A0A077ZEI5_TRITR Loading...

Dystrophin

AlphaFold DB , UniProt , Accession A0A077ZEI5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,280 aa.

						>A0A077ZEI5_TRITR|A0A077ZEI5
MFLAASKHLRQLDNKDEKAASGDSKQQARRASLSAHRKHSSTVPHTAADEHSVAKGLDLPSEGHVEQGDSSARNIEGETSLDPLSRIQHGQVTWKTISKQISKFVTDLPVLSVVIFEQLSSPNLFELLNSLNDWLEYASCFIRCQYVETKAPRKDALVKLNEKVAFFKQYELAVKTLLEILDDKLASGATDSQVRSAAQSFSSKWSHLLELTDSAVESLTSYLENAPDMQLEKAMQSLLEWLDCAEDVITTQDLDVIDQVEVTAAKISRLKELEKEMAVQRERLSFVVNVADEMRREGSNEYEALSNKVSALVPRWSDIERVLTNQLARLDAGFSLLQDWELRVSELEKWMVQVTEFIYAEKPAVGIVETLKAQLEQSQALINDVDALAPKVKEMETWAEELKAICTPRMTEYLRARMEEIISHWNEVVRVTKAKHESLNEAYSRSMKTFDDINMLTKWLWGIEQEVHSFGSPNSGKELCAMIKRHKQILEELRSKSETIESAVCLGGVIIDAVDQADETTRQLKQQFLNAREQWRAVCQQMESRLSILTDAYELWKEFQELVAVERVSLDRLEETLKEPMKSAADAEEFSEQLDEFERQMEGGGGHSRIMEIAQALNSQKLLSSAIKSELNKYLARREEVLEPARERQKFLESDAREAQNIEQQLHECLSWLSQVDFILKTRSECDILASDVPEDYKKLYDDFDSHKNGIFRLEKQIAHYQQVDQQLAAQRLAEQVNHLKKYMCDLQSKLERYKQPSELDDRLQRVRRILDDLEQSFELLAVTSDDLEEIDQLLEKVEVTDEAVCELQGEVSDLKATRAKAQPSSSTVGTLEIEELEEALRSFHVKVMESRDKYQSIKDMLTVSSTNLQTCSELLNEVESELRKSEGDDTPAPEDRRRLALAHRKQVADCSKYLRDTQVGLQKFSELTSPEAAAELQSILDLLRNKISIINGKLDEWALTNEKITKEVVELQKKFFDIHADVACELNLTESDISQCGNDHLCLKAQLDYLKSLRPKVDSLKETAVKIIAKQGDPLHAIEAESSQLCRRWEGLLESTKDQLSQATHTDECDDQKTVSVTASFGKEGVSLSADKEEGKSTAATEQQMSVDESGAQVKLEEESFTADRLVAQANALADSIVSVEDLLIESEKDFAQLQSKFQDVSNTVEACSCHVHQLLDRTEKEKCAELRPTVVPILSKLETMDSKLKMLSKKVKTLIDINENHKRKHEVLSTHAKSCLANLVFLENSVVAFFFQRKRKGSGFWIDLNFENGKALDEGHSL
					

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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	33.5	Very low	46.4	Very low	149 Å²	149	88.8 Å²	88.8	73%	0.734	45%	0.446	S	S	*	.				0	-46.6	0	-84.9	168.3	63.1	0	0	114.6	L3 A4 A5 Q870	M1-L3 VanDerWaalsContact C-N 3.33Å; M1-L3 PolarHBondContact O-N 2.78Å; M1-A4 WeakPolarHBondContact O-CA 3.46Å; M1-A4 VanDerWaalsContact O-CB 3.27Å; M1-A4 WeakPolarHBondContact O-CB 3.43Å; M1-A4 PolarHBondContact O-N 3.43Å; M1-A5 PolarHBondContact O-N 3.37Å; M1-Q870 VanDerWaalsContact CE-OE1 3.25Å
2	F	37.8	Very low	46.3	Very low	45 Å²	45	88.6 Å²	88.6	20%	0.197	45%	0.446	C	S	.	.	H	α-helix	trans	-51.5	-43.2	-171.5	-159.1	-108.4	0	0	0	114.9	A4 A5 S6 L869 L937 I940	F2-A4 VanDerWaalsContact C-N 3.26Å; F2-A4 PolarHBondContact O-N 3.26Å; F2-A5 PolarHBondContact O-N 2.88Å; F2-A5 VanDerWaalsContact O-N 3.15Å; F2-S6 PolarHBondContact O-N 3.38Å; F2-L869 HydrophobicContact CE2-CB 4.13Å; F2-L869 HydrophobicContact CE2-CD1 3.61Å; F2-L869 HydrophobicContact CZ-CD1 3.59Å; F2-L937 HydrophobicContact CE1-CD2 3.5Å; F2-L937 VanDerWaalsContact CE1-CD2 3.5Å; F2-L937 HydrophobicContact CZ-CD2 3.48Å; F2-L937 VanDerWaalsContact CZ-CD2 3.48Å; F2-I940 HydrophobicContact CD1-CD1 4.33Å; F2-I940 HydrophobicContact CE1-CD1 3.37Å; F2-I940 HydrophobicContact CZ-CD1 3.58Å
