.7	V242 S243 H244	D240-V242 PolarHBondContact O-N 3.09Å; D240-S243 WeakPolarHBondContact O-CB 3.27Å; D240-S243 PolarHBondContact O-N 3.46Å; D240-S243 VanDerWaalsContact O-N 3.17Å; D240-S243 WeakPolarHBondContact OD1-CA 3.4Å; D240-S243 WeakPolarHBondContact OD1-CB 3.28Å; D240-S243 PolarHBondContact OD1-N 2.88Å; D240-S243 PolarHBondContact OD1-OG 2.85Å; D240-H244 PolarHBondContact O-CD2 3.12Å; D240-H244 VanDerWaalsContact O-CD2 3.27Å; D240-H244 PolarHBondContact O-N 3.3Å; D240-H244 VanDerWaalsContact O-N 3.15Å
241	V	95.4	Very high	95.7	Very high	7 Å²	7	45 Å²	45	4%	0.042	23%	0.234	C	C	.	.	H	α-helix	trans	-58.2	-36.2	-178.7	66.9	0	0	0	0	112.2	W164 A221 F228 H244 L245	W164-V241 HydrophobicContact CH2-CG2 3.85Å; A221-V241 HydrophobicContact CB-CG1 4Å; F228-V241 HydrophobicContact CB-CB 4.15Å; F228-V241 HydrophobicContact CB-CG1 3.55Å; F228-V241 HydrophobicContact CD1-CB 3.85Å; F228-V241 HydrophobicContact CD1-CG1 3.87Å; F228-V241 HydrophobicContact CD1-CG2 3.78Å; F228-V241 HydrophobicContact CD2-CG1 3.96Å; F228-V241 HydrophobicContact CE1-CB 4.47Å; F228-V241 HydrophobicContact CE1-CG2 3.9Å; F228-V241 HydrophobicContact CG-CB 4.04Å; F228-V241 HydrophobicContact CG-CG1 3.53Å; F228-V241 HydrophobicContact CG-CG2 4.3Å; V241-H244 PolarHBondContact O-N 3.05Å; V241-L245 HydrophobicContact CG2-CD1 4.32Å; V241-L245 HydrophobicContact CG2-CG 4.46Å; V241-L245 WeakPolarHBondContact O-CG 3.44Å; V241-L245 PolarHBondContact O-N 3.34Å
242	V	94.9	Very high	95.8	Very high	41 Å²	41	44.9 Å²	44.9	25%	0.248	23%	0.233	C	C	.	.	H	α-helix	trans	-67.8	-39.3	-178.6	-179	0	0	0	0	110.4	A221 D240 L245 M246	A221-V242 HydrophobicContact CB-CG2 4.11Å; D240-V242 PolarHBondContact O-N 3.09Å; V242-L245 PolarHBondContact O-N 2.85Å; V242-M246 PolarHBondContact O-N 3.38Å
243	S	95.7	Very high	95.8	Very high	51 Å²	51	43.5 Å²	43.5	36%	0.357	23%	0.23	S	C	.	.	H	α-helix	trans	-60.7	-45.4	173.3	-63.6	0	0	0	0	111.3	D240 L245 M246 Q247	D240-S243 WeakPolarHBondContact O-CB 3.27Å; D240-S243 PolarHBondContact O-N 3.46Å; D240-S243 VanDerWaalsContact O-N 3.17Å; D240-S243 WeakPolarHBondContact OD1-CA 3.4Å; D240-S243 WeakPolarHBondContact OD1-CB 3.28Å; D240-S243 PolarHBondContact OD1-N 2.88Å; D240-S243 PolarHBondContact OD1-OG 2.85Å; S243-L245 PolarHBondContact O-N 2.67Å; S243-M246 PolarHBondContact O-N 3.07Å; S243-M246 VanDerWaalsContact O-N 3.16Å; S243-Q247 WeakPolarHBondContact O-CG 3.5Å; S243-Q247 PolarHBondContact O-N 3.27Å
244	H	96.8	Very high	95.8	Very high	3 Å²	3	43.9 Å²	43.9	1%	0.014	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-47.6	174.4	-73.5	-63.2	0	0	0	112.1	V112 W167 D237 D240 V241 M246 Q247	V112-H244 HydrophobicContact CG2-CB 3.9Å; W167-H244 HydrophobicContact CH2-CB 4.34Å; W167-H244 WeakPolarHBondContact CH2-O 3.4Å; D237-H244 IonicContact OD1-NE2 3.95Å; D237-H244 IonicContact OD2-CD2 3.47Å; D237-H244 IonicContact OD2-CE1 3Å; D237-H244 IonicContact OD2-NE2 3.8Å; D237-H244 PolarHBondContact OD2-NE2 3.2Å; D240-H244 PolarHBondContact O-CD2 3.12Å; D240-H244 VanDerWaalsContact O-CD2 3.27Å; D240-H244 PolarHBondContact O-N 3.3Å; D240-H244 VanDerWaalsContact O-N 3.15Å; V241-H244 PolarHBondContact O-N 3.05Å; H244-M246 PolarHBondContact O-N 3.49Å; H244-M246 VanDerWaalsContact O-N 3.15Å; H244-Q247 PolarHBondContact ND1-NE2 2.93Å; H244-Q247 WeakPolarHBondContact O-CB 3.43Å; H244-Q247 PolarHBondContact O-N 2.89Å
245	L	97.2	Very high	96	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-25.3	178.1	-69.6	173.6	0	0	0	112.9	I163 W164 W167 Y210 H214 A217 A221 V241 V242 S243	I163-L245 HydrophobicContact CG2-CD1 4.42Å; I163-L245 HydrophobicContact CG2-CD2 4.43Å; W164-L245 HydrophobicContact CE3-CD2 4.24Å; W164-L245 HydrophobicContact CZ3-CD2 4.06Å; W167-L245 HydrophobicContact CZ3-CD2 4.25Å; Y210-L245 VanDerWaalsContact OH-C 3.3Å; Y210-L245 WeakPolarHBondContact OH-CA 3.29Å; Y210-L245 PolarHBondContact OH-O 3.45Å; H214-L245 PolarHBondContact CE1-O 3.13Å; H214-L245 PolarHBondContact ND1-O 3.16Å; A217-L245 HydrophobicContact CB-CD1 4.23Å; A217-L245 HydrophobicContact CB-CD2 4.32Å; A221-L245 HydrophobicContact CB-CD1 3.84Å; V241-L245 HydrophobicContact CG2-CD1 4.32Å; V241-L245 HydrophobicContact CG2-CG 4.46Å; V241-L245 WeakPolarHBondContact O-CG 3.44Å; V241-L245 PolarHBondContact O-N 3.34Å; V242-L245 PolarHBondContact O-N 2.85Å; S243-L245 PolarHBondContact O-N 2.67Å
246	M	96.3	Very high	96.1	Very high	43 Å²	43	38.9 Å²	38.9	21%	0.212	20%	0.201	C	C	.	.	H	α-helix	trans	-82.2	-21.6	177.6	-168.3	55	63.2	0	0	113.3	L15 H214 V242 S243 H244 V249 Q250	L15-M246 HydrophobicContact CD1-SD 4.13Å; H214-M246 VanDerWaalsContact NE2-CE 3.25Å; H214-M246 WeakPolarHBondContact NE2-CE 3.22Å; V242-M246 PolarHBondContact O-N 3.38Å; S243-M246 PolarHBondContact O-N 3.07Å; S243-M246 VanDerWaalsContact O-N 3.16Å; H244-M246 PolarHBondContact O-N 3.49Å; H244-M246 VanDerWaalsContact O-N 3.15Å; M246-V249 PolarHBondContact O-N 3.21Å; M246-V249 VanDerWaalsContact O-N 3.16Å; M246-V249 HydrophobicContact SD-CB 3.97Å; M246-V249 HydrophobicContact SD-CG1 4.24Å; M246-V249 HydrophobicContact SD-CG2 4.39Å; M246-Q250 HydrophobicContact CG-CG 3.96Å; M246-Q250 WeakPolarHBondContact O-CG 3.43Å; M246-Q250 PolarHBondContact O-N 3.42Å
247	Q	96.7	Very high	96.2	Very high	8 Å²	8	39.5 Å²	39.5	4%	0.037	19%	0.19	C	C	.	.	H	α-helix	trans	-57.7	-42.1	-172.8	-69.5	170.8	15.2	0	0	114.3	Y105 R108 E239 S243 H244 Q250 R251	Y105-Q247 HydrophobicContact CE2-CB 4.09Å; R108-Q247 VanDerWaalsContact CD-NE2 3.32Å; E239-Q247 PolarHBondContact OE2-NE2 3.26Å; S243-Q247 WeakPolarHBondContact O-CG 3.5Å; S243-Q247 PolarHBondContact O-N 3.27Å; H244-Q247 PolarHBondContact ND1-NE2 2.93Å; H244-Q247 WeakPolarHBondContact O-CB 3.43Å; H244-Q247 PolarHBondContact O-N 2.89Å; Q247-Q250 PolarHBondContact O-N 2.93Å; Q247-R251 WeakPolarHBondContact O-CB 3.48Å; Q247-R251 PolarHBondContact O-N 2.89Å
248	P	97.9	Very high	96.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63	-45	176.7	-24.3	36.3	0	0	0	112.1	Y105 L109 W167 L170 Y207 Y210 Q250 R251 I252	Y105-P248 VanDerWaalsContact OH-CA 3.31Å; Y105-P248 WeakPolarHBondContact OH-CA 3.34Å; Y105-P248 WeakPolarHBondContact OH-CB 3.33Å; Y105-P248 WeakPolarHBondContact OH-CG 3.4Å; L109-P248 HydrophobicContact CD2-CG 4.39Å; W167-P248 HydrophobicContact CH2-CG 4.49Å; W167-P248 HydrophobicContact CZ3-CG 4.18Å; L170-P248 HydrophobicContact CD1-CB 4.02Å; L170-P248 HydrophobicContact CD1-CG 3.98Å; Y207-P248 HydrophobicContact CE1-CB 3.93Å; Y207-P248 WeakPolarHBondContact CE1-O 3.45Å; Y210-P248 HydrophobicContact CD1-CB 3.76Å; Y210-P248 HydrophobicContact CD1-CG 4.23Å; Y210-P248 HydrophobicContact CE1-CB 3.59Å; Y210-P248 HydrophobicContact CE1-CG 3.66Å; Y210-P248 HydrophobicContact CE2-CG 4.13Å; Y210-P248 HydrophobicContact CG-CB 4.36Å; P248-Q250 PolarHBondContact O-N 2.93Å; P248-R251 PolarHBondContact O-N 3.26Å; P248-I252 PolarHBondContact O-N 2.93Å; P248-I252 VanDerWaalsContact O-N 3.11Å
249	V	96.7	Very high	96.5	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	15%	0.145	C	C	.	.	H	α-helix	trans	-56.4	-42.1	176.2	-177.7	0	0	0	0	110.4	L15 Y210 M246 I252 M253 L295	L15-V249 HydrophobicContact CD1-CG1 4.13Å; Y210-V249 HydrophobicContact CD1-CG2 4.44Å; Y210-V249 HydrophobicContact CE1-CG2 4.17Å; M246-V249 PolarHBondContact O-N 3.21Å; M246-V249 VanDerWaalsContact O-N 3.16Å; M246-V249 HydrophobicContact SD-CB 3.97Å; M246-V249 HydrophobicContact SD-CG1 4.24Å; M246-V249 HydrophobicContact SD-CG2 4.39Å; V249-I252 WeakPolarHBondContact O-CG2 3.3Å; V249-M253 WeakPolarHBondContact O-CG 3.26Å; V249-L295 HydrophobicContact CG1-CD1 3.97Å
250	Q	96.6	Very high	96.7	Very high	49 Å²	49	26.5 Å²	26.5	23%	0.229	14%	0.136	C	C	.	.	H	α-helix	trans	-68.6	-38.6	175.4	-67.1	175	-0.1	0	0	113.2	M18 M246 Q247 P248 M253 R254	M18-Q250 HydrophobicContact SD-CG 4.41Å; M246-Q250 HydrophobicContact CG-CG 3.96Å; M246-Q250 WeakPolarHBondContact O-CG 3.43Å; M246-Q250 PolarHBondContact O-N 3.42Å; Q247-Q250 PolarHBondContact O-N 2.93Å; P248-Q250 PolarHBondContact O-N 2.93Å; Q250-M253 PolarHBondContact O-N 3.03Å; Q250-R254 VanDerWaalsContact O-CG 3.25Å; Q250-R254 WeakPolarHBondContact O-CG 3.38Å; Q250-R254 PolarHBondContact O-N 3.28Å
251	R	98.1	Very high	96.8	Very high	19 Å²	19	26.6 Å²	26.6	7%	0.072	13%	0.134	C	C	.	.	H	α-helix	trans	-64.6	-48.3	-175.8	-177.7	62.8	178.8	166.2	1	111	S101 E102 Y105 Q247 P248 M253 R254 Y255	S101-R251 PolarHBondContact OG-NH1 3.44Å; S101-R251 PolarHBondContact OG-NH2 3.34Å; E102-R251 VanDerWaalsContact CA-NH2 3.26Å; E102-R251 VanDerWaalsContact N-NH2 3.2Å; E102-R251 IonicContact OE2-CZ 2.77Å; E102-R251 VanDerWaalsContact OE2-CZ 3.26Å; E102-R251 IonicContact OE2-NE 2.76Å; E102-R251 PolarHBondContact OE2-NE 3.31Å; E102-R251 VanDerWaalsContact OE2-NE 3.12Å; E102-R251 IonicContact OE2-NH2 3.12Å; E102-R251 PolarHBondContact OE2-NH2 3.38Å; Y105-R251 HydrophobicContact CD1-CB 4.39Å; Y105-R251 HydrophobicContact CD1-CG 3.7Å; Y105-R251 HydrophobicContact CD2-CB 4.16Å; Y105-R251 HydrophobicContact CD2-CG 4.25Å; Y105-R251 HydrophobicContact CE1-CB 4.09Å; Y105-R251 HydrophobicContact CE1-CG 3.66Å; Y105-R251 HydrophobicContact CE2-CB 3.85Å; Y105-R251 HydrophobicContact CE2-CG 4.23Å; Y105-R251 HydrophobicContact CG-CB 4.41Å; Y105-R251 HydrophobicContact CG-CG 3.98Å; Q247-R251 WeakPolarHBondContact O-CB 3.48Å; Q247-R251 PolarHBondContact O-N 2.89Å; P248-R251 PolarHBondContact O-N 3.26Å; R251-M253 PolarHBondContact O-N 2.83Å; R251-R254 PolarHBondContact O-N 3.31Å; R251-Y255 HydrophobicContact CG-CE2 3.85Å; R251-Y255 PolarHBondContact NE-OH 3.08Å; R251-Y255 PolarHBondContact O-N 3.19Å
252	I	97.5	Very high	96.9	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-61.7	-35.7	-177.9	-166.6	63.2	0	0	0	111.7	L203 Y207 P248 V249 R254 Y255 I287 P288 T291	L203-I252 HydrophobicContact CD1-CD1 4.14Å; L203-I252 HydrophobicContact CD2-CD1 3.85Å; L203-I252 HydrophobicContact CG-CD1 3.87Å; Y207-I252 HydrophobicContact CD1-CB 3.59Å; Y207-I252 HydrophobicContact CD1-CD1 4.44Å; Y207-I252 HydrophobicContact CD1-CG1 4.07Å; Y207-I252 HydrophobicContact CD1-CG2 3.81Å; Y207-I252 HydrophobicContact CD2-CD1 4.03Å; Y207-I252 HydrophobicContact CD2-CG1 4.48Å; Y207-I252 HydrophobicContact CE1-CB 3.59Å; Y207-I252 HydrophobicContact CE1-CG1 4.4Å; Y207-I252 HydrophobicContact CE1-CG2 4.07Å; Y207-I252 HydrophobicContact CE2-CD1 4.17Å; Y207-I252 HydrophobicContact CG-CB 4.12Å; Y207-I252 HydrophobicContact CG-CD1 4.15Å; Y207-I252 HydrophobicContact CG-CG1 4.1Å; P248-I252 PolarHBondContact O-N 2.93Å; P248-I252 VanDerWaalsContact O-N 3.11Å; V249-I252 WeakPolarHBondContact O-CG2 3.3Å; I252-R254 VanDerWaalsContact C-N 3.28Å; I252-R254 PolarHBondContact O-N 2.86Å; I252-Y255 HydrophobicContact CD1-CD2 4.14Å; I252-Y255 HydrophobicContact CD1-CE2 4.4Å; I252-I287 HydrophobicContact CD1-CB 4.41Å; I252-I287 HydrophobicContact CD1-CG2 3.73Å; I252-I287 HydrophobicContact CG1-CG2 3.79Å; I252-P288 HydrophobicContact CG1-CG 4.5Å; I252-P288 WeakPolarHBondContact O-CG 3.47Å; I252-T291 HydrophobicContact CG2-CG2 4.33Å
253	M	95.7	Very high	96.9	Very high	30 Å²	30	25.3 Å²	25.3	15%	0.148	13%	0.126	C	C	.	.	H	α-helix	trans	-67.2	-24.6	176.3	-69.7	-176.7	156	0	0	114.1	V19 V249 Q250 R251 Q256 P288	V19-M253 HydrophobicContact CG2-CE 3.33Å; V19-M253 HydrophobicContact CG2-SD 3.97Å; V249-M253 WeakPolarHBondContact O-CG 3.26Å; Q250-M253 PolarHBondContact O-N 3.03Å; R251-M253 PolarHBondContact O-N 2.83Å; M253-Q256 WeakPolarHBondContact O-CG 3.22Å; M253-Q256 PolarHBondContact O-NE2 2.95Å; M253-P288 HydrophobicContact CG-CB 4.4Å
254	R	96.4	Very high	96.9	Very high	118 Å²	118	26.9 Å²	26.9	45%	0.445	13%	0.126	S	C	.	.	H	α-helix	trans	-92.5	-21.9	-171.8	-72.8	176.1	-170.4	-168.6	8.7	114.4	Q250 R251 I252 Q256 L257 P258	Q250-R254 VanDerWaalsContact O-CG 3.25Å; Q250-R254 WeakPolarHBondContact O-CG 3.38Å; Q250-R254 PolarHBondContact O-N 3.28Å; R251-R254 PolarHBondContact O-N 3.31Å; I252-R254 VanDerWaalsContact C-N 3.28Å; I252-R254 PolarHBondContact O-N 2.86Å; R254-Q256 PolarHBondContact O-N 3.37Å; R254-Q256 VanDerWaalsContact O-N 3.14Å; R254-L257 HydrophobicContact CG-CD1 4.46Å; R254-L257 WeakPolarHBondContact O-CB 3.33Å; R254-L257 WeakPolarHBondContact O-CG 3.26Å; R254-L257 PolarHBondContact O-N 2.85Å; R254-P258 VanDerWaalsContact O-CD 3.29Å; R254-P258 WeakPolarHBondContact O-CD 3.07Å
255	Y	97.8	Very high	96.8	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-38.8	-176.2	-80.4	-61	0	0	0	113.8	L98 E102 H174 F196 R251 I252 L257 P258 I259 M284	L98-Y255 HydrophobicContact CD1-CD1 4.08Å; L98-Y255 HydrophobicContact CD1-CE1 4.37Å; E102-Y255 PolarHBondContact OE1-OH 3.28Å; E102-Y255 WeakPolarHBondContact OE2-CE1 3.46Å; E102-Y255 PolarHBondContact OE2-OH 3.36Å; H174-Y255 PolarHBondContact CE1-OH 3.05Å; H174-Y255 PolarHBondContact ND1-OH 3.44Å; F196-Y255 AromaticContact CE1-CD1 3.97Å; F196-Y255 HydrophobicContact CE1-CD1 3.97Å; F196-Y255 HydrophobicContact CE1-CE1 4.26Å; F196-Y255 HydrophobicContact CE1-CG 4.38Å; F196-Y255 HydrophobicContact CZ-CD1 4.11Å; F196-Y255 HydrophobicContact CZ-CE1 4.43Å; R251-Y255 HydrophobicContact CG-CE2 3.85Å; R251-Y255 PolarHBondContact NE-OH 3.08Å; R251-Y255 PolarHBondContact O-N 3.19Å; I252-Y255 HydrophobicContact CD1-CD2 4.14Å; I252-Y255 HydrophobicContact CD1-CE2 4.4Å; Y255-L257 PolarHBondContact O-N 3.37Å; Y255-L257 VanDerWaalsContact O-N 3.15Å; Y255-P258 WeakPolarHBondContact O-CD 3.4Å; Y255-I259 VanDerWaalsContact O-CD1 3.24Å; Y255-I259 WeakPolarHBondContact O-CD1 3.19Å; Y255-I259 VanDerWaalsContact O-CG1 3.25Å; Y255-I259 WeakPolarHBondContact O-CG1 3.25Å; Y255-M284 HydrophobicContact CD2-SD 4.31Å; Y255-M284 HydrophobicContact CG-SD 4.14Å
256	Q	96.5	Very high	96.7	Very high	29 Å²	29	28.7 Å²	28.7	14%	0.136	13%	0.133	C	C	.	.	H	α-helix	trans	-60.3	-22.6	178.4	56	170.8	-10.6	0	0	114.4	M253 R254 A260 L281 M284 K285	M253-Q256 WeakPolarHBondContact O-CG 3.22Å; M253-Q256 PolarHBondContact O-NE2 2.95Å; R254-Q256 PolarHBondContact O-N 3.37Å; R254-Q256 VanDerWaalsContact O-N 3.14Å; Q256-A260 WeakPolarHBondContact O-CB 3.45Å; Q256-A260 PolarHBondContact O-N 3.27Å; Q256-L281 HydrophobicContact CB-CD1 4.03Å; Q256-L281 WeakPolarHBondContact O-CD1 3.23Å; Q256-M284 HydrophobicContact CB-CB 4.23Å; Q256-K285 HydrophobicContact CB-CG 4.36Å
257	L	96.8	Very high	96.6	Very high	72 Å²	72	32 Å²	32	38%	0.377	15%	0.148	S	C	.	.	H	α-helix	trans	-70.6	-60.9	-174.9	-57.3	179.4	0	0	0	112.5	R254 Y255 I259 A260 E261	R254-L257 HydrophobicContact CG-CD1 4.46Å; R254-L257 WeakPolarHBondContact O-CB 3.33Å; R254-L257 WeakPolarHBondContact O-CG 3.26Å; R254-L257 PolarHBondContact O-N 2.85Å; Y255-L257 PolarHBondContact O-N 3.37Å; Y255-L257 VanDerWaalsContact O-N 3.15Å; L257-I259 VanDerWaalsContact C-N 3.27Å; L257-I259 PolarHBondContact O-N 2.66Å; L257-A260 PolarHBondContact O-N 3.17Å; L257-E261 PolarHBondContact O-N 2.97Å
258	P	97.2	Very high	96.3	Very high	9 Å²	9	38.2 Å²	38.2	6%	0.058	17%	0.171	C	C	.	.	H	α-helix	trans	-63.2	-35.6	176.6	25.5	-34.8	0	0	0	111.5	L98 R254 Y255 A260 E261 I262	L98-P258 HydrophobicContact CB-CB 4.23Å; L98-P258 HydrophobicContact CB-CG 4.35Å; L98-P258 HydrophobicContact CD1-CG 3.97Å; R254-P258 VanDerWaalsContact O-CD 3.29Å; R254-P258 WeakPolarHBondContact O-CD 3.07Å; Y255-P258 WeakPolarHBondContact O-CD 3.4Å; P258-A260 VanDerWaalsContact C-N 3.31Å; P258-A260 PolarHBondContact O-N 3.43Å; P258-E261 PolarHBondContact O-N 3.42Å; P258-E261 VanDerWaalsContact O-N 3.13Å; P258-I262 VanDerWaalsContact O-CG1 3.26Å; P258-I262 WeakPolarHBondContact O-CG1 3.4Å; P258-I262 PolarHBondContact O-N 2.96Å
259	I	97.7	Very high	96	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-38.7	178.1	-65.7	170.9	0	0	0	111.3	F196 Y255 L257 I262 L263 W277 T280 L281 M284	F196-I259 HydrophobicContact CD2-CD1 4.35Å; F196-I259 HydrophobicContact CE1-CD1 4.26Å; F196-I259 HydrophobicContact CE2-CD1 3.95Å; F196-I259 HydrophobicContact CZ-CD1 3.88Å; Y255-I259 VanDerWaalsContact O-CD1 3.24Å; Y255-I259 WeakPolarHBondContact O-CD1 3.19Å; Y255-I259 VanDerWaalsContact O-CG1 3.25Å; Y255-I259 WeakPolarHBondContact O-CG1 3.25Å; L257-I259 VanDerWaalsContact C-N 3.27Å; L257-I259 PolarHBondContact O-N 2.66Å; I259-I262 PolarHBondContact O-N 3.22Å; I259-L263 WeakPolarHBondContact O-CB 3.35Å; I259-L263 PolarHBondContact O-N 3.01Å; I259-W277 HydrophobicContact CG1-CZ3 4.49Å; I259-W277 HydrophobicContact CG2-CE3 4.16Å; I259-W277 HydrophobicContact CG2-CZ3 4.3Å; I259-T280 HydrophobicContact CD1-CG2 4.1Å; I259-T280 HydrophobicContact CG2-CG2 4.17Å; I259-L281 HydrophobicContact CB-CD1 4.46Å; I259-L281 HydrophobicContact CG2-CB 3.98Å; I259-L281 HydrophobicContact CG2-CD1 4.09Å; I259-M284 HydrophobicContact CD1-CB 4.25Å; I259-M284 HydrophobicContact CD1-CG 3.63Å
260	A	97.3	Very high	95.6	Very high	19 Å²	19	43.6 Å²	43.6	16%	0.157	21%	0.208	C	C	.	.	H	α-helix	trans	-66	-36.5	175	0	0	0	0	0	112.6	Q256 L257 P258 K264 L281	Q256-A260 WeakPolarHBondContact O-CB 3.45Å; Q256-A260 PolarHBondContact O-N 3.27Å; L257-A260 PolarHBondContact O-N 3.17Å; P258-A260 VanDerWaalsContact C-N 3.31Å; P258-A260 PolarHBondContact O-N 3.43Å; A260-K264 PolarHBondContact O-N 3.49Å; A260-L281 HydrophobicContact CB-CD1 4Å; A260-L281 HydrophobicContact CB-CD2 4.18Å
261	E	97.2	Very high	95	Very high	57 Å²	57	42 Å²	42	27%	0.266	20%	0.202	S	C	.	.	H	α-helix	trans	-71.3	-40.8	174.3	-67.2	-52.5	118.8	0	0	111.9	K26 P94 L257 P258 L263 K264 Y265	K26-E261 VanDerWaalsContact CE-OE1 3.32Å; K26-E261 WeakPolarHBondContact CE-OE1 3.24Å; K26-E261 IonicContact NZ-OE1 3.94Å; K26-E261 PolarHBondContact NZ-OE1 3.27Å; P94-E261 HydrophobicContact CB-CB 3.84Å; P94-E261 HydrophobicContact CG-CB 4.17Å; L257-E261 PolarHBondContact O-N 2.97Å; P258-E261 PolarHBondContact O-N 3.42Å; P258-E261 VanDerWaalsContact O-N 3.13Å; E261-L263 VanDerWaalsContact C-N 3.29Å; E261-L263 PolarHBondContact O-N 2.93Å; E261-K264 WeakPolarHBondContact O-CB 3.34Å; E261-K264 PolarHBondContact O-N 3.23Å; E261-K264 IonicContact OE2-NZ 3.3Å; E261-Y265 WeakPolarHBondContact O-CD2 3.38Å; E261-Y265 PolarHBondContact O-N 2.9Å
262	I	97.1	Very high	94.4	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.1	-44.5	173.5	-65.4	160.7	0	0	0	110.2	R91 P94 L95 L98 P258 I259 K264 Y265 T266 W277	R91-I262 HydrophobicContact CG-CG2 4.02Å; P94-I262 HydrophobicContact CB-CG1 3.86Å; P94-I262 HydrophobicContact CG-CG1 3.83Å; L95-I262 HydrophobicContact CD2-CD1 3.71Å; L95-I262 HydrophobicContact CD2-CG1 4.22Å; L95-I262 HydrophobicContact CD2-CG2 4.46Å; L95-I262 HydrophobicContact CG-CD1 4.09Å; L95-I262 HydrophobicContact CG-CG1 4.12Å; L98-I262 HydrophobicContact CD2-CD1 4.39Å; P258-I262 VanDerWaalsContact O-CG1 3.26Å; P258-I262 WeakPolarHBondContact O-CG1 3.4Å; P258-I262 PolarHBondContact O-N 2.96Å; I259-I262 PolarHBondContact O-N 3.22Å; I262-K264 VanDerWaalsContact C-N 3.34Å; I262-K264 PolarHBondContact O-N 3.05Å; I262-Y265 PolarHBondContact O-N 3.22Å; I262-T266 WeakPolarHBondContact O-CB 3.29Å; I262-T266 PolarHBondContact O-N 2.87Å; I262-T266 PolarHBondContact O-OG1 2.88Å; I262-W277 HydrophobicContact CB-CE3 4.35Å; I262-W277 HydrophobicContact CB-CH2 4.37Å; I262-W277 HydrophobicContact CB-CZ3 4.13Å; I262-W277 HydrophobicContact CD1-CH2 3.93Å; I262-W277 HydrophobicContact CD1-CZ3 3.97Å; I262-W277 HydrophobicContact CG2-CD2 3.86Å; I262-W277 HydrophobicContact CG2-CE3 3.82Å; I262-W277 HydrophobicContact CG2-CH2 3.57Å; I262-W277 HydrophobicContact CG2-CZ2 3.58Å; I262-W277 HydrophobicContact CG2-CZ3 3.69Å
263	L	96.1	Very high	93.9	Very high	21 Å²	21	49.2 Å²	49.2	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-60.5	-42	179.3	178.5	64.9	0	0	0	112.1	I259 E261 Y265 T266 Q267 L274 W277 K278 L281	I259-L263 WeakPolarHBondContact O-CB 3.35Å; I259-L263 PolarHBondContact O-N 3.01Å; E261-L263 VanDerWaalsContact C-N 3.29Å; E261-L263 PolarHBondContact O-N 2.93Å; L263-Y265 VanDerWaalsContact C-N 3.33Å; L263-Y265 PolarHBondContact O-N 3.16Å; L263-T266 PolarHBondContact O-N 3.03Å; L263-Q267 WeakPolarHBondContact O-CB 3.24Å; L263-Q267 PolarHBondContact O-N 3.26Å; L263-L274 HydrophobicContact CD1-CD1 3.52Å; L263-W277 HydrophobicContact CD1-CB 3.67Å; L263-K278 HydrophobicContact CD1-CG 3.77Å; L263-K278 HydrophobicContact CD2-CG 4.14Å; L263-L281 HydrophobicContact CD2-CB 4.46Å; L263-L281 HydrophobicContact CD2-CD2 3.54Å
264	K	95.5	Very high	93.8	Very high	84 Å²	84	49.3 Å²	49.3	37%	0.365	25%	0.25	S	C	.	.	H	α-helix	trans	-57.6	-44.1	177.5	172.9	-175	170	-169.3	0	112.1	A260 E261 I262 R268	A260-K264 PolarHBondContact O-N 3.49Å; E261-K264 WeakPolarHBondContact O-CB 3.34Å; E261-K264 PolarHBondContact O-N 3.23Å; E261-K264 IonicContact OE2-NZ 3.3Å; I262-K264 VanDerWaalsContact C-N 3.34Å; I262-K264 PolarHBondContact O-N 3.05Å; K264-R268 WeakPolarHBondContact O-CG 3.42Å; K264-R268 PolarHBondContact O-N 3.28Å
265	Y	95.2	Very high	93.7	Very high	42 Å²	42	49.9 Å²	49.9	17%	0.165	26%	0.261	C	S	.	.	H	α-helix	trans	-77.6	-34.2	178.2	-63.4	-63.4	0	0	0	112.8	Q90 P94 E261 I262 L263 Q267 R268 A269	Q90-Y265 HydrophobicContact CB-CD1 3.5Å; Q90-Y265 VanDerWaalsContact CB-CD1 3.5Å; Q90-Y265 HydrophobicContact CB-CD2 4.46Å; Q90-Y265 HydrophobicContact CB-CE1 3.46Å; Q90-Y265 VanDerWaalsContact CB-CE1 3.46Å; Q90-Y265 HydrophobicContact CB-CE2 4.42Å; Q90-Y265 HydrophobicContact CB-CG 4.03Å; Q90-Y265 HydrophobicContact CG-CE1 4.17Å; P94-Y265 HydrophobicContact CG-CD2 4.21Å; P94-Y265 HydrophobicContact CG-CE2 4.39Å; E261-Y265 WeakPolarHBondContact O-CD2 3.38Å; E261-Y265 PolarHBondContact O-N 2.9Å; I262-Y265 PolarHBondContact O-N 3.22Å; L263-Y265 VanDerWaalsContact C-N 3.33Å; L263-Y265 PolarHBondContact O-N 3.16Å; Y265-Q267 VanDerWaalsContact C-N 3.28Å; Y265-Q267 PolarHBondContact O-N 2.85Å; Y265-R268 PolarHBondContact O-N 3.28Å; Y265-A269 WeakPolarHBondContact O-CB 3.29Å; Y265-A269 PolarHBondContact O-N 2.75Å
266	T	94	Very high	93.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-38.2	173.2	-56.9	0	0	0	0	111.5	R91 I262 L263 A269 C270 S271 L274 W277	R91-T266 VanDerWaalsContact CD-OG1 3.29Å; R91-T266 WeakPolarHBondContact CD-OG1 3.37Å; I262-T266 WeakPolarHBondContact O-CB 3.29Å; I262-T266 PolarHBondContact O-N 2.87Å; I262-T266 PolarHBondContact O-OG1 2.88Å; L263-T266 PolarHBondContact O-N 3.03Å; T266-A269 PolarHBondContact O-N 2.87Å; T266-C270 PolarHBondContact O-N 3.47Å; T266-S271 PolarHBondContact O-N 2.79Å; T266-L274 HydrophobicContact CG2-CD1 4.28Å; T266-W277 HydrophobicContact CG2-CG 4.34Å
267	Q	93.8	Very high	93.6	Very high	113 Å²	113	51 Å²	51	53%	0.528	27%	0.267	S	S	.	.	H	α-helix	trans	-67	-39.3	175.3	-174.2	173.5	-6.1	0	0	112.4	L263 Y265 A269 C270 L274	L263-Q267 WeakPolarHBondContact O-CB 3.24Å; L263-Q267 PolarHBondContact O-N 3.26Å; Y265-Q267 VanDerWaalsContact C-N 3.28Å; Y265-Q267 PolarHBondContact O-N 2.85Å; Q267-A269 VanDerWaalsContact C-N 3.33Å; Q267-C270 PolarHBondContact O-N 3.13Å; Q267-L274 HydrophobicContact CB-CD1 3.83Å; Q267-L274 HydrophobicContact CG-CD1 4.41Å; Q267-L274 HydrophobicContact CG-CD2 4.34Å
268	R	92.1	Very high	93.6	Very high	137 Å²	137	51.6 Å²	51.6	52%	0.517	27%	0.267	S	S	.	.	H	α-helix	trans	-68.6	-32.3	175.8	-70.8	176.7	-177	-174.5	-4.7	112.9	A87 K264 Y265 C270	A87-R268 HydrophobicContact CB-CB 3.69Å; K264-R268 WeakPolarHBondContact O-CG 3.42Å; K264-R268 PolarHBondContact O-N 3.28Å; Y265-R268 PolarHBondContact O-N 3.28Å; R268-C270 PolarHBondContact O-N 3.06Å
269	A	91.2	Very high	93.6	Very high	8 Å²	8	54.7 Å²	54.7	7%	0.066	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-0.7	175.9	0	0	0	0	0	113.4	V84 A87 L88 Y265 T266 Q267 S271	V84-A269 HydrophobicContact CG1-CB 4.23Å; A87-A269 HydrophobicContact CB-CB 3.97Å; L88-A269 HydrophobicContact CD2-CB 3.72Å; L88-A269 HydrophobicContact CG-CB 3.9Å; Y265-A269 WeakPolarHBondContact O-CB 3.29Å; Y265-A269 PolarHBondContact O-N 2.75Å; T266-A269 PolarHBondContact O-N 2.87Å; Q267-A269 VanDerWaalsContact C-N 3.33Å; A269-S271 PolarHBondContact O-N 3.43Å; A269-S271 VanDerWaalsContact O-N 3.08Å
270	C	87	Confident	93.7	Very high	106 Å²	106	54.7 Å²	54.7	72%	0.716	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	35	-175.7	-64.5	0	0	0	0	113.6	T266 Q267 R268	T266-C270 PolarHBondContact O-N 3.47Å; Q267-C270 PolarHBondContact O-N 3.13Å; R268-C270 PolarHBondContact O-N 3.06Å
271	S	84.7	Confident	93.7	Very high	16 Å²	16	54.6 Å²	54.6	11%	0.112	28%	0.276	C	S	.	.			trans	-65.9	140.8	-176.1	159.7	0	0	0	0	111.7	T266 A269 D273 L274	T266-S271 PolarHBondContact O-N 2.79Å; A269-S271 PolarHBondContact O-N 3.43Å; A269-S271 VanDerWaalsContact O-N 3.08Å; S271-D273 PolarHBondContact O-N 3.16Å; S271-D273 PolarHBondContact OG-N 3.14Å; S271-L274 WeakPolarHBondContact O-CB 3.37Å; S271-L274 PolarHBondContact O-N 3.22Å
272	P	85.2	Confident	93.7	Very high	117 Å²	117	58.1 Å²	58.1	76%	0.76	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.8	178.3	25.5	-34.6	0	0	0	113	L274	P272-L274 PolarHBondContact O-N 3.04Å
273	D	88.2	Confident	93.7	Very high	55 Å²	55	58.4 Å²	58.4	29%	0.294	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	9.6	-177.2	-61	-63.9	0	0	0	113.8	D190 S271 L275 L276 W277	D190-D273 HydrophobicContact CB-CB 4.24Å; D190-D273 WeakPolarHBondContact CB-OD2 3.4Å; S271-D273 PolarHBondContact O-N 3.16Å; S271-D273 PolarHBondContact OG-N 3.14Å; D273-L275 PolarHBondContact O-N 3.45Å; D273-L276 WeakPolarHBondContact O-CB 3.43Å; D273-L276 PolarHBondContact O-N 3Å; D273-W277 PolarHBondContact O-N 2.92Å; D273-W277 VanDerWaalsContact O-N 3.1Å
274	L	92.5	Very high	93.8	Very high	32 Å²	32	57.4 Å²	57.4	17%	0.168	29%	0.289	C	S	.	.	H	α-helix	trans	-53.1	-39.7	179	-179.3	64.2	0	0	0	112.6	L263 T266 Q267 S271 P272 L276 W277 K278	L263-L274 HydrophobicContact CD1-CD1 3.52Å; T266-L274 HydrophobicContact CG2-CD1 4.28Å; Q267-L274 HydrophobicContact CB-CD1 3.83Å; Q267-L274 HydrophobicContact CG-CD1 4.41Å; Q267-L274 HydrophobicContact CG-CD2 4.34Å; S271-L274 WeakPolarHBondContact O-CB 3.37Å; S271-L274 PolarHBondContact O-N 3.22Å; P272-L274 PolarHBondContact O-N 3.04Å; L274-L276 VanDerWaalsContact C-N 3.31Å; L274-L276 PolarHBondContact O-N 3.46Å; L274-W277 PolarHBondContact O-N 3.16Å; L274-K278 HydrophobicContact CG-CD 4.44Å; L274-K278 WeakPolarHBondContact O-CG 3.39Å; L274-K278 PolarHBondContact O-N 3.46Å
275	L	94.5	Very high	93.9	Very high	131 Å²	131	58 Å²	58	69%	0.686	29%	0.292	S	S	*	.	H	α-helix	trans	-65.6	-35.1	178.8	-66.9	178.7	0	0	0	112.1	D273 K278 K279	D273-L275 PolarHBondContact O-N 3.45Å; L275-K278 PolarHBondContact O-N 3.03Å; L275-K279 WeakPolarHBondContact O-CB 3.36Å; L275-K279 PolarHBondContact O-N 2.96Å
276	L	96	Very high	93.9	Very high	51 Å²	51	59.1 Å²	59.1	27%	0.267	30%	0.298	S	S	.	.	H	α-helix	trans	-72.2	-40.7	179.6	-157.9	67.9	0	0	0	111	P193 K194 I197 D273 L274 K279 T280	P193-L276 HydrophobicContact CB-CB 3.95Å; P193-L276 HydrophobicContact CB-CD2 3.62Å; P193-L276 HydrophobicContact CB-CG 3.45Å; P193-L276 VanDerWaalsContact CB-CG 3.45Å; P193-L276 HydrophobicContact CG-CD2 4.38Å; P193-L276 HydrophobicContact CG-CG 4.44Å; K194-L276 HydrophobicContact CB-CD2 4.27Å; I197-L276 HydrophobicContact CD1-CD1 3.24Å; I197-L276 HydrophobicContact CD1-CG 3.69Å; D273-L276 WeakPolarHBondContact O-CB 3.43Å; D273-L276 PolarHBondContact O-N 3Å; L274-L276 VanDerWaalsContact C-N 3.31Å; L274-L276 PolarHBondContact O-N 3.46Å; L276-K279 PolarHBondContact O-N 3.45Å; L276-T280 WeakPolarHBondContact O-CB 3.35Å; L276-T280 PolarHBondContact O-N 3.37Å; L276-T280 PolarHBondContact O-OG1 3.4Å