3	L	45.6	Very low	46.5	Very low	117 Å²	117	91.2 Å²	91.2	61%	0.613	46%	0.462	S	S	*	.	H	α-helix	trans	-56.5	-33.6	172.6	-77.2	165.2	0	0	0	113.9	M1 K7	M1-L3 VanDerWaalsContact C-N 3.33Å; M1-L3 PolarHBondContact O-N 2.78Å; L3-K7 WeakPolarHBondContact O-CB 3.37Å; L3-K7 PolarHBondContact O-N 3.16Å
4	A	44	Very low	46.8	Very low	61 Å²	61	91.6 Å²	91.6	50%	0.504	47%	0.466	S	S	.	.	H	α-helix	trans	-70.1	-40.5	177.3	0	0	0	0	0	111.5	M1 F2 K7 H8	M1-A4 WeakPolarHBondContact O-CA 3.46Å; M1-A4 VanDerWaalsContact O-CB 3.27Å; M1-A4 WeakPolarHBondContact O-CB 3.43Å; M1-A4 PolarHBondContact O-N 3.43Å; F2-A4 VanDerWaalsContact C-N 3.26Å; F2-A4 PolarHBondContact O-N 3.26Å; A4-K7 PolarHBondContact O-N 3.04Å; A4-H8 WeakPolarHBondContact O-CB 3.26Å; A4-H8 PolarHBondContact O-N 3.4Å
5	A	46.7	Very low	46.8	Very low	44 Å²	44	95.1 Å²	95.1	36%	0.364	48%	0.477	S	S	.	.	H	α-helix	trans	-64.6	-46.1	174	0	0	0	0	0	111.5	M1 F2 K7 H8 L9	M1-A5 PolarHBondContact O-N 3.37Å; F2-A5 PolarHBondContact O-N 2.88Å; F2-A5 VanDerWaalsContact O-N 3.15Å; A5-K7 VanDerWaalsContact C-N 3.28Å; A5-K7 PolarHBondContact O-N 3.18Å; A5-H8 PolarHBondContact O-N 3.12Å; A5-L9 WeakPolarHBondContact O-CG 3.48Å; A5-L9 PolarHBondContact O-N 3.12Å
6	S	47.6	Very low	46.9	Very low	10 Å²	10	95.3 Å²	95.3	7%	0.07	48%	0.48	C	S	.	.	H	α-helix	trans	-58.1	-39.6	174.8	-163.4	0	0	0	0	111.9	F2 R10	F2-S6 PolarHBondContact O-N 3.38Å; S6-R10 VanDerWaalsContact O-CG 3.29Å; S6-R10 WeakPolarHBondContact O-CG 3.26Å; S6-R10 PolarHBondContact O-N 2.93Å; S6-R10 PolarHBondContact OG-NE 3.05Å; S6-R10 PolarHBondContact OG-NH2 3.04Å
7	K	54.3	Low	46.8	Very low	140 Å²	140	99.4 Å²	99.4	61%	0.609	50%	0.497	S	S	*	.	H	α-helix	trans	-71.5	-36.8	176.1	-166.9	172.7	-173.8	175.8	0	112.9	L3 A4 A5 Q11	L3-K7 WeakPolarHBondContact O-CB 3.37Å; L3-K7 PolarHBondContact O-N 3.16Å; A4-K7 PolarHBondContact O-N 3.04Å; A5-K7 VanDerWaalsContact C-N 3.28Å; A5-K7 PolarHBondContact O-N 3.18Å; K7-Q11 WeakPolarHBondContact O-CB 3.48Å; K7-Q11 VanDerWaalsContact O-CG 3.27Å; K7-Q11 WeakPolarHBondContact O-CG 3.49Å; K7-Q11 PolarHBondContact O-N 3.45Å; K7-Q11 VanDerWaalsContact O-N 3.13Å
8	H	44.6	Very low	46.8	Very low	124 Å²	124	102.6 Å²	102.6	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-66.2	-46	174.9	-118.1	-94.8	0	0	0	111.9	A4 A5 R10 Q11 L12	A4-H8 WeakPolarHBondContact O-CB 3.26Å; A4-H8 PolarHBondContact O-N 3.4Å; A5-H8 PolarHBondContact O-N 3.12Å; H8-R10 PolarHBondContact O-N 3.33Å; H8-Q11 PolarHBondContact O-N 3.34Å; H8-L12 WeakPolarHBondContact O-CG 3.29Å; H8-L12 PolarHBondContact O-N 2.94Å
9	L	50.3	Low	46.7	Very low	42 Å²	42	100.9 Å²	100.9	22%	0.22	51%	0.512	C	S	.	.	H	α-helix	trans	-58.3	-48.6	176.9	-71.9	167.4	0	0	0	111.3	A5 Q11 L12	A5-L9 WeakPolarHBondContact O-CG 3.48Å; A5-L9 PolarHBondContact O-N 3.12Å; L9-Q11 PolarHBondContact O-N 3.19Å; L9-L12 PolarHBondContact O-N 3Å
10	R	54.3	Low	46.7	Very low	141 Å²	141	100.7 Å²	100.7	53%	0.532	53%	0.526	S	S	.	.	H	α-helix	trans	-64.8	-20.9	176.1	-64.1	-179.8	-139.4	-155	8	113.5	S6 H8 N14 E936	S6-R10 VanDerWaalsContact O-CG 3.29Å; S6-R10 WeakPolarHBondContact O-CG 3.26Å; S6-R10 PolarHBondContact O-N 2.93Å; S6-R10 PolarHBondContact OG-NE 3.05Å; S6-R10 PolarHBondContact OG-NH2 3.04Å; H8-R10 PolarHBondContact O-N 3.33Å; R10-N14 PolarHBondContact O-ND2 3.23Å; R10-E936 IonicContact NH2-OE2 2.69Å; R10-E936 PolarHBondContact NH2-OE2 2.73Å
11	Q	51.4	Low	46.6	Very low	104 Å²	104	100.8 Å²	100.8	49%	0.486	54%	0.535	S	S	.	.	H	α-helix	trans	-89.3	-23.2	177.9	-80.4	-175.1	4.3	0	0	114.8	K7 H8 L9	K7-Q11 WeakPolarHBondContact O-CB 3.48Å; K7-Q11 VanDerWaalsContact O-CG 3.27Å; K7-Q11 WeakPolarHBondContact O-CG 3.49Å; K7-Q11 PolarHBondContact O-N 3.45Å; K7-Q11 VanDerWaalsContact O-N 3.13Å; H8-Q11 PolarHBondContact O-N 3.34Å; L9-Q11 PolarHBondContact O-N 3.19Å
12	L	44.9	Very low	47	Very low	86 Å²	86	96 Å²	96	45%	0.45	52%	0.523	S	S	.	.	H	α-helix	trans	-72.4	-47.2	175.3	-73.3	165.6	0	0	0	111	H8 L9 N14 K15	H8-L12 WeakPolarHBondContact O-CG 3.29Å; H8-L12 PolarHBondContact O-N 2.94Å; L9-L12 PolarHBondContact O-N 3Å; L12-N14 PolarHBondContact O-N 2.88Å; L12-K15 WeakPolarHBondContact O-CB 3.5Å; L12-K15 PolarHBondContact O-N 3.19Å
13	D	49.8	Very low	47.6	Very low	123 Å²	123	100.4 Å²	100.4	66%	0.658	55%	0.549	S	S	*	.	H	α-helix	trans	-52.4	-40.7	177.9	-155.2	39	0	0	0	112.2	K15	D13-K15 VanDerWaalsContact C-N 3.26Å; D13-K15 PolarHBondContact O-N 2.94Å
14	N	50.9	Low	47.8	Very low	96 Å²	96	100.9 Å²	100.9	51%	0.513	56%	0.562	S	S	.	*	H	α-helix	trans	-72.5	-4.4	178.6	-87.5	-88.9	0	0	0	115.9	R10 L12	R10-N14 PolarHBondContact O-ND2 3.23Å; L12-N14 PolarHBondContact O-N 2.88Å
15	K	46.2	Very low	48	Very low	144 Å²	144	107 Å²	107	63%	0.626	58%	0.578	S	S	*	*	H	α-helix	trans	-101.2	-45.7	179.3	-77.5	-178.8	175.3	177.7	0	112.9	L12 D13 E17 K18	L12-K15 WeakPolarHBondContact O-CB 3.5Å; L12-K15 PolarHBondContact O-N 3.19Å; D13-K15 VanDerWaalsContact C-N 3.26Å; D13-K15 PolarHBondContact O-N 2.94Å; K15-E17 PolarHBondContact O-N 3.25Å; K15-K18 PolarHBondContact O-N 3.05Å; K15-K18 VanDerWaalsContact O-N 3.12Å
16	D	48.3	Very low	48.1	Very low	98 Å²	98	112.7 Å²	112.7	52%	0.524	60%	0.597	S	S	.	*	H	α-helix	trans	-68.9	-31.7	-171.9	-77.2	-15.4	0	0	0	112.6	K18 A19 R884	D16-K18 PolarHBondContact O-N 3.16Å; D16-K18 VanDerWaalsContact O-N 3.13Å; D16-A19 PolarHBondContact O-N 3.15Å; D16-R884 IonicContact OD2-NH2 2.68Å