277	W	96.8	Very high	94	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-42.6	171.6	-79.5	104.3	0	0	0	112.5	L95 I192 P193 I259 I262 L263 T266 D273 L274 T280 L281	L95-W277 HydrophobicContact CD2-CH2 4.22Å; L95-W277 HydrophobicContact CD2-CZ2 4.43Å; I192-W277 HydrophobicContact CB-CH2 3.95Å; I192-W277 HydrophobicContact CB-CZ2 4.2Å; I192-W277 HydrophobicContact CG2-CH2 3.78Å; I192-W277 HydrophobicContact CG2-CZ3 4.48Å; P193-W277 HydrophobicContact CB-CD2 4.46Å; P193-W277 HydrophobicContact CG-CD2 3.33Å; P193-W277 HydrophobicContact CG-CE3 3.8Å; P193-W277 HydrophobicContact CG-CG 3.67Å; P193-W277 HydrophobicContact CG-CH2 3.96Å; P193-W277 HydrophobicContact CG-CZ2 3.53Å; P193-W277 HydrophobicContact CG-CZ3 4.09Å; I259-W277 HydrophobicContact CG1-CZ3 4.49Å; I259-W277 HydrophobicContact CG2-CE3 4.16Å; I259-W277 HydrophobicContact CG2-CZ3 4.3Å; I262-W277 HydrophobicContact CB-CE3 4.35Å; I262-W277 HydrophobicContact CB-CH2 4.37Å; I262-W277 HydrophobicContact CB-CZ3 4.13Å; I262-W277 HydrophobicContact CD1-CH2 3.93Å; I262-W277 HydrophobicContact CD1-CZ3 3.97Å; I262-W277 HydrophobicContact CG2-CD2 3.86Å; I262-W277 HydrophobicContact CG2-CE3 3.82Å; I262-W277 HydrophobicContact CG2-CH2 3.57Å; I262-W277 HydrophobicContact CG2-CZ2 3.58Å; I262-W277 HydrophobicContact CG2-CZ3 3.69Å; L263-W277 HydrophobicContact CD1-CB 3.67Å; T266-W277 HydrophobicContact CG2-CG 4.34Å; D273-W277 PolarHBondContact O-N 2.92Å; D273-W277 VanDerWaalsContact O-N 3.1Å; L274-W277 PolarHBondContact O-N 3.16Å; W277-T280 WeakPolarHBondContact O-CB 3.28Å; W277-T280 PolarHBondContact O-N 2.87Å; W277-L281 PolarHBondContact O-N 3.45Å
278	K	97.1	Very high	94	Very high	85 Å²	85	54.3 Å²	54.3	37%	0.37	28%	0.277	S	S	.	.	H	α-helix	trans	-58.3	-50	174.8	-77.3	179.1	179.3	176.6	0	111.3	L263 L274 L275 T280 L281 E282	L263-K278 HydrophobicContact CD1-CG 3.77Å; L263-K278 HydrophobicContact CD2-CG 4.14Å; L274-K278 HydrophobicContact CG-CD 4.44Å; L274-K278 WeakPolarHBondContact O-CG 3.39Å; L274-K278 PolarHBondContact O-N 3.46Å; L275-K278 PolarHBondContact O-N 3.03Å; K278-T280 VanDerWaalsContact C-N 3.31Å; K278-T280 PolarHBondContact O-N 3.42Å; K278-L281 PolarHBondContact O-N 2.83Å; K278-E282 WeakPolarHBondContact O-CG 3.48Å; K278-E282 PolarHBondContact O-N 2.93Å
279	K	97.4	Very high	94.1	Very high	74 Å²	74	52.2 Å²	52.2	32%	0.322	27%	0.272	S	S	.	.	H	α-helix	trans	-59.9	-40.2	176.4	-177.7	175.3	177.3	-177.1	0	112.2	I197 L275 L276 E282 I283	I197-K279 HydrophobicContact CD1-CB 4.31Å; I197-K279 HydrophobicContact CD1-CD 3.93Å; I197-K279 HydrophobicContact CD1-CG 4.1Å; I197-K279 HydrophobicContact CG1-CD 4.38Å; I197-K279 HydrophobicContact CG1-CG 4.31Å; L275-K279 WeakPolarHBondContact O-CB 3.36Å; L275-K279 PolarHBondContact O-N 2.96Å; L276-K279 PolarHBondContact O-N 3.45Å; K279-E282 WeakPolarHBondContact O-CB 3.32Å; K279-E282 PolarHBondContact O-N 2.63Å; K279-I283 HydrophobicContact CG-CD1 4.24Å; K279-I283 WeakPolarHBondContact O-CG1 3.29Å; K279-I283 PolarHBondContact O-N 3.17Å; K279-I283 VanDerWaalsContact O-N 3.08Å
280	T	97.9	Very high	94.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.4	-44.1	176.7	-61.7	0	0	0	0	111.6	P193 F196 I259 L276 W277 K278 E282 I283 M284	P193-T280 VanDerWaalsContact CA-OG1 3.32Å; P193-T280 WeakPolarHBondContact CA-OG1 3.49Å; P193-T280 VanDerWaalsContact CB-OG1 3.3Å; P193-T280 WeakPolarHBondContact CB-OG1 3.44Å; P193-T280 PolarHBondContact O-OG1 2.96Å; F196-T280 HydrophobicContact CB-CG2 3.56Å; F196-T280 HydrophobicContact CD2-CG2 3.82Å; F196-T280 HydrophobicContact CG-CG2 3.83Å; I259-T280 HydrophobicContact CD1-CG2 4.1Å; I259-T280 HydrophobicContact CG2-CG2 4.17Å; L276-T280 WeakPolarHBondContact O-CB 3.35Å; L276-T280 PolarHBondContact O-N 3.37Å; L276-T280 PolarHBondContact O-OG1 3.4Å; W277-T280 WeakPolarHBondContact O-CB 3.28Å; W277-T280 PolarHBondContact O-N 2.87Å; K278-T280 VanDerWaalsContact C-N 3.31Å; K278-T280 PolarHBondContact O-N 3.42Å; T280-E282 VanDerWaalsContact C-N 3.33Å; T280-E282 PolarHBondContact O-N 3.46Å; T280-I283 PolarHBondContact O-N 3.29Å; T280-M284 HydrophobicContact CG2-CG 4.48Å; T280-M284 WeakPolarHBondContact O-CG 3.4Å; T280-M284 PolarHBondContact O-N 3.04Å
281	L	98	Very high	94.5	Very high	18 Å²	18	48.3 Å²	48.3	9%	0.094	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-38.4	176.4	-177.7	59.9	0	0	0	112.2	Q256 I259 A260 L263 W277 K278 M284 K285	Q256-L281 HydrophobicContact CB-CD1 4.03Å; Q256-L281 WeakPolarHBondContact O-CD1 3.23Å; I259-L281 HydrophobicContact CB-CD1 4.46Å; I259-L281 HydrophobicContact CG2-CB 3.98Å; I259-L281 HydrophobicContact CG2-CD1 4.09Å; A260-L281 HydrophobicContact CB-CD1 4Å; A260-L281 HydrophobicContact CB-CD2 4.18Å; L263-L281 HydrophobicContact CD2-CB 4.46Å; L263-L281 HydrophobicContact CD2-CD2 3.54Å; W277-L281 PolarHBondContact O-N 3.45Å; K278-L281 PolarHBondContact O-N 2.83Å; L281-M284 PolarHBondContact O-N 2.94Å; L281-K285 HydrophobicContact CD1-CD 4.48Å; L281-K285 HydrophobicContact CG-CD 4.29Å; L281-K285 WeakPolarHBondContact O-CB 3.22Å; L281-K285 WeakPolarHBondContact O-CG 3.26Å; L281-K285 PolarHBondContact O-N 3.1Å
282	E	97.8	Very high	95	Very high	131 Å²	131	49.3 Å²	49.3	61%	0.612	25%	0.246	S	C	*	.	H	α-helix	trans	-60	-47.1	174.5	-71.6	173.1	174.9	0	0	111.4	K278 K279 T280 M284 K285 E286	K278-E282 WeakPolarHBondContact O-CG 3.48Å; K278-E282 PolarHBondContact O-N 2.93Å; K279-E282 WeakPolarHBondContact O-CB 3.32Å; K279-E282 PolarHBondContact O-N 2.63Å; T280-E282 VanDerWaalsContact C-N 3.33Å; T280-E282 PolarHBondContact O-N 3.46Å; E282-M284 PolarHBondContact O-N 3.31Å; E282-K285 WeakPolarHBondContact O-CB 3.16Å; E282-K285 PolarHBondContact O-N 3.48Å; E282-E286 WeakPolarHBondContact O-CB 3.29Å; E282-E286 PolarHBondContact O-N 3.31Å
283	I	97.4	Very high	95.4	Very high	5 Å²	5	45.3 Å²	45.3	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-62.9	-44	178	-64.6	166.7	0	0	0	111.1	I197 R200 K279 T280 K285 E286 I287	I197-I283 HydrophobicContact CB-CD1 4.3Å; I197-I283 HydrophobicContact CG1-CD1 3.74Å; I197-I283 HydrophobicContact CG2-CD1 4.47Å; R200-I283 HydrophobicContact CB-CG2 3.95Å; R200-I283 HydrophobicContact CG-CG2 3.6Å; K279-I283 HydrophobicContact CG-CD1 4.24Å; K279-I283 WeakPolarHBondContact O-CG1 3.29Å; K279-I283 PolarHBondContact O-N 3.17Å; K279-I283 VanDerWaalsContact O-N 3.08Å; T280-I283 PolarHBondContact O-N 3.29Å; I283-K285 PolarHBondContact O-N 3.36Å; I283-E286 PolarHBondContact O-N 3.31Å; I283-E286 VanDerWaalsContact O-N 3.08Å; I283-I287 HydrophobicContact CG2-CD1 3.76Å; I283-I287 HydrophobicContact CG2-CG1 4.23Å; I283-I287 WeakPolarHBondContact O-CG1 3.11Å; I283-I287 PolarHBondContact O-N 2.8Å
284	M	97.5	Very high	95.8	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-72.4	-11.3	-179.9	-65.3	-66	132.1	0	0	113.4	F196 L203 Y255 Q256 I259 T280 L281 E282 I287 P288	F196-M284 HydrophobicContact CB-CE 4.06Å; F196-M284 HydrophobicContact CD1-CE 3.33Å; F196-M284 HydrophobicContact CD1-CG 4.4Å; F196-M284 HydrophobicContact CD1-SD 3.81Å; F196-M284 HydrophobicContact CE1-CE 4.1Å; F196-M284 HydrophobicContact CE1-SD 3.99Å; F196-M284 HydrophobicContact CG-CE 4.07Å; L203-M284 HydrophobicContact CD2-CE 3.59Å; L203-M284 HydrophobicContact CD2-SD 4.09Å; Y255-M284 HydrophobicContact CD2-SD 4.31Å; Y255-M284 HydrophobicContact CG-SD 4.14Å; Q256-M284 HydrophobicContact CB-CB 4.23Å; I259-M284 HydrophobicContact CD1-CB 4.25Å; I259-M284 HydrophobicContact CD1-CG 3.63Å; T280-M284 HydrophobicContact CG2-CG 4.48Å; T280-M284 WeakPolarHBondContact O-CG 3.4Å; T280-M284 PolarHBondContact O-N 3.04Å; L281-M284 PolarHBondContact O-N 2.94Å; E282-M284 PolarHBondContact O-N 3.31Å; M284-I287 HydrophobicContact CE-CD1 4.15Å; M284-P288 WeakPolarHBondContact O-CD 3.37Å; M284-P288 VanDerWaalsContact O-CG 3.26Å; M284-P288 WeakPolarHBondContact O-CG 3.32Å
285	K	96.8	Very high	95.8	Very high	97 Å²	97	42.2 Å²	42.2	42%	0.422	20%	0.201	S	C	.	.	H	α-helix	trans	-89	-30.3	166.7	-81	173.3	174.8	-171.8	0	112.9	Q256 L281 E282 I283 K289	Q256-K285 HydrophobicContact CB-CG 4.36Å; L281-K285 HydrophobicContact CD1-CD 4.48Å; L281-K285 HydrophobicContact CG-CD 4.29Å; L281-K285 WeakPolarHBondContact O-CB 3.22Å; L281-K285 WeakPolarHBondContact O-CG 3.26Å; L281-K285 PolarHBondContact O-N 3.1Å; E282-K285 WeakPolarHBondContact O-CB 3.16Å; E282-K285 PolarHBondContact O-N 3.48Å; I283-K285 PolarHBondContact O-N 3.36Å; K285-K289 WeakPolarHBondContact O-CG 3.37Å
286	E	95.4	Very high	95.7	Very high	65 Å²	65	37.3 Å²	37.3	30%	0.304	18%	0.175	S	C	.	.	H	α-helix	trans	-75.7	-50.9	-178.4	-171.7	-169.8	161.1	0	0	111.8	R200 R204 E282 I283 K289 D290	R200-E286 IonicContact CZ-OE1 3.24Å; R200-E286 IonicContact CZ-OE2 3.89Å; R200-E286 VanDerWaalsContact CZ-OE2 3.32Å; R200-E286 IonicContact NE-OE2 2.74Å; R200-E286 IonicContact NH2-OE1 3.64Å; R200-E286 PolarHBondContact NH2-OE1 3.49Å; R200-E286 IonicContact NH2-OE2 2.71Å; R200-E286 PolarHBondContact NH2-OE2 3.38Å; R204-E286 IonicContact CZ-OE1 3.64Å; R204-E286 IonicContact NH1-OE1 3.91Å; R204-E286 IonicContact NH2-OE1 3.01Å; R204-E286 PolarHBondContact NH2-OE1 2.98Å; R204-E286 IonicContact NH2-OE2 3.58Å; E282-E286 WeakPolarHBondContact O-CB 3.29Å; E282-E286 PolarHBondContact O-N 3.31Å; I283-E286 PolarHBondContact O-N 3.31Å; I283-E286 VanDerWaalsContact O-N 3.08Å; E286-K289 WeakPolarHBondContact O-CA 3.31Å; E286-K289 WeakPolarHBondContact O-CB 3.29Å; E286-K289 PolarHBondContact O-N 3.34Å; E286-D290 PolarHBondContact O-N 2.94Å; E286-D290 VanDerWaalsContact O-N 3.08Å
287	I	96	Very high	95.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.9	-41.2	-175.1	-60.1	170	0	0	0	112.8	R200 L203 R204 I252 I283 M284 K289 D290 T291	R200-I287 HydrophobicContact CG-CD1 4.44Å; L203-I287 HydrophobicContact CB-CD1 4.3Å; L203-I287 HydrophobicContact CD2-CD1 3.75Å; L203-I287 HydrophobicContact CG-CD1 4.16Å; R204-I287 HydrophobicContact CB-CG1 4.49Å; R204-I287 HydrophobicContact CB-CG2 4.48Å; I252-I287 HydrophobicContact CD1-CB 4.41Å; I252-I287 HydrophobicContact CD1-CG2 3.73Å; I252-I287 HydrophobicContact CG1-CG2 3.79Å; I283-I287 HydrophobicContact CG2-CD1 3.76Å; I283-I287 HydrophobicContact CG2-CG1 4.23Å; I283-I287 WeakPolarHBondContact O-CG1 3.11Å; I283-I287 PolarHBondContact O-N 2.8Å; M284-I287 HydrophobicContact CE-CD1 4.15Å; I287-K289 VanDerWaalsContact C-N 3.3Å; I287-K289 PolarHBondContact O-N 3.5Å; I287-D290 PolarHBondContact O-N 3.06Å; I287-T291 WeakPolarHBondContact O-CB 3.48Å; I287-T291 PolarHBondContact O-N 2.88Å; I287-T291 PolarHBondContact O-OG1 3.24Å
288	P	95	Very high	95.4	Very high	13 Å²	13	35.5 Å²	35.5	8%	0.084	17%	0.167	C	C	.	.	H	α-helix	trans	-61.2	-35.4	174	-26.8	37.2	0	0	0	113.8	I252 M253 M284 T291 Q292	I252-P288 HydrophobicContact CG1-CG 4.5Å; I252-P288 WeakPolarHBondContact O-CG 3.47Å; M253-P288 HydrophobicContact CG-CB 4.4Å; M284-P288 WeakPolarHBondContact O-CD 3.37Å; M284-P288 VanDerWaalsContact O-CG 3.26Å; M284-P288 WeakPolarHBondContact O-CG 3.32Å; P288-T291 PolarHBondContact O-N 2.72Å; P288-Q292 WeakPolarHBondContact O-CB 3.45Å; P288-Q292 PolarHBondContact O-N 3Å
289	K	94.6	Very high	95.2	Very high	93 Å²	93	33.4 Å²	33.4	40%	0.404	16%	0.157	S	C	.	.	H	α-helix	trans	-65.2	-45.8	175.3	-64.4	174.3	179.4	-177.9	0	110.6	K285 E286 I287 T291 Q292 L293 S687	K285-K289 WeakPolarHBondContact O-CG 3.37Å; E286-K289 WeakPolarHBondContact O-CA 3.31Å; E286-K289 WeakPolarHBondContact O-CB 3.29Å; E286-K289 PolarHBondContact O-N 3.34Å; I287-K289 VanDerWaalsContact C-N 3.3Å; I287-K289 PolarHBondContact O-N 3.5Å; K289-T291 VanDerWaalsContact C-N 3.28Å; K289-T291 PolarHBondContact O-N 3.02Å; K289-Q292 WeakPolarHBondContact O-CB 3.3Å; K289-Q292 PolarHBondContact O-N 2.75Å; K289-L293 WeakPolarHBondContact O-CG 3.25Å; K289-L293 PolarHBondContact O-N 2.83Å; K289-L293 VanDerWaalsContact O-N 3.12Å; K289-S687 PolarHBondContact NZ-O 3.43Å
290	D	93.7	Very high	95	Very high	28 Å²	28	30.5 Å²	30.5	15%	0.15	15%	0.145	C	C	.	.	H	α-helix	trans	-60.2	-42.5	176.4	-54.8	-25	0	0	0	111	R204 E286 I287 Q292 L293 I294	R204-D290 IonicContact CZ-OD2 3.79Å; R204-D290 IonicContact NE-OD2 3.58Å; R204-D290 PolarHBondContact NE-OD2 3.02Å; R204-D290 IonicContact NH2-OD2 2.69Å; R204-D290 PolarHBondContact NH2-OD2 3.03Å; E286-D290 PolarHBondContact O-N 2.94Å; E286-D290 VanDerWaalsContact O-N 3.08Å; I287-D290 PolarHBondContact O-N 3.06Å; D290-Q292 PolarHBondContact O-N 3.43Å; D290-L293 PolarHBondContact O-N 3.49Å; D290-I294 WeakPolarHBondContact O-CG1 3.31Å; D290-I294 PolarHBondContact O-N 3.5Å
291	T	92.9	Very high	94.7	Very high	4 Å²	4	34.3 Å²	34.3	3%	0.025	17%	0.165	C	C	.	.	H	α-helix	trans	-65	-40	-180	-55.6	0	0	0	0	111.5	C211 I252 I287 P288 K289 L293 I294 L295	C211-T291 HydrophobicContact CB-CG2 3.93Å; C211-T291 WeakPolarHBondContact SG-CG2 3.43Å; I252-T291 HydrophobicContact CG2-CG2 4.33Å; I287-T291 WeakPolarHBondContact O-CB 3.48Å; I287-T291 PolarHBondContact O-N 2.88Å; I287-T291 PolarHBondContact O-OG1 3.24Å; P288-T291 PolarHBondContact O-N 2.72Å; K289-T291 VanDerWaalsContact C-N 3.28Å; K289-T291 PolarHBondContact O-N 3.02Å; T291-L293 VanDerWaalsContact C-N 3.33Å; T291-L293 PolarHBondContact O-N 2.77Å; T291-I294 PolarHBondContact O-N 3.03Å; T291-L295 PolarHBondContact O-N 3.27Å
292	Q	93.3	Very high	94.4	Very high	37 Å²	37	36.7 Å²	36.7	17%	0.173	19%	0.194	C	C	.	.	H	α-helix	trans	-60.9	-42.9	174.2	-176	64	26.5	0	0	111.6	P288 K289 D290 I294 L295 E296	P288-Q292 WeakPolarHBondContact O-CB 3.45Å; P288-Q292 PolarHBondContact O-N 3Å; K289-Q292 WeakPolarHBondContact O-CB 3.3Å; K289-Q292 PolarHBondContact O-N 2.75Å; D290-Q292 PolarHBondContact O-N 3.43Å; Q292-I294 VanDerWaalsContact C-N 3.3Å; Q292-I294 PolarHBondContact O-N 3.4Å; Q292-L295 PolarHBondContact O-N 3.14Å; Q292-E296 PolarHBondContact O-N 3.39Å
293	L	95.2	Very high	94.2	Very high	32 Å²	32	32 Å²	32	17%	0.168	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-36.2	176.5	-66.8	170.8	0	0	0	111.9	K289 D290 T291 E296 A297 I313 R316	K289-L293 WeakPolarHBondContact O-CG 3.25Å; K289-L293 PolarHBondContact O-N 2.83Å; K289-L293 VanDerWaalsContact O-N 3.12Å; D290-L293 PolarHBondContact O-N 3.49Å; T291-L293 VanDerWaalsContact C-N 3.33Å; T291-L293 PolarHBondContact O-N 2.77Å; L293-E296 PolarHBondContact O-N 3.05Å; L293-A297 WeakPolarHBondContact O-CB 3.49Å; L293-A297 PolarHBondContact O-N 3.48Å; L293-I313 HydrophobicContact CB-CB 4.36Å; L293-I313 HydrophobicContact CB-CD1 3.58Å; L293-I313 HydrophobicContact CB-CG2 4.41Å; L293-I313 HydrophobicContact CD1-CB 4.16Å; L293-I313 HydrophobicContact CD1-CG2 3.96Å; L293-R316 HydrophobicContact CD2-CB 3.93Å; L293-R316 HydrophobicContact CD2-CG 4.46Å
294	I	95.5	Very high	93.9	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.036	21%	0.205	C	C	.	.	H	α-helix	trans	-68.8	-40.3	174.7	-65.1	-69.9	0	0	0	111.7	S208 C211 E212 D290 T291 Q292 E296 A297 A298 I307 T308 I313 F423	S208-I294 WeakPolarHBondContact O-CG2 3.22Å; C211-I294 HydrophobicContact CB-CG2 4.17Å; E212-I294 HydrophobicContact CB-CG2 4.11Å; D290-I294 WeakPolarHBondContact O-CG1 3.31Å; D290-I294 PolarHBondContact O-N 3.5Å; T291-I294 PolarHBondContact O-N 3.03Å; Q292-I294 VanDerWaalsContact C-N 3.3Å; Q292-I294 PolarHBondContact O-N 3.4Å; I294-E296 PolarHBondContact O-N 3.24Å; I294-A297 PolarHBondContact O-N 2.94Å; I294-A298 VanDerWaalsContact O-CB 3.29Å; I294-A298 WeakPolarHBondContact O-CB 3.34Å; I294-A298 PolarHBondContact O-N 3.05Å; I294-I307 HydrophobicContact CD1-CG2 4.1Å; I294-T308 HydrophobicContact CD1-CG2 4.29Å; I294-T308 HydrophobicContact CG2-CG2 4.32Å; I294-I313 HydrophobicContact CD1-CD1 3.81Å; I294-I313 HydrophobicContact CD1-CG1 4.33Å; I294-I313 HydrophobicContact CG1-CD1 4.31Å; I294-F423 HydrophobicContact CD1-CE1 4.38Å
295	L	93.4	Very high	93.6	Very high	16 Å²	16	39.4 Å²	39.4	8%	0.084	23%	0.228	C	C	.	.	H	α-helix	trans	-60.3	-34.8	173.7	-74.8	169	0	0	0	112.1	L15 C211 H214 V249 T291 Q292	L15-L295 HydrophobicContact CD2-CD1 3.94Å; C211-L295 HydrophobicContact CB-CD2 3.73Å; C211-L295 HydrophobicContact CB-CG 3.87Å; H214-L295 HydrophobicContact CB-CD2 4.38Å; V249-L295 HydrophobicContact CG1-CD1 3.97Å; T291-L295 PolarHBondContact O-N 3.27Å; Q292-L295 PolarHBondContact O-N 3.14Å
296	E	92.7	Very high	93.4	Very high	27 Å²	27	38.6 Å²	38.6	13%	0.126	23%	0.231	C	C	.	.	H	α-helix	trans	-72.9	-48.1	174.4	-175	176.7	-178.6	0	0	111.9	Q292 L293 I294 A298 R299 R316 R419 F421 Y450	Q292-E296 PolarHBondContact O-N 3.39Å; L293-E296 PolarHBondContact O-N 3.05Å; I294-E296 PolarHBondContact O-N 3.24Å; E296-A298 PolarHBondContact O-N 3.15Å; E296-R299 VanDerWaalsContact O-CB 3.26Å; E296-R299 WeakPolarHBondContact O-CB 3.21Å; E296-R299 WeakPolarHBondContact O-CG 3.33Å; E296-R299 PolarHBondContact O-N 3.28Å; E296-R316 VanDerWaalsContact CD-CD 3.47Å; E296-R316 WeakPolarHBondContact OE1-CD 3.38Å; E296-R316 WeakPolarHBondContact OE2-CD 3.38Å; E296-R316 IonicContact OE2-NE 3.56Å; E296-R419 WeakPolarHBondContact OE1-CD 3.47Å; E296-R419 IonicContact OE1-NE 3.36Å; E296-F421 HydrophobicContact CG-CE1 4.18Å; E296-F421 HydrophobicContact CG-CZ 4.13Å; E296-Y450 HydrophobicContact CG-CE2 3.81Å; E296-Y450 PolarHBondContact OE1-OH 3.38Å
297	A	93.9	Very high	93.4	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-30	176.4	0	0	0	0	0	112.2	L293 I294 R299 I300 I307 I313 F421 F423	L293-A297 WeakPolarHBondContact O-CB 3.49Å; L293-A297 PolarHBondContact O-N 3.48Å; I294-A297 PolarHBondContact O-N 2.94Å; A297-R299 PolarHBondContact O-N 3.49Å; A297-I300 HydrophobicContact CB-CD1 4.21Å; A297-I300 VanDerWaalsContact O-CB 3.27Å; A297-I300 WeakPolarHBondContact O-CB 3.41Å; A297-I300 WeakPolarHBondContact O-CD1 3.33Å; A297-I300 WeakPolarHBondContact O-CG1 3.38Å; A297-I300 PolarHBondContact O-N 3.31Å; A297-I307 HydrophobicContact CB-CD1 4.31Å; A297-I307 HydrophobicContact CB-CG2 3.96Å; A297-I307 WeakPolarHBondContact O-CD1 3.39Å; A297-I313 HydrophobicContact CB-CD1 4.21Å; A297-F421 HydrophobicContact CB-CD1 4.15Å; A297-F421 HydrophobicContact CB-CE1 4.04Å; A297-F423 HydrophobicContact CB-CZ 4.25Å
298	A	92.7	Very high	93.4	Very high	13 Å²	13	37.5 Å²	37.5	11%	0.107	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-8.2	174.8	0	0	0	0	0	113.9	I294 E296 I300	I294-A298 VanDerWaalsContact O-CB 3.29Å; I294-A298 WeakPolarHBondContact O-CB 3.34Å; I294-A298 PolarHBondContact O-N 3.05Å; E296-A298 PolarHBondContact O-N 3.15Å; A298-I300 VanDerWaalsContact C-N 3.31Å
299	R	91.6	Very high	93.4	Very high	42 Å²	42	39.8 Å²	39.8	16%	0.158	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-0.2	172.4	-52.2	-179.3	-168.8	-174.5	-0.9	113.6	R215 E296 A297 D301 T449 Y450	R215-R299 VanDerWaalsContact NH1-CB 3.34Å; E296-R299 VanDerWaalsContact O-CB 3.26Å; E296-R299 WeakPolarHBondContact O-CB 3.21Å; E296-R299 WeakPolarHBondContact O-CG 3.33Å; E296-R299 PolarHBondContact O-N 3.28Å; A297-R299 PolarHBondContact O-N 3.49Å; R299-D301 PolarHBondContact O-N 3.16Å; R299-T449 WeakPolarHBondContact O-CG2 3.45Å; R299-Y450 HydrophobicContact CB-CD2 4.03Å; R299-Y450 HydrophobicContact CB-CE2 4.1Å; R299-Y450 PolarHBondContact O-N 3.07Å; R299-Y450 VanDerWaalsContact O-N 3.08Å
300	I	93.6	Very high	93.4	Very high	13 Å²	13	36.1 Å²	36.1	7%	0.067	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	114.2	176	-58.9	168.1	0	0	0	108.3	A297 A298 F303 F421 L428 T430 Y450 F452	A297-I300 HydrophobicContact CB-CD1 4.21Å; A297-I300 VanDerWaalsContact O-CB 3.27Å; A297-I300 WeakPolarHBondContact O-CB 3.41Å; A297-I300 WeakPolarHBondContact O-CD1 3.33Å; A297-I300 WeakPolarHBondContact O-CG1 3.38Å; A297-I300 PolarHBondContact O-N 3.31Å; A298-I300 VanDerWaalsContact C-N 3.31Å; I300-F303 HydrophobicContact CG2-CB 4.06Å; I300-F421 HydrophobicContact CD1-CD2 3.76Å; I300-F421 HydrophobicContact CD1-CE2 3.72Å; I300-F421 HydrophobicContact CD1-CG 4.42Å; I300-F421 HydrophobicContact CD1-CZ 4.34Å; I300-F421 HydrophobicContact CG1-CE2 4.15Å; I300-L428 HydrophobicContact CD1-CD1 4.01Å; I300-T430 HydrophobicContact CD1-CG2 3.95Å; I300-T430 HydrophobicContact CG1-CG2 3.99Å; I300-T430 HydrophobicContact CG2-CG2 4.04Å; I300-Y450 CarbonylContact C-O 3.46Å; I300-Y450 VanDerWaalsContact CA-O 3.29Å; I300-Y450 WeakPolarHBondContact CA-O 3.42Å; I300-Y450 HydrophobicContact CG1-CD2 4.18Å; I300-F452 HydrophobicContact CG2-CB 3.92Å
301	D	91.1	Very high	93.4	Very high	79 Å²	79	35.7 Å²	35.7	42%	0.422	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	139.6	175	-77	4.2	0	0	0	110.2	R215 R299 T449 Y450 F452	R215-D301 IonicContact NH2-OD1 2.73Å; R215-D301 PolarHBondContact NH2-OD1 2.87Å; R215-D301 VanDerWaalsContact NH2-OD1 3.1Å; R215-D301 IonicContact NH2-OD2 2.75Å; R299-D301 PolarHBondContact O-N 3.16Å; D301-T449 HydrophobicContact CB-CG2 3.68Å; D301-T449 WeakPolarHBondContact OD2-CG2 3.47Å; D301-Y450 PolarHBondContact N-O 3.12Å; D301-F452 VanDerWaalsContact O-CB 3.31Å; D301-F452 WeakPolarHBondContact O-CB 3.25Å; D301-F452 PolarHBondContact O-N 3.47Å
302	G	91.7	Very high	93.3	Very high	68 Å²	68	38 Å²	38	70%	0.701	25%	0.247	S	C	*	.	S	Bend	trans	87.4	2.2	175.7	0	0	0	0	0	116.1	P304	G302-P304 WeakPolarHBondContact O-CD 3.48Å
303	F	93.7	Very high	93.4	Very high	34 Å²	34	37 Å²	37	15%	0.149	24%	0.243	C	C	.	.			trans	-71.2	121.4	174.3	176.8	-114.4	0	0	0	111.3	I300 G305 I307 L310 M426 L428 F452	I300-F303 HydrophobicContact CG2-CB 4.06Å; F303-G305 VanDerWaalsContact C-N 3.28Å; F303-G305 PolarHBondContact O-N 3.01Å; F303-I307 HydrophobicContact CD1-CG1 4.19Å; F303-L310 HydrophobicContact CE1-CD1 4.07Å; F303-L310 HydrophobicContact CZ-CD1 3.79Å; F303-L310 HydrophobicContact CZ-CD2 4.1Å; F303-L310 HydrophobicContact CZ-CG 4.36Å; F303-M426 HydrophobicContact CE2-SD 4.21Å; F303-M426 HydrophobicContact CZ-SD 4.36Å; F303-L428 HydrophobicContact CD2-CD1 4.45Å; F303-L428 HydrophobicContact CD2-CD2 4Å; F303-L428 HydrophobicContact CE2-CD1 4.47Å; F303-L428 HydrophobicContact CE2-CD2 3.58Å; F303-L428 HydrophobicContact CZ-CD2 4.23Å; F303-F452 HydrophobicContact CB-CB 4.35Å; F303-F452 HydrophobicContact CB-CD2 4.23Å; F303-F452 HydrophobicContact CB-CG 4.25Å; F303-F452 AromaticContact CD2-CD2 3.83Å; F303-F452 HydrophobicContact CD2-CD2 3.83Å; F303-F452 AromaticContact CD2-CE2 3.69Å; F303-F452 HydrophobicContact CD2-CE2 3.69Å; F303-F452 HydrophobicContact CD2-CG 4.45Å; F303-F452 HydrophobicContact CD2-CZ 4.21Å; F303-F452 HydrophobicContact CE2-CE2 4.32Å
304	P	90.9	Very high	93.4	Very high	113 Å²	113	38.2 Å²	38.2	73%	0.734	25%	0.249	S	C	*	.	S	Bend	trans	-84.7	63.5	-176.8	35.3	-36.2	0	0	0	111.7	G302	G302-P304 WeakPolarHBondContact O-CD 3.48Å
305	G	92.1	Very high	93.4	Very high	46 Å²	46	39.4 Å²	39.4	47%	0.474	26%	0.256	S	S	.	.	S	Bend	trans	-178.6	-176.4	-179.4	0	0	0	0	0	114.4	F303	F303-G305 VanDerWaalsContact C-N 3.28Å; F303-G305 PolarHBondContact O-N 3.01Å
306	V	93.3	Very high	93.5	Very high	80 Å²	80	40 Å²	40	49%	0.485	26%	0.257	S	S	.	.			trans	-99.2	121.2	174.9	179	0	0	0	0	108.2	E212 T308 A309	E212-V306 WeakPolarHBondContact OE1-CG1 3.24Å; E212-V306 WeakPolarHBondContact OE2-CG1 3.32Å; V306-T308 VanDerWaalsContact C-N 3.31Å; V306-T308 WeakPolarHBondContact CG1-OG1 3.43Å; V306-T308 PolarHBondContact O-N 3.22Å; V306-A309 HydrophobicContact CB-CB 4.01Å; V306-A309 HydrophobicContact CG1-CB 4.31Å; V306-A309 WeakPolarHBondContact O-CB 3.43Å; V306-A309 PolarHBondContact O-N 2.57Å; V306-A309 VanDerWaalsContact O-N 3.09Å
307	I	94.9	Very high	93.6	Very high	10 Å²	10	39 Å²	39	5%	0.051	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-61	-44.4	-175.8	-66.9	171.8	0	0	0	110	E212 I294 A297 F303 A309 L310 F423	E212-I307 HydrophobicContact CG-CB 4.28Å; E212-I307 PolarHBondContact OE1-N 3.14Å; I294-I307 HydrophobicContact CD1-CG2 4.1Å; A297-I307 HydrophobicContact CB-CD1 4.31Å; A297-I307 HydrophobicContact CB-CG2 3.96Å; A297-I307 WeakPolarHBondContact O-CD1 3.39Å; F303-I307 HydrophobicContact CD1-CG1 4.19Å; I307-A309 PolarHBondContact O-N 3.2Å; I307-A309 VanDerWaalsContact O-N 3.15Å; I307-L310 WeakPolarHBondContact O-CB 3.36Å; I307-L310 WeakPolarHBondContact O-CG 3.2Å; I307-L310 PolarHBondContact O-N 2.73Å; I307-L310 VanDerWaalsContact O-N 3.09Å; I307-F423 HydrophobicContact CG2-CE1 3.75Å; I307-F423 HydrophobicContact CG2-CZ 3.65Å
308	T	94.9	Very high	93.6	Very high	33 Å²	33	41.3 Å²	41.3	20%	0.202	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-69.6	-9.8	-180	54.7	0	0	0	0	114.5	S208 K209 E212 I294 V306 L310	S208-T308 WeakPolarHBondContact O-CG2 3.45Å; K209-T308 HydrophobicContact CG-CG2 4.49Å; E212-T308 HydrophobicContact CB-CG2 4.08Å; E212-T308 VanDerWaalsContact OE2-CB 3.25Å; E212-T308 WeakPolarHBondContact OE2-CB 3.13Å; E212-T308 WeakPolarHBondContact OE2-CG2 3.33Å; E212-T308 PolarHBondContact OE2-N 3.42Å; E212-T308 PolarHBondContact OE2-OG1 2.89Å; I294-T308 HydrophobicContact CD1-CG2 4.29Å; I294-T308 HydrophobicContact CG2-CG2 4.32Å; V306-T308 VanDerWaalsContact C-N 3.31Å; V306-T308 WeakPolarHBondContact CG1-OG1 3.43Å; V306-T308 PolarHBondContact O-N 3.22Å; T308-L310 VanDerWaalsContact C-N 3.32Å
309	A	95.3	Very high	93.7	Very high	60 Å²	60	40.7 Å²	40.7	50%	0.496	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-78.9	-17.3	172.6	0	0	0	0	0	112.9	V306 I307 G311 Q425	V306-A309 HydrophobicContact CB-CB 4.01Å; V306-A309 HydrophobicContact CG1-CB 4.31Å; V306-A309 WeakPolarHBondContact O-CB 3.43Å; V306-A309 PolarHBondContact O-N 2.57Å; V306-A309 VanDerWaalsContact O-N 3.09Å; I307-A309 PolarHBondContact O-N 3.2Å; I307-A309 VanDerWaalsContact O-N 3.15Å; A309-G311 PolarHBondContact O-N 3.45Å; A309-Q425 PolarHBondContact O-NE2 3.5Å
310	L	95.2	Very high	93.9	Very high	17 Å²	17	41.3 Å²	41.3	9%	0.089	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-76.9	-5.6	-177.9	-53.9	-179.7	0	0	0	113.8	F303 I307 T308 F423 Q425 M426 L428	F303-L310 HydrophobicContact CE1-CD1 4.07Å; F303-L310 HydrophobicContact CZ-CD1 3.79Å; F303-L310 HydrophobicContact CZ-CD2 4.1Å; F303-L310 HydrophobicContact CZ-CG 4.36Å; I307-L310 WeakPolarHBondContact O-CB 3.36Å; I307-L310 WeakPolarHBondContact O-CG 3.2Å; I307-L310 PolarHBondContact O-N 2.73Å; I307-L310 VanDerWaalsContact O-N 3.09Å; T308-L310 VanDerWaalsContact C-N 3.32Å; L310-F423 HydrophobicContact CB-CB 3.81Å; L310-F423 HydrophobicContact CB-CD1 3.64Å; L310-F423 HydrophobicContact CB-CD2 4.37Å; L310-F423 HydrophobicContact CB-CE1 4.27Å; L310-F423 HydrophobicContact CB-CG 3.7Å; L310-F423 HydrophobicContact CD1-CD1 4.37Å; L310-F423 HydrophobicContact CD1-CD2 3.99Å; L310-F423 HydrophobicContact CD1-CE1 4.42Å; L310-F423 HydrophobicContact CD1-CE2 4.07Å; L310-F423 HydrophobicContact CD1-CG 4.16Å; L310-F423 HydrophobicContact CD1-CZ 4.3Å; L310-F423 WeakPolarHBondContact O-CB 3.49Å; L310-Q425 VanDerWaalsContact O-CB 3.24Å; L310-Q425 WeakPolarHBondContact O-CB 3.38Å; L310-Q425 WeakPolarHBondContact O-CG 3.31Å; L310-Q425 PolarHBondContact O-N 3.15Å; L310-M426 HydrophobicContact CD1-CB 4.41Å; L310-M426 HydrophobicContact CD2-CB 4.03Å; L310-M426 HydrophobicContact CD2-SD 3.96Å; L310-L428 HydrophobicContact CD1-CD1 3.88Å; L310-L428 HydrophobicContact CD1-CD2 4.18Å; L310-L428 HydrophobicContact CD1-CG 4.2Å
311	G	93.1	Very high	94.1	Very high	18 Å²	18	40.9 Å²	40.9	19%	0.186	26%	0.264	C	S	.	.			trans	92.3	-163.3	-175.4	0	0	0	0	0	112.7	A309	A309-G311 PolarHBondContact O-N 3.45Å
312	N	92.4	Very high	94.3	Very high	54 Å²	54	37.1 Å²	37.1	29%	0.289	24%	0.244	S	C	.	.			trans	-73.3	149.5	177.9	-55.9	-46.7	0	0	0	110.9	R204 L314 F423 E424	R204-N312 VanDerWaalsContact CD-OD1 3.28Å; R204-N312 WeakPolarHBondContact CD-OD1 3.5Å; N312-L314 PolarHBondContact O-N 2.93Å; N312-F423 CarbonylContact O-C 3.56Å; N312-F423 VanDerWaalsContact O-CA 3.29Å; N312-F423 WeakPolarHBondContact O-CA 3.27Å; N312-E424 HydrophobicContact CB-CG 4.25Å; N312-E424 PolarHBondContact N-OE2 3.25Å; N312-E424 PolarHBondContact ND2-OE1 3.35Å; N312-E424 PolarHBondContact O-N 3.02Å