17	E	45.9	Very low	48.2	Very low	166 Å²	166	121.2 Å²	121.2	78%	0.776	64%	0.635	S	S	*	*	H	α-helix	trans	-55.9	-29.5	171.6	-76.8	-157.3	131.7	0	0	113.9	K15	K15-E17 PolarHBondContact O-N 3.25Å
18	K	45.9	Very low	47.7	Very low	156 Å²	156	119.4 Å²	119.4	68%	0.678	65%	0.646	S	S	*	*	H	α-helix	trans	-86.7	-24.8	-175.4	-75.6	171.9	-177.9	138.8	0	113.5	K15 D16	K15-K18 PolarHBondContact O-N 3.05Å; K15-K18 VanDerWaalsContact O-N 3.12Å; D16-K18 PolarHBondContact O-N 3.16Å; D16-K18 VanDerWaalsContact O-N 3.13Å
19	A	45	Very low	47.6	Very low	72 Å²	72	124.9 Å²	124.9	60%	0.595	66%	0.662	S	S	*	*	H	α-helix	trans	-72.1	-39.3	-179.7	0	0	0	0	0	112.3	D16 S21	D16-A19 PolarHBondContact O-N 3.15Å; A19-S21 PolarHBondContact O-N 2.81Å
20	A	46.8	Very low	47.1	Very low	96 Å²	96	134.7 Å²	134.7	79%	0.793	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-9.2	-168.8	0	0	0	0	0	116.4
21	S	44.2	Very low	46.4	Very low	102 Å²	102	132.5 Å²	132.5	71%	0.713	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-4.1	-174.2	71.8	0	0	0	0	115.7	A19	A19-S21 PolarHBondContact O-N 2.81Å
22	G	43.2	Very low	45.6	Very low	48 Å²	48	133 Å²	133	50%	0.495	72%	0.723	S	S	.	*	S	Bend	trans	-84.1	-63.5	-168.5	0	0	0	0	0	116.7	S24	G22-S24 PolarHBondContact O-N 3.49Å
23	D	49.7	Very low	45.3	Very low	138 Å²	138	137.4 Å²	137.4	74%	0.738	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-73.7	-16.1	-153.7	-80.6	-51.6	0	0	0	117.1	K25 Q26	D23-K25 PolarHBondContact O-N 2.73Å; D23-Q26 PolarHBondContact O-N 3.12Å
24	S	49.6	Very low	44.7	Very low	127 Å²	127	137.7 Å²	137.7	89%	0.888	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-62.2	-0.5	-170.9	-156	0	0	0	0	115.4	G22	G22-S24 PolarHBondContact O-N 3.49Å
25	K	49.3	Very low	44.1	Very low	190 Å²	190	137.5 Å²	137.5	83%	0.826	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-104.6	-15.9	-176.5	-72.4	172.8	-179.5	162.9	0	116.1	D23	D23-K25 PolarHBondContact O-N 2.73Å
26	Q	47	Very low	43.7	Very low	163 Å²	163	140 Å²	140	76%	0.762	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-24.4	-171.7	-89.9	-173.7	-15.1	0	0	115.7	D23 A28	D23-Q26 PolarHBondContact O-N 3.12Å; Q26-A28 VanDerWaalsContact C-N 3.29Å; Q26-A28 PolarHBondContact O-N 3.46Å
27	Q	49.9	Very low	43.2	Very low	189 Å²	189	145.8 Å²	145.8	88%	0.883	80%	0.797	S	S	*	*	G	3₁₀ helix	trans	-71.6	-17.4	-166.3	-145.2	167.4	13.7	0	0	114.8	R29	Q27-R29 VanDerWaalsContact C-N 3.35Å; Q27-R29 PolarHBondContact O-N 2.85Å
28	A	44.9	Very low	42.8	Very low	102 Å²	102	145.3 Å²	145.3	84%	0.843	79%	0.793	S	S	*	*	G	3₁₀ helix	trans	-80.2	6.3	-169.3	0	0	0	0	0	116.8	Q26	Q26-A28 VanDerWaalsContact C-N 3.29Å; Q26-A28 PolarHBondContact O-N 3.46Å