313	I	95.3	Very high	94.5	Very high	16 Å²	16	37.6 Å²	37.6	8%	0.082	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	117.2	170.3	-62.6	169.7	0	0	0	107.5	L293 I294 A297 F423	L293-I313 HydrophobicContact CB-CB 4.36Å; L293-I313 HydrophobicContact CB-CD1 3.58Å; L293-I313 HydrophobicContact CB-CG2 4.41Å; L293-I313 HydrophobicContact CD1-CB 4.16Å; L293-I313 HydrophobicContact CD1-CG2 3.96Å; I294-I313 HydrophobicContact CD1-CD1 3.81Å; I294-I313 HydrophobicContact CD1-CG1 4.33Å; I294-I313 HydrophobicContact CG1-CD1 4.31Å; A297-I313 HydrophobicContact CB-CD1 4.21Å; I313-F423 HydrophobicContact CD1-CE1 3.71Å; I313-F423 HydrophobicContact CD1-CZ 3.76Å; I313-F423 HydrophobicContact CG1-CD1 3.53Å; I313-F423 HydrophobicContact CG1-CE1 3.17Å; I313-F423 HydrophobicContact CG1-CE2 4.24Å; I313-F423 HydrophobicContact CG1-CG 4.22Å; I313-F423 HydrophobicContact CG1-CZ 3.55Å
314	L	94.8	Very high	94.5	Very high	56 Å²	56	36.4 Å²	36.4	29%	0.293	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	-42.7	177.6	-59.1	-180	0	0	0	111.1	N312 L422 E424 I532	N312-L314 PolarHBondContact O-N 2.93Å; L314-L422 HydrophobicContact CB-CD2 4.41Å; L314-L422 HydrophobicContact CB-CG 4.3Å; L314-L422 WeakPolarHBondContact CB-O 3.37Å; L314-L422 HydrophobicContact CD1-CG 4.39Å; L314-L422 PolarHBondContact N-O 3.1Å; L314-E424 HydrophobicContact CD1-CG 4.44Å; L314-E424 HydrophobicContact CD2-CG 3.82Å; L314-E424 HydrophobicContact CG-CG 4.17Å; L314-I532 HydrophobicContact CD1-CD1 4.18Å
315	L	95.3	Very high	94.6	Very high	33 Å²	33	32.9 Å²	32.9	17%	0.173	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	145.6	-176.9	-165.3	59.3	0	0	0	111.6	L422 A524 W525 Q528	L315-L422 HydrophobicContact CB-CB 4.23Å; L315-L422 HydrophobicContact CB-CD2 4.46Å; L315-L422 PolarHBondContact N-O 3.11Å; L315-L422 PolarHBondContact O-N 2.73Å; L315-A524 HydrophobicContact CD2-CB 4.45Å; L315-W525 HydrophobicContact CD2-CB 4.25Å; L315-W525 VanDerWaalsContact CD2-CD1 3.46Å; L315-W525 HydrophobicContact CD2-CD2 3.67Å; L315-W525 HydrophobicContact CD2-CE3 4.41Å; L315-W525 HydrophobicContact CD2-CG 3.59Å; L315-W525 HydrophobicContact CD2-CZ2 4.28Å; L315-W525 HydrophobicContact CG-CZ2 4.4Å; L315-Q528 HydrophobicContact CD2-CG 4.3Å
316	R	94.3	Very high	94.4	Very high	27 Å²	27	32.4 Å²	32.4	10%	0.102	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	131.2	171.8	-178.8	-140.6	63.7	78.4	-3	108.7	L293 E296 D318 L420 F421 A690	L293-R316 HydrophobicContact CD2-CB 3.93Å; L293-R316 HydrophobicContact CD2-CG 4.46Å; E296-R316 VanDerWaalsContact CD-CD 3.47Å; E296-R316 WeakPolarHBondContact OE1-CD 3.38Å; E296-R316 WeakPolarHBondContact OE2-CD 3.38Å; E296-R316 IonicContact OE2-NE 3.56Å; R316-D318 IonicContact NH1-OD1 3.3Å; R316-D318 PolarHBondContact NH1-OD1 3.48Å; R316-D318 IonicContact NH1-OD2 2.66Å; R316-L420 WeakPolarHBondContact CA-O 3.41Å; R316-F421 HydrophobicContact CB-CD1 4.4Å; R316-F421 HydrophobicContact CG-CD1 3.95Å; R316-F421 HydrophobicContact CG-CE1 3.79Å; R316-F421 HydrophobicContact CG-CZ 4.43Å; R316-A690 PolarHBondContact NH2-O 3.33Å
317	S	95.2	Very high	94.1	Very high	7 Å²	7	35 Å²	35	5%	0.049	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	157.5	175.8	-56.3	0	0	0	0	112.1	L420 W525	S317-L420 PolarHBondContact N-O 3.29Å; S317-L420 PolarHBondContact O-N 2.87Å; S317-W525 PolarHBondContact OG-NE1 3.23Å
318	D	94.7	Very high	93.9	Very high	49 Å²	49	38.8 Å²	38.8	26%	0.262	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	108.4	176.1	-53.4	-24.6	0	0	0	107	R316 R419	R316-D318 IonicContact NH1-OD1 3.3Å; R316-D318 PolarHBondContact NH1-OD1 3.48Å; R316-D318 IonicContact NH1-OD2 2.66Å; D318-R419 VanDerWaalsContact OD1-CG 3.32Å; D318-R419 WeakPolarHBondContact OD1-CG 3.48Å; D318-R419 IonicContact OD1-CZ 2.8Å; D318-R419 IonicContact OD1-NE 3.1Å; D318-R419 PolarHBondContact OD1-NE 2.79Å; D318-R419 IonicContact OD1-NH2 3.76Å; D318-R419 PolarHBondContact OD1-NH2 3.16Å; D318-R419 IonicContact OD2-CZ 3.77Å; D318-R419 IonicContact OD2-NE 3.7Å; D318-R419 IonicContact OD2-NH2 3.33Å; D318-R419 PolarHBondContact OD2-NH2 3.02Å
319	L	95.6	Very high	93.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	161.8	-170.4	-58.6	-172.8	0	0	0	110	S418 L420 I514 P516 N521 W525	L319-S418 PolarHBondContact N-O 3.01Å; L319-S418 PolarHBondContact O-N 3.34Å; L319-S418 VanDerWaalsContact O-O 3.07Å; L319-L420 HydrophobicContact CB-CD1 4.46Å; L319-L420 HydrophobicContact CD1-CD1 4.09Å; L319-I514 HydrophobicContact CB-CG2 4.07Å; L319-I514 HydrophobicContact CD1-CG2 3.45Å; L319-I514 VanDerWaalsContact CD1-CG2 3.45Å; L319-I514 HydrophobicContact CG-CG2 4.41Å; L319-P516 WeakPolarHBondContact CD2-O 3.46Å; L319-N521 HydrophobicContact CD2-CB 4.15Å; L319-W525 HydrophobicContact CD1-CD2 4.2Å; L319-W525 HydrophobicContact CD1-CG 4.37Å; L319-W525 HydrophobicContact CD1-CZ2 4.22Å
320	L	95.7	Very high	93.3	Very high	54 Å²	54	36.2 Å²	36.2	28%	0.283	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	126.7	171.2	-69.7	178.7	0	0	0	108.8	F415 E417 D515 I517	L320-F415 HydrophobicContact CB-CB 4.28Å; L320-F415 HydrophobicContact CB-CD1 4.05Å; L320-E417 HydrophobicContact CD2-CB 4.19Å; L320-D515 HydrophobicContact CB-CB 3.93Å; L320-D515 PolarHBondContact N-O 3.19Å; L320-D515 VanDerWaalsContact N-O 3.16Å; L320-D515 PolarHBondContact O-N 3.05Å; L320-I517 HydrophobicContact CD1-CG1 4.48Å; L320-I517 HydrophobicContact CG-CD1 4.31Å; L320-I517 HydrophobicContact CG-CG1 4.26Å
321	V	96.5	Very high	93	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.024	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	128.1	-176.6	-176.9	0	0	0	0	109.9	V416 L420 Y512 V513 I514	V321-V416 PolarHBondContact N-O 3.1Å; V321-V416 PolarHBondContact O-N 3.44Å; V321-L420 HydrophobicContact CG2-CD1 4.06Å; V321-L420 HydrophobicContact CG2-CD2 4.1Å; V321-L420 HydrophobicContact CG2-CG 4.32Å; V321-Y512 HydrophobicContact CG1-CD1 4.16Å; V321-V513 WeakPolarHBondContact CA-O 3.2Å; V321-I514 HydrophobicContact CG2-CG1 4.36Å
322	A	95.6	Very high	93	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.2	166.8	0	0	0	0	0	109.3	L413 K414 F415 Y512 V513	A322-L413 HydrophobicContact CB-CB 3.91Å; A322-K414 WeakPolarHBondContact CA-O 3.42Å; A322-K414 WeakPolarHBondContact CB-O 3.26Å; A322-F415 HydrophobicContact CB-CD1 3.82Å; A322-F415 HydrophobicContact CB-CD2 4.17Å; A322-F415 HydrophobicContact CB-CE1 3.77Å; A322-F415 HydrophobicContact CB-CE2 4.11Å; A322-F415 HydrophobicContact CB-CG 4.02Å; A322-F415 HydrophobicContact CB-CZ 3.91Å; A322-Y512 WeakPolarHBondContact O-CA 3.4Å; A322-V513 HydrophobicContact CB-CB 4.37Å; A322-V513 PolarHBondContact N-O 3.24Å; A322-V513 PolarHBondContact O-N 2.74Å
323	T	95.1	Very high	92.8	Very high	78 Å²	78	37.4 Å²	37.4	48%	0.479	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.8	173.4	-55	0	0	0	0	108.6	F510 Y512	T323-F510 HydrophobicContact CG2-CD1 3.94Å; T323-Y512 HydrophobicContact CG2-CD1 4.17Å; T323-Y512 HydrophobicContact CG2-CE1 3.78Å; T323-Y512 WeakPolarHBondContact OG1-CD1 3.48Å
324	T	93.8	Very high	92.5	Very high	8 Å²	8	39.2 Å²	39.2	5%	0.049	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	167.5	-177.5	-169.8	0	0	0	0	110.7	Q328 L329 L413 F510 V511	T324-Q328 VanDerWaalsContact OG1-CB 3.23Å; T324-Q328 WeakPolarHBondContact OG1-CB 3.25Å; T324-Q328 PolarHBondContact OG1-OE1 3.12Å; T324-L329 HydrophobicContact CG2-CB 3.88Å; T324-L329 HydrophobicContact CG2-CD1 4.11Å; T324-L329 HydrophobicContact CG2-CG 4.47Å; T324-L413 HydrophobicContact CG2-CD2 3.74Å; T324-F510 WeakPolarHBondContact O-CA 3.04Å; T324-V511 HydrophobicContact CG2-CB 4.28Å; T324-V511 PolarHBondContact N-O 3.48Å; T324-V511 PolarHBondContact O-N 3.07Å
325	T	92.7	Very high	92.3	Very high	39 Å²	39	38.5 Å²	38.5	24%	0.239	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	162.2	169.4	58.7	0	0	0	0	110.6	E327 Q328 L329 D509	T325-E327 VanDerWaalsContact C-N 3.27Å; T325-E327 PolarHBondContact O-N 2.74Å; T325-Q328 PolarHBondContact O-N 3.4Å; T325-Q328 WeakPolarHBondContact OG1-CB 3.35Å; T325-Q328 VanDerWaalsContact OG1-CD 3.32Å; T325-Q328 VanDerWaalsContact OG1-CG 3.27Å; T325-Q328 WeakPolarHBondContact OG1-CG 3.42Å; T325-Q328 PolarHBondContact OG1-N 3.46Å; T325-Q328 PolarHBondContact OG1-OE1 2.88Å; T325-Q328 VanDerWaalsContact OG1-OE1 3.05Å; T325-L329 WeakPolarHBondContact O-CB 3.44Å; T325-L329 PolarHBondContact O-N 3.4Å; T325-D509 WeakPolarHBondContact CA-O 3.25Å
326	R	88.2	Confident	92	Very high	36 Å²	36	37.5 Å²	37.5	14%	0.136	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-37.6	176.8	-172.7	178.9	-67.6	104.5	17.3	111.9	L329 L330 T471 D509 V511	R326-L329 PolarHBondContact O-N 3.38Å; R326-L330 HydrophobicContact CG-CD1 4.28Å; R326-L330 WeakPolarHBondContact O-CD1 3.5Å; R326-L330 VanDerWaalsContact O-CG 3.26Å; R326-L330 WeakPolarHBondContact O-CG 3.17Å; R326-L330 PolarHBondContact O-N 3.1Å; R326-L330 VanDerWaalsContact O-N 3.08Å; R326-T471 VanDerWaalsContact CD-O 3.24Å; R326-T471 WeakPolarHBondContact CD-O 3.45Å; R326-T471 PolarHBondContact NE-O 3.39Å; R326-D509 WeakPolarHBondContact CB-OD1 3.46Å; R326-D509 WeakPolarHBondContact CB-OD2 3.49Å; R326-D509 IonicContact CZ-OD1 3.58Å; R326-D509 PolarHBondContact N-O 3.27Å; R326-D509 PolarHBondContact N-OD2 2.89Å; R326-D509 IonicContact NH1-OD1 3.78Å; R326-D509 PolarHBondContact NH1-OD1 2.76Å; R326-D509 IonicContact NH2-OD1 2.73Å; R326-V511 HydrophobicContact CB-CG2 4.43Å
327	E	86.8	Confident	91.6	Very high	136 Å²	136	37.8 Å²	37.8	64%	0.636	20%	0.199	S	C	*	.	H	α-helix	trans	-62.2	-54	177.2	-177.1	173.8	-161.6	0	0	111.8	T325 L329 L330 E331	T325-E327 VanDerWaalsContact C-N 3.27Å; T325-E327 PolarHBondContact O-N 2.74Å; E327-L329 PolarHBondContact O-N 3.49Å; E327-L330 WeakPolarHBondContact O-CB 3.43Å; E327-L330 PolarHBondContact O-N 3.4Å; E327-E331 PolarHBondContact O-N 2.89Å; E327-E331 VanDerWaalsContact O-N 3.14Å
328	Q	90.5	Very high	91.2	Very high	89 Å²	89	41.6 Å²	41.6	42%	0.416	22%	0.217	S	C	.	.	H	α-helix	trans	-61	-34.5	178.2	-73.7	169.4	-27.1	0	0	112.6	T324 T325 E331 T332 N412	T324-Q328 VanDerWaalsContact OG1-CB 3.23Å; T324-Q328 WeakPolarHBondContact OG1-CB 3.25Å; T324-Q328 PolarHBondContact OG1-OE1 3.12Å; T325-Q328 PolarHBondContact O-N 3.4Å; T325-Q328 WeakPolarHBondContact OG1-CB 3.35Å; T325-Q328 VanDerWaalsContact OG1-CD 3.32Å; T325-Q328 VanDerWaalsContact OG1-CG 3.27Å; T325-Q328 WeakPolarHBondContact OG1-CG 3.42Å; T325-Q328 PolarHBondContact OG1-N 3.46Å; T325-Q328 PolarHBondContact OG1-OE1 2.88Å; T325-Q328 VanDerWaalsContact OG1-OE1 3.05Å; Q328-E331 WeakPolarHBondContact O-CB 3.25Å; Q328-E331 PolarHBondContact O-N 3.24Å; Q328-T332 PolarHBondContact O-N 3.49Å; Q328-T332 PolarHBondContact O-OG1 3.46Å; Q328-N412 PolarHBondContact O-ND2 3.35Å
329	L	91	Very high	90.8	Very high	2 Å²	2	40 Å²	40	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-64.6	-42.1	174.8	-175.9	64.2	0	0	0	111.8	T324 T325 R326 E327 E331 T332 V333 L413 W467 C470 V511 V513	T324-L329 HydrophobicContact CG2-CB 3.88Å; T324-L329 HydrophobicContact CG2-CD1 4.11Å; T324-L329 HydrophobicContact CG2-CG 4.47Å; T325-L329 WeakPolarHBondContact O-CB 3.44Å; T325-L329 PolarHBondContact O-N 3.4Å; R326-L329 PolarHBondContact O-N 3.38Å; E327-L329 PolarHBondContact O-N 3.49Å; L329-E331 VanDerWaalsContact C-N 3.31Å; L329-E331 PolarHBondContact O-N 3.27Å; L329-T332 WeakPolarHBondContact O-CA 3.49Å; L329-T332 VanDerWaalsContact O-CB 3.29Å; L329-T332 WeakPolarHBondContact O-CB 3.32Å; L329-T332 PolarHBondContact O-N 2.94Å; L329-T332 VanDerWaalsContact O-N 3.12Å; L329-T332 PolarHBondContact O-OG1 3.17Å; L329-V333 HydrophobicContact CG-CG2 4.45Å; L329-V333 VanDerWaalsContact O-CG2 3.29Å; L329-V333 WeakPolarHBondContact O-CG2 3.34Å; L329-V333 PolarHBondContact O-N 3.03Å; L329-L413 HydrophobicContact CD1-CD1 4.49Å; L329-L413 HydrophobicContact CD1-CD2 4.45Å; L329-W467 HydrophobicContact CD1-CE3 3.79Å; L329-W467 HydrophobicContact CD1-CZ3 4.08Å; L329-C470 HydrophobicContact CD2-CB 3.71Å; L329-V511 HydrophobicContact CD2-CB 3.99Å; L329-V511 HydrophobicContact CD2-CG1 3.63Å; L329-V511 HydrophobicContact CD2-CG2 4.08Å; L329-V513 HydrophobicContact CD1-CG2 3.71Å
330	L	87.7	Confident	90.2	Very high	36 Å²	36	40.9 Å²	40.9	19%	0.188	22%	0.215	C	C	.	.	H	α-helix	trans	-62.7	-41.4	177.9	-70.2	160	0	0	0	110.8	R326 E327 T332 V333 T334 L472	R326-L330 HydrophobicContact CG-CD1 4.28Å; R326-L330 WeakPolarHBondContact O-CD1 3.5Å; R326-L330 VanDerWaalsContact O-CG 3.26Å; R326-L330 WeakPolarHBondContact O-CG 3.17Å; R326-L330 PolarHBondContact O-N 3.1Å; R326-L330 VanDerWaalsContact O-N 3.08Å; E327-L330 WeakPolarHBondContact O-CB 3.43Å; E327-L330 PolarHBondContact O-N 3.4Å; L330-T332 VanDerWaalsContact C-N 3.31Å; L330-T332 PolarHBondContact O-N 3.48Å; L330-V333 PolarHBondContact O-N 2.95Å; L330-V333 VanDerWaalsContact O-N 3.15Å; L330-T334 PolarHBondContact O-N 3.08Å; L330-T334 PolarHBondContact O-OG1 2.78Å; L330-T334 VanDerWaalsContact O-OG1 3.1Å; L330-L472 HydrophobicContact CD1-CD2 3.42Å; L330-L472 VanDerWaalsContact CD1-CD2 3.42Å; L330-L472 HydrophobicContact CD1-CG 4.44Å; L330-L472 HydrophobicContact CD2-CD2 3.94Å; L330-L472 HydrophobicContact CD2-CG 4.34Å; L330-L472 HydrophobicContact CG-CD2 4.34Å
331	E	89.4	Confident	89.7	Confident	112 Å²	112	41.3 Å²	41.3	52%	0.523	22%	0.216	S	C	.	.	H	α-helix	trans	-57.9	-43.3	171.6	-63.2	175.1	170.6	0	0	111.6	E327 Q328 L329 V333 T334 A335	E327-E331 PolarHBondContact O-N 2.89Å; E327-E331 VanDerWaalsContact O-N 3.14Å; Q328-E331 WeakPolarHBondContact O-CB 3.25Å; Q328-E331 PolarHBondContact O-N 3.24Å; L329-E331 VanDerWaalsContact C-N 3.31Å; L329-E331 PolarHBondContact O-N 3.27Å; E331-V333 PolarHBondContact O-N 2.77Å; E331-T334 PolarHBondContact O-N 2.69Å; E331-A335 WeakPolarHBondContact O-CB 3.45Å; E331-A335 PolarHBondContact O-N 2.84Å
332	T	91.3	Very high	88.9	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-60.5	-44.2	174.4	-34	0	0	0	0	111.7	Q328 L329 L330 A335 Y336 F409 N412 L413 W467	Q328-T332 PolarHBondContact O-N 3.49Å; Q328-T332 PolarHBondContact O-OG1 3.46Å; L329-T332 WeakPolarHBondContact O-CA 3.49Å; L329-T332 VanDerWaalsContact O-CB 3.29Å; L329-T332 WeakPolarHBondContact O-CB 3.32Å; L329-T332 PolarHBondContact O-N 2.94Å; L329-T332 VanDerWaalsContact O-N 3.12Å; L329-T332 PolarHBondContact O-OG1 3.17Å; L330-T332 VanDerWaalsContact C-N 3.31Å; L330-T332 PolarHBondContact O-N 3.48Å; T332-A335 PolarHBondContact O-N 2.65Å; T332-Y336 WeakPolarHBondContact O-CB 3.09Å; T332-Y336 PolarHBondContact O-N 3.01Å; T332-F409 HydrophobicContact CG2-CE1 4.2Å; T332-N412 WeakPolarHBondContact CB-OD1 3.35Å; T332-N412 WeakPolarHBondContact CG2-OD1 3.5Å; T332-N412 PolarHBondContact OG1-OD1 3.41Å; T332-L413 HydrophobicContact CG2-CD1 3.9Å; T332-L413 HydrophobicContact CG2-CG 3.79Å; T332-W467 HydrophobicContact CG2-CH2 4.08Å; T332-W467 HydrophobicContact CG2-CZ3 4.03Å
333	V	89.8	Confident	87.8	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-65.5	-43.1	-177.9	174.4	0	0	0	0	110.6	L329 L330 E331 Y336 K337 W467 N478 E480 I484	L329-V333 HydrophobicContact CG-CG2 4.45Å; L329-V333 VanDerWaalsContact O-CG2 3.29Å; L329-V333 WeakPolarHBondContact O-CG2 3.34Å; L329-V333 PolarHBondContact O-N 3.03Å; L330-V333 PolarHBondContact O-N 2.95Å; L330-V333 VanDerWaalsContact O-N 3.15Å; E331-V333 PolarHBondContact O-N 2.77Å; V333-Y336 WeakPolarHBondContact O-CB 3.5Å; V333-Y336 PolarHBondContact O-N 3.06Å; V333-K337 PolarHBondContact O-N 2.76Å; V333-W467 HydrophobicContact CB-CZ3 4.46Å; V333-W467 HydrophobicContact CG2-CE3 3.97Å; V333-W467 HydrophobicContact CG2-CH2 4.25Å; V333-W467 HydrophobicContact CG2-CZ3 3.48Å; V333-W467 VanDerWaalsContact CG2-CZ3 3.48Å; V333-N478 WeakPolarHBondContact CG1-ND2 3.45Å; V333-E480 HydrophobicContact CG1-CB 4.4Å; V333-I484 HydrophobicContact CG1-CD1 3.46Å; V333-I484 VanDerWaalsContact CG1-CD1 3.46Å
334	T	88.8	Confident	86.3	Confident	53 Å²	53	50.1 Å²	50.1	33%	0.325	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-45	174.3	-55.6	0	0	0	0	111	L330 E331 Y336 K337 M338 E480	L330-T334 PolarHBondContact O-N 3.08Å; L330-T334 PolarHBondContact O-OG1 2.78Å; L330-T334 VanDerWaalsContact O-OG1 3.1Å; E331-T334 PolarHBondContact O-N 2.69Å; T334-Y336 VanDerWaalsContact C-N 3.32Å; T334-Y336 PolarHBondContact O-N 3.37Å; T334-K337 PolarHBondContact O-N 3.3Å; T334-M338 HydrophobicContact CG2-CE 4.43Å; T334-M338 VanDerWaalsContact O-CG 3.32Å; T334-M338 WeakPolarHBondContact O-CG 3.25Å; T334-M338 PolarHBondContact O-N 2.87Å; T334-E480 WeakPolarHBondContact CA-OE2 3.49Å; T334-E480 WeakPolarHBondContact CB-OE2 3.46Å; T334-E480 PolarHBondContact N-OE2 3.26Å; T334-E480 PolarHBondContact OG1-OE2 3.18Å
335	A	89.5	Confident	84.7	Confident	42 Å²	42	53.6 Å²	53.6	35%	0.347	29%	0.287	S	S	.	.	H	α-helix	trans	-62.7	-38.4	176.2	0	0	0	0	0	112.4	E331 T332 M338 A339 F409	E331-A335 WeakPolarHBondContact O-CB 3.45Å; E331-A335 PolarHBondContact O-N 2.84Å; T332-A335 PolarHBondContact O-N 2.65Å; A335-M338 PolarHBondContact O-N 3.42Å; A335-A339 WeakPolarHBondContact O-CB 3.43Å; A335-A339 PolarHBondContact O-N 3.25Å; A335-F409 HydrophobicContact CB-CE1 4.34Å; A335-F409 HydrophobicContact CB-CZ 3.81Å
336	Y	89.4	Confident	82.7	Confident	11 Å²	11	54.8 Å²	54.8	4%	0.043	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-43.9	176.8	-178.9	-126	0	0	0	112	T332 V333 T334 M338 A339 L340 F409 W467 Y468 I484	T332-Y336 WeakPolarHBondContact O-CB 3.09Å; T332-Y336 PolarHBondContact O-N 3.01Å; V333-Y336 WeakPolarHBondContact O-CB 3.5Å; V333-Y336 PolarHBondContact O-N 3.06Å; T334-Y336 VanDerWaalsContact C-N 3.32Å; T334-Y336 PolarHBondContact O-N 3.37Å; Y336-M338 VanDerWaalsContact C-N 3.34Å; Y336-M338 PolarHBondContact O-N 3.15Å; Y336-A339 WeakPolarHBondContact O-CB 3.47Å; Y336-A339 PolarHBondContact O-N 3.36Å; Y336-L340 HydrophobicContact CD1-CD1 4.11Å; Y336-L340 HydrophobicContact CD2-CG 4.38Å; Y336-L340 HydrophobicContact CE1-CD1 3.68Å; Y336-L340 HydrophobicContact CE1-CG 4.42Å; Y336-L340 HydrophobicContact CE2-CD1 4.2Å; Y336-L340 HydrophobicContact CE2-CD2 4.18Å; Y336-L340 HydrophobicContact CE2-CG 4.06Å; Y336-L340 WeakPolarHBondContact O-CG 3.49Å; Y336-L340 PolarHBondContact O-N 3.09Å; Y336-F409 HydrophobicContact CD2-CB 3.69Å; Y336-F409 AromaticContact CD2-CD1 3.44Å; Y336-F409 HydrophobicContact CD2-CD1 3.44Å; Y336-F409 VanDerWaalsContact CD2-CD1 3.44Å; Y336-F409 HydrophobicContact CD2-CE1 4.21Å; Y336-F409 AromaticContact CD2-CG 3.66Å; Y336-F409 HydrophobicContact CD2-CG 3.66Å; Y336-F409 HydrophobicContact CE2-CB 3.89Å; Y336-F409 HydrophobicContact CE2-CD1 4.41Å; Y336-F409 HydrophobicContact CE2-CG 4.37Å; Y336-F409 AromaticContact CG-CD1 3.97Å; Y336-F409 HydrophobicContact CG-CD1 3.97Å; Y336-F409 HydrophobicContact CG-CE1 4.4Å; Y336-W467 AromaticContact CD1-CH2 3.97Å; Y336-W467 HydrophobicContact CD1-CH2 3.97Å; Y336-W467 AromaticContact CD1-CZ2 3.6Å; Y336-W467 HydrophobicContact CD1-CZ2 3.6Å; Y336-W467 HydrophobicContact CD2-CZ2 4.37Å; Y336-W467 AromaticContact CE1-CZ2 3.95Å; Y336-W467 HydrophobicContact CE1-CZ2 3.95Å; Y336-W467 AromaticContact CG-CH2 3.97Å; Y336-W467 HydrophobicContact CG-CH2 3.97Å; Y336-W467 AromaticContact CG-CZ2 3.82Å; Y336-W467 HydrophobicContact CG-CZ2 3.82Å; Y336-Y468 HydrophobicContact CE1-CD1 4.14Å; Y336-Y468 HydrophobicContact CE1-CE1 4.5Å; Y336-I484 HydrophobicContact CD1-CD1 4.21Å; Y336-I484 HydrophobicContact CD1-CG2 4.16Å; Y336-I484 HydrophobicContact CE1-CG2 3.79Å
337	K	86.9	Confident	80.2	Confident	34 Å²	34	58.2 Å²	58.2	15%	0.148	33%	0.332	C	S	.	.	H	α-helix	trans	-57.8	-45.8	172.9	172.9	-179.5	155.2	-163.5	0	111.8	V333 T334 A339 L340 Q341 E480 T483 I484 L487	V333-K337 PolarHBondContact O-N 2.76Å; T334-K337 PolarHBondContact O-N 3.3Å; K337-A339 VanDerWaalsContact C-N 3.33Å; K337-A339 PolarHBondContact O-N 3.3Å; K337-L340 PolarHBondContact O-N 3.39Å; K337-Q341 WeakPolarHBondContact O-CG 3.46Å; K337-Q341 PolarHBondContact O-N 3.03Å; K337-E480 HydrophobicContact CD-CB 4.01Å; K337-E480 HydrophobicContact CD-CG 4.21Å; K337-E480 IonicContact NZ-OE1 3.32Å; K337-E480 PolarHBondContact NZ-OE1 3.46Å; K337-T483 HydrophobicContact CD-CG2 4.36Å; K337-I484 HydrophobicContact CB-CD1 4.15Å; K337-I484 HydrophobicContact CB-CG1 3.92Å; K337-I484 HydrophobicContact CG-CG1 4.43Å; K337-L487 HydrophobicContact CG-CD1 4.43Å
338	M	86.7	Confident	77.5	Confident	87 Å²	87	61.3 Å²	61.3	43%	0.429	34%	0.344	S	S	.	.	H	α-helix	trans	-63.6	-39.7	177.7	-64.1	-63.4	160.9	0	0	111.7	T334 A335 Y336 Q341 N342	T334-M338 HydrophobicContact CG2-CE 4.43Å; T334-M338 VanDerWaalsContact O-CG 3.32Å; T334-M338 WeakPolarHBondContact O-CG 3.25Å; T334-M338 PolarHBondContact O-N 2.87Å; A335-M338 PolarHBondContact O-N 3.42Å; Y336-M338 VanDerWaalsContact C-N 3.34Å; Y336-M338 PolarHBondContact O-N 3.15Å; M338-Q341 PolarHBondContact O-N 3.48Å; M338-N342 VanDerWaalsContact O-CG 3.27Å; M338-N342 PolarHBondContact O-N 3.23Å; M338-N342 PolarHBondContact O-ND2 3.1Å
339	A	85.4	Confident	74.6	Confident	14 Å²	14	61.2 Å²	61.2	12%	0.116	35%	0.352	C	S	.	.	H	α-helix	trans	-61.2	-47	174.5	0	0	0	0	0	112.2	A335 Y336 K337 Q341 N342 V343 I402 F409	A335-A339 WeakPolarHBondContact O-CB 3.43Å; A335-A339 PolarHBondContact O-N 3.25Å; Y336-A339 WeakPolarHBondContact O-CB 3.47Å; Y336-A339 PolarHBondContact O-N 3.36Å; K337-A339 VanDerWaalsContact C-N 3.33Å; K337-A339 PolarHBondContact O-N 3.3Å; A339-Q341 VanDerWaalsContact C-N 3.33Å; A339-Q341 PolarHBondContact O-N 2.89Å; A339-N342 PolarHBondContact O-N 3.4Å; A339-V343 WeakPolarHBondContact O-CG2 3.31Å; A339-V343 PolarHBondContact O-N 3.38Å; A339-V343 VanDerWaalsContact O-N 3.14Å; A339-I402 HydrophobicContact CB-CD1 3.95Å; A339-F409 HydrophobicContact CB-CD2 4Å; A339-F409 HydrophobicContact CB-CE2 3.93Å
340	L	84.1	Confident	71.6	Confident	19 Å²	19	70 Å²	70	10%	0.099	39%	0.393	C	S	.	.	H	α-helix	trans	-62	-39.1	176.5	-71.2	175.8	0	0	0	112.4	Y336 K337 V343 N344 I484 L487 L488	Y336-L340 HydrophobicContact CD1-CD1 4.11Å; Y336-L340 HydrophobicContact CD2-CG 4.38Å; Y336-L340 HydrophobicContact CE1-CD1 3.68Å; Y336-L340 HydrophobicContact CE1-CG 4.42Å; Y336-L340 HydrophobicContact CE2-CD1 4.2Å; Y336-L340 HydrophobicContact CE2-CD2 4.18Å; Y336-L340 HydrophobicContact CE2-CG 4.06Å; Y336-L340 WeakPolarHBondContact O-CG 3.49Å; Y336-L340 PolarHBondContact O-N 3.09Å; K337-L340 PolarHBondContact O-N 3.39Å; L340-V343 PolarHBondContact O-N 3.36Å; L340-N344 PolarHBondContact O-N 3.36Å; L340-I484 HydrophobicContact CD1-CG2 3.98Å; L340-L487 HydrophobicContact CB-CB 4.36Å; L340-L487 HydrophobicContact CB-CD1 4.03Å; L340-L487 HydrophobicContact CD1-CB 4.29Å; L340-L488 HydrophobicContact CD1-CD2 3.96Å; L340-L488 HydrophobicContact CD1-CG 4.27Å; L340-L488 HydrophobicContact CD2-CD2 4.1Å
341	Q	83.6	Confident	68.9	Low	64 Å²	64	73.5 Å²	73.5	30%	0.299	42%	0.417	S	S	.	.	H	α-helix	trans	-64.5	-38.4	176.1	-74	177.4	-22	0	0	112.5	K337 M338 A339 N344 S345 L487	K337-Q341 WeakPolarHBondContact O-CG 3.46Å; K337-Q341 PolarHBondContact O-N 3.03Å; M338-Q341 PolarHBondContact O-N 3.48Å; A339-Q341 VanDerWaalsContact C-N 3.33Å; A339-Q341 PolarHBondContact O-N 2.89Å; Q341-N344 PolarHBondContact O-N 3.5Å; Q341-S345 WeakPolarHBondContact O-CB 3.47Å; Q341-S345 PolarHBondContact O-N 3.41Å; Q341-S345 PolarHBondContact O-OG 3.11Å; Q341-L487 HydrophobicContact CG-CD1 3.85Å; Q341-L487 HydrophobicContact CG-CD2 4.33Å
342	N	79.9	Confident	65.9	Low	120 Å²	120	76.1 Å²	76.1	64%	0.642	43%	0.434	S	S	*	.	H	α-helix	trans	-66.5	-39.8	177.2	-71	-19.2	0	0	0	112	M338 A339 S345	M338-N342 VanDerWaalsContact O-CG 3.27Å; M338-N342 PolarHBondContact O-N 3.23Å; M338-N342 PolarHBondContact O-ND2 3.1Å; A339-N342 PolarHBondContact O-N 3.4Å; N342-S345 PolarHBondContact O-N 3.17Å
343	V	72.9	Confident	63.1	Low	82 Å²	82	81.4 Å²	81.4	50%	0.497	47%	0.467	S	S	.	.	H	α-helix	trans	-63.9	-45	175.5	176.1	0	0	0	0	110.7	A339 L340 S345	A339-V343 WeakPolarHBondContact O-CG2 3.31Å; A339-V343 PolarHBondContact O-N 3.38Å; A339-V343 VanDerWaalsContact O-N 3.14Å; L340-V343 PolarHBondContact O-N 3.36Å; V343-S345 VanDerWaalsContact C-N 3.31Å; V343-S345 PolarHBondContact O-N 2.57Å
344	N	64.5	Low	60.3	Low	66 Å²	66	86.9 Å²	86.9	35%	0.353	51%	0.505	S	S	.	.	H	α-helix	trans	-71.8	-21.8	-179.9	-79.4	-1.5	0	0	0	114.1	L340 Q341 L487 S490	L340-N344 PolarHBondContact O-N 3.36Å; Q341-N344 PolarHBondContact O-N 3.5Å; N344-L487 WeakPolarHBondContact ND2-CD2 3.32Å; N344-S490 PolarHBondContact ND2-OG 2.66Å; N344-S490 VanDerWaalsContact ND2-OG 3.16Å
345	S	59.9	Low	57.5	Low	80 Å²	80	92.3 Å²	92.3	56%	0.559	53%	0.531	S	S	*	.	H	α-helix	trans	-85.4	-10.5	-178	-58.8	0	0	0	0	113.9	Q341 N342 V343 V347	Q341-S345 WeakPolarHBondContact O-CB 3.47Å; Q341-S345 PolarHBondContact O-N 3.41Å; Q341-S345 PolarHBondContact O-OG 3.11Å; N342-S345 PolarHBondContact O-N 3.17Å; V343-S345 VanDerWaalsContact C-N 3.31Å; V343-S345 PolarHBondContact O-N 2.57Å; S345-V347 VanDerWaalsContact O-CG2 3.28Å; S345-V347 WeakPolarHBondContact O-CG2 3.36Å; S345-V347 PolarHBondContact O-N 3.36Å
346	G	49.4	Very low	54.7	Low	64 Å²	64	98 Å²	98	66%	0.66	56%	0.556	S	S	*	*			trans	60.9	12.1	174.1	0	0	0	0	0	116.1	F348	G346-F348 PolarHBondContact O-N 3.27Å
347	V	36.9	Very low	52.1	Low	108 Å²	108	107.4 Å²	107.4	66%	0.655	60%	0.597	S	S	*	*			trans	-92.2	85.6	-175.9	-169.7	0	0	0	0	110.6	S345 S349	S345-V347 VanDerWaalsContact O-CG2 3.28Å; S345-V347 WeakPolarHBondContact O-CG2 3.36Å; S345-V347 PolarHBondContact O-N 3.36Å; V347-S349 PolarHBondContact O-N 3.15Å
348	F	29.6	Very low	49.4	Very low	202 Å²	202	113.1 Å²	113.1	89%	0.886	63%	0.627	S	S	*	*			trans	-70.8	97	148.8	-82	-87.1	0	0	0	107.4	G346	G346-F348 PolarHBondContact O-N 3.27Å
349	S	29.5	Very low	46.9	Very low	86 Å²	86	113.6 Å²	113.6	60%	0.601	64%	0.637	S	S	*	*			trans	-106.7	91.3	163.3	-117.4	0	0	0	0	108.6	V347 T351	V347-S349 PolarHBondContact O-N 3.15Å; S349-T351 VanDerWaalsContact C-N 3.32Å; S349-T351 PolarHBondContact O-N 3.17Å
350	E	27.6	Very low	44.5	Very low	187 Å²	187	120.4 Å²	120.4	87%	0.874	67%	0.666	S	S	*	*			trans	-57.5	98.3	155.6	-71	-176.9	154.3	0	0	108.2
351	T	31.5	Very low	42.1	Very low	110 Å²	110	127.2 Å²	127.2	68%	0.675	70%	0.701	S	S	*	*			trans	-127.8	81.9	160.1	44.2	0	0	0	0	108.8	S349 T353	S349-T351 VanDerWaalsContact C-N 3.32Å; S349-T351 PolarHBondContact O-N 3.17Å; T351-T353 PolarHBondContact O-N 2.58Å; T351-T353 VanDerWaalsContact O-N 3.15Å
352	N	27	Very low	39.7	Very low	166 Å²	166	127.3 Å²	127.3	89%	0.888	72%	0.719	S	S	*	*			trans	-60.7	103.9	153.1	-84.5	-42.6	0	0	0	108.2
353	T	32.5	Very low	37.5	Very low	113 Å²	113	133.3 Å²	133.3	69%	0.693	73%	0.733	S	S	*	*			trans	-140.4	91.1	162.8	-1.6	0	0	0	0	110.2	T351 L355	T351-T353 PolarHBondContact O-N 2.58Å; T351-T353 VanDerWaalsContact O-N 3.15Å; T353-L355 PolarHBondContact O-N 2.8Å
354	S	31	Very low	35.7	Very low	117 Å²	117	135.1 Å²	135.1	82%	0.818	75%	0.749	S	S	*	*			trans	-39.3	123.6	160.4	44	0	0	0	0	113.7
355	L	30	Very low	34.3	Very low	167 Å²	167	134.9 Å²	134.9	87%	0.874	76%	0.762	S	S	*	*			trans	-134	94.8	165.5	-109.3	146.3	0	0	0	108.9	T353	T353-L355 PolarHBondContact O-N 2.8Å
356	N	30.2	Very low	33.4	Very low	162 Å²	162	137.2 Å²	137.2	87%	0.866	77%	0.773	S	S	*	*			trans	-145.3	100.8	161.9	-106.4	-18.1	0	0	0	108.1
357	K	35.8	Very low	32.8	Very low	207 Å²	207	140.5 Å²	140.5	90%	0.9	78%	0.775	S	S	*	*			trans	-173.3	103.5	149.6	-107.9	170.9	-175.9	-179.6	0	110.6
358	I	30.2	Very low	32.8	Very low	154 Å²	154	141.7 Å²	141.7	79%	0.79	78%	0.783	S	S	*	*			trans	-61.2	145.2	152.2	-59	170.5	0	0	0	105.2
359	P	34.2	Very low	33.1	Very low	97 Å²	97	135.5 Å²	135.5	63%	0.63	78%	0.776	S	S	*	*				-160	171	59.5	47.3	-25.6	0	0	0	121.4
360	H	33.8	Very low	33.7	Very low	158 Å²	158	136.2 Å²	136.2	73%	0.731	79%	0.787	S	S	*	*			trans	75.8	115.6	148.5	-66.1	-50.2	0	0	0	121.7
361	I	33.3	Very low	34.5	Very low	162 Å²	162	132.7 Å²	132.7	83%	0.831	78%	0.781	S	S	*	*				70.9	118.7	128.3	-57.8	166.8	0	0	0	118
362	G	33.6	Very low	34.8	Very low	66 Å²	66	135.2 Å²	135.2	68%	0.68	79%	0.789	S	S	*	*			trans	120	87.4	134.6	0	0	0	0	0	118.3
363	R	34.4	Very low	35.4	Very low	245 Å²	245	131.1 Å²	131.1	93%	0.925	77%	0.774	S	S	*	*				66.4	104	128.3	-144.3	175.5	-169.5	-173.4	2.3	119.5
364	S	34.9	Very low	35.5	Very low	121 Å²	121	131.4 Å²	131.4	85%	0.846	78%	0.775	S	S	*	*				49.6	116.9	129.3	-173.7	0	0	0	0	120.3
365	G	35.7	Very low	35.8	Very low	61 Å²	61	132.2 Å²	132.2	63%	0.629	77%	0.771	S	S	*	*				136.9	103	116.7	0	0	0	0	0	118.2
366	V	39.6	Very low	36.1	Very low	129 Å²	129	129.5 Å²	129.5	78%	0.782	76%	0.761	S	S	*	*				75.6	105.8	129.5	-172.7	0	0	0	0	119.3
367	N	36.8	Very low	36.5	Very low	132 Å²	132	127.1 Å²	127.1	71%	0.706	76%	0.757	S	S	*	*				84.8	120.9	129.8	-71.8	1.3	0	0	0	124
368	T	38.1	Very low	36.6	Very low	134 Å²	134	121 Å²	121	82%	0.822	75%	0.745	S	S	*	*				77.6	124.5	125.2	58.5	0	0	0	0	120.1
369	G	35.1	Very low	37	Very low	72 Å²	72	120 Å²	120	74%	0.742	75%	0.746	S	S	*	*			trans	136.8	76	134.6	0	0	0	0	0	116.8
370	A	42.4	Very low	37.4	Very low	100 Å²	100	120.1 Å²	120.1	83%	0.826	75%	0.747	S	S	*	*			trans	47.8	152	134.4	0	0	0	0	0	123
371	P	45.4	Very low	37.5	Very low	114 Å²	114	123.7 Å²	123.7	74%	0.74	76%	0.756	S	S	*	*			trans	-116.9	-171.8	-150.5	40.2	-24.1	0	0	0	113.2
372	L	37.1	Very low	37.6	Very low	162 Å²	162	121.2 Å²	121.2	85%	0.848	75%	0.753	S	S	*	*			trans	143.9	141.3	156.4	-93.2	112.8	0	0	0	107.3
373	S	38.6	Very low	37.9	Very low	81 Å²	81	123 Å²	123	57%	0.566	76%	0.755	S	S	*	*			cis	-176.7	155.1	-9.3	-90.1	0	0	0	0	105.9
374	T	36.3	Very low	37.8	Very low	118 Å²	118	116.3 Å²	116.3	72%	0.724	75%	0.745	S	S	*	*			trans	60	137.8	144.3	52	0	0	0	0	118.5
375	D	36	Very low	37.9	Very low	135 Å²	135	117.1 Å²	117.1	72%	0.722	75%	0.745	S	S	*	*			cis	-175.6	147.8	17.6	-112.9	-8.3	0	0	0	110.3
376	T	36.5	Very low	37.8	Very low	109 Å²	109	120.3 Å²	120.3	67%	0.669	75%	0.752	S	S	*	*				76.6	124.2	128	-52	0	0	0	0	124
377	S	38.1	Very low	37.8	Very low	112 Å²	112	119 Å²	119	78%	0.783	75%	0.747	S	S	*	*			trans	76.7	144.4	144.7	70.6	0	0	0	0	119.5
378	A	38.7	Very low	37.8	Very low	78 Å²	78	120.1 Å²	120.1	65%	0.645	75%	0.752	S	S	*	*			cis	-169.8	141.5	0.9	0	0	0	0	0	110.6
379	T	38.5	Very low	37.6	Very low	135 Å²	135	120.9 Å²	120.9	83%	0.828	75%	0.751	S	S	*	*			trans	63.5	166.8	134.7	71.8	0	0	0	0	120.8
380	P	42.5	Very low	37.7	Very low	98 Å²	98	126.2 Å²	126.2	64%	0.636	76%	0.762	S	S	*	*				-128.4	-175.3	-102.3	26.3	0.2	0	0	0	111.9
381	Y	35.5	Very low	37.1	Very low	234 Å²	234	124.7 Å²	124.7	92%	0.918	76%	0.756	S	S	*	*			trans	-176.8	127.3	137.4	-92.5	-65	0	0	0	112.8
382	S	36.1	Very low	36.6	Very low	110 Å²	110	127.7 Å²	127.7	77%	0.769	77%	0.765	S	S	*	*			trans	-27.3	144.9	167.8	-155.4	0	0	0	0	121.2
383	S	40	Very low	36.7	Very low	103 Å²	103	125.2 Å²	125.2	72%	0.72	76%	0.759	S	S	*	*				158.9	103.1	116.9	48	0	0	0	0	110.9
384	S	32.6	Very low	36.5	Very low	104 Å²	104	127 Å²	127	73%	0.727	77%	0.768	S	S	*	*				59.9	117.1	103.2	72	0	0	0	0	116.3
385	V	35.7	Very low	36.2	Very low	138 Å²	138	127.2 Å²	127.2	84%	0.836	77%	0.769	S	S	*	*				170.9	132	114.3	161.6	0	0	0	0	109.2
386	T	33.8	Very low	35.9	Very low	128 Å²	128	130 Å²	130	79%	0.785	78%	0.778	S	S	*	*			trans	-91.8	-164.8	-175	49	0	0	0	0	111.6
387	P	41	Very low	35.5	Very low	102 Å²	102	127.8 Å²	127.8	66%	0.662	78%	0.777	S	S	*	*				-125	-179	-89.7	37.2	-18.2	0	0	0	111.5
388	N	35.6	Very low	35	Very low	155 Å²	155	128.7 Å²	128.7	83%	0.829	78%	0.782	S	S	*	*			trans	-170.4	127.8	138.2	-96.8	-20.9	0	0	0	114.6
389	N	34.1	Very low	34.5	Very low	150 Å²	150	132.2 Å²	132.2	80%	0.802	79%	0.79	S	S	*	*			trans	-28	147.5	165.1	-75.8	-35.4	0	0	0	118.8
390	L	37.1	Very low	34.3	Very low	184 Å²	184	129.8 Å²	129.8	96%	0.963	78%	0.779	S	S	*	*				-166.8	122.8	120.5	-97	156.7	0	0	0	109.4
391	G	30.7	Very low	33.9	Very low	69 Å²	69	130.2 Å²	130.2	71%	0.711	78%	0.779	S	S	*	*			trans	-106.6	175.3	-173.2	0	0	0	0	0	115
392	L	34.6	Very low	33.8	Very low	177 Å²	177	124.3 Å²	124.3	93%	0.927	76%	0.762	S	S	*	*			trans	-172.7	155	147.6	-93.8	161.9	0	0	0	108.2
393	P	38.1	Very low	33.4	Very low	110 Å²	110	123.4 Å²	123.4	71%	0.714	76%	0.756	S	S	*	*			trans	-106.4	171.1	-138.7	40.3	-35.8	0	0	0	115.4
394	P	34.9	Very low	32.8	Very low	118 Å²	118	128 Å²	128	77%	0.766	77%	0.766	S	S	*	*				-149.1	144.8	127.2	34.3	-15.5	0	0	0	116.8
395	V	30.3	Very low	32.7	Very low	122 Å²	122	125.6 Å²	125.6	74%	0.739	76%	0.758	S	S	*	*				33	134.5	127.4	-173.8	0	0	0	0	120.7
396	E	28.8	Very low	33.1	Very low	193 Å²	193	127.3 Å²	127.3	90%	0.902	76%	0.762	S	S	*	*			trans	80	126.6	159.3	-82.7	165.3	-160.7	0	0	119.8
397	G	28.6	Very low	34.3	Very low	63 Å²	63	130 Å²	130	65%	0.649	77%	0.766	S	S	*	*			trans	140.9	115.7	158.4	0	0	0	0	0	115.5	N399	G397-N399 PolarHBondContact O-N 3.37Å
398	C	27.3	Very low	35.8	Very low	132 Å²	132	128.1 Å²	128.1	89%	0.892	75%	0.75	S	S	*	*			trans	-31.7	117.9	171.5	-152.9	0	0	0	0	115
399	N	28.3	Very low	38	Very low	151 Å²	151	122.5 Å²	122.5	81%	0.807	72%	0.718	S	S	*	*			trans	-128.3	100.6	169.9	-77.8	-28.8	0	0	0	109.6	G397	G397-N399 PolarHBondContact O-N 3.37Å
400	S	34.4	Very low	40.4	Very low	85 Å²	85	118.4 Å²	118.4	59%	0.594	70%	0.699	S	S	*	*			trans	-119.8	86.1	157.6	170.1	0	0	0	0	106.9
401	V	33.6	Very low	42.7	Very low	107 Å²	107	111.5 Å²	111.5	65%	0.648	67%	0.672	S	S	*	*			trans	-82	119.2	167.5	177	0	0	0	0	106.4	S403	V401-S403 PolarHBondContact O-N 3.03Å
402	I	33.3	Very low	45.4	Very low	109 Å²	109	112 Å²	112	56%	0.559	66%	0.658	S	S	*	*			trans	-68.6	90.8	165.2	-60.2	172.1	0	0	0	105.3	A339	A339-I402 HydrophobicContact CB-CD1 3.95Å
403	S	28.5	Very low	48.2	Very low	92 Å²	92	104.1 Å²	104.1	64%	0.643	62%	0.617	S	S	*	*			trans	-86.4	135.4	171.2	-79.4	0	0	0	0	109.3	V401 G405	V401-S403 PolarHBondContact O-N 3.03Å; S403-G405 PolarHBondContact O-N 2.8Å; S403-G405 VanDerWaalsContact O-N 3.13Å
404	E	28	Very low	50.8	Low	200 Å²	200	107.1 Å²	107.1	94%	0.935	62%	0.619	S	S	*	*	S	Bend	trans	-46.4	111	179.1	-62.8	179.2	149.3	0	0	112.3
405	G	30.7	Very low	53.5	Low	53 Å²	53	103.6 Å²	103.6	55%	0.546	59%	0.591	S	S	.	*	S	Bend	trans	155.7	69.5	172.9	0	0	0	0	0	114.3	S403 E407	S403-G405 PolarHBondContact O-N 2.8Å; S403-G405 VanDerWaalsContact O-N 3.13Å; G405-E407 PolarHBondContact O-N 3.31Å
406	N	44	Very low	56.5	Low	173 Å²	173	100 Å²	100	93%	0.925	57%	0.569	S	S	*	*	S	Bend	trans	47.8	8.2	162.4	-114.7	41.7	0	0	0	119.9	L408	N406-L408 PolarHBondContact O-N 3.47Å
407	E	58.5	Low	59.6	Low	184 Å²	184	96.4 Å²	96.4	86%	0.86	55%	0.553	S	S	*	*			trans	-82.2	116.3	-180	-72.8	-172	173.8	0	0	110.1	G405	G405-E407 PolarHBondContact O-N 3.31Å
408	L	71.9	Confident	62.8	Low	63 Å²	63	93.6 Å²	93.6	33%	0.33	52%	0.523	S	S	.	.			trans	-59.4	140.7	175.8	-75.8	159.5	0	0	0	110.6	N406 T410	N406-L408 PolarHBondContact O-N 3.47Å; L408-T410 PolarHBondContact O-N 2.99Å; L408-T410 VanDerWaalsContact O-N 3.1Å
409	F	82.5	Confident	66	Low	37 Å²	37	89 Å²	89	16%	0.162	49%	0.487	C	S	.	.			trans	-61.4	114.8	177.1	-179.3	-91.2	0	0	0	111.1	T332 A335 Y336 A339 R498	T332-F409 HydrophobicContact CG2-CE1 4.2Å; A335-F409 HydrophobicContact CB-CE1 4.34Å; A335-F409 HydrophobicContact CB-CZ 3.81Å; Y336-F409 HydrophobicContact CD2-CB 3.69Å; Y336-F409 AromaticContact CD2-CD1 3.44Å; Y336-F409 HydrophobicContact CD2-CD1 3.44Å; Y336-F409 VanDerWaalsContact CD2-CD1 3.44Å; Y336-F409 HydrophobicContact CD2-CE1 4.21Å; Y336-F409 AromaticContact CD2-CG 3.66Å; Y336-F409 HydrophobicContact CD2-CG 3.66Å; Y336-F409 HydrophobicContact CE2-CB 3.89Å; Y336-F409 HydrophobicContact CE2-CD1 4.41Å; Y336-F409 HydrophobicContact CE2-CG 4.37Å; Y336-F409 AromaticContact CG-CD1 3.97Å; Y336-F409 HydrophobicContact CG-CD1 3.97Å; Y336-F409 HydrophobicContact CG-CE1 4.4Å; A339-F409 HydrophobicContact CB-CD2 4Å; A339-F409 HydrophobicContact CB-CE2 3.93Å; F409-R498 VanDerWaalsContact O-CZ 3.27Å; F409-R498 PolarHBondContact O-NH1 3.03Å; F409-R498 PolarHBondContact O-NH2 3.39Å
410	T	84.1	Confident	69.3	Low	65 Å²	65	81.8 Å²	81.8	40%	0.399	45%	0.448	S	S	.	.			trans	-100.4	-24.5	178.9	52.5	0	0	0	0	113	L408 N412 L413 F415	L408-T410 PolarHBondContact O-N 2.99Å; L408-T410 VanDerWaalsContact O-N 3.1Å; T410-N412 PolarHBondContact O-N 3.34Å; T410-L413 WeakPolarHBondContact O-CB 3.34Å; T410-L413 WeakPolarHBondContact O-CG 3.16Å; T410-L413 PolarHBondContact O-N 2.98Å; T410-F415 HydrophobicContact CG2-CD2 3.93Å; T410-F415 HydrophobicContact CG2-CE2 3.91Å
411	G	86	Confident	72.2	Confident	38 Å²	38	77.7 Å²	77.7	39%	0.392	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	-127.3	-175.8	0	0	0	0	0	111.8	L413	G411-L413 VanDerWaalsContact C-N 3.33Å
412	N	87	Confident	75.3	Confident	81 Å²	81	72.6 Å²	72.6	43%	0.433	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	1.8	174.2	61.3	-18.1	0	0	0	113.6	Q328 T332 T410	Q328-N412 PolarHBondContact O-ND2 3.35Å; T332-N412 WeakPolarHBondContact CB-OD1 3.35Å; T332-N412 WeakPolarHBondContact CG2-OD1 3.5Å; T332-N412 PolarHBondContact OG1-OD1 3.41Å; T410-N412 PolarHBondContact O-N 3.34Å
413	L	92.4	Very high	78.4	Confident	11 Å²	11	67.4 Å²	67.4	6%	0.058	36%	0.363	C	S	.	.			trans	-80.2	124.2	-178.7	-57.9	176.7	0	0	0	111.2	A322 T324 L329 T332 T410 G411 F415 V513	A322-L413 HydrophobicContact CB-CB 3.91Å; T324-L413 HydrophobicContact CG2-CD2 3.74Å; L329-L413 HydrophobicContact CD1-CD1 4.49Å; L329-L413 HydrophobicContact CD1-CD2 4.45Å; T332-L413 HydrophobicContact CG2-CD1 3.9Å; T332-L413 HydrophobicContact CG2-CG 3.79Å; T410-L413 WeakPolarHBondContact O-CB 3.34Å; T410-L413 WeakPolarHBondContact O-CG 3.16Å; T410-L413 PolarHBondContact O-N 2.98Å; G411-L413 VanDerWaalsContact C-N 3.33Å; L413-F415 HydrophobicContact CB-CD2 4.39Å; L413-F415 HydrophobicContact CB-CE2 3.8Å; L413-F415 HydrophobicContact CB-CZ 4.39Å; L413-F415 HydrophobicContact CD1-CE2 4.35Å; L413-F415 HydrophobicContact CD1-CZ 4.28Å; L413-V513 HydrophobicContact CD1-CB 4.32Å; L413-V513 HydrophobicContact CD1-CG1 4.28Å; L413-V513 HydrophobicContact CD1-CG2 4.08Å
414	K	92.8	Very high	81.5	Confident	173 Å²	173	66.3 Å²	66.3	75%	0.752	35%	0.347	S	S	*	.			trans	-99	107.7	174	-174	178.7	179.6	-179.9	0	110.3	A322	A322-K414 WeakPolarHBondContact CA-O 3.42Å; A322-K414 WeakPolarHBondContact CB-O 3.26Å
415	F	93.4	Very high	84.7	Confident	43 Å²	43	61 Å²	61	19%	0.189	32%	0.322	C	S	.	.			trans	-82	136.3	176.4	-71.4	-90	0	0	0	111.5	L320 A322 T410 L413 V513 D515	L320-F415 HydrophobicContact CB-CB 4.28Å; L320-F415 HydrophobicContact CB-CD1 4.05Å; A322-F415 HydrophobicContact CB-CD1 3.82Å; A322-F415 HydrophobicContact CB-CD2 4.17Å; A322-F415 HydrophobicContact CB-CE1 3.77Å; A322-F415 HydrophobicContact CB-CE2 4.11Å; A322-F415 HydrophobicContact CB-CG 4.02Å; A322-F415 HydrophobicContact CB-CZ 3.91Å; T410-F415 HydrophobicContact CG2-CD2 3.93Å; T410-F415 HydrophobicContact CG2-CE2 3.91Å; L413-F415 HydrophobicContact CB-CD2 4.39Å; L413-F415 HydrophobicContact CB-CE2 3.8Å; L413-F415 HydrophobicContact CB-CZ 4.39Å; L413-F415 HydrophobicContact CD1-CE2 4.35Å; L413-F415 HydrophobicContact CD1-CZ 4.28Å; F415-V513 HydrophobicContact CE1-CB 4.46Å; F415-V513 HydrophobicContact CE1-CG1 4.09Å; F415-V513 HydrophobicContact CZ-CB 4.43Å; F415-V513 HydrophobicContact CZ-CG1 3.89Å; F415-D515 HydrophobicContact CD1-CB 4.35Å; F415-D515 HydrophobicContact CE1-CB 4.13Å
416	V	93.3	Very high	87.8	Confident	46 Å²	46	59.7 Å²	59.7	28%	0.279	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.6	176	-176	0	0	0	0	109	V321 S418 E431	V321-V416 PolarHBondContact N-O 3.1Å; V321-V416 PolarHBondContact O-N 3.44Å; V416-S418 PolarHBondContact O-N 3.27Å; V416-S418 VanDerWaalsContact O-N 3.13Å; V416-S418 PolarHBondContact O-OG 3.25Å; V416-S418 VanDerWaalsContact O-OG 3.08Å; V416-E431 HydrophobicContact CG1-CG 3.88Å
417	E	93.6	Very high	90.3	Very high	119 Å²	119	51.5 Å²	51.5	56%	0.556	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.9	114.1	171.7	-172.6	175.6	-166.2	0	0	109.6	L320	L320-E417 HydrophobicContact CD2-CB 4.19Å
418	S	94.3	Very high	92.2	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.028	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	137.7	-173.2	-58.2	0	0	0	0	110.1	L319 V416 T430	L319-S418 PolarHBondContact N-O 3.01Å; L319-S418 PolarHBondContact O-N 3.34Å; L319-S418 VanDerWaalsContact O-O 3.07Å; V416-S418 PolarHBondContact O-N 3.27Å; V416-S418 VanDerWaalsContact O-N 3.13Å; V416-S418 PolarHBondContact O-OG 3.25Å; V416-S418 VanDerWaalsContact O-OG 3.08Å; S418-T430 CarbonylContact C-O 3.57Å; S418-T430 WeakPolarHBondContact CA-O 3.36Å; S418-T430 VanDerWaalsContact CB-O 3.27Å; S418-T430 WeakPolarHBondContact CB-O 3.39Å
419	R	95	Very high	93.4	Very high	34 Å²	34	39.9 Å²	39.9	13%	0.128	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	115.2	171.3	-177.5	161.6	-74.8	128.3	12.5	108.4	E296 D318 F421 T430 Y450	E296-R419 WeakPolarHBondContact OE1-CD 3.47Å; E296-R419 IonicContact OE1-NE 3.36Å; D318-R419 VanDerWaalsContact OD1-CG 3.32Å; D318-R419 WeakPolarHBondContact OD1-CG 3.48Å; D318-R419 IonicContact OD1-CZ 2.8Å; D318-R419 IonicContact OD1-NE 3.1Å; D318-R419 PolarHBondContact OD1-NE 2.79Å; D318-R419 IonicContact OD1-NH2 3.76Å; D318-R419 PolarHBondContact OD1-NH2 3.16Å; D318-R419 IonicContact OD2-CZ 3.77Å; D318-R419 IonicContact OD2-NE 3.7Å; D318-R419 IonicContact OD2-NH2 3.33Å; D318-R419 PolarHBondContact OD2-NH2 3.02Å; R419-F421 HydrophobicContact CB-CE2 4.48Å; R419-F421 HydrophobicContact CG-CE2 3.7Å; R419-F421 HydrophobicContact CG-CZ 3.85Å; R419-T430 PolarHBondContact N-O 3.04Å; R419-T430 PolarHBondContact O-N 3.38Å; R419-T430 PolarHBondContact O-OG1 2.63Å; R419-Y450 PolarHBondContact NH1-OH 3.36Å
420	L	97	Very high	94	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	138.4	-176	-58.5	-172.6	0	0	0	110.8	R316 S317 L319 V321 L427 L428 V429 I514 W525	R316-L420 WeakPolarHBondContact CA-O 3.41Å; S317-L420 PolarHBondContact N-O 3.29Å; S317-L420 PolarHBondContact O-N 2.87Å; L319-L420 HydrophobicContact CB-CD1 4.46Å; L319-L420 HydrophobicContact CD1-CD1 4.09Å; V321-L420 HydrophobicContact CG2-CD1 4.06Å; V321-L420 HydrophobicContact CG2-CD2 4.1Å; V321-L420 HydrophobicContact CG2-CG 4.32Å; L420-L427 HydrophobicContact CB-CD1 4.41Å; L420-L428 WeakPolarHBondContact CA-O 3.48Å; L420-V429 HydrophobicContact CD2-CB 3.96Å; L420-V429 HydrophobicContact CD2-CG1 3.78Å; L420-V429 HydrophobicContact CD2-CG2 3.83Å; L420-I514 HydrophobicContact CD1-CD1 4Å; L420-W525 HydrophobicContact CB-CH2 3.51Å; L420-W525 HydrophobicContact CB-CZ2 3.67Å; L420-W525 HydrophobicContact CD1-CH2 3.75Å; L420-W525 HydrophobicContact CD1-CZ2 4.03Å; L420-W525 HydrophobicContact CD1-CZ3 4.29Å; L420-W525 HydrophobicContact CG-CH2 4.3Å; L420-W525 HydrophobicContact CG-CZ2 4.46Å
421	F	97.3	Very high	94.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	109.6	172.9	-59.5	-96.8	0	0	0	109.2	E296 A297 I300 R316 R419 F423 L428 T430 Y450	E296-F421 HydrophobicContact CG-CE1 4.18Å; E296-F421 HydrophobicContact CG-CZ 4.13Å; A297-F421 HydrophobicContact CB-CD1 4.15Å; A297-F421 HydrophobicContact CB-CE1 4.04Å; I300-F421 HydrophobicContact CD1-CD2 3.76Å; I300-F421 HydrophobicContact CD1-CE2 3.72Å; I300-F421 HydrophobicContact CD1-CG 4.42Å; I300-F421 HydrophobicContact CD1-CZ 4.34Å; I300-F421 HydrophobicContact CG1-CE2 4.15Å; R316-F421 HydrophobicContact CB-CD1 4.4Å; R316-F421 HydrophobicContact CG-CD1 3.95Å; R316-F421 HydrophobicContact CG-CE1 3.79Å; R316-F421 HydrophobicContact CG-CZ 4.43Å; R419-F421 HydrophobicContact CB-CE2 4.48Å; R419-F421 HydrophobicContact CG-CE2 3.7Å; R419-F421 HydrophobicContact CG-CZ 3.85Å; F421-F423 HydrophobicContact CB-CD2 4.14Å; F421-F423 HydrophobicContact CB-CE2 3.53Å; F421-F423 HydrophobicContact CB-CZ 4.36Å; F421-F423 HydrophobicContact CG-CE2 4.46Å; F421-L428 HydrophobicContact CB-CB 4.33Å; F421-L428 PolarHBondContact N-O 3.32Å; F421-L428 PolarHBondContact O-N 2.73Å; F421-T430 HydrophobicContact CD2-CG2 4.3Å; F421-T430 HydrophobicContact CE2-CG2 4.31Å; F421-Y450 HydrophobicContact CE2-CD2 4.31Å; F421-Y450 HydrophobicContact CZ-CD2 4.17Å; F421-Y450 HydrophobicContact CZ-CE2 4.15Å
422	L	97.7	Very high	94.1	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	109.4	174.1	-179.5	62.5	0	0	0	108.9	L314 L315 L427 V458 M461 W525 Q528 L529 I532	L314-L422 HydrophobicContact CB-CD2 4.41Å; L314-L422 HydrophobicContact CB-CG 4.3Å; L314-L422 WeakPolarHBondContact CB-O 3.37Å; L314-L422 HydrophobicContact CD1-CG 4.39Å; L314-L422 PolarHBondContact N-O 3.1Å; L315-L422 HydrophobicContact CB-CB 4.23Å; L315-L422 HydrophobicContact CB-CD2 4.46Å; L315-L422 PolarHBondContact N-O 3.11Å; L315-L422 PolarHBondContact O-N 2.73Å; L422-L427 HydrophobicContact CB-CD1 4.18Å; L422-L427 HydrophobicContact CD1-CB 4.12Å; L422-L427 HydrophobicContact CD1-CD1 4.27Å; L422-V458 HydrophobicContact CD1-CG2 4.39Å; L422-M461 HydrophobicContact CD1-CE 4.23Å; L422-W525 HydrophobicContact CB-CH2 4.17Å; L422-W525 HydrophobicContact CB-CZ3 4.24Å; L422-W525 HydrophobicContact CD2-CZ3 4.43Å; L422-Q528 HydrophobicContact CD2-CB 3.93Å; L422-L529 HydrophobicContact CD2-CD2 4.49Å; L422-I532 HydrophobicContact CD1-CD1 4.04Å; L422-I532 HydrophobicContact CD2-CD1 4Å; L422-I532 HydrophobicContact CG-CD1 4.36Å
423	F	97.4	Very high	93.7	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	164.8	170.4	-62.9	-105.6	0	0	0	110.6	I294 A297 I307 L310 N312 I313 F421 Q425 M426 L428 V458	I294-F423 HydrophobicContact CD1-CE1 4.38Å; A297-F423 HydrophobicContact CB-CZ 4.25Å; I307-F423 HydrophobicContact CG2-CE1 3.75Å; I307-F423 HydrophobicContact CG2-CZ 3.65Å; L310-F423 HydrophobicContact CB-CB 3.81Å; L310-F423 HydrophobicContact CB-CD1 3.64Å; L310-F423 HydrophobicContact CB-CD2 4.37Å; L310-F423 HydrophobicContact CB-CE1 4.27Å; L310-F423 HydrophobicContact CB-CG 3.7Å; L310-F423 HydrophobicContact CD1-CD1 4.37Å; L310-F423 HydrophobicContact CD1-CD2 3.99Å; L310-F423 HydrophobicContact CD1-CE1 4.42Å; L310-F423 HydrophobicContact CD1-CE2 4.07Å; L310-F423 HydrophobicContact CD1-CG 4.16Å; L310-F423 HydrophobicContact CD1-CZ 4.3Å; L310-F423 WeakPolarHBondContact O-CB 3.49Å; N312-F423 CarbonylContact O-C 3.56Å; N312-F423 VanDerWaalsContact O-CA 3.29Å; N312-F423 WeakPolarHBondContact O-CA 3.27Å; I313-F423 HydrophobicContact CD1-CE1 3.71Å; I313-F423 HydrophobicContact CD1-CZ 3.76Å; I313-F423 HydrophobicContact CG1-CD1 3.53Å; I313-F423 HydrophobicContact CG1-CE1 3.17Å; I313-F423 HydrophobicContact CG1-CE2 4.24Å; I313-F423 HydrophobicContact CG1-CG 4.22Å; I313-F423 HydrophobicContact CG1-CZ 3.55Å; F421-F423 HydrophobicContact CB-CD2 4.14Å; F421-F423 HydrophobicContact CB-CE2 3.53Å; F421-F423 HydrophobicContact CB-CZ 4.36Å; F421-F423 HydrophobicContact CG-CE2 4.46Å; F423-Q425 PolarHBondContact O-N 3.1Å; F423-M426 WeakPolarHBondContact CA-O 3.46Å; F423-M426 VanDerWaalsContact CB-O 3.28Å; F423-M426 WeakPolarHBondContact CB-O 3.32Å; F423-M426 PolarHBondContact N-O 3.4Å; F423-M426 PolarHBondContact O-N 2.86Å; F423-L428 HydrophobicContact CD2-CD1 4.33Å; F423-L428 HydrophobicContact CD2-CG 4.23Å; F423-L428 HydrophobicContact CE2-CD1 3.64Å; F423-L428 HydrophobicContact CE2-CG 3.98Å; F423-L428 HydrophobicContact CZ-CD1 4.37Å; F423-V458 WeakPolarHBondContact O-CG2 3.42Å
424	E	94.1	Very high	92.5	Very high	68 Å²	68	46.8 Å²	46.8	32%	0.318	22%	0.22	S	C	.	.	S	Bend	trans	-53.4	-33.3	173	-72.5	171.5	165.9	0	0	113.4	N312 L314	N312-E424 HydrophobicContact CB-CG 4.25Å; N312-E424 PolarHBondContact N-OE2 3.25Å; N312-E424 PolarHBondContact ND2-OE1 3.35Å; N312-E424 PolarHBondContact O-N 3.02Å; L314-E424 HydrophobicContact CD1-CG 4.44Å; L314-E424 HydrophobicContact CD2-CG 3.82Å; L314-E424 HydrophobicContact CG-CG 4.17Å
425	Q	94.8	Very high	91	Very high	89 Å²	89	42.7 Å²	42.7	42%	0.416	21%	0.211	S	C	.	.	S	Bend	trans	-109.2	-17.2	-177.1	-58.8	177.5	37.1	0	0	114.5	A309 L310 F423 V458	A309-Q425 PolarHBondContact O-NE2 3.5Å; L310-Q425 VanDerWaalsContact O-CB 3.24Å; L310-Q425 WeakPolarHBondContact O-CB 3.38Å; L310-Q425 WeakPolarHBondContact O-CG 3.31Å; L310-Q425 PolarHBondContact O-N 3.15Å; F423-Q425 PolarHBondContact O-N 3.1Å; Q425-V458 VanDerWaalsContact C-CG2 3.42Å; Q425-V458 WeakPolarHBondContact O-CB 3.35Å; Q425-V458 PolarHBondContact O-N 3.3Å
426	M	96.7	Very high	89.1	Confident	25 Å²	25	50.2 Å²	50.2	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	140.3	-171.9	-170.5	163.8	-85.2	0	0	112.6	F303 L310 F423 L428 A455 I456 N457	F303-M426 HydrophobicContact CE2-SD 4.21Å; F303-M426 HydrophobicContact CZ-SD 4.36Å; L310-M426 HydrophobicContact CD1-CB 4.41Å; L310-M426 HydrophobicContact CD2-CB 4.03Å; L310-M426 HydrophobicContact CD2-SD 3.96Å; F423-M426 WeakPolarHBondContact CA-O 3.46Å; F423-M426 VanDerWaalsContact CB-O 3.28Å; F423-M426 WeakPolarHBondContact CB-O 3.32Å; F423-M426 PolarHBondContact N-O 3.4Å; F423-M426 PolarHBondContact O-N 2.86Å; M426-L428 HydrophobicContact CG-CD2 3.84Å; M426-L428 HydrophobicContact SD-CD2 3.86Å; M426-A455 HydrophobicContact CE-CB 4.31Å; M426-A455 HydrophobicContact CG-CB 4.13Å; M426-A455 HydrophobicContact SD-CB 3.6Å; M426-A455 VanDerWaalsContact SD-CB 3.6Å; M426-I456 CarbonylContact C-O 3.55Å; M426-I456 VanDerWaalsContact CA-O 3.31Å; M426-I456 WeakPolarHBondContact CA-O 3.44Å; M426-I456 WeakPolarHBondContact CG-O 3.38Å; M426-N457 HydrophobicContact CE-CB 4.49Å; M426-N457 WeakPolarHBondContact CE-OD1 3.35Å
427	L	97.5	Very high	87.4	Confident	1 Å²	1	59 Å²	59	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	125.4	164.6	174.1	62.4	0	0	0	109	L420 L422 A455 I456 M461 I501 W525	L420-L427 HydrophobicContact CB-CD1 4.41Å; L422-L427 HydrophobicContact CB-CD1 4.18Å; L422-L427 HydrophobicContact CD1-CB 4.12Å; L422-L427 HydrophobicContact CD1-CD1 4.27Å; L427-A455 WeakPolarHBondContact O-CA 3.43Å; L427-I456 HydrophobicContact CB-CB 4.4Å; L427-I456 HydrophobicContact CD2-CD1 4.18Å; L427-I456 PolarHBondContact N-O 3.34Å; L427-I456 PolarHBondContact O-N 3.35Å; L427-M461 HydrophobicContact CB-SD 4.19Å; L427-M461 HydrophobicContact CD2-SD 4.09Å; L427-I501 HydrophobicContact CD2-CD1 3.64Å; L427-I501 HydrophobicContact CD2-CG2 4.36Å; L427-W525 HydrophobicContact CD1-CH2 3.87Å; L427-W525 HydrophobicContact CD1-CZ3 3.95Å
428	L	97.5	Very high	85.2	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	130.7	171.9	-55	-175	0	0	0	110.5	I300 F303 L310 L420 F421 F423 M426 F452 A455	I300-L428 HydrophobicContact CD1-CD1 4.01Å; F303-L428 HydrophobicContact CD2-CD1 4.45Å; F303-L428 HydrophobicContact CD2-CD2 4Å; F303-L428 HydrophobicContact CE2-CD1 4.47Å; F303-L428 HydrophobicContact CE2-CD2 3.58Å; F303-L428 HydrophobicContact CZ-CD2 4.23Å; L310-L428 HydrophobicContact CD1-CD1 3.88Å; L310-L428 HydrophobicContact CD1-CD2 4.18Å; L310-L428 HydrophobicContact CD1-CG 4.2Å; L420-L428 WeakPolarHBondContact CA-O 3.48Å; F421-L428 HydrophobicContact CB-CB 4.33Å; F421-L428 PolarHBondContact N-O 3.32Å; F421-L428 PolarHBondContact O-N 2.73Å; F423-L428 HydrophobicContact CD2-CD1 4.33Å; F423-L428 HydrophobicContact CD2-CG 4.23Å; F423-L428 HydrophobicContact CE2-CD1 3.64Å; F423-L428 HydrophobicContact CE2-CG 3.98Å; F423-L428 HydrophobicContact CZ-CD1 4.37Å; M426-L428 HydrophobicContact CG-CD2 3.84Å; M426-L428 HydrophobicContact SD-CD2 3.86Å; L428-F452 HydrophobicContact CD2-CE2 4.3Å; L428-A455 HydrophobicContact CD2-CB 3.91Å
429	V	96.7	Very high	83.1	Confident	4 Å²	4	68.2 Å²	68.2	2%	0.024	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	124.6	173	-175.6	0	0	0	0	108.2	L420 K453 A454 Y512	L420-V429 HydrophobicContact CD2-CB 3.96Å; L420-V429 HydrophobicContact CD2-CG1 3.78Å; L420-V429 HydrophobicContact CD2-CG2 3.83Å; V429-K453 PolarHBondContact O-N 2.73Å; V429-A454 HydrophobicContact CB-CB 4.19Å; V429-A454 HydrophobicContact CG2-CB 4.39Å; V429-A454 PolarHBondContact N-O 2.83Å; V429-A454 PolarHBondContact O-N 3.21Å; V429-Y512 HydrophobicContact CG2-CD1 4.32Å; V429-Y512 HydrophobicContact CG2-CE1 4.26Å
430	T	95.6	Very high	80.9	Confident	0 Å²	0	71 Å²	71	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	152.4	-178.3	75.2	0	0	0	0	111.1	I300 S418 R419 F421 Q451	I300-T430 HydrophobicContact CD1-CG2 3.95Å; I300-T430 HydrophobicContact CG1-CG2 3.99Å; I300-T430 HydrophobicContact CG2-CG2 4.04Å; S418-T430 CarbonylContact C-O 3.57Å; S418-T430 WeakPolarHBondContact CA-O 3.36Å; S418-T430 VanDerWaalsContact CB-O 3.27Å; S418-T430 WeakPolarHBondContact CB-O 3.39Å; R419-T430 PolarHBondContact N-O 3.04Å; R419-T430 PolarHBondContact O-N 3.38Å; R419-T430 PolarHBondContact O-OG1 2.63Å; F421-T430 HydrophobicContact CD2-CG2 4.3Å; F421-T430 HydrophobicContact CE2-CG2 4.31Å; T430-Q451 VanDerWaalsContact CA-O 3.26Å; T430-Q451 WeakPolarHBondContact CA-O 3.42Å; T430-Q451 WeakPolarHBondContact CB-O 3.45Å
431	E	90.5	Very high	78.6	Confident	58 Å²	58	78 Å²	78	27%	0.271	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	143.6	173.2	-75.7	177.5	-159.5	0	0	110.2	V416 V433 Y450 Q451 K453	V416-E431 HydrophobicContact CG1-CG 3.88Å; E431-V433 PolarHBondContact O-N 3.4Å; E431-Y450 CarbonylContact O-C 3.48Å; E431-Q451 PolarHBondContact N-O 2.75Å; E431-Q451 PolarHBondContact O-N 2.98Å; E431-K453 HydrophobicContact CB-CG 4.2Å; E431-K453 HydrophobicContact CG-CD 4.43Å; E431-K453 HydrophobicContact CG-CG 3.78Å; E431-K453 WeakPolarHBondContact OE1-CE 3.34Å; E431-K453 WeakPolarHBondContact OE2-CE 3.38Å; E431-K453 IonicContact OE2-NZ 3.05Å; E431-K453 PolarHBondContact OE2-NZ 3.39Å; E431-K453 VanDerWaalsContact OE2-NZ 3.07Å
432	E	81.3	Confident	76.3	Confident	78 Å²	78	82.2 Å²	82.2	36%	0.364	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	123	175	-173.8	167.7	-171.7	0	0	110.9	K434 S448	E432-K434 PolarHBondContact O-N 2.94Å; E432-S448 WeakPolarHBondContact OE1-CB 3.48Å; E432-S448 PolarHBondContact OE1-OG 3.34Å
433	V	78.2	Confident	74	Confident	66 Å²	66	85.7 Å²	85.7	40%	0.4	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	108.4	172.9	-175.4	0	0	0	0	108.5	E431 T449 Q451	E431-V433 PolarHBondContact O-N 3.4Å; V433-T449 PolarHBondContact N-O 2.9Å; V433-Q451 HydrophobicContact CG2-CB 3.55Å
434	K	68.2	Low	71.5	Confident	174 Å²	174	91.3 Å²	91.3	76%	0.757	45%	0.454	S	S	*	.			trans	-62.4	124.4	169.2	-65.5	-175.6	-177.9	178.3	0	108.6	E432 K436	E432-K434 PolarHBondContact O-N 2.94Å; K434-K436 PolarHBondContact O-N 3.29Å; K434-K436 VanDerWaalsContact O-N 3.14Å
435	P	61.4	Low	69.4	Low	88 Å²	88	92.5 Å²	92.5	57%	0.571	46%	0.459	S	S	*	.			trans	-61.6	118.6	-176.1	22.5	-31.7	0	0	0	110.7	R437	P435-R437 PolarHBondContact O-N 2.8Å
436	K	53.1	Low	67.4	Low	200 Å²	200	90.9 Å²	90.9	87%	0.87	46%	0.457	S	S	*	.			trans	-86.2	74.9	173.1	-79	-177.2	174.6	177.2	0	110.1	K434	K434-K436 PolarHBondContact O-N 3.29Å; K434-K436 VanDerWaalsContact O-N 3.14Å
437	R	57.5	Low	65.5	Low	231 Å²	231	93.6 Å²	93.6	87%	0.872	47%	0.469	S	S	*	.	S	Bend	trans	163.8	155.9	156.5	-94.6	161.1	-171.5	151.2	1.1	110.5	P435 V439	P435-R437 PolarHBondContact O-N 2.8Å; R437-V439 PolarHBondContact O-N 3.32Å
438	R	47.9	Very low	63.8	Low	248 Å²	248	95.1 Å²	95.1	94%	0.936	48%	0.48	S	S	*	.			trans	-65.1	100.7	169.6	-78.7	-175.2	-166.7	179.8	4.7	109.1	T440	R438-T440 PolarHBondContact O-N 3.38Å