29	R	41.7	Very low	42.5	Very low	240 Å²	240	145.9 Å²	145.9	91%	0.906	80%	0.798	S	S	*	*	G	3₁₀ helix	trans	-110.9	1.9	-166.6	-88.6	-174.4	171	-175	-2.2	117.6	Q27	Q27-R29 VanDerWaalsContact C-N 3.35Å; Q27-R29 PolarHBondContact O-N 2.85Å
30	R	41.2	Very low	41.9	Very low	248 Å²	248	148 Å²	148	94%	0.936	81%	0.808	S	S	*	*			trans	-110.3	5.6	-159	-109.7	178.2	177.5	169.1	-1.3	119
31	A	38.4	Very low	41.4	Very low	94 Å²	94	148.1 Å²	148.1	78%	0.777	80%	0.803	S	S	*	*			trans	-124.4	73.2	-163	0	0	0	0	0	115.7
32	S	35.9	Very low	41.1	Very low	115 Å²	115	149.7 Å²	149.7	80%	0.804	81%	0.809	S	S	*	*			trans	-151.8	-3.8	-174.8	-53.1	0	0	0	0	122
33	L	38.5	Very low	40.6	Very low	179 Å²	179	153.7 Å²	153.7	94%	0.937	82%	0.823	S	S	*	*			trans	-143.5	114.8	-172.9	-72.2	174.2	0	0	0	116.6
34	S	35.7	Very low	40.6	Very low	129 Å²	129	152.1 Å²	152.1	90%	0.902	82%	0.821	S	S	*	*			trans	-169.3	140.2	155.2	77.6	0	0	0	0	112.4
35	A	38.6	Very low	39.9	Very low	92 Å²	92	154.9 Å²	154.9	76%	0.76	82%	0.819	S	S	*	*			trans	-173.3	138.5	171.7	0	0	0	0	0	117.8
36	H	39.2	Very low	39.2	Very low	195 Å²	195	152 Å²	152	90%	0.903	82%	0.818	S	S	*	*			trans	82.9	156.6	148.3	-75.5	60.9	0	0	0	124.4
37	R	36.6	Very low	38.6	Very low	220 Å²	220	149.5 Å²	149.5	83%	0.83	83%	0.825	S	S	*	*			trans	-158.6	145.7	-160.8	-91.1	-177.1	170.1	-178.6	-0.1	117.6
38	K	37.5	Very low	37.9	Very low	156 Å²	156	145.6 Å²	145.6	68%	0.678	83%	0.825	S	S	*	*			trans	46.5	146.4	140.3	-53.2	-173.6	-179.8	-171.8	0	127.2
39	H	38.7	Very low	37.5	Very low	168 Å²	168	149.1 Å²	149.1	78%	0.778	83%	0.829	S	S	*	*				140.1	144.5	114.9	-90.9	-65	0	0	0	123
40	S	34	Very low	37.2	Very low	118 Å²	118	146.3 Å²	146.3	83%	0.825	83%	0.826	S	S	*	*			trans	109	167.8	142.3	-131.8	0	0	0	0	125.6
41	S	36.4	Very low	37	Very low	98 Å²	98	143 Å²	143	69%	0.685	82%	0.822	S	S	*	*			trans	-162.5	179.7	-150.1	55.8	0	0	0	0	121.4
42	T	36.8	Very low	36.8	Very low	135 Å²	135	145.1 Å²	145.1	83%	0.828	83%	0.83	S	S	*	*			trans	85.8	168.7	161.4	71.6	0	0	0	0	121.4
43	V	33.5	Very low	36.8	Very low	131 Å²	131	146.9 Å²	146.9	79%	0.794	84%	0.836	S	S	*	*			cis	-161.6	164.7	10.2	78.7	0	0	0	0	115.1
44	P	48.5	Very low	36.6	Very low	106 Å²	106	142.6 Å²	142.6	69%	0.688	83%	0.826	S	S	*	*			trans	-134	178.9	-179	43.6	-29.3	0	0	0	119.7
45	H	35.9	Very low	36.6	Very low	184 Å²	184	146.2 Å²	146.2	85%	0.852	83%	0.826	S	S	*	*			trans	179.3	131.2	161.5	-100.4	-73.1	0	0	0	122.3
46	T	33.9	Very low	36.5	Very low	130 Å²	130	146.1 Å²	146.1	80%	0.798	83%	0.833	S	S	*	*			trans	63.6	0	136.6	50.1	0	0	0	0	136
47	A	34.5	Very low	36.2	Very low	111 Å²	111	144.9 Å²	144.9	92%	0.917	83%	0.833	S	S	*	*				0	0	0	0	0	0	0	0	136
48	A	35.9	Very low	36.1	Very low	106 Å²	106	141.9 Å²	141.9	88%	0.876	83%	0.833	S	S	*	*				0	0	0	0	0	0	0	0	136.4