439	V	49.6	Very low	62.9	Low	69 Å²	69	96.7 Å²	96.7	42%	0.418	49%	0.49	S	S	.	.			trans	-44.2	118.9	164.2	168.2	0	0	0	0	109.8	R437 D443 S446	R437-V439 PolarHBondContact O-N 3.32Å; V439-D443 HydrophobicContact CB-CB 4.33Å; V439-D443 HydrophobicContact CG1-CB 3.34Å; V439-S446 WeakPolarHBondContact CG1-OG 3.34Å
440	T	49.3	Very low	62.5	Low	91 Å²	91	97 Å²	97	56%	0.558	49%	0.491	S	S	*	.			trans	-76.8	157.1	169.3	44.6	0	0	0	0	109.5	R438 S442 D443	R438-T440 PolarHBondContact O-N 3.38Å; T440-S442 PolarHBondContact O-N 2.9Å; T440-S442 PolarHBondContact OG1-OG 2.71Å; T440-D443 WeakPolarHBondContact O-CB 3.35Å; T440-D443 PolarHBondContact O-N 3.27Å
441	T	48.1	Very low	62.4	Low	149 Å²	149	101.3 Å²	101.3	91%	0.914	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-5	-173.2	47.1	0	0	0	0	116
442	S	48.6	Very low	62.6	Low	87 Å²	87	100.7 Å²	100.7	61%	0.608	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-16.1	170.9	55.2	0	0	0	0	114.1	T440 T444	T440-S442 PolarHBondContact O-N 2.9Å; T440-S442 PolarHBondContact OG1-OG 2.71Å; S442-T444 VanDerWaalsContact C-N 3.27Å; S442-T444 PolarHBondContact O-N 3.14Å
443	D	50.2	Low	63.3	Low	74 Å²	74	101.1 Å²	101.1	40%	0.396	51%	0.508	S	S	.	.			trans	-91.2	39.2	-174.4	-82.1	-16.2	0	0	0	111.7	V439 T440 F445 S446	V439-D443 HydrophobicContact CB-CB 4.33Å; V439-D443 HydrophobicContact CG1-CB 3.34Å; T440-D443 WeakPolarHBondContact O-CB 3.35Å; T440-D443 PolarHBondContact O-N 3.27Å; D443-F445 PolarHBondContact O-N 3.04Å; D443-S446 VanDerWaalsContact O-CB 3.26Å; D443-S446 WeakPolarHBondContact O-CB 3.4Å; D443-S446 PolarHBondContact O-N 3.08Å; D443-S446 PolarHBondContact O-OG 2.98Å
444	T	45.3	Very low	64.1	Low	117 Å²	117	98.8 Å²	98.8	72%	0.718	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-15.4	177.4	-32.7	0	0	0	0	112.2	S442	S442-T444 VanDerWaalsContact C-N 3.27Å; S442-T444 PolarHBondContact O-N 3.14Å
445	F	50.2	Low	65.4	Low	94 Å²	94	91.5 Å²	91.5	41%	0.412	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.4	170.7	-102.1	-88.8	0	0	0	115	A218 L219 D443 Q447	A218-F445 HydrophobicContact CB-CE1 4.16Å; A218-F445 HydrophobicContact CB-CE2 4.15Å; A218-F445 HydrophobicContact CB-CZ 3.59Å; L219-F445 HydrophobicContact CD2-CB 3.89Å; L219-F445 HydrophobicContact CD2-CD1 4.37Å; L219-F445 HydrophobicContact CD2-CG 4.16Å; D443-F445 PolarHBondContact O-N 3.04Å; F445-Q447 PolarHBondContact O-N 3.37Å
446	S	51.9	Low	67	Low	55 Å²	55	87.3 Å²	87.3	39%	0.385	44%	0.441	S	S	.	.			trans	-76.3	42.8	179.8	77	0	0	0	0	113.5	V439 D443 S448	V439-S446 WeakPolarHBondContact CG1-OG 3.34Å; D443-S446 VanDerWaalsContact O-CB 3.26Å; D443-S446 WeakPolarHBondContact O-CB 3.4Å; D443-S446 PolarHBondContact O-N 3.08Å; D443-S446 PolarHBondContact O-OG 2.98Å; S446-S448 PolarHBondContact O-N 3.25Å
447	Q	57.6	Low	69	Low	81 Å²	81	81 Å²	81	38%	0.379	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-60.7	139.2	161.3	-70.9	-177.1	-15.8	0	0	107.9	F445 T449	F445-Q447 PolarHBondContact O-N 3.37Å; Q447-T449 PolarHBondContact O-N 3.25Å
448	S	61.4	Low	70.8	Confident	33 Å²	33	70.5 Å²	70.5	23%	0.231	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-49.6	132.2	-176.3	46.8	0	0	0	0	110.3	E432 S446	E432-S448 WeakPolarHBondContact OE1-CB 3.48Å; E432-S448 PolarHBondContact OE1-OG 3.34Å; S446-S448 PolarHBondContact O-N 3.25Å
449	T	77.7	Confident	73	Confident	34 Å²	34	63.4 Å²	63.4	21%	0.209	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	142	-178.4	-73.1	0	0	0	0	108.2	R215 R299 D301 V433 Q447	R215-T449 PolarHBondContact NH1-OG1 3.25Å; R215-T449 PolarHBondContact NH2-OG1 3.34Å; R299-T449 WeakPolarHBondContact O-CG2 3.45Å; D301-T449 HydrophobicContact CB-CG2 3.68Å; D301-T449 WeakPolarHBondContact OD2-CG2 3.47Å; V433-T449 PolarHBondContact N-O 2.9Å; Q447-T449 PolarHBondContact O-N 3.25Å
450	Y	89.4	Confident	75	Confident	9 Å²	9	63.9 Å²	63.9	4%	0.035	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	123.7	179.5	-47.5	-43.8	0	0	0	108.7	E296 R299 I300 D301 R419 F421 E431	E296-Y450 HydrophobicContact CG-CE2 3.81Å; E296-Y450 PolarHBondContact OE1-OH 3.38Å; R299-Y450 HydrophobicContact CB-CD2 4.03Å; R299-Y450 HydrophobicContact CB-CE2 4.1Å; R299-Y450 PolarHBondContact O-N 3.07Å; R299-Y450 VanDerWaalsContact O-N 3.08Å; I300-Y450 CarbonylContact C-O 3.46Å; I300-Y450 VanDerWaalsContact CA-O 3.29Å; I300-Y450 WeakPolarHBondContact CA-O 3.42Å; I300-Y450 HydrophobicContact CG1-CD2 4.18Å; D301-Y450 PolarHBondContact N-O 3.12Å; R419-Y450 PolarHBondContact NH1-OH 3.36Å; F421-Y450 HydrophobicContact CE2-CD2 4.31Å; F421-Y450 HydrophobicContact CZ-CD2 4.17Å; F421-Y450 HydrophobicContact CZ-CE2 4.15Å; E431-Y450 CarbonylContact O-C 3.48Å
451	Q	92.7	Very high	77.2	Confident	91 Å²	91	59.8 Å²	59.8	43%	0.425	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125.6	173.7	-171.9	177.5	39.4	0	0	109.1	T430 E431 V433 K453	T430-Q451 VanDerWaalsContact CA-O 3.26Å; T430-Q451 WeakPolarHBondContact CA-O 3.42Å; T430-Q451 WeakPolarHBondContact CB-O 3.45Å; E431-Q451 PolarHBondContact N-O 2.75Å; E431-Q451 PolarHBondContact O-N 2.98Å; V433-Q451 HydrophobicContact CG2-CB 3.55Å; Q451-K453 PolarHBondContact O-N 2.98Å
452	F	95.4	Very high	79.3	Confident	46 Å²	46	55.9 Å²	55.9	20%	0.202	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	131.5	170.1	174	-106.9	0	0	0	111	I300 D301 F303 L428 A454 A455	I300-F452 HydrophobicContact CG2-CB 3.92Å; D301-F452 VanDerWaalsContact O-CB 3.31Å; D301-F452 WeakPolarHBondContact O-CB 3.25Å; D301-F452 PolarHBondContact O-N 3.47Å; F303-F452 HydrophobicContact CB-CB 4.35Å; F303-F452 HydrophobicContact CB-CD2 4.23Å; F303-F452 HydrophobicContact CB-CG 4.25Å; F303-F452 AromaticContact CD2-CD2 3.83Å; F303-F452 HydrophobicContact CD2-CD2 3.83Å; F303-F452 AromaticContact CD2-CE2 3.69Å; F303-F452 HydrophobicContact CD2-CE2 3.69Å; F303-F452 HydrophobicContact CD2-CG 4.45Å; F303-F452 HydrophobicContact CD2-CZ 4.21Å; F303-F452 HydrophobicContact CE2-CE2 4.32Å; L428-F452 HydrophobicContact CD2-CE2 4.3Å; F452-A454 VanDerWaalsContact CE2-C 3.41Å; F452-A454 VanDerWaalsContact CE2-O 3.23Å; F452-A454 WeakPolarHBondContact CE2-O 3.47Å; F452-A455 HydrophobicContact CE2-CB 3.8Å; F452-A455 HydrophobicContact CZ-CB 3.78Å
453	K	95.1	Very high	81.4	Confident	87 Å²	87	52.3 Å²	52.3	38%	0.378	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	-50.5	175.2	-68.2	-53.1	-158.6	-168	0	113.3	V429 E431 Q451	V429-K453 PolarHBondContact O-N 2.73Å; E431-K453 HydrophobicContact CB-CG 4.2Å; E431-K453 HydrophobicContact CG-CD 4.43Å; E431-K453 HydrophobicContact CG-CG 3.78Å; E431-K453 WeakPolarHBondContact OE1-CE 3.34Å; E431-K453 WeakPolarHBondContact OE2-CE 3.38Å; E431-K453 IonicContact OE2-NZ 3.05Å; E431-K453 PolarHBondContact OE2-NZ 3.39Å; E431-K453 VanDerWaalsContact OE2-NZ 3.07Å; Q451-K453 PolarHBondContact O-N 2.98Å
454	A	95	Very high	83.4	Confident	16 Å²	16	50.1 Å²	50.1	13%	0.132	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	157.5	-176.5	0	0	0	0	0	112	V429 F452 Y512	V429-A454 HydrophobicContact CB-CB 4.19Å; V429-A454 HydrophobicContact CG2-CB 4.39Å; V429-A454 PolarHBondContact N-O 2.83Å; V429-A454 PolarHBondContact O-N 3.21Å; F452-A454 VanDerWaalsContact CE2-C 3.41Å; F452-A454 VanDerWaalsContact CE2-O 3.23Å; F452-A454 WeakPolarHBondContact CE2-O 3.47Å; A454-Y512 HydrophobicContact CB-CE1 3.95Å; A454-Y512 VanDerWaalsContact CB-OH 3.27Å; A454-Y512 WeakPolarHBondContact CB-OH 3.48Å
455	A	95.7	Very high	85.6	Confident	21 Å²	21	46.4 Å²	46.4	17%	0.174	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	133.7	176.2	0	0	0	0	0	109.6	M426 L427 L428 F452	M426-A455 HydrophobicContact CE-CB 4.31Å; M426-A455 HydrophobicContact CG-CB 4.13Å; M426-A455 HydrophobicContact SD-CB 3.6Å; M426-A455 VanDerWaalsContact SD-CB 3.6Å; L427-A455 WeakPolarHBondContact O-CA 3.43Å; L428-A455 HydrophobicContact CD2-CB 3.91Å; F452-A455 HydrophobicContact CE2-CB 3.8Å; F452-A455 HydrophobicContact CZ-CB 3.78Å
456	I	96.1	Very high	87.5	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	120.2	177	-47.3	175.4	0	0	0	107.7	M426 L427 V458 M461 I501 D503 Y512	M426-I456 CarbonylContact C-O 3.55Å; M426-I456 VanDerWaalsContact CA-O 3.31Å; M426-I456 WeakPolarHBondContact CA-O 3.44Å; M426-I456 WeakPolarHBondContact CG-O 3.38Å; L427-I456 HydrophobicContact CB-CB 4.4Å; L427-I456 HydrophobicContact CD2-CD1 4.18Å; L427-I456 PolarHBondContact N-O 3.34Å; L427-I456 PolarHBondContact O-N 3.35Å; I456-V458 PolarHBondContact O-N 3.38Å; I456-M461 HydrophobicContact CG2-CB 4.05Å; I456-M461 HydrophobicContact CG2-CG 4.25Å; I456-I501 HydrophobicContact CD1-CG2 3.91Å; I456-D503 HydrophobicContact CG1-CB 4.38Å; I456-D503 HydrophobicContact CG2-CB 4.01Å; I456-Y512 HydrophobicContact CD1-CD2 3.38Å; I456-Y512 HydrophobicContact CD1-CE2 3.27Å; I456-Y512 HydrophobicContact CD1-CG 4.22Å; I456-Y512 HydrophobicContact CG1-CD2 4.43Å; I456-Y512 HydrophobicContact CG1-CE2 3.86Å
457	N	95.4	Very high	89.4	Confident	68 Å²	68	41.7 Å²	41.7	36%	0.364	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	132.4	172	-76.5	-60.8	0	0	0	109.3	M426 N459 K460 M461	M426-N457 HydrophobicContact CE-CB 4.49Å; M426-N457 WeakPolarHBondContact CE-OD1 3.35Å; N457-N459 VanDerWaalsContact CB-OD1 3.23Å; N457-N459 WeakPolarHBondContact CB-OD1 3.34Å; N457-N459 PolarHBondContact O-N 2.94Å; N457-K460 HydrophobicContact CB-CB 4.36Å; N457-K460 HydrophobicContact CB-CG 4.32Å; N457-K460 CarbonylContact O-C 3.39Å; N457-K460 WeakPolarHBondContact O-CA 3.37Å; N457-K460 PolarHBondContact O-N 2.8Å; N457-M461 PolarHBondContact O-N 3.4Å; N457-M461 VanDerWaalsContact O-N 3.11Å
458	V	95.3	Very high	91	Very high	11 Å²	11	38.1 Å²	38.1	7%	0.067	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-56.3	-38.9	179.1	163.2	0	0	0	0	110.5	L422 F423 Q425 I456 K460 M461 I532 Q536	L422-V458 HydrophobicContact CD1-CG2 4.39Å; F423-V458 WeakPolarHBondContact O-CG2 3.42Å; Q425-V458 VanDerWaalsContact C-CG2 3.42Å; Q425-V458 WeakPolarHBondContact O-CB 3.35Å; Q425-V458 PolarHBondContact O-N 3.3Å; I456-V458 PolarHBondContact O-N 3.38Å; V458-K460 PolarHBondContact O-N 3.49Å; V458-K460 VanDerWaalsContact O-N 3.15Å; V458-M461 HydrophobicContact CG2-CE 4.43Å; V458-M461 WeakPolarHBondContact O-CB 3.46Å; V458-M461 PolarHBondContact O-N 3.08Å; V458-M461 VanDerWaalsContact O-N 3.08Å; V458-I532 HydrophobicContact CG1-CD1 4.38Å; V458-I532 HydrophobicContact CG1-CG1 4.41Å; V458-I532 HydrophobicContact CG1-CG2 3.52Å; V458-Q536 PolarHBondContact O-NE2 3.39Å
459	N	93	Very high	92.2	Very high	98 Å²	98	38.1 Å²	38.1	52%	0.524	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-70.2	-5.1	176.9	70.1	-0.4	0	0	0	115.6	N457	N457-N459 VanDerWaalsContact CB-OD1 3.23Å; N457-N459 WeakPolarHBondContact CB-OD1 3.34Å; N457-N459 PolarHBondContact O-N 2.94Å
460	K	92.5	Very high	92.3	Very high	80 Å²	80	36.7 Å²	36.7	35%	0.348	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-117.2	6.5	172.8	-61	-57.1	176.9	-174.4	0	111.8	N457 V458 Q504	N457-K460 HydrophobicContact CB-CB 4.36Å; N457-K460 HydrophobicContact CB-CG 4.32Å; N457-K460 CarbonylContact O-C 3.39Å; N457-K460 WeakPolarHBondContact O-CA 3.37Å; N457-K460 PolarHBondContact O-N 2.8Å; V458-K460 PolarHBondContact O-N 3.49Å; V458-K460 VanDerWaalsContact O-N 3.15Å; K460-Q504 WeakPolarHBondContact O-CA 3.34Å; K460-Q504 VanDerWaalsContact O-CB 3.25Å; K460-Q504 WeakPolarHBondContact O-CB 3.29Å; K460-Q504 PolarHBondContact O-N 3.45Å
461	M	94	Very high	91.4	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.02	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.1	-178.6	-168.4	173.7	66.6	0	0	109.9	L422 L427 I456 N457 V458 I501 L529 I532 Q536	L422-M461 HydrophobicContact CD1-CE 4.23Å; L427-M461 HydrophobicContact CB-SD 4.19Å; L427-M461 HydrophobicContact CD2-SD 4.09Å; I456-M461 HydrophobicContact CG2-CB 4.05Å; I456-M461 HydrophobicContact CG2-CG 4.25Å; N457-M461 PolarHBondContact O-N 3.4Å; N457-M461 VanDerWaalsContact O-N 3.11Å; V458-M461 HydrophobicContact CG2-CE 4.43Å; V458-M461 WeakPolarHBondContact O-CB 3.46Å; V458-M461 PolarHBondContact O-N 3.08Å; V458-M461 VanDerWaalsContact O-N 3.08Å; M461-I501 HydrophobicContact CG-CG2 3.34Å; M461-I501 HydrophobicContact SD-CD1 4.33Å; M461-I501 HydrophobicContact SD-CG2 3.72Å; M461-L529 HydrophobicContact CE-CD2 3.44Å; M461-L529 VanDerWaalsContact CE-CD2 3.44Å; M461-L529 HydrophobicContact SD-CD2 4.09Å; M461-I532 HydrophobicContact CE-CD1 3.91Å; M461-I532 HydrophobicContact CE-CG2 3.97Å; M461-Q536 PolarHBondContact O-NE2 2.93Å
462	R	92.4	Very high	90	Very high	68 Å²	68	35.1 Å²	35.1	26%	0.257	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.9	168.5	174.1	178.3	176.5	-175.8	2.4	109.7	E464 T471 I501 L502 Q504	R462-E464 IonicContact CZ-OE1 3.51Å; R462-E464 IonicContact NE-OE1 3.58Å; R462-E464 PolarHBondContact NE-OE1 3Å; R462-E464 IonicContact NH2-OE1 2.57Å; R462-E464 PolarHBondContact NH2-OE1 3.11Å; R462-T471 PolarHBondContact NH1-OG1 2.91Å; R462-T471 VanDerWaalsContact NH2-CG2 3.27Å; R462-I501 CarbonylContact O-C 3.6Å; R462-I501 WeakPolarHBondContact O-CA 3.38Å; R462-L502 HydrophobicContact CB-CB 4.32Å; R462-L502 PolarHBondContact N-O 3.37Å; R462-L502 PolarHBondContact O-N 2.78Å; R462-Q504 HydrophobicContact CB-CG 3.98Å
463	Y	93.7	Very high	88.4	Confident	12 Å²	12	37.8 Å²	37.8	5%	0.047	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	139.1	175.4	158.5	-102.5	0	0	0	110.5	S465 F499 V526 L529 R530 Q533	Y463-S465 VanDerWaalsContact OH-CA 3.29Å; Y463-S465 WeakPolarHBondContact OH-CA 3.44Å; Y463-F499 HydrophobicContact CD2-CD2 4.01Å; Y463-F499 HydrophobicContact CE2-CB 3.89Å; Y463-F499 AromaticContact CE2-CD2 3.86Å; Y463-F499 HydrophobicContact CE2-CD2 3.86Å; Y463-F499 HydrophobicContact CE2-CG 4.08Å; Y463-V526 HydrophobicContact CE1-CG1 4.48Å; Y463-V526 HydrophobicContact CE2-CG2 4.05Å; Y463-V526 VanDerWaalsContact OH-CG1 3.26Å; Y463-V526 WeakPolarHBondContact OH-CG1 3.26Å; Y463-V526 VanDerWaalsContact OH-CG2 3.22Å; Y463-V526 WeakPolarHBondContact OH-CG2 3.34Å; Y463-L529 HydrophobicContact CD1-CB 4.3Å; Y463-L529 HydrophobicContact CD2-CB 4.01Å; Y463-L529 HydrophobicContact CD2-CD1 3.51Å; Y463-L529 HydrophobicContact CD2-CG 4.38Å; Y463-L529 HydrophobicContact CE2-CD1 4.02Å; Y463-L529 HydrophobicContact CG-CB 3.83Å; Y463-L529 HydrophobicContact CG-CD1 4.14Å; Y463-R530 HydrophobicContact CD1-CG 4.47Å; Y463-R530 HydrophobicContact CE1-CG 4.03Å; Y463-Q533 PolarHBondContact O-NE2 3.19Å
464	E	92.9	Very high	86.6	Confident	28 Å²	28	37.3 Å²	37.3	13%	0.131	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	130.7	169.7	-69.6	-62.7	161.9	0	0	109.2	R462 H466 F499 A500 L502	R462-E464 IonicContact CZ-OE1 3.51Å; R462-E464 IonicContact NE-OE1 3.58Å; R462-E464 PolarHBondContact NE-OE1 3Å; R462-E464 IonicContact NH2-OE1 2.57Å; R462-E464 PolarHBondContact NH2-OE1 3.11Å; E464-H466 PolarHBondContact O-N 3.26Å; E464-F499 WeakPolarHBondContact O-CB 3.43Å; E464-A500 HydrophobicContact CB-CB 4.42Å; E464-A500 PolarHBondContact N-O 2.91Å; E464-A500 PolarHBondContact O-N 3.25Å; E464-A500 VanDerWaalsContact O-N 3.11Å; E464-L502 HydrophobicContact CB-CD1 4.36Å; E464-L502 HydrophobicContact CG-CD1 3.67Å
465	S	91	Very high	84.9	Confident	38 Å²	38	39.4 Å²	39.4	27%	0.266	23%	0.233	S	C	.	.	S	Bend	trans	-64.1	-29.7	-174	57.7	0	0	0	0	114.2	Y463 R522	Y463-S465 VanDerWaalsContact OH-CA 3.29Å; Y463-S465 WeakPolarHBondContact OH-CA 3.44Å; S465-R522 PolarHBondContact O-NH2 3.43Å
466	H	90.5	Very high	83.2	Confident	50 Å²	50	44.5 Å²	44.5	23%	0.231	25%	0.253	C	S	.	.	S	Bend	trans	-128.7	135.2	174.7	-54.5	121.1	0	0	0	108.1	E464 Y468 N469	E464-H466 PolarHBondContact O-N 3.26Å; H466-Y468 HydrophobicContact CB-CD1 4.12Å; H466-Y468 HydrophobicContact CB-CD2 4.15Å; H466-Y468 HydrophobicContact CB-CE1 3.64Å; H466-Y468 HydrophobicContact CB-CE2 3.66Å; H466-Y468 HydrophobicContact CB-CG 4.36Å; H466-Y468 AromaticContact CG-CZ 3.67Å; H466-Y468 VanDerWaalsContact CG-OH 3.31Å; H466-Y468 PolarHBondContact O-N 2.75Å; H466-N469 WeakPolarHBondContact O-CB 3.36Å; H466-N469 PolarHBondContact O-N 3.23Å
467	W	91.5	Very high	81.6	Confident	0 Å²	0	51 Å²	51	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-61.4	-28.7	-175.1	66	-85	0	0	0	113.3	L329 T332 V333 Y336 N469 C470 D496 R498 A500 V513	L329-W467 HydrophobicContact CD1-CE3 3.79Å; L329-W467 HydrophobicContact CD1-CZ3 4.08Å; T332-W467 HydrophobicContact CG2-CH2 4.08Å; T332-W467 HydrophobicContact CG2-CZ3 4.03Å; V333-W467 HydrophobicContact CB-CZ3 4.46Å; V333-W467 HydrophobicContact CG2-CE3 3.97Å; V333-W467 HydrophobicContact CG2-CH2 4.25Å; V333-W467 HydrophobicContact CG2-CZ3 3.48Å; V333-W467 VanDerWaalsContact CG2-CZ3 3.48Å; Y336-W467 AromaticContact CD1-CH2 3.97Å; Y336-W467 HydrophobicContact CD1-CH2 3.97Å; Y336-W467 AromaticContact CD1-CZ2 3.6Å; Y336-W467 HydrophobicContact CD1-CZ2 3.6Å; Y336-W467 HydrophobicContact CD2-CZ2 4.37Å; Y336-W467 AromaticContact CE1-CZ2 3.95Å; Y336-W467 HydrophobicContact CE1-CZ2 3.95Å; Y336-W467 AromaticContact CG-CH2 3.97Å; Y336-W467 HydrophobicContact CG-CH2 3.97Å; Y336-W467 AromaticContact CG-CZ2 3.82Å; Y336-W467 HydrophobicContact CG-CZ2 3.82Å; W467-N469 VanDerWaalsContact C-N 3.3Å; W467-N469 PolarHBondContact O-N 3.42Å; W467-C470 PolarHBondContact O-SG 2.94Å; W467-D496 PolarHBondContact NE1-OD2 3.46Å; W467-R498 HydrophobicContact CG-CB 4.27Å; W467-R498 PolarHBondContact N-O 3.08Å; W467-A500 HydrophobicContact CB-CB 4.08Å; W467-V513 HydrophobicContact CB-CG1 3.78Å; W467-V513 HydrophobicContact CB-CG2 4.29Å; W467-V513 HydrophobicContact CG-CG1 4.09Å
468	Y	89.8	Confident	80.4	Confident	7 Å²	7	48.4 Å²	48.4	3%	0.027	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-77.1	-9.9	177.3	53	-101.6	0	0	0	114.4	Y336 H466 C470 A481 I484 D485 L488	Y336-Y468 HydrophobicContact CE1-CD1 4.14Å; Y336-Y468 HydrophobicContact CE1-CE1 4.5Å; H466-Y468 HydrophobicContact CB-CD1 4.12Å; H466-Y468 HydrophobicContact CB-CD2 4.15Å; H466-Y468 HydrophobicContact CB-CE1 3.64Å; H466-Y468 HydrophobicContact CB-CE2 3.66Å; H466-Y468 HydrophobicContact CB-CG 4.36Å; H466-Y468 AromaticContact CG-CZ 3.67Å; H466-Y468 VanDerWaalsContact CG-OH 3.31Å; H466-Y468 PolarHBondContact O-N 2.75Å; Y468-C470 PolarHBondContact O-N 3.05Å; Y468-A481 HydrophobicContact CD2-CB 4.31Å; Y468-I484 HydrophobicContact CD1-CG2 3.99Å; Y468-I484 HydrophobicContact CD2-CB 4.21Å; Y468-I484 HydrophobicContact CD2-CD1 4.44Å; Y468-I484 HydrophobicContact CD2-CG2 3.87Å; Y468-I484 HydrophobicContact CE1-CG2 3.97Å; Y468-I484 HydrophobicContact CE2-CB 4.39Å; Y468-I484 HydrophobicContact CE2-CG2 3.87Å; Y468-I484 HydrophobicContact CG-CD1 4.25Å; Y468-I484 HydrophobicContact CG-CG2 3.94Å; Y468-D485 WeakPolarHBondContact CE2-OD1 3.12Å; Y468-D485 PolarHBondContact OH-OD1 3.43Å; Y468-D485 VanDerWaalsContact OH-OD1 3.1Å; Y468-L488 HydrophobicContact CE1-CD1 3.84Å; Y468-L488 WeakPolarHBondContact OH-CD1 3.39Å
469	N	86.9	Confident	79.3	Confident	32 Å²	32	52.4 Å²	52.4	17%	0.171	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-79.5	-3.7	176.7	-71.4	-2.6	0	0	0	113.6	H466 W467 T471 A481	H466-N469 WeakPolarHBondContact O-CB 3.36Å; H466-N469 PolarHBondContact O-N 3.23Å; W467-N469 VanDerWaalsContact C-N 3.3Å; W467-N469 PolarHBondContact O-N 3.42Å; N469-T471 PolarHBondContact O-N 3.41Å; N469-A481 WeakPolarHBondContact OD1-CB 3.21Å
470	C	80.7	Confident	78.6	Confident	4 Å²	4	49 Å²	49	3%	0.027	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-55.5	124.1	-178.1	-69.5	0	0	0	0	112	L329 W467 Y468 A500 L502	L329-C470 HydrophobicContact CD2-CB 3.71Å; W467-C470 PolarHBondContact O-SG 2.94Å; Y468-C470 PolarHBondContact O-N 3.05Å; C470-A500 VanDerWaalsContact SG-CB 3.52Å; C470-L502 HydrophobicContact CB-CD2 4.38Å
471	T	71.1	Confident	78	Confident	13 Å²	13	45.6 Å²	45.6	8%	0.08	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-72.3	149.1	-178.8	56.1	0	0	0	0	112.4	R326 R462 N469	R326-T471 VanDerWaalsContact CD-O 3.24Å; R326-T471 WeakPolarHBondContact CD-O 3.45Å; R326-T471 PolarHBondContact NE-O 3.39Å; R462-T471 PolarHBondContact NH1-OG1 2.91Å; R462-T471 VanDerWaalsContact NH2-CG2 3.27Å; N469-T471 PolarHBondContact O-N 3.41Å
472	L	63	Low	77.4	Confident	55 Å²	55	48.7 Å²	48.7	29%	0.288	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-60.1	157.5	172.3	-71.9	151.3	0	0	0	111.3	L330 S474 G475 H476	L330-L472 HydrophobicContact CD1-CD2 3.42Å; L330-L472 VanDerWaalsContact CD1-CD2 3.42Å; L330-L472 HydrophobicContact CD1-CG 4.44Å; L330-L472 HydrophobicContact CD2-CD2 3.94Å; L330-L472 HydrophobicContact CD2-CG 4.34Å; L330-L472 HydrophobicContact CG-CD2 4.34Å; L472-S474 WeakPolarHBondContact CB-OG 3.32Å; L472-S474 PolarHBondContact O-N 3.26Å; L472-S474 VanDerWaalsContact O-N 3.1Å; L472-G475 PolarHBondContact O-N 2.92Å; L472-H476 HydrophobicContact CD1-CB 4.24Å; L472-H476 PolarHBondContact N-O 3.08Å
473	S	60	Low	77	Confident	102 Å²	102	48 Å²	48	71%	0.713	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-21.4	174.6	44.5	0	0	0	0	113.1	G475	S473-G475 VanDerWaalsContact C-N 3.28Å; S473-G475 PolarHBondContact O-N 3.09Å
474	S	58.9	Low	76.6	Confident	76 Å²	76	47.5 Å²	47.5	53%	0.531	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-2.5	174.1	55.7	0	0	0	0	114.6	L472 H476	L472-S474 WeakPolarHBondContact CB-OG 3.32Å; L472-S474 PolarHBondContact O-N 3.26Å; L472-S474 VanDerWaalsContact O-N 3.1Å; S474-H476 PolarHBondContact O-N 3.25Å; S474-H476 PolarHBondContact OG-CD2 2.65Å
475	G	59.4	Low	76	Confident	60 Å²	60	48.8 Å²	48.8	62%	0.619	30%	0.304	S	S	*	.	S	Bend	trans	79.2	-1.1	-175.7	0	0	0	0	0	114.3	L472 S473	L472-G475 PolarHBondContact O-N 2.92Å; S473-G475 VanDerWaalsContact C-N 3.28Å; S473-G475 PolarHBondContact O-N 3.09Å
476	H	60.2	Low	75.6	Confident	128 Å²	128	53.7 Å²	53.7	59%	0.593	32%	0.323	S	S	*	.			trans	-75.8	140.3	172.8	-68.3	-60.2	0	0	0	111.3	L472 S474	L472-H476 HydrophobicContact CD1-CB 4.24Å; L472-H476 PolarHBondContact N-O 3.08Å; S474-H476 PolarHBondContact O-N 3.25Å; S474-H476 PolarHBondContact OG-CD2 2.65Å
477	I	62.1	Low	75.2	Confident	138 Å²	138	52.4 Å²	52.4	71%	0.708	32%	0.317	S	S	*	.			trans	-58.7	142.2	168.9	55.2	171.5	0	0	0	109.5	S479	I477-S479 PolarHBondContact O-N 3.36Å; I477-S479 VanDerWaalsContact O-N 3.08Å
478	N	69.5	Low	74.6	Confident	12 Å²	12	54 Å²	54	6%	0.064	33%	0.326	C	S	.	.			trans	-67.3	110.2	172.7	-175.5	0.2	0	0	0	108.1	V333 E480 A481	V333-N478 WeakPolarHBondContact CG1-ND2 3.45Å; N478-E480 PolarHBondContact O-N 3.12Å; N478-E480 WeakPolarHBondContact OD1-CB 3.41Å; N478-E480 WeakPolarHBondContact OD1-CG 3.49Å; N478-E480 PolarHBondContact OD1-N 3.33Å; N478-E480 VanDerWaalsContact OD1-N 3.11Å; N478-A481 HydrophobicContact CB-CB 4.35Å; N478-A481 VanDerWaalsContact O-CB 3.27Å; N478-A481 WeakPolarHBondContact O-CB 3.3Å; N478-A481 PolarHBondContact O-N 3.02Å
479	S	72.2	Confident	73.9	Confident	96 Å²	96	59.2 Å²	59.2	67%	0.671	36%	0.362	S	S	*	.	H	α-helix	trans	-58.7	-21.9	179.3	52.3	0	0	0	0	112.8	I477	I477-S479 PolarHBondContact O-N 3.36Å; I477-S479 VanDerWaalsContact O-N 3.08Å
480	E	77.5	Confident	73	Confident	25 Å²	25	60.4 Å²	60.4	12%	0.117	37%	0.372	C	S	.	.	H	α-helix	trans	-73.7	-26.6	177	-53.8	-156.6	120.9	0	0	113.2	V333 T334 K337 N478 A482 T483 I484	V333-E480 HydrophobicContact CG1-CB 4.4Å; T334-E480 WeakPolarHBondContact CA-OE2 3.49Å; T334-E480 WeakPolarHBondContact CB-OE2 3.46Å; T334-E480 PolarHBondContact N-OE2 3.26Å; T334-E480 PolarHBondContact OG1-OE2 3.18Å; K337-E480 HydrophobicContact CD-CB 4.01Å; K337-E480 HydrophobicContact CD-CG 4.21Å; K337-E480 IonicContact NZ-OE1 3.32Å; K337-E480 PolarHBondContact NZ-OE1 3.46Å; N478-E480 PolarHBondContact O-N 3.12Å; N478-E480 WeakPolarHBondContact OD1-CB 3.41Å; N478-E480 WeakPolarHBondContact OD1-CG 3.49Å; N478-E480 PolarHBondContact OD1-N 3.33Å; N478-E480 VanDerWaalsContact OD1-N 3.11Å; E480-A482 PolarHBondContact O-N 3.29Å; E480-T483 WeakPolarHBondContact O-CA 3.46Å; E480-T483 WeakPolarHBondContact O-CB 3.32Å; E480-T483 PolarHBondContact O-N 3.44Å; E480-I484 WeakPolarHBondContact O-CG1 3.4Å; E480-I484 PolarHBondContact O-N 3.14Å
481	A	81.2	Confident	71.9	Confident	9 Å²	9	63.1 Å²	63.1	7%	0.074	40%	0.402	C	S	.	.	H	α-helix	trans	-59.5	-47.6	-177.4	0	0	0	0	0	112.1	Y468 N469 N478 T483 I484 D485	Y468-A481 HydrophobicContact CD2-CB 4.31Å; N469-A481 WeakPolarHBondContact OD1-CB 3.21Å; N478-A481 HydrophobicContact CB-CB 4.35Å; N478-A481 VanDerWaalsContact O-CB 3.27Å; N478-A481 WeakPolarHBondContact O-CB 3.3Å; N478-A481 PolarHBondContact O-N 3.02Å; A481-T483 PolarHBondContact O-N 3.03Å; A481-I484 WeakPolarHBondContact O-CB 3.43Å; A481-I484 PolarHBondContact O-N 3.39Å; A481-D485 PolarHBondContact O-N 3.47Å
482	A	80.8	Confident	71	Confident	70 Å²	70	71.5 Å²	71.5	58%	0.579	43%	0.433	S	S	*	.	H	α-helix	trans	-62.2	-31	176.6	0	0	0	0	0	112.7	E480 H486	E480-A482 PolarHBondContact O-N 3.29Å; A482-H486 PolarHBondContact O-N 3.25Å
483	T	83.9	Confident	70.5	Confident	54 Å²	54	70.5 Å²	70.5	33%	0.331	43%	0.431	S	S	.	.	H	α-helix	trans	-71.4	-40.5	174.9	-51.9	0	0	0	0	110.7	K337 E480 A481 H486 L487	K337-T483 HydrophobicContact CD-CG2 4.36Å; E480-T483 WeakPolarHBondContact O-CA 3.46Å; E480-T483 WeakPolarHBondContact O-CB 3.32Å; E480-T483 PolarHBondContact O-N 3.44Å; A481-T483 PolarHBondContact O-N 3.03Å; T483-H486 PolarHBondContact O-N 2.88Å; T483-L487 HydrophobicContact CG2-CD1 4.19Å; T483-L487 VanDerWaalsContact O-CG 3.27Å; T483-L487 WeakPolarHBondContact O-CG 3.46Å; T483-L487 PolarHBondContact O-N 3.29Å
484	I	84.6	Confident	70.4	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	42%	0.424	C	S	.	.	H	α-helix	trans	-64.5	-47.6	176.6	-68.6	163.9	0	0	0	110.2	V333 Y336 K337 L340 Y468 E480 A481 H486 L487 L488	V333-I484 HydrophobicContact CG1-CD1 3.46Å; V333-I484 VanDerWaalsContact CG1-CD1 3.46Å; Y336-I484 HydrophobicContact CD1-CD1 4.21Å; Y336-I484 HydrophobicContact CD1-CG2 4.16Å; Y336-I484 HydrophobicContact CE1-CG2 3.79Å; K337-I484 HydrophobicContact CB-CD1 4.15Å; K337-I484 HydrophobicContact CB-CG1 3.92Å; K337-I484 HydrophobicContact CG-CG1 4.43Å; L340-I484 HydrophobicContact CD1-CG2 3.98Å; Y468-I484 HydrophobicContact CD1-CG2 3.99Å; Y468-I484 HydrophobicContact CD2-CB 4.21Å; Y468-I484 HydrophobicContact CD2-CD1 4.44Å; Y468-I484 HydrophobicContact CD2-CG2 3.87Å; Y468-I484 HydrophobicContact CE1-CG2 3.97Å; Y468-I484 HydrophobicContact CE2-CB 4.39Å; Y468-I484 HydrophobicContact CE2-CG2 3.87Å; Y468-I484 HydrophobicContact CG-CD1 4.25Å; Y468-I484 HydrophobicContact CG-CG2 3.94Å; E480-I484 WeakPolarHBondContact O-CG1 3.4Å; E480-I484 PolarHBondContact O-N 3.14Å; A481-I484 WeakPolarHBondContact O-CB 3.43Å; A481-I484 PolarHBondContact O-N 3.39Å; I484-H486 VanDerWaalsContact C-N 3.27Å; I484-H486 PolarHBondContact O-N 3.14Å; I484-L487 WeakPolarHBondContact O-CB 3.4Å; I484-L487 PolarHBondContact O-N 3.28Å; I484-L488 HydrophobicContact CG2-CD1 3.75Å; I484-L488 HydrophobicContact CG2-CG 4.12Å; I484-L488 VanDerWaalsContact O-CG 3.31Å; I484-L488 WeakPolarHBondContact O-CG 3.34Å; I484-L488 PolarHBondContact O-N 2.67Å
485	D	82.1	Confident	71.1	Confident	56 Å²	56	73.2 Å²	73.2	30%	0.299	44%	0.436	S	S	.	.	H	α-helix	trans	-53	-46.9	175.2	-76.8	-32.2	0	0	0	111	Y468 A481 L487 L488 C489	Y468-D485 WeakPolarHBondContact CE2-OD1 3.12Å; Y468-D485 PolarHBondContact OH-OD1 3.43Å; Y468-D485 VanDerWaalsContact OH-OD1 3.1Å; A481-D485 PolarHBondContact O-N 3.47Å; D485-L487 PolarHBondContact O-N 2.97Å; D485-L488 PolarHBondContact O-N 3.42Å; D485-C489 WeakPolarHBondContact O-CB 3.34Å; D485-C489 PolarHBondContact O-N 2.88Å; D485-C489 PolarHBondContact O-SG 3.04Å
486	H	81.7	Confident	72.3	Confident	140 Å²	140	71 Å²	71	65%	0.648	41%	0.41	S	S	*	.	H	α-helix	trans	-62.3	-40.8	176.5	-176.8	-74.8	0	0	0	112.9	A482 T483 I484 S490	A482-H486 PolarHBondContact O-N 3.25Å; T483-H486 PolarHBondContact O-N 2.88Å; I484-H486 VanDerWaalsContact C-N 3.27Å; I484-H486 PolarHBondContact O-N 3.14Å; H486-S490 PolarHBondContact O-N 3.37Å
487	L	81.3	Confident	73.7	Confident	24 Å²	24	67.1 Å²	67.1	13%	0.126	39%	0.393	C	S	.	.	H	α-helix	trans	-66.1	-39.1	176.8	-71.4	166	0	0	0	111.6	K337 L340 Q341 N344 T483 I484 D485 S490	K337-L487 HydrophobicContact CG-CD1 4.43Å; L340-L487 HydrophobicContact CB-CB 4.36Å; L340-L487 HydrophobicContact CB-CD1 4.03Å; L340-L487 HydrophobicContact CD1-CB 4.29Å; Q341-L487 HydrophobicContact CG-CD1 3.85Å; Q341-L487 HydrophobicContact CG-CD2 4.33Å; N344-L487 WeakPolarHBondContact ND2-CD2 3.32Å; T483-L487 HydrophobicContact CG2-CD1 4.19Å; T483-L487 VanDerWaalsContact O-CG 3.27Å; T483-L487 WeakPolarHBondContact O-CG 3.46Å; T483-L487 PolarHBondContact O-N 3.29Å; I484-L487 WeakPolarHBondContact O-CB 3.4Å; I484-L487 PolarHBondContact O-N 3.28Å; D485-L487 PolarHBondContact O-N 2.97Å; L487-S490 PolarHBondContact O-N 3.48Å; L487-S490 PolarHBondContact O-OG 3.25Å
488	L	79.6	Confident	75.2	Confident	34 Å²	34	60.6 Å²	60.6	18%	0.178	36%	0.36	C	S	.	.	H	α-helix	trans	-69.9	-42.5	178.3	-66.2	175.7	0	0	0	111.9	L340 Y468 I484 D485 S490 G491 S493	L340-L488 HydrophobicContact CD1-CD2 3.96Å; L340-L488 HydrophobicContact CD1-CG 4.27Å; L340-L488 HydrophobicContact CD2-CD2 4.1Å; Y468-L488 HydrophobicContact CE1-CD1 3.84Å; Y468-L488 WeakPolarHBondContact OH-CD1 3.39Å; I484-L488 HydrophobicContact CG2-CD1 3.75Å; I484-L488 HydrophobicContact CG2-CG 4.12Å; I484-L488 VanDerWaalsContact O-CG 3.31Å; I484-L488 WeakPolarHBondContact O-CG 3.34Å; I484-L488 PolarHBondContact O-N 2.67Å; D485-L488 PolarHBondContact O-N 3.42Å; L488-S490 PolarHBondContact O-N 3.04Å; L488-G491 PolarHBondContact O-N 3.19Å; L488-S493 WeakPolarHBondContact CD2-OG 3.32Å
489	C	74.3	Confident	76.4	Confident	116 Å²	116	60 Å²	60	78%	0.784	36%	0.357	S	S	*	.	H	α-helix	trans	-63.1	-18.9	175.1	-72	0	0	0	0	113.7	D485 G491	D485-C489 WeakPolarHBondContact O-CB 3.34Å; D485-C489 PolarHBondContact O-N 2.88Å; D485-C489 PolarHBondContact O-SG 3.04Å; C489-G491 PolarHBondContact O-N 3.08Å
490	S	68.8	Low	77.5	Confident	56 Å²	56	55.5 Å²	55.5	39%	0.392	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	3.3	-178.2	73.1	0	0	0	0	115.5	N344 H486 L487 L488	N344-S490 PolarHBondContact ND2-OG 2.66Å; N344-S490 VanDerWaalsContact ND2-OG 3.16Å; H486-S490 PolarHBondContact O-N 3.37Å; L487-S490 PolarHBondContact O-N 3.48Å; L487-S490 PolarHBondContact O-OG 3.25Å; L488-S490 PolarHBondContact O-N 3.04Å
491	G	57.4	Low	78.4	Confident	62 Å²	62	54.3 Å²	54.3	64%	0.639	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.9	12.6	156.3	0	0	0	0	0	117.9	L488 C489	L488-G491 PolarHBondContact O-N 3.19Å; C489-G491 PolarHBondContact O-N 3.08Å
492	Y	51.7	Low	79	Confident	188 Å²	188	54 Å²	54	74%	0.737	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.1	9	-176.3	-72	-83.6	0	0	0	115.5
493	S	52.9	Low	79.6	Confident	35 Å²	35	50.7 Å²	50.7	25%	0.245	29%	0.289	C	S	.	.	S	Bend	trans	-111.2	140.1	-179.8	179	0	0	0	0	112	L488	L488-S493 WeakPolarHBondContact CD2-OG 3.32Å
494	P	58.8	Low	80	Confident	88 Å²	88	52.6 Å²	52.6	57%	0.571	29%	0.294	S	S	*	.			trans	-58.3	146.8	165.3	26.3	-33.4	0	0	0	110.6	D496	P494-D496 PolarHBondContact O-N 3.4Å
495	D	72.5	Confident	80.3	Confident	146 Å²	146	54.1 Å²	54.1	78%	0.781	30%	0.304	S	S	*	.			trans	-59	103.6	173.9	-73.6	-28.3	0	0	0	109.6	L497	D495-L497 HydrophobicContact CB-CD2 4.36Å; D495-L497 PolarHBondContact O-N 3.06Å
496	D	85.4	Confident	80.7	Confident	15 Å²	15	56.8 Å²	56.8	8%	0.08	32%	0.324	C	S	.	.			trans	-75.6	96.7	175.6	-168.6	-7.4	0	0	0	109.4	W467 P494 R498	W467-D496 PolarHBondContact NE1-OD2 3.46Å; P494-D496 PolarHBondContact O-N 3.4Å; D496-R498 PolarHBondContact O-N 2.81Å; D496-R498 VanDerWaalsContact OD1-CB 3.24Å; D496-R498 WeakPolarHBondContact OD1-CB 3.28Å; D496-R498 VanDerWaalsContact OD1-CG 3.23Å; D496-R498 WeakPolarHBondContact OD1-CG 3.35Å; D496-R498 IonicContact OD1-CZ 2.88Å; D496-R498 PolarHBondContact OD1-N 3.31Å; D496-R498 VanDerWaalsContact OD1-N 3.16Å; D496-R498 IonicContact OD1-NE 3.99Å; D496-R498 PolarHBondContact OD1-NE 3.47Å; D496-R498 IonicContact OD1-NH2 3.07Å; D496-R498 IonicContact OD2-CZ 2.68Å; D496-R498 IonicContact OD2-NE 3.65Å; D496-R498 PolarHBondContact OD2-NE 3.31Å; D496-R498 IonicContact OD2-NH2 2.83Å; D496-R498 PolarHBondContact OD2-NH2 3.24Å
497	L	90.1	Very high	80.9	Confident	45 Å²	45	54.4 Å²	54.4	24%	0.236	34%	0.338	C	S	.	.			trans	-71.2	-8.1	-177.3	-63	-177.4	0	0	0	113.5	D495 P516 C519 R522	D495-L497 HydrophobicContact CB-CD2 4.36Å; D495-L497 PolarHBondContact O-N 3.06Å; L497-P516 HydrophobicContact CB-CG 3.8Å; L497-C519 HydrophobicContact CD1-CB 4.27Å; L497-R522 VanDerWaalsContact O-CD 3.23Å; L497-R522 WeakPolarHBondContact O-CD 3.42Å; L497-R522 PolarHBondContact O-NE 3.24Å; L497-R522 VanDerWaalsContact O-NE 3.14Å
498	R	93.8	Very high	81.2	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.008	35%	0.35	C	S	.	.			trans	-67.1	134.1	-174	-66.1	178.8	-65.5	179.3	1.2	111.9	F409 W467 D496 V513 I514 D515	F409-R498 VanDerWaalsContact O-CZ 3.27Å; F409-R498 PolarHBondContact O-NH1 3.03Å; F409-R498 PolarHBondContact O-NH2 3.39Å; W467-R498 HydrophobicContact CG-CB 4.27Å; W467-R498 PolarHBondContact N-O 3.08Å; D496-R498 PolarHBondContact O-N 2.81Å; D496-R498 VanDerWaalsContact OD1-CB 3.24Å; D496-R498 WeakPolarHBondContact OD1-CB 3.28Å; D496-R498 VanDerWaalsContact OD1-CG 3.23Å; D496-R498 WeakPolarHBondContact OD1-CG 3.35Å; D496-R498 IonicContact OD1-CZ 2.88Å; D496-R498 PolarHBondContact OD1-N 3.31Å; D496-R498 VanDerWaalsContact OD1-N 3.16Å; D496-R498 IonicContact OD1-NE 3.99Å; D496-R498 PolarHBondContact OD1-NE 3.47Å; D496-R498 IonicContact OD1-NH2 3.07Å; D496-R498 IonicContact OD2-CZ 2.68Å; D496-R498 IonicContact OD2-NE 3.65Å; D496-R498 PolarHBondContact OD2-NE 3.31Å; D496-R498 IonicContact OD2-NH2 2.83Å; D496-R498 PolarHBondContact OD2-NH2 3.24Å; R498-V513 HydrophobicContact CB-CG1 4.43Å; R498-I514 VanDerWaalsContact CA-O 3.31Å; R498-I514 WeakPolarHBondContact CA-O 3.5Å; R498-D515 HydrophobicContact CG-CB 3.82Å
499	F	94.8	Very high	81.5	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	168.5	175	63.4	-87.6	0	0	0	110	Y463 E464 I501 I514 P516 R522 W525 L529	Y463-F499 HydrophobicContact CD2-CD2 4.01Å; Y463-F499 HydrophobicContact CE2-CB 3.89Å; Y463-F499 AromaticContact CE2-CD2 3.86Å; Y463-F499 HydrophobicContact CE2-CD2 3.86Å; Y463-F499 HydrophobicContact CE2-CG 4.08Å; E464-F499 WeakPolarHBondContact O-CB 3.43Å; F499-I501 HydrophobicContact CD2-CG1 4.39Å; F499-I501 HydrophobicContact CE2-CD1 4.21Å; F499-I501 HydrophobicContact CE2-CG1 4.21Å; F499-I514 HydrophobicContact CD1-CB 4.48Å; F499-I514 HydrophobicContact CD2-CB 4.29Å; F499-I514 HydrophobicContact CD2-CD1 4.5Å; F499-I514 HydrophobicContact CE1-CB 4.06Å; F499-I514 HydrophobicContact CE1-CG2 3.78Å; F499-I514 HydrophobicContact CE2-CB 3.87Å; F499-I514 HydrophobicContact CE2-CD1 3.67Å; F499-I514 HydrophobicContact CE2-CG1 4.26Å; F499-I514 HydrophobicContact CE2-CG2 4.13Å; F499-I514 HydrophobicContact CZ-CB 3.74Å; F499-I514 HydrophobicContact CZ-CD1 4.03Å; F499-I514 HydrophobicContact CZ-CG1 4.47Å; F499-I514 HydrophobicContact CZ-CG2 3.5Å; F499-I514 VanDerWaalsContact CZ-CG2 3.5Å; F499-I514 PolarHBondContact N-O 3.28Å; F499-I514 VanDerWaalsContact N-O 3.15Å; F499-I514 PolarHBondContact O-N 3.34Å; F499-P516 HydrophobicContact CE1-CB 4.24Å; F499-P516 HydrophobicContact CE1-CG 4.46Å; F499-R522 HydrophobicContact CD1-CG 4.42Å; F499-W525 HydrophobicContact CE1-CB 4.36Å; F499-W525 HydrophobicContact CZ-CB 3.88Å; F499-W525 HydrophobicContact CZ-CD2 4.38Å; F499-W525 HydrophobicContact CZ-CE3 4.42Å; F499-W525 HydrophobicContact CZ-CG 4.15Å; F499-L529 HydrophobicContact CD2-CD1 4.08Å; F499-L529 HydrophobicContact CE2-CD1 3.63Å; F499-L529 HydrophobicContact CZ-CD1 4.45Å
500	A	95.2	Very high	82.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.4	179.7	0	0	0	0	0	112.6	E464 W467 C470 L502 V511 Y512	E464-A500 HydrophobicContact CB-CB 4.42Å; E464-A500 PolarHBondContact N-O 2.91Å; E464-A500 PolarHBondContact O-N 3.25Å; E464-A500 VanDerWaalsContact O-N 3.11Å; W467-A500 HydrophobicContact CB-CB 4.08Å; C470-A500 VanDerWaalsContact SG-CB 3.52Å; A500-L502 HydrophobicContact CB-CD1 4.48Å; A500-V511 HydrophobicContact CB-CG1 4.09Å; A500-Y512 WeakPolarHBondContact CA-O 3.45Å
501	I	95.8	Very high	83.5	Confident	0 Å²	0	55 Å²	55	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	125	170.2	-60.4	-177.1	0	0	0	108.2	L427 I456 M461 R462 F499 Y512 I514 L529	L427-I501 HydrophobicContact CD2-CD1 3.64Å; L427-I501 HydrophobicContact CD2-CG2 4.36Å; I456-I501 HydrophobicContact CD1-CG2 3.91Å; M461-I501 HydrophobicContact CG-CG2 3.34Å; M461-I501 HydrophobicContact SD-CD1 4.33Å; M461-I501 HydrophobicContact SD-CG2 3.72Å; R462-I501 CarbonylContact O-C 3.6Å; R462-I501 WeakPolarHBondContact O-CA 3.38Å; F499-I501 HydrophobicContact CD2-CG1 4.39Å; F499-I501 HydrophobicContact CE2-CD1 4.21Å; F499-I501 HydrophobicContact CE2-CG1 4.21Å; I501-Y512 PolarHBondContact N-O 3.02Å; I501-Y512 PolarHBondContact O-N 2.81Å; I501-I514 HydrophobicContact CD1-CD1 3.51Å; I501-I514 HydrophobicContact CG1-CD1 3.91Å; I501-L529 HydrophobicContact CD1-CD1 3.96Å; I501-L529 HydrophobicContact CD1-CD2 4.02Å; I501-L529 HydrophobicContact CG1-CD1 4.26Å
502	L	93.8	Very high	85.4	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.9	179.7	-60.4	81.5	0	0	0	109.9	R462 E464 C470 A500 V511	R462-L502 HydrophobicContact CB-CB 4.32Å; R462-L502 PolarHBondContact N-O 3.37Å; R462-L502 PolarHBondContact O-N 2.78Å; E464-L502 HydrophobicContact CB-CD1 4.36Å; E464-L502 HydrophobicContact CG-CD1 3.67Å; C470-L502 HydrophobicContact CB-CD2 4.38Å; A500-L502 HydrophobicContact CB-CD1 4.48Å; L502-V511 HydrophobicContact CD2-CG2 4.4Å; L502-V511 HydrophobicContact CG-CG1 4.13Å; L502-V511 HydrophobicContact CG-CG2 4.16Å
503	D	93.8	Very high	87.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	104.8	169.7	-173	-8.7	0	0	0	109.4	I456 T505 K508 F510 Y512	I456-D503 HydrophobicContact CG1-CB 4.38Å; I456-D503 HydrophobicContact CG2-CB 4.01Å; D503-T505 PolarHBondContact O-N 3.22Å; D503-T505 WeakPolarHBondContact OD1-CB 3.49Å; D503-T505 PolarHBondContact OD1-N 3.23Å; D503-T505 PolarHBondContact OD1-OG1 2.89Å; D503-K508 WeakPolarHBondContact OD2-CD 3.24Å; D503-K508 IonicContact OD2-NZ 3.17Å; D503-K508 PolarHBondContact OD2-NZ 2.93Å; D503-K508 VanDerWaalsContact OD2-NZ 3.11Å; D503-F510 PolarHBondContact N-O 2.96Å; D503-Y512 HydrophobicContact CB-CE2 4.39Å
504	Q	90.9	Very high	89.6	Confident	94 Å²	94	41.9 Å²	41.9	44%	0.439	25%	0.245	S	C	.	.			trans	-86.8	18	178.8	-53.1	-173.4	-56.3	0	0	113	K460 R462 P506	K460-Q504 WeakPolarHBondContact O-CA 3.34Å; K460-Q504 VanDerWaalsContact O-CB 3.25Å; K460-Q504 WeakPolarHBondContact O-CB 3.29Å; K460-Q504 PolarHBondContact O-N 3.45Å; R462-Q504 HydrophobicContact CB-CG 3.98Å; Q504-P506 WeakPolarHBondContact O-CD 3.38Å
505	T	92.2	Very high	91.3	Very high	33 Å²	33	39 Å²	39	20%	0.202	22%	0.224	C	C	.	.	S	Bend	trans	-63.1	125.8	171.7	-58.9	0	0	0	0	109.1	D503 G507 K508	D503-T505 PolarHBondContact O-N 3.22Å; D503-T505 WeakPolarHBondContact OD1-CB 3.49Å; D503-T505 PolarHBondContact OD1-N 3.23Å; D503-T505 PolarHBondContact OD1-OG1 2.89Å; T505-G507 PolarHBondContact O-N 3.45Å; T505-K508 HydrophobicContact CG2-CD 4.32Å; T505-K508 HydrophobicContact CG2-CG 4.38Å; T505-K508 PolarHBondContact O-N 3.33Å
506	P	89.1	Confident	92.3	Very high	112 Å²	112	32 Å²	32	73%	0.727	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.3	128.8	179.6	-26.9	34.7	0	0	0	112	Q504 K508	Q504-P506 WeakPolarHBondContact O-CD 3.38Å; P506-K508 VanDerWaalsContact C-N 3.33Å
507	G	87	Confident	92.6	Very high	90 Å²	90	35.9 Å²	35.9	93%	0.928	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.4	-5.6	-178.5	0	0	0	0	0	115.3	T505	T505-G507 PolarHBondContact O-N 3.45Å
508	K	86.6	Confident	92.8	Very high	89 Å²	89	36.7 Å²	36.7	39%	0.387	21%	0.214	S	C	.	.			trans	-98.5	143.3	166.6	-66.4	-169.5	-176.3	-179.8	0	110.1	D503 T505 P506 F510	D503-K508 WeakPolarHBondContact OD2-CD 3.24Å; D503-K508 IonicContact OD2-NZ 3.17Å; D503-K508 PolarHBondContact OD2-NZ 2.93Å; D503-K508 VanDerWaalsContact OD2-NZ 3.11Å; T505-K508 HydrophobicContact CG2-CD 4.32Å; T505-K508 HydrophobicContact CG2-CG 4.38Å; T505-K508 PolarHBondContact O-N 3.33Å; P506-K508 VanDerWaalsContact C-N 3.33Å; K508-F510 HydrophobicContact CB-CD2 4.41Å
509	D	86.9	Confident	92.7	Very high	59 Å²	59	39.4 Å²	39.4	32%	0.316	23%	0.233	S	C	.	.			trans	-127.4	27.2	-179.5	-162.2	40	0	0	0	113.4	T325 R326	T325-D509 WeakPolarHBondContact CA-O 3.25Å; R326-D509 WeakPolarHBondContact CB-OD1 3.46Å; R326-D509 WeakPolarHBondContact CB-OD2 3.49Å; R326-D509 IonicContact CZ-OD1 3.58Å; R326-D509 PolarHBondContact N-O 3.27Å; R326-D509 PolarHBondContact N-OD2 2.89Å; R326-D509 IonicContact NH1-OD1 3.78Å; R326-D509 PolarHBondContact NH1-OD1 2.76Å; R326-D509 IonicContact NH2-OD1 2.73Å
510	F	91.8	Very high	92.7	Very high	93 Å²	93	43.4 Å²	43.4	41%	0.408	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	136.7	-176.4	-65.6	-71	0	0	0	112.1	T323 T324 D503 K508 Y512	T323-F510 HydrophobicContact CG2-CD1 3.94Å; T324-F510 WeakPolarHBondContact O-CA 3.04Å; D503-F510 PolarHBondContact N-O 2.96Å; K508-F510 HydrophobicContact CB-CD2 4.41Å; F510-Y512 HydrophobicContact CB-CE2 3.99Å
511	V	93.9	Very high	92.6	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136	168.4	-173.1	0	0	0	0	108.7	T324 R326 L329 A500 L502	T324-V511 HydrophobicContact CG2-CB 4.28Å; T324-V511 PolarHBondContact N-O 3.48Å; T324-V511 PolarHBondContact O-N 3.07Å; R326-V511 HydrophobicContact CB-CG2 4.43Å; L329-V511 HydrophobicContact CD2-CB 3.99Å; L329-V511 HydrophobicContact CD2-CG1 3.63Å; L329-V511 HydrophobicContact CD2-CG2 4.08Å; A500-V511 HydrophobicContact CB-CG1 4.09Å; L502-V511 HydrophobicContact CD2-CG2 4.4Å; L502-V511 HydrophobicContact CG-CG1 4.13Å; L502-V511 HydrophobicContact CG-CG2 4.16Å
512	Y	96.1	Very high	92.6	Very high	9 Å²	9	47.2 Å²	47.2	4%	0.035	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	106.7	177.9	-57.8	-94.8	0	0	0	107.8	V321 A322 T323 V429 A454 I456 A500 I501 D503 F510	V321-Y512 HydrophobicContact CG1-CD1 4.16Å; A322-Y512 WeakPolarHBondContact O-CA 3.4Å; T323-Y512 HydrophobicContact CG2-CD1 4.17Å; T323-Y512 HydrophobicContact CG2-CE1 3.78Å; T323-Y512 WeakPolarHBondContact OG1-CD1 3.48Å; V429-Y512 HydrophobicContact CG2-CD1 4.32Å; V429-Y512 HydrophobicContact CG2-CE1 4.26Å; A454-Y512 HydrophobicContact CB-CE1 3.95Å; A454-Y512 VanDerWaalsContact CB-OH 3.27Å; A454-Y512 WeakPolarHBondContact CB-OH 3.48Å; I456-Y512 HydrophobicContact CD1-CD2 3.38Å; I456-Y512 HydrophobicContact CD1-CE2 3.27Å; I456-Y512 HydrophobicContact CD1-CG 4.22Å; I456-Y512 HydrophobicContact CG1-CD2 4.43Å; I456-Y512 HydrophobicContact CG1-CE2 3.86Å; A500-Y512 WeakPolarHBondContact CA-O 3.45Å; I501-Y512 PolarHBondContact N-O 3.02Å; I501-Y512 PolarHBondContact O-N 2.81Å; D503-Y512 HydrophobicContact CB-CE2 4.39Å; F510-Y512 HydrophobicContact CB-CE2 3.99Å
513	V	96.1	Very high	92.6	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.3	172.6	-178.5	0	0	0	0	107.5	V321 A322 L329 L413 F415 W467 R498	V321-V513 WeakPolarHBondContact CA-O 3.2Å; A322-V513 HydrophobicContact CB-CB 4.37Å; A322-V513 PolarHBondContact N-O 3.24Å; A322-V513 PolarHBondContact O-N 2.74Å; L329-V513 HydrophobicContact CD1-CG2 3.71Å; L413-V513 HydrophobicContact CD1-CB 4.32Å; L413-V513 HydrophobicContact CD1-CG1 4.28Å; L413-V513 HydrophobicContact CD1-CG2 4.08Å; F415-V513 HydrophobicContact CE1-CB 4.46Å; F415-V513 HydrophobicContact CE1-CG1 4.09Å; F415-V513 HydrophobicContact CZ-CB 4.43Å; F415-V513 HydrophobicContact CZ-CG1 3.89Å; W467-V513 HydrophobicContact CB-CG1 3.78Å; W467-V513 HydrophobicContact CB-CG2 4.29Å; W467-V513 HydrophobicContact CG-CG1 4.09Å; R498-V513 HydrophobicContact CB-CG1 4.43Å
514	I	96.4	Very high	92.7	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.1	-172.8	-59.9	177	0	0	0	108.8	L319 V321 L420 R498 F499 I501	L319-I514 HydrophobicContact CB-CG2 4.07Å; L319-I514 HydrophobicContact CD1-CG2 3.45Å; L319-I514 VanDerWaalsContact CD1-CG2 3.45Å; L319-I514 HydrophobicContact CG-CG2 4.41Å; V321-I514 HydrophobicContact CG2-CG1 4.36Å; L420-I514 HydrophobicContact CD1-CD1 4Å; R498-I514 VanDerWaalsContact CA-O 3.31Å; R498-I514 WeakPolarHBondContact CA-O 3.5Å; F499-I514 HydrophobicContact CD1-CB 4.48Å; F499-I514 HydrophobicContact CD2-CB 4.29Å; F499-I514 HydrophobicContact CD2-CD1 4.5Å; F499-I514 HydrophobicContact CE1-CB 4.06Å; F499-I514 HydrophobicContact CE1-CG2 3.78Å; F499-I514 HydrophobicContact CE2-CB 3.87Å; F499-I514 HydrophobicContact CE2-CD1 3.67Å; F499-I514 HydrophobicContact CE2-CG1 4.26Å; F499-I514 HydrophobicContact CE2-CG2 4.13Å; F499-I514 HydrophobicContact CZ-CB 3.74Å; F499-I514 HydrophobicContact CZ-CD1 4.03Å; F499-I514 HydrophobicContact CZ-CG1 4.47Å; F499-I514 HydrophobicContact CZ-CG2 3.5Å; F499-I514 VanDerWaalsContact CZ-CG2 3.5Å; F499-I514 PolarHBondContact N-O 3.28Å; F499-I514 VanDerWaalsContact N-O 3.15Å; F499-I514 PolarHBondContact O-N 3.34Å; I501-I514 HydrophobicContact CD1-CD1 3.51Å; I501-I514 HydrophobicContact CG1-CD1 3.91Å
515	D	95.2	Very high	93	Very high	26 Å²	26	50 Å²	50	14%	0.139	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	113.2	166.4	174.9	1.1	0	0	0	109.2	L320 F415 R498 I517	L320-D515 HydrophobicContact CB-CB 3.93Å; L320-D515 PolarHBondContact N-O 3.19Å; L320-D515 VanDerWaalsContact N-O 3.16Å; L320-D515 PolarHBondContact O-N 3.05Å; F415-D515 HydrophobicContact CD1-CB 4.35Å; F415-D515 HydrophobicContact CE1-CB 4.13Å; R498-D515 HydrophobicContact CG-CB 3.82Å; D515-I517 PolarHBondContact O-N 3.39Å; D515-I517 PolarHBondContact OD1-N 3.35Å
516	P	94.5	Very high	93.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.289	C	S	.	.			trans	-72.2	-8.9	-177.2	29.3	-33.5	0	0	0	113.6	L319 L497 F499 T518 N521 R522	L319-P516 WeakPolarHBondContact CD2-O 3.46Å; L497-P516 HydrophobicContact CB-CG 3.8Å; F499-P516 HydrophobicContact CE1-CB 4.24Å; F499-P516 HydrophobicContact CE1-CG 4.46Å; P516-T518 PolarHBondContact O-N 2.69Å; P516-N521 HydrophobicContact CB-CB 3.96Å; P516-N521 WeakPolarHBondContact O-CB 3.39Å; P516-N521 PolarHBondContact O-ND2 3.28Å; P516-R522 HydrophobicContact CB-CB 3.9Å; P516-R522 HydrophobicContact CG-CB 3.73Å; P516-R522 HydrophobicContact CG-CG 4.18Å
517	I	91.6	Very high	93.5	Very high	97 Å²	97	47.1 Å²	47.1	50%	0.497	28%	0.277	S	S	.	.	S	Bend	trans	67.1	-37.6	-175.3	-50.8	169.5	0	0	0	113.1	L320 D515	L320-I517 HydrophobicContact CD1-CG1 4.48Å; L320-I517 HydrophobicContact CG-CD1 4.31Å; L320-I517 HydrophobicContact CG-CG1 4.26Å; D515-I517 PolarHBondContact O-N 3.39Å; D515-I517 PolarHBondContact OD1-N 3.35Å
518	T	92.3	Very high	93.8	Very high	62 Å²	62	45.3 Å²	45.3	38%	0.38	25%	0.245	S	C	.	.	S	Bend	trans	-135.3	152.5	-179.5	67.7	0	0	0	0	111.5	P516 S520 N521 R522	P516-T518 PolarHBondContact O-N 2.69Å; T518-S520 VanDerWaalsContact C-N 3.31Å; T518-S520 PolarHBondContact O-N 2.87Å; T518-N521 PolarHBondContact O-N 3.02Å; T518-N521 WeakPolarHBondContact OG1-CB 3.27Å; T518-N521 VanDerWaalsContact OG1-CG 3.23Å; T518-N521 PolarHBondContact OG1-N 3.11Å; T518-N521 PolarHBondContact OG1-ND2 3.29Å; T518-R522 PolarHBondContact O-N 3.13Å; T518-R522 VanDerWaalsContact O-N 3.15Å
519	C	92.4	Very high	94.3	Very high	59 Å²	59	41 Å²	41	40%	0.399	23%	0.226	S	C	.	.	H	α-helix	trans	-60.6	-40	175.8	-167.3	0	0	0	0	112.1	L497 N521 R522 E523	L497-C519 HydrophobicContact CD1-CB 4.27Å; C519-N521 VanDerWaalsContact C-N 3.33Å; C519-N521 PolarHBondContact O-N 3.15Å; C519-R522 WeakPolarHBondContact O-CA 3.41Å; C519-R522 VanDerWaalsContact O-CB 3.25Å; C519-R522 WeakPolarHBondContact O-CB 3.35Å; C519-R522 PolarHBondContact O-N 3.03Å; C519-E523 WeakPolarHBondContact O-CG 3.37Å; C519-E523 PolarHBondContact O-N 3.15Å
520	S	94.3	Very high	94.7	Very high	84 Å²	84	45 Å²	45	59%	0.587	24%	0.237	S	C	*	.	H	α-helix	trans	-62.4	-37.9	178.5	-52.8	0	0	0	0	113.1	T518 A524	T518-S520 VanDerWaalsContact C-N 3.31Å; T518-S520 PolarHBondContact O-N 2.87Å; S520-A524 WeakPolarHBondContact O-CB 3.35Å; S520-A524 PolarHBondContact O-N 2.97Å; S520-A524 VanDerWaalsContact O-N 3.09Å
521	N	94.4	Very high	94.8	Very high	34 Å²	34	44.5 Å²	44.5	18%	0.182	24%	0.239	C	C	.	.	H	α-helix	trans	-64	-43.6	172	-76.3	-13.7	0	0	0	110.7	L319 P516 T518 C519 E523 A524 W525	L319-N521 HydrophobicContact CD2-CB 4.15Å; P516-N521 HydrophobicContact CB-CB 3.96Å; P516-N521 WeakPolarHBondContact O-CB 3.39Å; P516-N521 PolarHBondContact O-ND2 3.28Å; T518-N521 PolarHBondContact O-N 3.02Å; T518-N521 WeakPolarHBondContact OG1-CB 3.27Å; T518-N521 VanDerWaalsContact OG1-CG 3.23Å; T518-N521 PolarHBondContact OG1-N 3.11Å; T518-N521 PolarHBondContact OG1-ND2 3.29Å; C519-N521 VanDerWaalsContact C-N 3.33Å; C519-N521 PolarHBondContact O-N 3.15Å; N521-E523 PolarHBondContact O-N 2.95Å; N521-A524 PolarHBondContact O-N 2.88Å; N521-W525 PolarHBondContact O-N 3.36Å
522	R	95.1	Very high	94.8	Very high	45 Å²	45	44.8 Å²	44.8	17%	0.17	24%	0.24	C	C	.	.	H	α-helix	trans	-56.3	-52.7	176.4	-169	-177.4	-179.7	-100.1	3.1	110.9	S465 L497 F499 P516 T518 C519 A524 W525 V526	S465-R522 PolarHBondContact O-NH2 3.43Å; L497-R522 VanDerWaalsContact O-CD 3.23Å; L497-R522 WeakPolarHBondContact O-CD 3.42Å; L497-R522 PolarHBondContact O-NE 3.24Å; L497-R522 VanDerWaalsContact O-NE 3.14Å; F499-R522 HydrophobicContact CD1-CG 4.42Å; P516-R522 HydrophobicContact CB-CB 3.9Å; P516-R522 HydrophobicContact CG-CB 3.73Å; P516-R522 HydrophobicContact CG-CG 4.18Å; T518-R522 PolarHBondContact O-N 3.13Å; T518-R522 VanDerWaalsContact O-N 3.15Å; C519-R522 WeakPolarHBondContact O-CA 3.41Å; C519-R522 VanDerWaalsContact O-CB 3.25Å; C519-R522 WeakPolarHBondContact O-CB 3.35Å; C519-R522 PolarHBondContact O-N 3.03Å; R522-A524 VanDerWaalsContact C-N 3.34Å; R522-A524 PolarHBondContact O-N 3.1Å; R522-W525 PolarHBondContact O-N 3.1Å; R522-V526 HydrophobicContact CG-CG2 3.96Å; R522-V526 VanDerWaalsContact O-CB 3.29Å; R522-V526 WeakPolarHBondContact O-CB 3.35Å; R522-V526 WeakPolarHBondContact O-CG2 3.29Å; R522-V526 PolarHBondContact O-N 3.21Å
523	E	94.6	Very high	94.6	Very high	114 Å²	114	47 Å²	47	53%	0.533	25%	0.251	S	S	.	.	H	α-helix	trans	-56.5	-47.2	-179.7	-71.4	172.2	179.1	0	0	111.8	C519 N521 W525 V526 V527	C519-E523 WeakPolarHBondContact O-CG 3.37Å; C519-E523 PolarHBondContact O-N 3.15Å; N521-E523 PolarHBondContact O-N 2.95Å; E523-W525 PolarHBondContact O-N 3.5Å; E523-V526 PolarHBondContact O-N 2.95Å; E523-V527 VanDerWaalsContact O-CG2 3.32Å; E523-V527 WeakPolarHBondContact O-CG2 3.42Å; E523-V527 PolarHBondContact O-N 3.1Å; E523-V527 VanDerWaalsContact O-N 3.11Å
524	A	95.4	Very high	94.5	Very high	42 Å²	42	52.5 Å²	52.5	35%	0.347	28%	0.276	S	S	.	.	H	α-helix	trans	-59.9	-44.3	179.2	0	0	0	0	0	112.6	L315 S520 N521 R522 Q528	L315-A524 HydrophobicContact CD2-CB 4.45Å; S520-A524 WeakPolarHBondContact O-CB 3.35Å; S520-A524 PolarHBondContact O-N 2.97Å; S520-A524 VanDerWaalsContact O-N 3.09Å; N521-A524 PolarHBondContact O-N 2.88Å; R522-A524 VanDerWaalsContact C-N 3.34Å; R522-A524 PolarHBondContact O-N 3.1Å; A524-Q528 WeakPolarHBondContact O-CG 3.44Å
525	W	97.1	Very high	94.2	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-46.3	178.4	-84.9	79.3	0	0	0	112.3	L315 S317 L319 L420 L422 L427 F499 N521 R522 E523 V527 Q528 L529	L315-W525 HydrophobicContact CD2-CB 4.25Å; L315-W525 VanDerWaalsContact CD2-CD1 3.46Å; L315-W525 HydrophobicContact CD2-CD2 3.67Å; L315-W525 HydrophobicContact CD2-CE3 4.41Å; L315-W525 HydrophobicContact CD2-CG 3.59Å; L315-W525 HydrophobicContact CD2-CZ2 4.28Å; L315-W525 HydrophobicContact CG-CZ2 4.4Å; S317-W525 PolarHBondContact OG-NE1 3.23Å; L319-W525 HydrophobicContact CD1-CD2 4.2Å; L319-W525 HydrophobicContact CD1-CG 4.37Å; L319-W525 HydrophobicContact CD1-CZ2 4.22Å; L420-W525 HydrophobicContact CB-CH2 3.51Å; L420-W525 HydrophobicContact CB-CZ2 3.67Å; L420-W525 HydrophobicContact CD1-CH2 3.75Å; L420-W525 HydrophobicContact CD1-CZ2 4.03Å; L420-W525 HydrophobicContact CD1-CZ3 4.29Å; L420-W525 HydrophobicContact CG-CH2 4.3Å; L420-W525 HydrophobicContact CG-CZ2 4.46Å; L422-W525 HydrophobicContact CB-CH2 4.17Å; L422-W525 HydrophobicContact CB-CZ3 4.24Å; L422-W525 HydrophobicContact CD2-CZ3 4.43Å; L427-W525 HydrophobicContact CD1-CH2 3.87Å; L427-W525 HydrophobicContact CD1-CZ3 3.95Å; F499-W525 HydrophobicContact CE1-CB 4.36Å; F499-W525 HydrophobicContact CZ-CB 3.88Å; F499-W525 HydrophobicContact CZ-CD2 4.38Å; F499-W525 HydrophobicContact CZ-CE3 4.42Å; F499-W525 HydrophobicContact CZ-CG 4.15Å; N521-W525 PolarHBondContact O-N 3.36Å; R522-W525 PolarHBondContact O-N 3.1Å; E523-W525 PolarHBondContact O-N 3.5Å; W525-V527 VanDerWaalsContact C-N 3.32Å; W525-V527 PolarHBondContact O-N 3.41Å; W525-Q528 PolarHBondContact O-N 2.98Å; W525-Q528 VanDerWaalsContact O-N 3.16Å; W525-L529 HydrophobicContact CE3-CD1 4.3Å; W525-L529 VanDerWaalsContact O-CG 3.3Å; W525-L529 WeakPolarHBondContact O-CG 3.36Å; W525-L529 PolarHBondContact O-N 3.01Å
526	V	95	Very high	94	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.03	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-38.6	-175.2	168.4	0	0	0	0	111.7	Y463 R522 E523 L529 R530	Y463-V526 HydrophobicContact CE1-CG1 4.48Å; Y463-V526 HydrophobicContact CE2-CG2 4.05Å; Y463-V526 VanDerWaalsContact OH-CG1 3.26Å; Y463-V526 WeakPolarHBondContact OH-CG1 3.26Å; Y463-V526 VanDerWaalsContact OH-CG2 3.22Å; Y463-V526 WeakPolarHBondContact OH-CG2 3.34Å; R522-V526 HydrophobicContact CG-CG2 3.96Å; R522-V526 VanDerWaalsContact O-CB 3.29Å; R522-V526 WeakPolarHBondContact O-CB 3.35Å; R522-V526 WeakPolarHBondContact O-CG2 3.29Å; R522-V526 PolarHBondContact O-N 3.21Å; E523-V526 PolarHBondContact O-N 2.95Å; V526-L529 PolarHBondContact O-N 3.48Å; V526-R530 HydrophobicContact CG1-CG 4.26Å; V526-R530 VanDerWaalsContact CG1-NH2 3.28Å; V526-R530 WeakPolarHBondContact O-CB 3.32Å; V526-R530 VanDerWaalsContact O-CG 3.29Å; V526-R530 WeakPolarHBondContact O-CG 3.48Å; V526-R530 PolarHBondContact O-N 2.69Å
527	V	95.7	Very high	93.8	Very high	79 Å²	79	62.9 Å²	62.9	48%	0.479	33%	0.325	S	S	.	.	H	α-helix	trans	-58.1	-50.5	173.9	169.9	0	0	0	0	110.7	E523 W525 L529 R530 D531	E523-V527 VanDerWaalsContact O-CG2 3.32Å; E523-V527 WeakPolarHBondContact O-CG2 3.42Å; E523-V527 PolarHBondContact O-N 3.1Å; E523-V527 VanDerWaalsContact O-N 3.11Å; W525-V527 VanDerWaalsContact C-N 3.32Å; W525-V527 PolarHBondContact O-N 3.41Å; V527-L529 PolarHBondContact O-N 2.95Å; V527-R530 PolarHBondContact O-N 3.45Å; V527-D531 WeakPolarHBondContact O-CB 3.35Å; V527-D531 VanDerWaalsContact O-CG 3.3Å; V527-D531 PolarHBondContact O-N 3.46Å
528	Q	95.2	Very high	93.7	Very high	52 Å²	52	60.7 Å²	60.7	24%	0.243	31%	0.312	C	S	.	.	H	α-helix	trans	-64.4	-41.7	-179.4	-63.3	-60	-42.3	0	0	112.5	L315 L422 A524 W525 D531 I532	L315-Q528 HydrophobicContact CD2-CG 4.3Å; L422-Q528 HydrophobicContact CD2-CB 3.93Å; A524-Q528 WeakPolarHBondContact O-CG 3.44Å; W525-Q528 PolarHBondContact O-N 2.98Å; W525-Q528 VanDerWaalsContact O-N 3.16Å; Q528-D531 PolarHBondContact O-N 3.46Å; Q528-I532 VanDerWaalsContact O-CG1 3.29Å; Q528-I532 WeakPolarHBondContact O-CG1 3.31Å; Q528-I532 PolarHBondContact O-N 3.19Å