49	D	36	Very low	36.1	Very low	176 Å²	176	143.2 Å²	143.2	94%	0.941	85%	0.847	S	S	*	*				0	0	0	-46.8	-24.8	0	0	0	145.5
50	E	35	Very low	36.5	Very low	181 Å²	181	141.4 Å²	141.4	85%	0.846	85%	0.85	S	S	*	*				0	0	0	-94.9	-65.4	47.9	0	0	141.5
51	H	38.4	Very low	37	Very low	180 Å²	180	141.8 Å²	141.8	83%	0.833	85%	0.852	S	S	*	*				0	0	0	-69.4	87	0	0	0	136.4
52	S	33.8	Very low	37.8	Very low	137 Å²	137	146.4 Å²	146.4	96%	0.958	86%	0.863	S	S	*	*				0	0	0	-72.2	0	0	0	0	130
53	V	35.9	Very low	38.2	Very low	153 Å²	153	143.2 Å²	143.2	93%	0.927	86%	0.857	S	S	*	*				0	0	0	72.3	0	0	0	0	129.6
54	A	34.9	Very low	38.9	Very low	88 Å²	88	146.8 Å²	146.8	73%	0.727	87%	0.865	S	S	*	*				0	0	0	0	0	0	0	0	134.4
55	K	35.4	Very low	38.8	Very low	206 Å²	206	147.9 Å²	147.9	90%	0.896	87%	0.869	S	S	*	*				0	0	0	-65.4	105.4	-162.4	125.8	0	129.2
56	G	35.4	Very low	38.8	Very low	89 Å²	89	147.1 Å²	147.1	92%	0.918	87%	0.866	S	S	*	*				0	0	0	0	0	0	0	0	126.3
57	L	32.8	Very low	38.4	Very low	170 Å²	170	149.5 Å²	149.5	89%	0.89	87%	0.868	S	S	*	*				0	0	0	-50.8	-173.2	0	0	0	125.3
58	D	35	Very low	38	Very low	156 Å²	156	147.2 Å²	147.2	83%	0.834	86%	0.855	S	S	*	*				0	0	0	-63.9	-55.9	0	0	0	131.3
59	L	38.1	Very low	37.1	Very low	185 Å²	185	146.8 Å²	146.8	97%	0.969	84%	0.838	S	S	*	*				0	0	0	-58	178.9	0	0	0	136.2
60	P	46.1	Very low	36	Very low	129 Å²	129	142.2 Å²	142.2	84%	0.838	82%	0.82	S	S	*	*				0	0	0	47.3	-32.1	0	0	0	137.4
61	S	45.2	Very low	35.1	Very low	126 Å²	126	137 Å²	137	88%	0.881	80%	0.803	S	S	*	*				0	0	0	-37.3	0	0	0	0	135.4
62	E	53.3	Low	34.5	Very low	196 Å²	196	131.4 Å²	131.4	92%	0.916	79%	0.788	S	S	*	*				0	0	0	-16.6	82.6	83.6	0	0	137.1
63	G	43.8	Very low	34	Very low	68 Å²	68	132.6 Å²	132.6	70%	0.701	77%	0.772	S	S	*	*				0	0	0	0	0	0	0	0	136.8
64	H	48.5	Very low	33.5	Very low	205 Å²	205	127.6 Å²	127.6	95%	0.949	74%	0.74	S	S	*	*				0	0	0	-37.3	-35.6	0	0	0	131.6
65	V	47.5	Very low	33.1	Very low	130 Å²	130	128.3 Å²	128.3	79%	0.788	73%	0.731	S	S	*	*				0	0	0	-152.5	0	0	0	0	127
66	E	34.5	Very low	32.7	Very low	168 Å²	168	124.4 Å²	124.4	79%	0.785	72%	0.715	S	S	*	*				0	0	0	-95.8	178.5	82.6	0	0	127.7
67	Q	26.4	Very low	32.2	Very low	180 Å²	180	121.9 Å²	121.9	84%	0.841	69%	0.689	S	S	*	*				0	0	0	-69.5	-163.9	48.6	0	0	126.7
68	G	25.9	Very low	31.8	Very low	62 Å²	62	120.6 Å²	120.6	64%	0.639	68%	0.679	S	S	*	*				0	0	0	0	0	0	0	0	130.2
69	D	16.7	Very low	31.9	Very low	97 Å²	97	116.5 Å²	116.5	52%	0.519	66%	0.66	S	S	.	*				0	0	0	-50.2	-32	0	0	0	131.7	R269 E276	D69-R269 IonicContact OD1-CZ 3.27Å; D69-R269 IonicContact OD1-NH1 3.5Å; D69-R269 PolarHBondContact OD1-NH1 3.11Å; D69-R269 IonicContact OD1-NH2 3.44Å; D69-R269 PolarHBondContact OD1-NH2 3.28Å; D69-R269 IonicContact OD2-CZ 2.74Å; D69-R269 IonicContact OD2-NH1 2.68Å; D69-R269 PolarHBondContact OD2-NH1 3.05Å; D69-E276 WeakPolarHBondContact CB-OE1 3.39Å