529	L	95.9	Very high	93.5	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68.8	-39.2	-179	-67.3	173.6	0	0	0	112.3	L422 M461 Y463 F499 I501 W525 V526 V527 I532 Q533	L422-L529 HydrophobicContact CD2-CD2 4.49Å; M461-L529 HydrophobicContact CE-CD2 3.44Å; M461-L529 VanDerWaalsContact CE-CD2 3.44Å; M461-L529 HydrophobicContact SD-CD2 4.09Å; Y463-L529 HydrophobicContact CD1-CB 4.3Å; Y463-L529 HydrophobicContact CD2-CB 4.01Å; Y463-L529 HydrophobicContact CD2-CD1 3.51Å; Y463-L529 HydrophobicContact CD2-CG 4.38Å; Y463-L529 HydrophobicContact CE2-CD1 4.02Å; Y463-L529 HydrophobicContact CG-CB 3.83Å; Y463-L529 HydrophobicContact CG-CD1 4.14Å; F499-L529 HydrophobicContact CD2-CD1 4.08Å; F499-L529 HydrophobicContact CE2-CD1 3.63Å; F499-L529 HydrophobicContact CZ-CD1 4.45Å; I501-L529 HydrophobicContact CD1-CD1 3.96Å; I501-L529 HydrophobicContact CD1-CD2 4.02Å; I501-L529 HydrophobicContact CG1-CD1 4.26Å; W525-L529 HydrophobicContact CE3-CD1 4.3Å; W525-L529 VanDerWaalsContact O-CG 3.3Å; W525-L529 WeakPolarHBondContact O-CG 3.36Å; W525-L529 PolarHBondContact O-N 3.01Å; V526-L529 PolarHBondContact O-N 3.48Å; V527-L529 PolarHBondContact O-N 2.95Å; L529-I532 PolarHBondContact O-N 3.43Å; L529-Q533 WeakPolarHBondContact O-CG 3.36Å; L529-Q533 PolarHBondContact O-N 3.27Å
530	R	95.5	Very high	93.3	Very high	142 Å²	142	63.8 Å²	63.8	54%	0.536	32%	0.318	S	S	.	.	H	α-helix	trans	-65.7	-42.7	174	-72.4	-176.1	-153.5	-175.2	7.4	111.6	Y463 V526 V527 I532 Q533 H534	Y463-R530 HydrophobicContact CD1-CG 4.47Å; Y463-R530 HydrophobicContact CE1-CG 4.03Å; V526-R530 HydrophobicContact CG1-CG 4.26Å; V526-R530 VanDerWaalsContact CG1-NH2 3.28Å; V526-R530 WeakPolarHBondContact O-CB 3.32Å; V526-R530 VanDerWaalsContact O-CG 3.29Å; V526-R530 WeakPolarHBondContact O-CG 3.48Å; V526-R530 PolarHBondContact O-N 2.69Å; V527-R530 PolarHBondContact O-N 3.45Å; R530-I532 VanDerWaalsContact C-N 3.3Å; R530-I532 PolarHBondContact O-N 2.95Å; R530-Q533 PolarHBondContact O-N 3.41Å; R530-H534 WeakPolarHBondContact O-CB 3.23Å; R530-H534 PolarHBondContact O-N 2.97Å
531	D	94.6	Very high	93.1	Very high	83 Å²	83	62.7 Å²	62.7	44%	0.444	31%	0.305	S	S	.	.	H	α-helix	trans	-59.3	-43.4	175.9	-75.7	-10.3	0	0	0	111	V527 Q528 H534 M535	V527-D531 WeakPolarHBondContact O-CB 3.35Å; V527-D531 VanDerWaalsContact O-CG 3.3Å; V527-D531 PolarHBondContact O-N 3.46Å; Q528-D531 PolarHBondContact O-N 3.46Å; D531-H534 PolarHBondContact O-N 3.37Å; D531-M535 WeakPolarHBondContact O-CB 3.33Å; D531-M535 WeakPolarHBondContact O-CG 3.34Å; D531-M535 PolarHBondContact O-N 3.44Å
532	I	93.9	Very high	92.9	Very high	5 Å²	5	61.9 Å²	61.9	3%	0.026	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-48.9	174.3	-74.7	168.6	0	0	0	111.5	L314 L422 V458 M461 Q528 L529 R530 H534 M535 Q536	L314-I532 HydrophobicContact CD1-CD1 4.18Å; L422-I532 HydrophobicContact CD1-CD1 4.04Å; L422-I532 HydrophobicContact CD2-CD1 4Å; L422-I532 HydrophobicContact CG-CD1 4.36Å; V458-I532 HydrophobicContact CG1-CD1 4.38Å; V458-I532 HydrophobicContact CG1-CG1 4.41Å; V458-I532 HydrophobicContact CG1-CG2 3.52Å; M461-I532 HydrophobicContact CE-CD1 3.91Å; M461-I532 HydrophobicContact CE-CG2 3.97Å; Q528-I532 VanDerWaalsContact O-CG1 3.29Å; Q528-I532 WeakPolarHBondContact O-CG1 3.31Å; Q528-I532 PolarHBondContact O-N 3.19Å; L529-I532 PolarHBondContact O-N 3.43Å; R530-I532 VanDerWaalsContact C-N 3.3Å; R530-I532 PolarHBondContact O-N 2.95Å; I532-H534 VanDerWaalsContact C-N 3.33Å; I532-H534 PolarHBondContact O-N 3.33Å; I532-M535 HydrophobicContact CG1-CE 4.21Å; I532-M535 PolarHBondContact O-N 3.28Å; I532-Q536 HydrophobicContact CG2-CG 4.44Å; I532-Q536 WeakPolarHBondContact O-CG 3.49Å; I532-Q536 PolarHBondContact O-N 3.37Å
533	Q	91.4	Very high	92.7	Very high	57 Å²	57	64.9 Å²	64.9	27%	0.266	32%	0.322	S	S	.	.	H	α-helix	trans	-62	-41.2	179.2	-78.2	-176.3	-42.8	0	0	112.4	Y463 L529 R530 Q536 H537	Y463-Q533 PolarHBondContact O-NE2 3.19Å; L529-Q533 WeakPolarHBondContact O-CG 3.36Å; L529-Q533 PolarHBondContact O-N 3.27Å; R530-Q533 PolarHBondContact O-N 3.41Å; Q533-Q536 PolarHBondContact O-N 2.82Å; Q533-H537 PolarHBondContact O-N 2.95Å
534	H	93.3	Very high	92.5	Very high	114 Å²	114	67 Å²	67	53%	0.528	33%	0.332	S	S	.	.	H	α-helix	trans	-62.6	-45.8	175.8	-175.6	61.5	0	0	0	111	R530 D531 I532 Q536 H537 E538	R530-H534 WeakPolarHBondContact O-CB 3.23Å; R530-H534 PolarHBondContact O-N 2.97Å; D531-H534 PolarHBondContact O-N 3.37Å; I532-H534 VanDerWaalsContact C-N 3.33Å; I532-H534 PolarHBondContact O-N 3.33Å; H534-Q536 PolarHBondContact O-N 3.28Å; H534-H537 PolarHBondContact O-N 2.85Å; H534-E538 IonicContact CE1-OE1 3.19Å; H534-E538 WeakPolarHBondContact O-CG 3.43Å; H534-E538 PolarHBondContact O-N 3.43Å
535	M	91.1	Very high	92.1	Very high	98 Å²	98	66.9 Å²	66.9	48%	0.483	33%	0.326	S	S	.	.	H	α-helix	trans	-61.3	-40.2	175.5	-74.4	-170.9	-66.4	0	0	112.8	D531 I532 F539	D531-M535 WeakPolarHBondContact O-CB 3.33Å; D531-M535 WeakPolarHBondContact O-CG 3.34Å; D531-M535 PolarHBondContact O-N 3.44Å; I532-M535 HydrophobicContact CG1-CE 4.21Å; I532-M535 PolarHBondContact O-N 3.28Å; M535-F539 WeakPolarHBondContact O-CB 3.44Å; M535-F539 PolarHBondContact O-N 3.23Å
536	Q	90.5	Very high	91.7	Very high	43 Å²	43	70.8 Å²	70.8	20%	0.201	35%	0.351	C	S	.	.	H	α-helix	trans	-61.5	-44.1	174.1	-71.6	171	-25.3	0	0	111.4	V458 M461 I532 Q533 H534 F539 L540	V458-Q536 PolarHBondContact O-NE2 3.39Å; M461-Q536 PolarHBondContact O-NE2 2.93Å; I532-Q536 HydrophobicContact CG2-CG 4.44Å; I532-Q536 WeakPolarHBondContact O-CG 3.49Å; I532-Q536 PolarHBondContact O-N 3.37Å; Q533-Q536 PolarHBondContact O-N 2.82Å; H534-Q536 PolarHBondContact O-N 3.28Å; Q536-F539 PolarHBondContact O-N 3.38Å; Q536-L540 WeakPolarHBondContact O-CB 3.47Å; Q536-L540 VanDerWaalsContact O-CG 3.29Å; Q536-L540 WeakPolarHBondContact O-CG 3.31Å; Q536-L540 PolarHBondContact O-N 3.47Å
537	H	89.7	Confident	91.1	Very high	106 Å²	106	80.1 Å²	80.1	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-63.2	-50.4	179	-176.3	70.1	0	0	0	111.6	Q533 H534 F539 L540 L541	Q533-H537 PolarHBondContact O-N 2.95Å; H534-H537 PolarHBondContact O-N 2.85Å; H537-F539 VanDerWaalsContact C-N 3.29Å; H537-F539 PolarHBondContact O-N 3.2Å; H537-L540 PolarHBondContact O-N 2.71Å; H537-L540 VanDerWaalsContact O-N 3.17Å; H537-L541 WeakPolarHBondContact O-CG 3.12Å; H537-L541 PolarHBondContact O-N 3.29Å
538	E	90	Very high	90.2	Very high	50 Å²	50	83.6 Å²	83.6	23%	0.234	39%	0.394	C	S	.	.	H	α-helix	trans	-58.9	-40.6	176.1	-71.1	-66.8	114.9	0	0	111.6	H534 L541 A542	H534-E538 IonicContact CE1-OE1 3.19Å; H534-E538 WeakPolarHBondContact O-CG 3.43Å; H534-E538 PolarHBondContact O-N 3.43Å; E538-L541 PolarHBondContact O-N 3.42Å; E538-A542 WeakPolarHBondContact O-CB 3.29Å; E538-A542 PolarHBondContact O-N 3.13Å
539	F	88.6	Confident	89.2	Confident	88 Å²	88	84.6 Å²	84.6	39%	0.386	40%	0.398	S	S	.	.	H	α-helix	trans	-65.8	-40.9	176.7	-175.9	-108.1	0	0	0	112.3	M535 Q536 H537 A542 L543	M535-F539 WeakPolarHBondContact O-CB 3.44Å; M535-F539 PolarHBondContact O-N 3.23Å; Q536-F539 PolarHBondContact O-N 3.38Å; H537-F539 VanDerWaalsContact C-N 3.29Å; H537-F539 PolarHBondContact O-N 3.2Å; F539-A542 PolarHBondContact O-N 3Å; F539-L543 HydrophobicContact CD1-CD1 3.93Å; F539-L543 HydrophobicContact CD1-CG 4.31Å; F539-L543 HydrophobicContact CE1-CD1 3.5Å; F539-L543 VanDerWaalsContact CE1-CD1 3.5Å; F539-L543 HydrophobicContact CE1-CD2 4.4Å; F539-L543 HydrophobicContact CE1-CG 3.98Å; F539-L543 HydrophobicContact CZ-CD1 4.04Å; F539-L543 HydrophobicContact CZ-CD2 4.09Å; F539-L543 HydrophobicContact CZ-CG 4.12Å; F539-L543 WeakPolarHBondContact O-CG 3.48Å; F539-L543 PolarHBondContact O-N 2.89Å
540	L	88.1	Confident	87.6	Confident	99 Å²	99	91.3 Å²	91.3	52%	0.518	43%	0.434	S	S	.	.	H	α-helix	trans	-64.3	-41.7	174.7	-73.1	171.2	0	0	0	111.6	Q536 H537 A542 L543 Q544	Q536-L540 WeakPolarHBondContact O-CB 3.47Å; Q536-L540 VanDerWaalsContact O-CG 3.29Å; Q536-L540 WeakPolarHBondContact O-CG 3.31Å; Q536-L540 PolarHBondContact O-N 3.47Å; H537-L540 PolarHBondContact O-N 2.71Å; H537-L540 VanDerWaalsContact O-N 3.17Å; L540-A542 VanDerWaalsContact C-N 3.29Å; L540-A542 PolarHBondContact O-N 2.73Å; L540-L543 PolarHBondContact O-N 3.3Å; L540-Q544 WeakPolarHBondContact O-CG 3.48Å; L540-Q544 PolarHBondContact O-N 2.87Å
541	L	89.5	Confident	85.5	Confident	61 Å²	61	88.9 Å²	88.9	32%	0.319	44%	0.435	S	S	.	.	H	α-helix	trans	-60.1	-41.2	172.4	-70.6	176.8	0	0	0	111.3	H537 E538 Q544 D545 F549	H537-L541 WeakPolarHBondContact O-CG 3.12Å; H537-L541 PolarHBondContact O-N 3.29Å; E538-L541 PolarHBondContact O-N 3.42Å; L541-Q544 PolarHBondContact O-N 3.41Å; L541-D545 PolarHBondContact O-N 3.3Å; L541-F549 HydrophobicContact CB-CE2 3.98Å; L541-F549 HydrophobicContact CB-CZ 3.81Å
542	A	90.6	Very high	83.3	Confident	17 Å²	17	91.1 Å²	91.1	14%	0.14	46%	0.457	C	S	.	.	H	α-helix	trans	-67.4	-33.5	176.9	0	0	0	0	0	112.9	E538 F539 L540 D545 P546 F549	E538-A542 WeakPolarHBondContact O-CB 3.29Å; E538-A542 PolarHBondContact O-N 3.13Å; F539-A542 PolarHBondContact O-N 3Å; L540-A542 VanDerWaalsContact C-N 3.29Å; L540-A542 PolarHBondContact O-N 2.73Å; A542-D545 CarbonylContact O-C 3.53Å; A542-P546 WeakPolarHBondContact O-CA 3.26Å; A542-P546 WeakPolarHBondContact O-CD 3.37Å; A542-P546 VanDerWaalsContact O-CG 3.31Å; A542-P546 WeakPolarHBondContact O-CG 3.39Å; A542-F549 HydrophobicContact CB-CB 4.36Å; A542-F549 HydrophobicContact CB-CD1 4.03Å; A542-F549 HydrophobicContact CB-CD2 3.5Å; A542-F549 VanDerWaalsContact CB-CD2 3.5Å; A542-F549 HydrophobicContact CB-CE1 4.17Å; A542-F549 HydrophobicContact CB-CE2 3.67Å; A542-F549 HydrophobicContact CB-CG 3.68Å; A542-F549 HydrophobicContact CB-CZ 3.99Å; A542-F549 VanDerWaalsContact N-CE2 3.29Å
543	L	90.7	Very high	80.8	Confident	108 Å²	108	94.6 Å²	94.6	57%	0.565	49%	0.487	S	S	*	.	H	α-helix	trans	-70.4	-35.5	172.6	-71.8	178.8	0	0	0	112.3	F539 L540	F539-L543 HydrophobicContact CD1-CD1 3.93Å; F539-L543 HydrophobicContact CD1-CG 4.31Å; F539-L543 HydrophobicContact CE1-CD1 3.5Å; F539-L543 VanDerWaalsContact CE1-CD1 3.5Å; F539-L543 HydrophobicContact CE1-CD2 4.4Å; F539-L543 HydrophobicContact CE1-CG 3.98Å; F539-L543 HydrophobicContact CZ-CD1 4.04Å; F539-L543 HydrophobicContact CZ-CD2 4.09Å; F539-L543 HydrophobicContact CZ-CG 4.12Å; F539-L543 WeakPolarHBondContact O-CG 3.48Å; F539-L543 PolarHBondContact O-N 2.89Å; L540-L543 PolarHBondContact O-N 3.3Å
544	Q	90.3	Very high	78.3	Confident	158 Å²	158	101.7 Å²	101.7	74%	0.738	51%	0.511	S	S	*	.	H	α-helix	trans	-72.1	-40.4	178.3	-73.3	176.5	-4.6	0	0	112.5	L540 L541	L540-Q544 WeakPolarHBondContact O-CG 3.48Å; L540-Q544 PolarHBondContact O-N 2.87Å; L541-Q544 PolarHBondContact O-N 3.41Å
545	D	87.5	Confident	75.4	Confident	39 Å²	39	102.7 Å²	102.7	21%	0.209	52%	0.52	C	S	.	.			trans	-139.3	83.5	174.6	-166.2	-4.9	0	0	0	111.6	L541 A542 R547 K548	L541-D545 PolarHBondContact O-N 3.3Å; A542-D545 CarbonylContact O-C 3.53Å; D545-R547 PolarHBondContact O-N 3.31Å; D545-R547 PolarHBondContact OD1-N 3.4Å; D545-R547 IonicContact OD1-NE 3.11Å; D545-K548 HydrophobicContact CB-CD 3.96Å; D545-K548 HydrophobicContact CB-CG 4.14Å; D545-K548 PolarHBondContact O-N 3.24Å; D545-K548 VanDerWaalsContact O-N 3.12Å; D545-K548 WeakPolarHBondContact OD2-CD 3.42Å; D545-K548 WeakPolarHBondContact OD2-CE 3.38Å; D545-K548 WeakPolarHBondContact OD2-CG 3.38Å; D545-K548 IonicContact OD2-NZ 3.79Å
546	P	88.7	Confident	72.8	Confident	83 Å²	83	104.4 Å²	104.4	54%	0.539	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-57.5	-26.2	-179.2	-25.2	32.8	0	0	0	113.5	A542 K548 F549 N550	A542-P546 WeakPolarHBondContact O-CA 3.26Å; A542-P546 WeakPolarHBondContact O-CD 3.37Å; A542-P546 VanDerWaalsContact O-CG 3.31Å; A542-P546 WeakPolarHBondContact O-CG 3.39Å; P546-K548 VanDerWaalsContact C-N 3.32Å; P546-K548 PolarHBondContact O-N 3.26Å; P546-F549 PolarHBondContact O-N 3.21Å; P546-N550 PolarHBondContact O-N 3.39Å
547	R	83.1	Confident	70	Confident	200 Å²	200	105.6 Å²	105.6	76%	0.755	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-69.4	-29.7	-177.7	-62.7	-179.8	-64.7	175.4	0.1	112.3	D545 F549 N550	D545-R547 PolarHBondContact O-N 3.31Å; D545-R547 PolarHBondContact OD1-N 3.4Å; D545-R547 IonicContact OD1-NE 3.11Å; R547-F549 PolarHBondContact O-N 3.22Å; R547-N550 PolarHBondContact O-N 3.42Å
548	K	77.1	Confident	67.3	Low	152 Å²	152	111.6 Å²	111.6	66%	0.661	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-64	-23.8	175.8	-73.9	179.6	-179.9	176.7	0	112.9	D545 P546	D545-K548 HydrophobicContact CB-CD 3.96Å; D545-K548 HydrophobicContact CB-CG 4.14Å; D545-K548 PolarHBondContact O-N 3.24Å; D545-K548 VanDerWaalsContact O-N 3.12Å; D545-K548 WeakPolarHBondContact OD2-CD 3.42Å; D545-K548 WeakPolarHBondContact OD2-CE 3.38Å; D545-K548 WeakPolarHBondContact OD2-CG 3.38Å; D545-K548 IonicContact OD2-NZ 3.79Å; P546-K548 VanDerWaalsContact C-N 3.32Å; P546-K548 PolarHBondContact O-N 3.26Å
549	F	72.7	Confident	64.5	Low	74 Å²	74	113.8 Å²	113.8	33%	0.325	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-102.7	-5.2	-177.2	-66.3	-96.5	0	0	0	113.1	L541 A542 P546 R547 T551 W601	L541-F549 HydrophobicContact CB-CE2 3.98Å; L541-F549 HydrophobicContact CB-CZ 3.81Å; A542-F549 HydrophobicContact CB-CB 4.36Å; A542-F549 HydrophobicContact CB-CD1 4.03Å; A542-F549 HydrophobicContact CB-CD2 3.5Å; A542-F549 VanDerWaalsContact CB-CD2 3.5Å; A542-F549 HydrophobicContact CB-CE1 4.17Å; A542-F549 HydrophobicContact CB-CE2 3.67Å; A542-F549 HydrophobicContact CB-CG 3.68Å; A542-F549 HydrophobicContact CB-CZ 3.99Å; A542-F549 VanDerWaalsContact N-CE2 3.29Å; P546-F549 PolarHBondContact O-N 3.21Å; R547-F549 PolarHBondContact O-N 3.22Å; F549-T551 VanDerWaalsContact C-N 3.34Å; F549-T551 PolarHBondContact O-N 3.24Å; F549-W601 HydrophobicContact CD1-CZ2 4.39Å
550	N	62.3	Low	61.8	Low	140 Å²	140	116.5 Å²	116.5	75%	0.749	61%	0.608	S	S	*	*			trans	-93.1	19.1	-177	-155.3	23	0	0	0	113.8	P546 R547	P546-N550 PolarHBondContact O-N 3.39Å; R547-N550 PolarHBondContact O-N 3.42Å
551	T	51.5	Low	59	Low	91 Å²	91	119.4 Å²	119.4	56%	0.558	62%	0.624	S	S	*	*			trans	-96	106.6	175.3	56	0	0	0	0	109.6	F549 A553	F549-T551 VanDerWaalsContact C-N 3.34Å; F549-T551 PolarHBondContact O-N 3.24Å; T551-A553 PolarHBondContact O-N 2.88Å
552	S	49.4	Very low	56.2	Low	131 Å²	131	121.8 Å²	121.8	92%	0.916	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	32	165.2	49.1	0	0	0	0	113.2
553	A	40.9	Very low	53.4	Low	78 Å²	78	128.7 Å²	128.7	65%	0.645	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	16.3	-171.7	0	0	0	0	0	113.6	T551 D555	T551-A553 PolarHBondContact O-N 2.88Å; A553-D555 PolarHBondContact O-N 3.32Å
554	R	39.6	Very low	50.5	Low	205 Å²	205	129.6 Å²	129.6	77%	0.774	69%	0.69	S	S	*	*			trans	-80.3	64	156.6	-85	-170	165.5	172.3	-2.3	109.1
555	D	32.5	Very low	47.8	Very low	135 Å²	135	131.1 Å²	131.1	72%	0.722	70%	0.697	S	S	*	*			trans	-89.1	137.1	164.4	-135	-9.9	0	0	0	107.7	A553 G557	A553-D555 PolarHBondContact O-N 3.32Å; D555-G557 PolarHBondContact O-N 3.24Å
556	E	36.3	Very low	45.1	Very low	134 Å²	134	137.2 Å²	137.2	63%	0.626	72%	0.724	S	S	*	*	S	Bend	trans	74.3	1.4	158.3	-57.9	-141.9	-178.5	0	0	123.7	K560	E556-K560 IonicContact OE2-NZ 3.17Å; E556-K560 PolarHBondContact OE2-NZ 3.41Å
557	G	31.5	Very low	42.4	Very low	69 Å²	69	138.8 Å²	138.8	71%	0.711	73%	0.734	S	S	*	*	S	Bend	trans	-95.1	-20.1	-172.8	0	0	0	0	0	119.7	D555	D555-G557 PolarHBondContact O-N 3.24Å
558	W	31.7	Very low	40.2	Very low	232 Å²	232	135.6 Å²	135.6	88%	0.879	74%	0.737	S	S	*	*	S	Bend	trans	-129.5	13.8	-170	-86.6	-21.9	0	0	0	114.6
559	A	31.4	Very low	38.2	Very low	95 Å²	95	133 Å²	133	79%	0.785	74%	0.738	S	S	*	*	S	Bend	trans	-125.1	2.8	-176.9	0	0	0	0	0	114.8
560	K	31.7	Very low	36.5	Very low	146 Å²	146	136.2 Å²	136.2	64%	0.635	76%	0.763	S	S	*	*	S	Bend	trans	-112.1	84.6	171.4	-84.7	171.9	176.5	160.9	0	107.5	E556	E556-K560 IonicContact OE2-NZ 3.17Å; E556-K560 PolarHBondContact OE2-NZ 3.41Å
561	D	29.5	Very low	35.2	Very low	159 Å²	159	138.9 Å²	138.9	85%	0.85	77%	0.769	S	S	*	*	S	Bend	trans	-178.3	72.1	161.7	-85.8	-23.5	0	0	0	107.7
562	S	31.1	Very low	34.5	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	78%	0.777	S	S	*	*	S	Bend	trans	-171.1	-0	168.1	-94.2	0	0	0	0	116
563	L	31.5	Very low	33.7	Very low	162 Å²	162	139.1 Å²	139.1	85%	0.848	77%	0.769	S	S	*	*	S	Bend	trans	-144.6	81.8	-179.8	-75.5	165.4	0	0	0	110
564	T	30.9	Very low	33.5	Very low	128 Å²	128	141.3 Å²	141.3	79%	0.785	77%	0.77	S	S	*	*			trans	146.7	106.8	153.4	50.8	0	0	0	0	108.3
565	H	33.8	Very low	33.2	Very low	190 Å²	190	139.4 Å²	139.4	88%	0.88	77%	0.77	S	S	*	*			trans	-174.6	100	144.9	-98.6	-65.6	0	0	0	109.8
566	E	30.1	Very low	33.3	Very low	167 Å²	167	137.9 Å²	137.9	78%	0.78	77%	0.77	S	S	*	*			trans	-59.6	139.1	148.5	-92.7	-92.5	136.3	0	0	108.6
567	P	33	Very low	33.3	Very low	115 Å²	115	137 Å²	137	75%	0.747	77%	0.773	S	S	*	*			trans	-88.7	120.4	178.5	33.4	-26.9	0	0	0	109.5
568	T	36.7	Very low	33.4	Very low	133 Å²	133	144 Å²	144	82%	0.816	78%	0.778	S	S	*	*			trans	-133.4	111.7	155.1	-43.7	0	0	0	0	109.1
569	S	33.7	Very low	33.5	Very low	99 Å²	99	138.2 Å²	138.2	69%	0.692	77%	0.769	S	S	*	*			trans	-60.2	136.3	172.7	52.9	0	0	0	0	111.9
570	T	38.4	Very low	33.6	Very low	140 Å²	140	141 Å²	141	86%	0.859	77%	0.77	S	S	*	*				-173.6	145.8	115.7	15.4	0	0	0	0	112.4
571	F	33.2	Very low	33.9	Very low	197 Å²	197	139 Å²	139	86%	0.864	78%	0.781	S	S	*	*			trans	-59.8	143.7	-177.2	-89.1	-109.5	0	0	0	115.7
572	S	37.4	Very low	34.1	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	78%	0.78	S	S	*	*				149.9	120	110.1	-84.1	0	0	0	0	114
573	T	32.6	Very low	34.4	Very low	121 Å²	121	142.7 Å²	142.7	74%	0.742	79%	0.786	S	S	*	*			trans	-8.9	136.3	140.6	-31.2	0	0	0	0	114.4
574	D	36	Very low	34.2	Very low	124 Å²	124	139.8 Å²	139.8	66%	0.663	78%	0.779	S	S	*	*				-173.8	161.2	57.6	-143	-12.7	0	0	0	112.9
575	Q	34.3	Very low	34.4	Very low	166 Å²	166	141.6 Å²	141.6	78%	0.776	78%	0.782	S	S	*	*			trans	-9.2	144.7	167.7	-66.9	157	49.8	0	0	122.5
576	S	33.6	Very low	34.1	Very low	102 Å²	102	137.8 Å²	137.8	71%	0.713	78%	0.777	S	S	*	*				129.1	116	112.6	-149.4	0	0	0	0	117
577	V	36.9	Very low	34.2	Very low	116 Å²	116	137.7 Å²	137.7	70%	0.703	78%	0.78	S	S	*	*			trans	82	105.9	130.6	172.7	0	0	0	0	120.9
578	R	33.9	Very low	34.3	Very low	215 Å²	215	137.5 Å²	137.5	81%	0.811	78%	0.781	S	S	*	*				75.6	131.4	125.5	-76.5	-173.7	173.3	158.1	-2.8	123.4
579	T	34.2	Very low	34.1	Very low	111 Å²	111	136.9 Å²	136.9	68%	0.681	78%	0.779	S	S	*	*			trans	87.4	110	132	48.4	0	0	0	0	120.7
580	D	32.6	Very low	33.8	Very low	154 Å²	154	137.8 Å²	137.8	82%	0.824	79%	0.785	S	S	*	*				52.8	115.3	127.1	-62.7	-34	0	0	0	119.9
581	A	38.2	Very low	33.4	Very low	104 Å²	104	138.4 Å²	138.4	86%	0.86	78%	0.782	S	S	*	*				-166.3	137.3	115.6	0	0	0	0	0	111.4
582	Q	35	Very low	33.4	Very low	178 Å²	178	137.7 Å²	137.7	83%	0.832	78%	0.782	S	S	*	*			trans	-53.8	152.4	175.6	-61.6	177.3	-21.4	0	0	113.5
583	L	36	Very low	33	Very low	170 Å²	170	137.3 Å²	137.3	89%	0.89	79%	0.785	S	S	*	*				-172.7	138.1	113.3	-93.2	161.1	0	0	0	111.6
584	S	28.3	Very low	33.1	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	78%	0.784	S	S	*	*			trans	-76.2	138.7	-170.8	49.6	0	0	0	0	114.9
585	I	34.4	Very low	33	Very low	166 Å²	166	139.8 Å²	139.8	85%	0.851	80%	0.796	S	S	*	*			trans	-145.2	125.4	139.7	-59.4	-173.6	0	0	0	109.2
586	S	26.9	Very low	32.8	Very low	110 Å²	110	139.3 Å²	139.3	77%	0.769	79%	0.793	S	S	*	*			trans	-88.2	125.5	-178.1	43.2	0	0	0	0	112.9
587	I	33.9	Very low	33	Very low	165 Å²	165	139.3 Å²	139.3	85%	0.846	79%	0.791	S	S	*	*			trans	-144.7	133.9	154.5	-57.3	-176.2	0	0	0	109.5
588	S	34	Very low	32.7	Very low	110 Å²	110	142.1 Å²	142.1	77%	0.769	80%	0.796	S	S	*	*			trans	-55.2	150.6	-167.6	-45.5	0	0	0	0	118.4
589	P	31.7	Very low	32.7	Very low	120 Å²	120	141.1 Å²	141.1	78%	0.779	80%	0.798	S	S	*	*			trans	-95.4	126.1	166.7	33.6	-25.1	0	0	0	111.9
590	C	29.2	Very low	32.7	Very low	119 Å²	119	145.1 Å²	145.1	80%	0.804	81%	0.806	S	S	*	*			trans	-82.8	115.9	167	-175.3	0	0	0	0	109.4	Q592	C590-Q592 PolarHBondContact O-N 2.97Å
591	N	28.7	Very low	32.8	Very low	152 Å²	152	145.3 Å²	145.3	81%	0.813	80%	0.795	S	S	*	*			trans	-66.4	119.6	172.9	-83.9	-29.2	0	0	0	111.5
592	Q	34.2	Very low	32.7	Very low	183 Å²	183	143.8 Å²	143.8	86%	0.855	78%	0.776	S	S	*	*			trans	-130.5	96.1	152.7	-75.1	-171.2	10.5	0	0	108.6	C590 S594	C590-Q592 PolarHBondContact O-N 2.97Å; Q592-S594 PolarHBondContact O-N 3.21Å
593	A	29.3	Very low	32.8	Very low	97 Å²	97	140.2 Å²	140.2	80%	0.802	77%	0.771	S	S	*	*			trans	-72.5	104.9	174.7	0	0	0	0	0	109.8	Q595	A593-Q595 PolarHBondContact O-N 3.35Å
594	S	33.7	Very low	32.8	Very low	103 Å²	103	138.3 Å²	138.3	72%	0.72	76%	0.755	S	S	*	*			trans	-77.8	109.9	167	89.1	0	0	0	0	108.7	Q592 Q596	Q592-S594 PolarHBondContact O-N 3.21Å; S594-Q596 PolarHBondContact O-N 3.08Å
595	Q	34.5	Very low	33.1	Very low	194 Å²	194	138.4 Å²	138.4	91%	0.907	75%	0.752	S	S	*	*			trans	-74.6	104.3	175.6	-67.2	-178.2	7.6	0	0	109.8	A593	A593-Q595 PolarHBondContact O-N 3.35Å
596	Q	30.5	Very low	33.1	Very low	155 Å²	155	139 Å²	139	72%	0.724	75%	0.753	S	S	*	*			trans	-79.6	146.9	165.1	-73.2	-163.2	-12.4	0	0	110.4	S594 H598	S594-Q596 PolarHBondContact O-N 3.08Å; Q596-H598 PolarHBondContact O-N 3.31Å; Q596-H598 VanDerWaalsContact O-N 3.17Å
597	P	36.7	Very low	33.5	Very low	103 Å²	103	142.5 Å²	142.5	67%	0.669	76%	0.755	S	S	*	*			trans	-78.4	109.6	-171.9	31.5	-30.9	0	0	0	110.4	K599	P597-K599 PolarHBondContact O-N 3.35Å
598	H	31.6	Very low	33.3	Very low	174 Å²	174	145.3 Å²	145.3	81%	0.806	76%	0.755	S	S	*	*			trans	-53.3	131.1	162.7	-67.4	-88.3	0	0	0	109.8	Q596 K600	Q596-H598 PolarHBondContact O-N 3.31Å; Q596-H598 VanDerWaalsContact O-N 3.17Å; H598-K600 VanDerWaalsContact C-N 3.25Å; H598-K600 PolarHBondContact O-N 3.41Å
599	K	32.3	Very low	33.3	Very low	195 Å²	195	145.9 Å²	145.9	85%	0.848	76%	0.756	S	S	*	*			trans	-62.8	90.5	164.2	-71.5	-178.9	179.7	179.1	0	107.5	P597 W601	P597-K599 PolarHBondContact O-N 3.35Å; K599-W601 PolarHBondContact O-N 3.28Å
600	K	35.1	Very low	33.6	Very low	194 Å²	194	146.6 Å²	146.6	84%	0.843	76%	0.758	S	S	*	*			trans	-63.7	129.6	171.7	-84	-178.9	175	179.5	0	108.1	H598	H598-K600 VanDerWaalsContact C-N 3.25Å; H598-K600 PolarHBondContact O-N 3.41Å
601	W	34.3	Very low	33.8	Very low	159 Å²	159	151.2 Å²	151.2	60%	0.602	76%	0.758	S	S	*	*			trans	-44.1	140.3	167.8	-76	77.4	0	0	0	110.1	F549 K599 S603	F549-W601 HydrophobicContact CD1-CZ2 4.39Å; K599-W601 PolarHBondContact O-N 3.28Å; W601-S603 PolarHBondContact O-N 3.42Å; W601-S603 VanDerWaalsContact O-N 3.1Å
602	P	35.8	Very low	34.1	Very low	72 Å²	72	152 Å²	152	47%	0.468	76%	0.762	S	S	.	*			trans	-53.3	123.1	166.5	-16.1	27.7	0	0	0	107	F604	P602-F604 VanDerWaalsContact C-N 3.33Å; P602-F604 PolarHBondContact O-N 3Å
603	S	36.7	Very low	34	Very low	102 Å²	102	146.3 Å²	146.3	71%	0.713	75%	0.751	S	S	*	*			trans	-66.9	97.5	179.3	69	0	0	0	0	108.4	W601 T605	W601-S603 PolarHBondContact O-N 3.42Å; W601-S603 VanDerWaalsContact O-N 3.1Å; S603-T605 PolarHBondContact O-N 3.29Å
604	F	36.4	Very low	34.2	Very low	130 Å²	130	147 Å²	147	57%	0.57	75%	0.75	S	S	*	*			trans	-68.3	83.4	161	-95.4	-86.8	0	0	0	107.2	P602 M606	P602-F604 VanDerWaalsContact C-N 3.33Å; P602-F604 PolarHBondContact O-N 3Å; F604-M606 PolarHBondContact O-N 3.42Å
605	T	35	Very low	34.1	Very low	104 Å²	104	149.9 Å²	149.9	64%	0.638	76%	0.758	S	S	*	*			trans	-72.3	91.4	163.8	49.3	0	0	0	0	106.9	S603 K607	S603-T605 PolarHBondContact O-N 3.29Å; T605-K607 PolarHBondContact O-N 3Å
606	M	33.5	Very low	34.2	Very low	177 Å²	177	145.7 Å²	145.7	87%	0.872	75%	0.75	S	S	*	*			trans	-67.4	82.2	168.2	-165.2	177.9	171.9	0	0	107.4	F604 R608	F604-M606 PolarHBondContact O-N 3.42Å; M606-R608 PolarHBondContact O-N 3.31Å
607	K	35.7	Very low	34.5	Very low	185 Å²	185	143.7 Å²	143.7	80%	0.804	75%	0.753	S	S	*	*			trans	-62.1	109.1	167.8	-74.3	-173.2	177.5	-178.2	0	106.4	T605	T605-K607 PolarHBondContact O-N 3Å
608	R	30.8	Very low	34.6	Very low	224 Å²	224	144 Å²	144	85%	0.845	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-52.4	130.7	169	-87.6	-177.6	-176.3	168.2	2.7	107.6	M606 V610	M606-R608 PolarHBondContact O-N 3.31Å; R608-V610 PolarHBondContact O-N 2.94Å
609	P	33.2	Very low	34.9	Very low	121 Å²	121	143.5 Å²	143.5	79%	0.786	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-54.1	128.2	164.9	-19.2	30.1	0	0	0	108	R611	P609-R611 PolarHBondContact O-N 3.42Å; P609-R611 VanDerWaalsContact O-N 3.11Å
610	V	37.4	Very low	35.1	Very low	136 Å²	136	137.7 Å²	137.7	82%	0.824	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-57.9	117.6	169.2	175.7	0	0	0	0	106.3	R608 L612	R608-V610 PolarHBondContact O-N 2.94Å; V610-L612 PolarHBondContact O-N 3.17Å; V610-L612 VanDerWaalsContact O-N 3.1Å
611	R	34.4	Very low	35	Very low	216 Å²	216	134.6 Å²	134.6	82%	0.815	75%	0.752	S	S	*	*			trans	-61.1	114.6	165.7	-91	-175.2	172.8	160.3	-1.5	106.3	P609 G613	P609-R611 PolarHBondContact O-N 3.42Å; P609-R611 VanDerWaalsContact O-N 3.11Å; R611-G613 VanDerWaalsContact C-N 3.29Å; R611-G613 PolarHBondContact O-N 2.92Å
612	L	35.7	Very low	35.1	Very low	169 Å²	169	135.6 Å²	135.6	89%	0.885	76%	0.761	S	S	*	*			trans	-55.1	103.9	154.7	-75.6	165.1	0	0	0	106.2	V610 S614	V610-L612 PolarHBondContact O-N 3.17Å; V610-L612 VanDerWaalsContact O-N 3.1Å; L612-S614 PolarHBondContact O-N 3.48Å
613	G	31.2	Very low	35.2	Very low	62 Å²	62	138.9 Å²	138.9	64%	0.639	77%	0.77	S	S	*	*			trans	-65.8	111.8	171.6	0	0	0	0	0	107.8	R611 N615	R611-G613 VanDerWaalsContact C-N 3.29Å; R611-G613 PolarHBondContact O-N 2.92Å; G613-N615 PolarHBondContact O-N 2.97Å
614	S	33.9	Very low	35.1	Very low	111 Å²	111	141.5 Å²	141.5	78%	0.776	77%	0.774	S	S	*	*			trans	-63.7	102.6	161.6	-58.5	0	0	0	0	107.9	L612 S616	L612-S614 PolarHBondContact O-N 3.48Å; S614-S616 PolarHBondContact O-N 3.47Å; S614-S616 VanDerWaalsContact O-N 3.14Å
615	N	31.3	Very low	35.1	Very low	164 Å²	164	138.7 Å²	138.7	88%	0.877	78%	0.782	S	S	*	*			trans	-72	98.6	163.6	-77.3	-8.7	0	0	0	108	G613	G613-N615 PolarHBondContact O-N 2.97Å
616	S	35.5	Very low	35.2	Very low	107 Å²	107	140.7 Å²	140.7	75%	0.748	79%	0.794	S	S	*	*			trans	-136	73.8	161.1	41.2	0	0	0	0	108.5	S614 S618	S614-S616 PolarHBondContact O-N 3.47Å; S614-S616 VanDerWaalsContact O-N 3.14Å; S616-S618 PolarHBondContact O-N 2.92Å
617	S	37.8	Very low	35.3	Very low	112 Å²	112	135.8 Å²	135.8	78%	0.783	79%	0.789	S	S	*	*			trans	-77.1	106.9	162.4	48.5	0	0	0	0	109
618	S	37.8	Very low	35.5	Very low	110 Å²	110	136 Å²	136	77%	0.769	79%	0.79	S	S	*	*			trans	-13.1	119.6	156.1	52.1	0	0	0	0	116.4	S616 G620	S616-S618 PolarHBondContact O-N 2.92Å; S618-G620 PolarHBondContact O-N 3.42Å
619	I	38.4	Very low	35.9	Very low	164 Å²	164	132.7 Å²	132.7	84%	0.841	78%	0.784	S	S	*	*			trans	-64.7	112.1	153.5	-82.7	162.6	0	0	0	107.8
620	G	37.7	Very low	36.3	Very low	72 Å²	72	131.8 Å²	131.8	74%	0.742	78%	0.781	S	S	*	*			trans	-80.1	119.7	163.5	0	0	0	0	0	109.3	S618	S618-G620 PolarHBondContact O-N 3.42Å
621	T	32.5	Very low	36.5	Very low	130 Å²	130	131 Å²	131	80%	0.798	78%	0.781	S	S	*	*			trans	-68.3	126.3	167.5	33.8	0	0	0	0	110.5
622	K	36.9	Very low	36.8	Very low	180 Å²	180	124 Å²	124	78%	0.783	78%	0.776	S	S	*	*			trans	-171.7	122.9	136	-108.8	-174.9	174.1	-166.4	0	113.2
623	E	36.5	Very low	36.9	Very low	141 Å²	141	121.4 Å²	121.4	66%	0.659	77%	0.772	S	S	*	*			trans	80.2	111	135.1	-76.4	175.6	-147.9	0	0	122.2
624	I	35.9	Very low	37.3	Very low	157 Å²	157	129.8 Å²	129.8	81%	0.805	78%	0.784	S	S	*	*			trans	83.6	114	130.8	-56.7	163.2	0	0	0	117.6
625	G	36.6	Very low	37.8	Very low	71 Å²	71	129 Å²	129	73%	0.732	78%	0.777	S	S	*	*			trans	168.3	66.3	168.2	0	0	0	0	0	115.2
626	T	36.3	Very low	38.1	Very low	146 Å²	146	127.9 Å²	127.9	90%	0.896	77%	0.769	S	S	*	*			trans	3.6	132.3	157.4	57.1	0	0	0	0	121.4
627	G	35.7	Very low	38.2	Very low	73 Å²	73	130.7 Å²	130.7	75%	0.753	77%	0.774	S	S	*	*			trans	154.1	96	144.7	0	0	0	0	0	117.9
628	K	39.1	Very low	38.2	Very low	191 Å²	191	130 Å²	130	83%	0.83	77%	0.767	S	S	*	*			trans	38	136.1	139.9	-69.8	172.4	167.1	179.8	0	118.9
629	Q	40.8	Very low	38	Very low	153 Å²	153	132.3 Å²	132.3	72%	0.715	77%	0.77	S	S	*	*			cis	-176	147.9	19.8	-114.8	174	68.5	0	0	109
630	S	40.6	Very low	37.9	Very low	103 Å²	103	133.9 Å²	133.9	72%	0.72	77%	0.77	S	S	*	*			trans	51.7	148.1	144.2	69.4	0	0	0	0	122.3
631	S	42.1	Very low	37.8	Very low	119 Å²	119	136 Å²	136	83%	0.832	77%	0.774	S	S	*	*			cis	168.3	146.6	-20.7	51.3	0	0	0	0	107.5
632	G	39.7	Very low	37.9	Very low	69 Å²	69	133.8 Å²	133.8	71%	0.711	78%	0.777	S	S	*	*			trans	111.1	94.6	157.8	0	0	0	0	0	115.3
633	S	39	Very low	37.8	Very low	114 Å²	114	130.3 Å²	130.3	80%	0.797	78%	0.776	S	S	*	*				71.7	99.8	74.3	-57	0	0	0	0	113.1
634	R	39.4	Very low	37.8	Very low	238 Å²	238	133 Å²	133	90%	0.898	79%	0.788	S	S	*	*				87.8	160.4	90.1	-94.4	-163.6	-179.3	-151.3	2.8	113.3
635	P	44.1	Very low	37.7	Very low	95 Å²	95	133 Å²	133	62%	0.617	79%	0.79	S	S	*	*				-152.8	-170.2	-53.6	44.4	-23.3	0	0	0	115.8
636	I	37.4	Very low	37.4	Very low	141 Å²	141	141 Å²	141	72%	0.723	80%	0.798	S	S	*	*			trans	78.6	124.7	151.7	-55.7	160.9	0	0	0	120.2
637	I	38.3	Very low	37.4	Very low	165 Å²	165	139.7 Å²	139.7	85%	0.846	79%	0.792	S	S	*	*				-175.7	145.7	114.3	-82.5	163.5	0	0	0	109.8
638	P	37.3	Very low	37.1	Very low	99 Å²	99	142.4 Å²	142.4	64%	0.643	79%	0.793	S	S	*	*			trans	-123	-173.7	-154.8	30.2	-7.7	0	0	0	117.1
639	L	34.1	Very low	36.8	Very low	158 Å²	158	139.3 Å²	139.3	83%	0.827	79%	0.794	S	S	*	*			trans	99.1	110.2	158.9	-71.1	117.3	0	0	0	120
640	K	36.3	Very low	36.2	Very low	196 Å²	196	140 Å²	140	85%	0.852	80%	0.802	S	S	*	*				178.8	126.9	103.7	-100.4	177.9	177.8	179.1	0	114.3
641	S	35.1	Very low	35.9	Very low	118 Å²	118	139.8 Å²	139.8	83%	0.825	81%	0.807	S	S	*	*			trans	0.5	139.4	155.1	58.4	0	0	0	0	123.5
642	G	34.8	Very low	35.2	Very low	83 Å²	83	145.1 Å²	145.1	86%	0.856	81%	0.809	S	S	*	*			trans	169.1	99.2	152.9	0	0	0	0	0	113.3
643	S	35.9	Very low	34.8	Very low	107 Å²	107	147.7 Å²	147.7	75%	0.748	82%	0.816	S	S	*	*			trans	-81.5	143.8	-177	60.4	0	0	0	0	114.1
644	Q	36.3	Very low	34.3	Very low	198 Å²	198	150.3 Å²	150.3	93%	0.925	82%	0.82	S	S	*	*				-158.4	121.9	128.3	-87.6	-145.3	-18.8	0	0	110.1
645	D	32.8	Very low	34	Very low	157 Å²	157	144.6 Å²	144.6	84%	0.84	82%	0.816	S	S	*	*			trans	-77.5	141.4	-177	-73.9	-56.3	0	0	0	113.4
646	R	29.7	Very low	33.3	Very low	239 Å²	239	144.8 Å²	144.8	90%	0.902	83%	0.826	S	S	*	*			trans	-109.7	137.7	155.3	-109.1	-175.7	174.8	-170.1	-0.1	106.9
647	P	37.4	Very low	33	Very low	118 Å²	118	147.6 Å²	147.6	77%	0.766	84%	0.836	S	S	*	*			trans	-120.1	121.4	153.9	31	-17.1	0	0	0	111.5
648	V	29.1	Very low	32.5	Very low	129 Å²	129	150.7 Å²	150.7	78%	0.782	84%	0.837	S	S	*	*			trans	-72.4	128.5	151.5	170.5	0	0	0	0	106.8
649	C	32.7	Very low	32.2	Very low	126 Å²	126	153.4 Å²	153.4	85%	0.851	84%	0.841	S	S	*	*			trans	-144	117	159.4	-98.3	0	0	0	0	111.5
650	L	27.6	Very low	32.1	Very low	167 Å²	167	154.6 Å²	154.6	87%	0.874	84%	0.84	S	S	*	*			trans	-65.3	135.9	159	-74.1	156.3	0	0	0	109.9
651	A	34.2	Very low	31.8	Very low	100 Å²	100	149.8 Å²	149.8	83%	0.826	83%	0.831	S	S	*	*			trans	-163.3	120.1	144.7	0	0	0	0	0	110.9
652	R	27.7	Very low	31.4	Very low	230 Å²	230	151.8 Å²	151.8	87%	0.868	83%	0.833	S	S	*	*			trans	-69.4	138.8	153.9	-80.6	172	165.9	143.1	-9.5	107.8
653	S	31.9	Very low	31.2	Very low	124 Å²	124	158.2 Å²	158.2	87%	0.867	83%	0.831	S	S	*	*			trans	-155.6	124.3	143.8	-98.6	0	0	0	0	110.9
654	L	28.3	Very low	31	Very low	169 Å²	169	160.5 Å²	160.5	89%	0.885	83%	0.83	S	S	*	*			trans	-73.5	138.1	161.7	-67.1	160.2	0	0	0	108.5
655	S	32.7	Very low	30.5	Very low	117 Å²	117	159 Å²	159	82%	0.818	83%	0.828	S	S	*	*			trans	168.8	112.8	148.7	-76.9	0	0	0	0	106.7
656	A	29	Very low	30.3	Very low	100 Å²	100	158.9 Å²	158.9	83%	0.826	83%	0.827	S	S	*	*				65.4	95.8	77.7	0	0	0	0	0	112.9
657	E	31.3	Very low	30.2	Very low	200 Å²	200	153.2 Å²	153.2	94%	0.935	82%	0.819	S	S	*	*			trans	-135.5	109.3	152.6	-108.5	169.8	160	0	0	108.5
658	R	27.7	Very low	29.9	Very low	230 Å²	230	154.9 Å²	154.9	87%	0.868	82%	0.821	S	S	*	*			trans	-105.2	154.3	165.5	-86.4	-175.7	170.3	-163.5	-2	107.3
659	Q	31.2	Very low	29.8	Very low	156 Å²	156	152.5 Å²	152.5	73%	0.729	81%	0.81	S	S	*	*			trans	81.4	127.9	166.4	-46.1	-162.8	-21.4	0	0	113
660	F	31.6	Very low	29.6	Very low	183 Å²	183	153.4 Å²	153.4	80%	0.803	81%	0.807	S	S	*	*			cis	-157.3	164	47.7	-84.3	-96.7	0	0	0	108.1
661	S	31.2	Very low	29.7	Very low	95 Å²	95	155.9 Å²	155.9	66%	0.664	81%	0.811	S	S	*	*			cis	180	138.7	-14	45.7	0	0	0	0	106.1
662	N	26.2	Very low	29.5	Very low	160 Å²	160	161.9 Å²	161.9	86%	0.856	81%	0.812	S	S	*	*			trans	3.7	128.5	158.4	-64.1	-19.8	0	0	0	120.3
663	R	30.4	Very low	29.5	Very low	218 Å²	218	156 Å²	156	82%	0.823	80%	0.802	S	S	*	*				-160.2	103.9	127.6	-112.6	-170.3	152.4	158.1	-1.6	108.9
664	E	31.5	Very low	29.5	Very low	155 Å²	155	154 Å²	154	72%	0.724	80%	0.801	S	S	*	*				87.9	116.4	96.9	-82.9	-177.2	153.5	0	0	112.2	L666	E664-L666 PolarHBondContact O-N 3.17Å
665	N	26.3	Very low	29.5	Very low	165 Å²	165	152 Å²	152	88%	0.882	79%	0.791	S	S	*	*			trans	-42.4	128	168.7	-59.3	-51.7	0	0	0	111.9
666	L	29.7	Very low	29.5	Very low	156 Å²	156	154 Å²	154	82%	0.817	79%	0.793	S	S	*	*			trans	-145.8	125.7	142.6	-159.8	66	0	0	0	109.7	E664 D668	E664-L666 PolarHBondContact O-N 3.17Å; L666-D668 PolarHBondContact O-N 2.64Å
667	V	27.2	Very low	29.5	Very low	120 Å²	120	155.3 Å²	155.3	73%	0.727	79%	0.79	S	S	*	*			trans	-56.7	119.7	169.5	175.7	0	0	0	0	108.2
668	D	31.1	Very low	29.5	Very low	152 Å²	152	151.4 Å²	151.4	81%	0.813	78%	0.784	S	S	*	*			trans	-132.2	94.3	155.1	-94.9	-35	0	0	0	109.5	L666	L666-D668 PolarHBondContact O-N 2.64Å
669	S	26.5	Very low	29.6	Very low	80 Å²	80	145.8 Å²	145.8	56%	0.559	77%	0.771	S	S	*	*			trans	-52	143.8	152	41.6	0	0	0	0	111.6
670	N	28.4	Very low	29.5	Very low	145 Å²	145	144.7 Å²	144.7	78%	0.775	78%	0.777	S	S	*	*			trans	98.9	91.5	169.1	-52	-38.1	0	0	0	115.3
671	F	30.9	Very low	29.5	Very low	219 Å²	219	139.7 Å²	139.7	96%	0.961	77%	0.765	S	S	*	*				-149.1	121.7	121.7	-115.3	-84	0	0	0	111
672	R	29.1	Very low	29.6	Very low	225 Å²	225	142 Å²	142	85%	0.849	78%	0.775	S	S	*	*			trans	-62	126.2	-174	-87.5	171.9	170.8	-168.6	-4.2	113.7
673	T	28.3	Very low	29.7	Very low	106 Å²	106	143 Å²	143	65%	0.65	77%	0.768	S	S	*	*				50.4	100	110.9	61.4	0	0	0	0	115.6
674	G	31.1	Very low	29.6	Very low	83 Å²	83	142.9 Å²	142.9	86%	0.856	77%	0.767	S	S	*	*			trans	-127.1	81.3	148.5	0	0	0	0	0	106.4	D676	G674-D676 PolarHBondContact O-N 2.88Å
675	D	28.4	Very low	29.5	Very low	128 Å²	128	144.6 Å²	144.6	68%	0.684	77%	0.772	S	S	*	*			trans	-75.2	108.9	-179.5	-67.8	-47.8	0	0	0	109.4	V677	D675-V677 HydrophobicContact CB-CG2 4.33Å
676	D	32.7	Very low	29.5	Very low	158 Å²	158	143 Å²	143	85%	0.845	78%	0.775	S	S	*	*			trans	-107	88.7	152.7	-111.8	-32.4	0	0	0	107.3	G674 C678	G674-D676 PolarHBondContact O-N 2.88Å; D676-C678 PolarHBondContact O-N 3.45Å; D676-C678 VanDerWaalsContact O-N 3.1Å
677	V	28.9	Very low	29.5	Very low	127 Å²	127	139.3 Å²	139.3	77%	0.77	76%	0.762	S	S	*	*			trans	-73.4	92.5	171.8	177.8	0	0	0	0	107.3	D675	D675-V677 HydrophobicContact CB-CG2 4.33Å
678	C	32.1	Very low	29.8	Very low	119 Å²	119	142.4 Å²	142.4	80%	0.804	77%	0.768	S	S	*	*			trans	-90	103.6	162.3	-92.4	0	0	0	0	110	D676	D676-C678 PolarHBondContact O-N 3.45Å; D676-C678 VanDerWaalsContact O-N 3.1Å
679	D	28.3	Very low	30	Very low	112 Å²	112	138.6 Å²	138.6	60%	0.599	75%	0.753	S	S	*	*			trans	-19.4	121	162.7	-156.6	-26.1	0	0	0	115.6	S681	D679-S681 PolarHBondContact O-N 3.08Å; D679-S681 WeakPolarHBondContact OD1-CB 3.26Å; D679-S681 PolarHBondContact OD1-OG 3.26Å; D679-S681 PolarHBondContact OD2-OG 3.22Å
680	P	29.3	Very low	30.4	Very low	132 Å²	132	137.9 Å²	137.9	86%	0.857	75%	0.752	S	S	*	*	S	Bend	trans	-81.5	61.1	173.9	35.1	-32.2	0	0	0	110.4
681	S	31.3	Very low	30.4	Very low	78 Å²	78	136.2 Å²	136.2	55%	0.545	74%	0.743	S	S	.	*			trans	-139.2	40.2	179.3	65.8	0	0	0	0	113.9	D679	D679-S681 PolarHBondContact O-N 3.08Å; D679-S681 WeakPolarHBondContact OD1-CB 3.26Å; D679-S681 PolarHBondContact OD1-OG 3.26Å; D679-S681 PolarHBondContact OD2-OG 3.22Å
682	V	34.4	Very low	30.3	Very low	144 Å²	144	130.8 Å²	130.8	87%	0.873	73%	0.733	S	S	*	*			trans	-125	70	165.1	-169.3	0	0	0	0	110.2
683	Y	27.2	Very low	30.5	Very low	180 Å²	180	125 Å²	125	71%	0.706	73%	0.727	S	S	*	*			trans	-88.3	126.9	172.2	-117.9	-94.2	0	0	0	110.8
684	R	29.1	Very low	30.4	Very low	217 Å²	217	128.8 Å²	128.8	82%	0.819	74%	0.742	S	S	*	*	S	Bend	trans	66.4	99.6	162.7	-74.3	175.8	-175.5	168.9	4.6	117.9
685	K	28.6	Very low	30.5	Very low	190 Å²	190	133.5 Å²	133.5	83%	0.826	74%	0.739	S	S	*	*				-179.8	42.8	126.1	-99.1	164.8	-175.4	175.5	0	114.4	S687	K685-S687 VanDerWaalsContact C-N 3.28Å; K685-S687 PolarHBondContact O-N 3.49Å
686	S	27.1	Very low	30.5	Very low	133 Å²	133	135.7 Å²	135.7	93%	0.93	75%	0.75	S	S	*	*			trans	-84.6	71	173.5	-49.9	0	0	0	0	111.3
687	S	30.7	Very low	30.3	Very low	78 Å²	78	134.5 Å²	134.5	55%	0.545	75%	0.748	S	S	.	*			trans	-140.8	48.1	165.4	55	0	0	0	0	110.5	K289 K685	K289-S687 PolarHBondContact NZ-O 3.43Å; K685-S687 VanDerWaalsContact C-N 3.28Å; K685-S687 PolarHBondContact O-N 3.49Å
688	Q	31.8	Very low	30.3	Very low	184 Å²	184	136 Å²	136	86%	0.86	75%	0.752	S	S	*	*			trans	-111.6	104.6	160.3	-66.7	-165	17.4	0	0	107.4	A690	Q688-A690 PolarHBondContact O-N 3.07Å
689	S	36.9	Very low	30.2	Very low	72 Å²	72	139.3 Å²	139.3	50%	0.503	76%	0.755	S	S	.	*			trans	-55.3	127.6	165.6	55.8	0	0	0	0	108.4	N691	S689-N691 PolarHBondContact O-N 3.41Å
690	A	33.9	Very low	30.3	Very low	65 Å²	65	139.6 Å²	139.6	54%	0.537	77%	0.766	S	S	.	*			trans	-63.9	86.2	165.8	0	0	0	0	0	109.1	R316 Q688	R316-A690 PolarHBondContact NH2-O 3.33Å; Q688-A690 PolarHBondContact O-N 3.07Å
691	N	28.9	Very low	30.4	Very low	111 Å²	111	140 Å²	140	59%	0.594	77%	0.766	S	S	*	*			trans	-112	75.1	167.6	-83.1	-2.2	0	0	0	107.5	S689	S689-N691 PolarHBondContact O-N 3.41Å
692	S	29.2	Very low	30.4	Very low	105 Å²	105	141.6 Å²	141.6	73%	0.734	78%	0.777	S	S	*	*			trans	179.2	113.8	158	51.1	0	0	0	0	110.3
693	S	31.3	Very low	30.2	Very low	103 Å²	103	139.5 Å²	139.5	72%	0.72	77%	0.769	S	S	*	*				177	88.3	125.2	-79.8	0	0	0	0	111.1	K695	S693-K695 PolarHBondContact O-N 3.18Å
694	L	27.7	Very low	30.5	Very low	185 Å²	185	140 Å²	140	97%	0.969	78%	0.775	S	S	*	*			trans	-73	101.9	143.7	-74.4	170	0	0	0	106.3
695	K	32.8	Very low	30.8	Very low	183 Å²	183	134.8 Å²	134.8	80%	0.796	77%	0.769	S	S	*	*			trans	-109.6	104.1	167.2	-117.1	177.9	-179.1	177.7	0	108.3	S693 T697	S693-K695 PolarHBondContact O-N 3.18Å; K695-T697 PolarHBondContact O-N 3.44Å
696	L	28.3	Very low	30.9	Very low	174 Å²	174	130.3 Å²	130.3	91%	0.911	76%	0.761	S	S	*	*			trans	-63.7	110.3	161.5	-74.6	159.3	0	0	0	107.7	N698	L696-N698 PolarHBondContact O-N 3.36Å
697	T	28.7	Very low	31.2	Very low	132 Å²	132	130.6 Å²	130.6	81%	0.81	75%	0.753	S	S	*	*			trans	-78.2	110.3	168.7	-67.3	0	0	0	0	108.8	K695	K695-T697 PolarHBondContact O-N 3.44Å
698	N	29.7	Very low	31.1	Very low	159 Å²	159	133.4 Å²	133.4	85%	0.85	76%	0.761	S	S	*	*			trans	-99.7	135.2	156.4	-97.7	-18.9	0	0	0	108.3	L696	L696-N698 PolarHBondContact O-N 3.36Å
699	Q	28.8	Very low	31.1	Very low	188 Å²	188	131.5 Å²	131.5	88%	0.879	76%	0.756	S	S	*	*			trans	-48.3	136.7	-179.5	-70.8	168.8	1.2	0	0	113.5
700	S	31.1	Very low	30.8	Very low	119 Å²	119	134.4 Å²	134.4	83%	0.832	77%	0.765	S	S	*	*			trans	-128	113.5	160.3	59.1	0	0	0	0	109.3
701	V	30.6	Very low	30.6	Very low	140 Å²	140	138.6 Å²	138.6	85%	0.848	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-83.2	133.9	166.8	175.9	0	0	0	0	108.3
702	S	31.4	Very low	30.6	Very low	112 Å²	112	138.9 Å²	138.9	78%	0.783	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-76.5	148.2	-176.7	69.7	0	0	0	0	113.8
703	S	30.2	Very low	30.7	Very low	99 Å²	99	141.6 Å²	141.6	69%	0.692	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-71.1	149.9	175.6	52.8	0	0	0	0	116.4
704	K	34	Very low	30.9	Very low	191 Å²	191	142.5 Å²	142.5	83%	0.83	78%	0.777	S	S	*	*				152.5	161.8	118.6	-85.9	-175.3	-178.4	178.6	0	111.5
705	P	35.3	Very low	31.1	Very low	108 Å²	108	139.6 Å²	139.6	70%	0.701	77%	0.768	S	S	*	*				-131.9	-162.7	-61.9	36.6	-15.7	0	0	0	111.3
706	S	30.6	Very low	31.3	Very low	95 Å²	95	135.9 Å²	135.9	66%	0.664	76%	0.762	S	S	*	*			trans	82.2	113.8	164	35.1	0	0	0	0	120.8
707	D	32.3	Very low	31.5	Very low	139 Å²	139	134.3 Å²	134.3	74%	0.743	75%	0.75	S	S	*	*			trans	73.4	110.2	130.3	-57.4	-19.6	0	0	0	122
708	N	30	Very low	31.9	Very low	137 Å²	137	135.4 Å²	135.4	73%	0.733	75%	0.75	S	S	*	*				83.6	121.5	127.2	-77.6	-30.6	0	0	0	120.7
709	I	32.2	Very low	32.1	Very low	145 Å²	145	136.3 Å²	136.3	74%	0.744	75%	0.746	S	S	*	*			trans	91.1	98	138.6	-61.3	163.8	0	0	0	117.1
710	L	29.1	Very low	32.4	Very low	133 Å²	133	131.3 Å²	131.3	70%	0.696	75%	0.745	S	S	*	*				60.6	117.8	122.1	-118.1	86.9	0	0	0	120.9
711	Q	29.8	Very low	32.5	Very low	152 Å²	152	129.1 Å²	129.1	71%	0.71	74%	0.741	S	S	*	*				79.2	124.8	129	-87.9	172.7	16.7	0	0	121.4
712	N	29.6	Very low	32.5	Very low	118 Å²	118	129.4 Å²	129.4	63%	0.631	74%	0.737	S	S	*	*			trans	105.3	113	132.7	-76.5	1.2	0	0	0	119.5
713	E	31.8	Very low	32.6	Very low	162 Å²	162	132.7 Å²	132.7	76%	0.757	75%	0.745	S	S	*	*				69.5	141.2	128.4	-61.6	-165.1	164.9	0	0	117
714	T	35	Very low	32.6	Very low	121 Å²	121	135.9 Å²	135.9	74%	0.742	75%	0.746	S	S	*	*			cis	-164	151.1	18	-5.4	0	0	0	0	109.2
715	T	31.8	Very low	32.6	Very low	125 Å²	125	137 Å²	137	77%	0.767	75%	0.751	S	S	*	*			trans	-61	-170.6	169.3	51.9	0	0	0	0	113.7
716	P	37.9	Very low	32.3	Very low	104 Å²	104	142 Å²	142	68%	0.675	76%	0.756	S	S	*	*			cis	-155.1	176.5	12.2	43.4	-20.5	0	0	0	120.9
717	H	32.1	Very low	32.3	Very low	142 Å²	142	144.4 Å²	144.4	66%	0.657	76%	0.762	S	S	*	*			trans	79.7	119.8	131.4	-98.6	-61.9	0	0	0	125.3
718	L	36	Very low	32.1	Very low	155 Å²	155	141.5 Å²	141.5	81%	0.812	76%	0.757	S	S	*	*				178.9	100.4	107.9	-93.5	155.1	0	0	0	110.7
719	K	35.4	Very low	32.1	Very low	177 Å²	177	144.3 Å²	144.3	77%	0.77	76%	0.763	S	S	*	*				57	129.8	104	-73.1	-175	178.3	176.5	0	114.9
720	G	33.4	Very low	31.9	Very low	84 Å²	84	143.1 Å²	143.1	87%	0.866	76%	0.762	S	S	*	*			cis	174.5	175	7.5	0	0	0	0	0	107.4
721	G	33.6	Very low	31.8	Very low	72 Å²	72	143.2 Å²	143.2	74%	0.742	76%	0.763	S	S	*	*			cis	-162.1	131.8	-6.2	0	0	0	0	0	105.9
722	L	30.2	Very low	31.7	Very low	146 Å²	146	144.8 Å²	144.8	76%	0.764	77%	0.768	S	S	*	*				69.8	110	93.5	-157	79.7	0	0	0	115.4	K724	L722-K724 HydrophobicContact CD1-CD 4.41Å; L722-K724 HydrophobicContact CD1-CG 4.42Å
723	L	34.2	Very low	31.7	Very low	181 Å²	181	149 Å²	149	95%	0.948	78%	0.781	S	S	*	*			trans	-152.2	106.4	130.8	-99.7	166.1	0	0	0	109.1
724	K	31.1	Very low	31.6	Very low	166 Å²	166	146.3 Å²	146.3	72%	0.722	78%	0.781	S	S	*	*			trans	-82.8	143.4	174.4	-85.5	170.4	170.5	167.2	0	110.1	L722	L722-K724 HydrophobicContact CD1-CD 4.41Å; L722-K724 HydrophobicContact CD1-CG 4.42Å
725	K	34.2	Very low	31.4	Very low	215 Å²	215	151.9 Å²	151.9	94%	0.935	79%	0.788	S	S	*	*			trans	-140.1	123.1	138.6	-104.6	-179.6	-178.4	177.2	0	110.8
726	R	27.8	Very low	31.5	Very low	214 Å²	214	149.6 Å²	149.6	81%	0.808	79%	0.789	S	S	*	*			trans	-77.8	151.6	172.8	-70.8	157.7	63.3	114.8	-7.8	109.9
727	N	31.2	Very low	31.2	Very low	144 Å²	144	154.5 Å²	154.5	77%	0.77	80%	0.8	S	S	*	*			trans	-178.5	111.8	133.4	-89.6	-10.5	0	0	0	105.8
728	A	28.2	Very low	31.4	Very low	78 Å²	78	153.3 Å²	153.3	65%	0.645	81%	0.805	S	S	*	*				51.7	95.8	61.2	0	0	0	0	0	112.1
729	F	28.7	Very low	31.3	Very low	197 Å²	197	154.8 Å²	154.8	86%	0.864	81%	0.805	S	S	*	*			trans	-152.2	102.7	144.8	-102	-74.2	0	0	0	110.3
730	V	28.7	Very low	31.1	Very low	119 Å²	119	153.7 Å²	153.7	72%	0.721	81%	0.806	S	S	*	*			trans	-94.4	139.4	160.1	164.8	0	0	0	0	106.1
731	N	27.4	Very low	30.9	Very low	136 Å²	136	161.6 Å²	161.6	73%	0.727	81%	0.81	S	S	*	*			trans	58.3	126.2	163.2	-64.8	-17	0	0	0	118.1
732	F	26.7	Very low	30.9	Very low	185 Å²	185	161.4 Å²	161.4	81%	0.811	81%	0.808	S	S	*	*				162	125.4	128.5	-106.7	-98.1	0	0	0	107.2
733	F	31	Very low	31.1	Very low	206 Å²	206	164.1 Å²	164.1	90%	0.904	81%	0.814	S	S	*	*				-178.8	86.8	125.1	-93.7	-65.1	0	0	0	110.2
734	S	29.4	Very low	30.9	Very low	106 Å²	106	163.5 Å²	163.5	74%	0.741	81%	0.806	S	S	*	*			trans	-76.4	132.7	148.8	-72.7	0	0	0	0	109.2
735	R	31.2	Very low	31.1	Very low	237 Å²	237	164.6 Å²	164.6	89%	0.894	81%	0.813	S	S	*	*			trans	33.4	122.4	148.1	-68.3	179.7	173.6	178.9	-1.2	119.5
736	G	33.7	Very low	30.9	Very low	77 Å²	77	163.7 Å²	163.7	79%	0.794	81%	0.812	S	S	*	*			trans	162.8	104.4	148.6	0	0	0	0	0	115
737	K	31.9	Very low	31.1	Very low	208 Å²	208	157.2 Å²	157.2	90%	0.904	81%	0.812	S	S	*	*			trans	-69.5	152.4	160.8	-67.9	-177.5	174.9	177.5	0	109
738	P	35.8	Very low	31.1	Very low	116 Å²	116	159.2 Å²	159.2	75%	0.753	82%	0.816	S	S	*	*				-154.1	149.5	91.5	35.7	-14.9	0	0	0	118
739	K	34.1	Very low	31.4	Very low	187 Å²	187	164.6 Å²	164.6	81%	0.813	83%	0.828	S	S	*	*			trans	41.3	120.4	135	-70.5	-176.9	174.5	174.9	0	122.8
740	L	30.7	Very low	31.6	Very low	154 Å²	154	162.9 Å²	162.9	81%	0.806	82%	0.822	S	S	*	*				65.5	117.6	123.7	-80.2	152.5	0	0	0	120.7
741	R	29	Very low	31.5	Very low	249 Å²	249	163.8 Å²	163.8	94%	0.94	82%	0.822	S	S	*	*				132.4	130.5	109.7	-162.9	175	178	-172.2	-1.5	115
742	G	33.7	Very low	31.8	Very low	69 Å²	69	163.5 Å²	163.5	71%	0.711	83%	0.825	S	S	*	*			trans	127	88.3	158.9	0	0	0	0	0	113.7
743	K	34.8	Very low	31.9	Very low	202 Å²	202	160.3 Å²	160.3	88%	0.878	82%	0.82	S	S	*	*				56.6	111.7	89	-81.2	-166.8	174.7	-173.3	0	116.2
744	H	30.2	Very low	32.1	Very low	169 Å²	169	156.2 Å²	156.2	78%	0.782	82%	0.815	S	S	*	*			trans	36.3	129.2	140	-75.3	-91	0	0	0	119.5
745	H	34.2	Very low	32	Very low	189 Å²	189	156.8 Å²	156.8	88%	0.875	82%	0.819	S	S	*	*				-171.7	153.4	101.2	-96	73.9	0	0	0	111.8
746	Q	30.2	Very low	32	Very low	196 Å²	196	148.9 Å²	148.9	92%	0.916	81%	0.811	S	S	*	*			trans	-90.5	151.3	-168.2	-162.2	172.1	12.1	0	0	110.6
747	G	32.6	Very low	32.1	Very low	77 Å²	77	154.1 Å²	154.1	79%	0.794	82%	0.82	S	S	*	*			trans	178.7	99.2	171.2	0	0	0	0	0	113.5
748	Q	30.7	Very low	31.9	Very low	186 Å²	186	153.1 Å²	153.1	87%	0.869	82%	0.818	S	S	*	*			trans	-60.9	147.7	167.1	-73.2	169	-34.8	0	0	111.4
749	H	35.2	Very low	31.7	Very low	191 Å²	191	151.9 Å²	151.9	88%	0.884	82%	0.818	S	S	*	*			trans	-165.9	104.3	138.4	-96.5	-71	0	0	0	111.2
750	H	33.2	Very low	31.6	Very low	162 Å²	162	152.8 Å²	152.8	75%	0.75	82%	0.822	S	S	*	*			trans	28.9	128.9	132.8	-132.1	-110.4	0	0	0	122.9
751	L	26.7	Very low	31.6	Very low	137 Å²	137	153.3 Å²	153.3	72%	0.717	82%	0.824	S	S	*	*			trans	46.7	132.1	144.5	-72	-179.2	0	0	0	121.2
752	V	32	Very low	31.8	Very low	131 Å²	131	149.7 Å²	149.7	79%	0.794	82%	0.818	S	S	*	*				179.9	126.4	109.4	160.9	0	0	0	0	109.4
753	V	29	Very low	31.6	Very low	117 Å²	117	154.6 Å²	154.6	71%	0.709	82%	0.823	S	S	*	*			trans	-87.9	150.8	164.5	173	0	0	0	0	108.6
754	P	35.1	Very low	31.5	Very low	120 Å²	120	151.7 Å²	151.7	78%	0.779	82%	0.817	S	S	*	*			trans	-131.3	126.9	139	22.3	-3.7	0	0	0	113.1
755	S	28.5	Very low	31.5	Very low	118 Å²	118	152.5 Å²	152.5	83%	0.825	82%	0.821	S	S	*	*			trans	-76.8	153.8	161.9	-57.9	0	0	0	0	111
756	G	31	Very low	31.3	Very low	71 Å²	71	148.2 Å²	148.2	73%	0.732	82%	0.818	S	S	*	*			trans	136.1	108.3	151.7	0	0	0	0	0	114.3
757	L	34.8	Very low	31.2	Very low	187 Å²	187	145 Å²	145	98%	0.979	81%	0.812	S	S	*	*				-163.7	133.7	124.6	-97	173.4	0	0	0	109.5
758	Q	29	Very low	31.2	Very low	187 Å²	187	146.9 Å²	146.9	87%	0.874	81%	0.813	S	S	*	*			trans	-122.5	155.3	-162	-160.3	177.1	5.9	0	0	109.2
759	A	30.7	Very low	31	Very low	90 Å²	90	144.6 Å²	144.6	74%	0.744	81%	0.807	S	S	*	*			trans	89.3	112.2	150.4	0	0	0	0	0	121.9
760	K	32.9	Very low	30.8	Very low	206 Å²	206	141.4 Å²	141.4	90%	0.896	80%	0.804	S	S	*	*				179.6	101.5	123.3	-109.7	-179.8	171.8	-175.9	0	108.3
761	L	31	Very low	30.5	Very low	165 Å²	165	138.8 Å²	138.8	86%	0.864	80%	0.804	S	S	*	*				66.5	135.4	78.1	-93.3	164.7	0	0	0	116.7
762	E	32	Very low	30.7	Very low	173 Å²	173	141.9 Å²	141.9	81%	0.808	81%	0.812	S	S	*	*			trans	94.2	95.2	171.8	-60.7	179.7	175.2	0	0	116.3
763	E	29.8	Very low	30.7	Very low	173 Å²	173	141.2 Å²	141.2	81%	0.808	81%	0.81	S	S	*	*				72.3	103.9	80.7	-83.1	-170.6	162.2	0	0	115.2
764	N	31.7	Very low	30.6	Very low	141 Å²	141	143.2 Å²	143.2	75%	0.754	82%	0.817	S	S	*	*				171.3	125.3	117.8	-89	-39.2	0	0	0	113.9
765	E	30.1	Very low	30.5	Very low	185 Å²	185	142.9 Å²	142.9	86%	0.864	82%	0.818	S	S	*	*			trans	65.1	142.8	136.5	-66.2	-164.7	139.6	0	0	124.9
766	A	31.5	Very low	30.5	Very low	100 Å²	100	143.7 Å²	143.7	83%	0.826	81%	0.813	S	S	*	*			trans	91.1	89.7	154.9	0	0	0	0	0	118.8
767	V	28.2	Very low	30.6	Very low	129 Å²	129	148.2 Å²	148.2	78%	0.782	82%	0.82	S	S	*	*			trans	-59.6	138.5	157.4	173.5	0	0	0	0	111.1
768	S	31.9	Very low	30.6	Very low	115 Å²	115	147.3 Å²	147.3	80%	0.804	81%	0.811	S	S	*	*			trans	-136.3	106	155.7	-60.7	0	0	0	0	109.3
769	D	27.4	Very low	30.7	Very low	139 Å²	139	144.1 Å²	144.1	74%	0.743	80%	0.804	S	S	*	*			trans	-55.5	135.5	164.3	-83.5	-42	0	0	0	111.3
770	C	29.3	Very low	30.6	Very low	123 Å²	123	145.7 Å²	145.7	83%	0.831	81%	0.808	S	S	*	*			trans	-134.6	90.7	156.3	-80.8	0	0	0	0	108.6
771	S	28.6	Very low	30.4	Very low	108 Å²	108	143.1 Å²	143.1	76%	0.755	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-60.1	131.5	171.8	-43	0	0	0	0	111.6
772	F	29.5	Very low	30.5	Very low	201 Å²	201	140.4 Å²	140.4	88%	0.882	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74.7	135.3	163.5	-81.4	-88.4	0	0	0	109.7	N774	F772-N774 PolarHBondContact O-N 3.23Å
773	P	32.7	Very low	30.4	Very low	117 Å²	117	141 Å²	141	76%	0.76	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-79.2	121.5	171.7	30	-28.4	0	0	0	110.1
774	N	26.5	Very low	30.6	Very low	160 Å²	160	139 Å²	139	86%	0.856	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-56.1	131	160.1	-85.1	-25	0	0	0	110.3	F772	F772-N774 PolarHBondContact O-N 3.23Å
775	S	32.8	Very low	30.4	Very low	113 Å²	113	139.2 Å²	139.2	79%	0.79	80%	0.802	S	S	*	*			trans	-134.3	99.9	154.2	60.3	0	0	0	0	108.7
776	N	29.2	Very low	30.7	Very low	135 Å²	135	138.5 Å²	138.5	72%	0.722	80%	0.803	S	S	*	*			trans	-51.2	137.9	157.6	-71.1	-31.3	0	0	0	109.1
777	D	33.8	Very low	30.8	Very low	166 Å²	166	136.8 Å²	136.8	89%	0.888	80%	0.796	S	S	*	*			trans	-146.9	134	144.3	-96.1	-32.8	0	0	0	110.9
778	H	34.1	Very low	31	Very low	168 Å²	168	137.8 Å²	137.8	78%	0.778	80%	0.796	S	S	*	*			trans	-72.4	144.7	-159.2	-85.6	-90.9	0	0	0	114.6
779	V	30.8	Very low	31.1	Very low	119 Å²	119	139.7 Å²	139.7	72%	0.721	80%	0.798	S	S	*	*			trans	-59.6	131.9	152.9	174	0	0	0	0	109.5
780	C	28.7	Very low	31.5	Very low	124 Å²	124	138.5 Å²	138.5	84%	0.838	80%	0.797	S	S	*	*			trans	-124.8	96.6	157.2	-88.9	0	0	0	0	108.4
781	N	28.7	Very low	31.8	Very low	152 Å²	152	140.2 Å²	140.2	81%	0.813	80%	0.796	S	S	*	*			trans	-94.3	125.1	154.3	-76.8	-15.2	0	0	0	106.6
782	S	32.9	Very low	32.1	Very low	108 Å²	108	142 Å²	142	76%	0.755	80%	0.796	S	S	*	*			trans	-121.2	102.4	167.7	51.3	0	0	0	0	108.4
783	E	29.3	Very low	32.3	Very low	185 Å²	185	137.4 Å²	137.4	86%	0.864	79%	0.789	S	S	*	*			trans	-64.2	136.3	162.7	-72	175	123.1	0	0	109.7
784	V	34.9	Very low	32.5	Very low	130 Å²	130	137.3 Å²	137.3	79%	0.788	79%	0.786	S	S	*	*			trans	-131.3	104.8	159.9	-161.3	0	0	0	0	107.7
785	N	27	Very low	32.9	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	78%	0.78	S	S	*	*			trans	-75.5	134.4	166.7	-105.8	-45.9	0	0	0	109.5
786	L	36.4	Very low	33.1	Very low	171 Å²	171	137 Å²	137	90%	0.895	78%	0.776	S	S	*	*			trans	-162.1	121.7	151.5	-103.1	133.6	0	0	0	109.3
787	G	33.3	Very low	33.4	Very low	64 Å²	64	138 Å²	138	66%	0.66	78%	0.78	S	S	*	*			trans	-92.3	177.3	-169.2	0	0	0	0	0	117.1
788	D	34	Very low	33.5	Very low	149 Å²	149	135.4 Å²	135.4	80%	0.797	77%	0.772	S	S	*	*			trans	59.8	100.5	143.5	-56.2	-19	0	0	0	121.1
789	N	32.5	Very low	33.5	Very low	156 Å²	156	133.4 Å²	133.4	83%	0.834	78%	0.776	S	S	*	*				153.2	146.1	101.5	-84.9	-45.4	0	0	0	114.3
790	P	36	Very low	33.7	Very low	113 Å²	113	135.6 Å²	135.6	73%	0.734	78%	0.783	S	S	*	*			trans	-117.6	151.6	-171.3	39.8	-26.9	0	0	0	115.8
791	I	35.4	Very low	34	Very low	159 Å²	159	138.2 Å²	138.2	82%	0.815	78%	0.78	S	S	*	*			trans	-154	103.6	162.7	-59.5	-173.9	0	0	0	108.4
792	I	35.5	Very low	34.5	Very low	147 Å²	147	137.2 Å²	137.2	75%	0.754	78%	0.782	S	S	*	*				77.9	117.3	95.2	-62.5	170.8	0	0	0	117.1
793	S	33.5	Very low	34.6	Very low	104 Å²	104	138.8 Å²	138.8	73%	0.727	78%	0.782	S	S	*	*			trans	61.7	147	146.7	-55.4	0	0	0	0	121
794	T	37	Very low	34.7	Very low	115 Å²	115	134.4 Å²	134.4	71%	0.706	78%	0.777	S	S	*	*			cis	-159.2	143.7	31.2	39.8	0	0	0	0	112.3
795	D	35.2	Very low	34.6	Very low	134 Å²	134	135.5 Å²	135.5	72%	0.717	78%	0.777	S	S	*	*			trans	56.8	114.5	131.3	-53.8	-23.5	0	0	0	124.3
796	N	36.1	Very low	34.7	Very low	133 Å²	133	137.1 Å²	137.1	71%	0.711	78%	0.78	S	S	*	*				142.5	100.9	108.4	-85.4	-33.6	0	0	0	116.8
797	I	37.1	Very low	34.4	Very low	156 Å²	156	138.4 Å²	138.4	80%	0.8	78%	0.775	S	S	*	*				68.1	141.4	126.4	-63.4	176.6	0	0	0	121
798	P	36.1	Very low	34.4	Very low	110 Å²	110	141 Å²	141	71%	0.714	78%	0.778	S	S	*	*			trans	-119	167	-135.9	41.7	-30.2	0	0	0	116.2
799	S	33.3	Very low	34.2	Very low	126 Å²	126	140.8 Å²	140.8	88%	0.881	78%	0.782	S	S	*	*			trans	-152	140.1	152.8	-88.8	0	0	0	0	112.3
800	I	34.7	Very low	34.2	Very low	166 Å²	166	146 Å²	146	85%	0.851	80%	0.801	S	S	*	*			trans	-77.6	130	-160.3	-66.2	155.5	0	0	0	112.5
801	K	34.3	Very low	34.1	Very low	178 Å²	178	147.6 Å²	147.6	77%	0.774	81%	0.805	S	S	*	*			trans	-143.9	130.2	154.8	-81.8	-174.6	178.3	177.4	0	108.5	D803	K801-D803 PolarHBondContact O-N 2.97Å
802	P	40.2	Very low	34.1	Very low	132 Å²	132	147 Å²	147	86%	0.857	80%	0.804	S	S	*	*			trans	-85.7	93.8	165.8	31.8	-24.6	0	0	0	108.1
803	D	34.8	Very low	34	Very low	141 Å²	141	147 Å²	147	75%	0.754	81%	0.807	S	S	*	*			trans	-84.2	155	164.4	-104.1	-35.7	0	0	0	110.8	K801	K801-D803 PolarHBondContact O-N 2.97Å
804	A	31.6	Very low	34	Very low	92 Å²	92	149.5 Å²	149.5	76%	0.76	81%	0.811	S	S	*	*			trans	-49.5	137.9	-179.9	0	0	0	0	0	114.4
805	L	32.9	Very low	33.8	Very low	153 Å²	153	151.7 Å²	151.7	80%	0.801	82%	0.818	S	S	*	*			trans	-106.4	97.2	159.9	-77.3	168.1	0	0	0	109.5	Y807	L805-Y807 HydrophobicContact CD2-CD2 3.84Å; L805-Y807 HydrophobicContact CD2-CE2 4.19Å
806	Q	29.2	Very low	33.7	Very low	181 Å²	181	152.9 Å²	152.9	85%	0.846	83%	0.825	S	S	*	*			trans	-65.6	120.1	139.4	-81.6	169.5	-47.2	0	0	107.9
807	Y	30	Very low	33.6	Very low	198 Å²	198	154.3 Å²	154.3	78%	0.776	83%	0.833	S	S	*	*			trans	-170	140.9	154	-90.4	-78.2	0	0	0	105.2	L805	L805-Y807 HydrophobicContact CD2-CD2 3.84Å; L805-Y807 HydrophobicContact CD2-CE2 4.19Å
808	T	33.4	Very low	33.3	Very low	119 Å²	119	154.2 Å²	154.2	73%	0.73	84%	0.835	S	S	*	*			cis	-166.6	145.1	-17.7	10.7	0	0	0	0	101.9
809	T	28.9	Very low	33.1	Very low	143 Å²	143	157.8 Å²	157.8	88%	0.877	85%	0.846	S	S	*	*			trans	-81.2	120.6	176.8	-21.3	0	0	0	0	108.3
810	E	33.5	Very low	33	Very low	265 Å²	265	160.7 Å²	160.7	100%	1.238	84%	0.842	S	S	*	*			trans	-122.9	0	148.7	-77.6	-169.5	163	0	0	107.9

Retrieved 810 of 810 residues in 252 ms (Link to these results)

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