70	S	14.5	Very low	32	Very low	80 Å²	80	111 Å²	111	56%	0.559	64%	0.637	S	S	*	*				0	0	0	81.4	0	0	0	0	136.7	Q280	S70-Q280 PolarHBondContact O-NE2 3.47Å
71	S	16.2	Very low	31.8	Very low	71 Å²	71	111.5 Å²	111.5	50%	0.497	63%	0.631	S	S	.	*				0	0	0	-154	0	0	0	0	135.8	Q280	S71-Q280 VanDerWaalsContact CB-NE2 3.27Å; S71-Q280 PolarHBondContact OG-NE2 3.09Å; S71-Q280 PolarHBondContact OG-OE1 3.27Å
72	A	24.3	Very low	32.3	Very low	63 Å²	63	108.4 Å²	108.4	52%	0.521	61%	0.605	S	S	.	*				0	0	0	0	0	0	0	0	135.1	R283	A72-R283 WeakPolarHBondContact O-CD 3.3Å; A72-R283 PolarHBondContact O-NE 3.26Å
73	R	23.3	Very low	32.3	Very low	162 Å²	162	101.5 Å²	101.5	61%	0.611	58%	0.577	S	S	*	*				0	0	0	-157.4	160.2	171.6	177	-0.9	134.5	Q230 F286	R73-Q230 PolarHBondContact O-OE1 2.95Å; R73-F286 HydrophobicContact CG-CD2 4.03Å; R73-F286 HydrophobicContact CG-CE2 4.11Å; R73-F286 HydrophobicContact CG-CG 4.27Å; R73-F286 HydrophobicContact CG-CZ 4.43Å
74	N	25.4	Very low	33	Very low	49 Å²	49	98.3 Å²	98.3	26%	0.262	54%	0.544	S	S	.	.				0	0	0	-163.2	12.9	0	0	0	132.8	Q230 F286	N74-Q230 HydrophobicContact CB-CB 3.75Å; N74-Q230 VanDerWaalsContact CB-CD 3.48Å; N74-Q230 HydrophobicContact CB-CG 3.91Å; N74-Q230 WeakPolarHBondContact ND2-CB 3.15Å; N74-Q230 WeakPolarHBondContact ND2-CG 3.32Å; N74-Q230 WeakPolarHBondContact OD1-CG 3.27Å; N74-Q230 PolarHBondContact OD1-NE2 3.46Å; N74-F286 HydrophobicContact CB-CE2 3.91Å; N74-F286 HydrophobicContact CB-CZ 3.63Å
75	I	27.8	Very low	33.7	Very low	103 Å²	103	91.3 Å²	91.3	53%	0.528	52%	0.518	S	S	.	.				0	0	0	-166	153.7	0	0	0	131.5	P227	I75-P227 HydrophobicContact CD1-CB 3.8Å
76	E	25.7	Very low	34.2	Very low	123 Å²	123	90.7 Å²	90.7	58%	0.575	50%	0.502	S	S	*	.				0	0	0	-105.6	-65.8	103.8	0	0	139.3	Y222	E76-Y222 WeakPolarHBondContact OE1-CE2 3.25Å; E76-Y222 PolarHBondContact OE1-OH 2.88Å
77	G	25.1	Very low	35.6	Very low	36 Å²	36	83.6 Å²	83.6	37%	0.371	47%	0.469	S	S	.	.				0	0	0	0	0	0	0	0	135.5	R153 Y222	G77-R153 PolarHBondContact O-NH2 3.33Å; G77-R153 VanDerWaalsContact O-NH2 3.12Å; G77-Y222 VanDerWaalsContact O-CE2 3.28Å; G77-Y222 WeakPolarHBondContact O-CE2 3.24Å
78	E	25.7	Very low	37.3	Very low	143 Å²	143	80.8 Å²	80.8	67%	0.668	46%	0.456	S	S	*	.				0	0	0	105.5	158.7	80.1	0	0	128.2	K150	E78-K150 VanDerWaalsContact CD-CE 3.41Å; E78-K150 WeakPolarHBondContact OE1-CE 3.23Å; E78-K150 IonicContact OE1-NZ 2.91Å; E78-K150 PolarHBondContact OE1-NZ 3.39Å; E78-K150 WeakPolarHBondContact OE2-CE 3.48Å; E78-K150 IonicContact OE2-NZ 3.86Å; E78-K150 PolarHBondContact OE2-NZ 3.44Å
79	T	35.1	Very low	39.1	Very low	71 Å²	71	84.8 Å²	84.8	44%	0.436	46%	0.458	S	S	.	.				0	0	0	62.8	0	0	0	0	126.3	V147 K150	T79-V147 WeakPolarHBondContact CA-O 3.29Å; T79-K150 HydrophobicContact CG2-CD 4.4Å; T79-K150 HydrophobicContact CG2-CG 3.88Å
80	S	41.1	Very low	41.4	Very low	70 Å²	70	82.5 Å²	82.5	49%	0.49	46%	0.457	S	S	.	.				0	0	0	-160.7	0	0	0	0	130.1	R143 E148	S80-R143 PolarHBondContact OG-NE 3.33Å; S80-E148 VanDerWaalsContact CA-CG 3.5Å; S80-E148 WeakPolarHBondContact O-CG 3.43Å
81	L	41.2	Very low	43.7	Very low	138 Å²	138	84.3 Å²	84.3	72%	0.723	46%	0.457	S	S	*	.				0	0	0	-137.9	173.7	0	0	0	132.8	L84 R143 E148	L81-L84 HydrophobicContact CB-CD2 4.45Å; L81-L84 HydrophobicContact CD2-CD2 3.95Å; L81-L84 HydrophobicContact CG-CD2 4.21Å; L81-R143 PolarHBondContact O-NH2 3.33Å; L81-R143 VanDerWaalsContact O-NH2 3.07Å; L81-E148 WeakPolarHBondContact CA-OE1 3.45Å; L81-E148 VanDerWaalsContact N-CD 3.32Å; L81-E148 PolarHBondContact N-OE1 3.11Å
82	D	55.4	Low	46	Very low	61 Å²	61	81.4 Å²	81.4	33%	0.326	44%	0.436	S	S	.	.	S	Bend		0	0	0	79	137.4	0	0	0	129.9	L84 S85 C140 R143	D82-L84 VanDerWaalsContact N-CB 3.33Å; D82-L84 WeakPolarHBondContact O-CA 3.01Å; D82-L84 WeakPolarHBondContact O-CB 3.43Å; D82-L84 PolarHBondContact O-N 3.39Å; D82-L84 VanDerWaalsContact O-N 3.16Å; D82-S85 PolarHBondContact O-N 2.96Å; D82-C140 PolarHBondContact OD1-SG 3.48Å; D82-C140 PolarHBondContact OD2-SG 3.44Å; D82-C140 VanDerWaalsContact OD2-SG 3.38Å; D82-R143 IonicContact OD1-NH1 2.65Å; D82-R143 IonicContact OD2-CZ 2.56Å; D82-R143 IonicContact OD2-NH1 2.9Å; D82-R143 PolarHBondContact OD2-NH1 3.38Å; D82-R143 IonicContact OD2-NH2 3.67Å; D82-R143 PolarHBondContact OD2-NH2 3.2Å
83	P	54.8	Low	48.5	Very low	51 Å²	51	81.2 Å²	81.2	33%	0.331	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn		0	-18.7	0	-19.6	-7.2	0	0	0	118.5	S85 R86 E136 C140	P83-S85 PolarHBondContact O-N 3.34Å; P83-R86 PolarHBondContact O-N 3.16Å; P83-E136 HydrophobicContact CG-CG 4.33Å; P83-C140 HydrophobicContact CB-CB 4.45Å
84	L	58.2	Low	51.1	Low	1 Å²	1	75.7 Å²	75.7	1%	0.005	41%	0.408	C	S	.	.	H	α-helix	trans	0.1	-58.4	130.1	-131.3	82.8	0	0	0	116.2	L81 D82 R86 I87 Q88 C144 E148	L81-L84 HydrophobicContact CB-CD2 4.45Å; L81-L84 HydrophobicContact CD2-CD2 3.95Å; L81-L84 HydrophobicContact CG-CD2 4.21Å; D82-L84 VanDerWaalsContact N-CB 3.33Å; D82-L84 WeakPolarHBondContact O-CA 3.01Å; D82-L84 WeakPolarHBondContact O-CB 3.43Å; D82-L84 PolarHBondContact O-N 3.39Å; D82-L84 VanDerWaalsContact O-N 3.16Å; L84-R86 VanDerWaalsContact C-N 3.32Å; L84-R86 PolarHBondContact O-N 3.21Å; L84-I87 CarbonylContact O-C 3.56Å; L84-I87 WeakPolarHBondContact O-CA 3.31Å; L84-I87 WeakPolarHBondContact O-CB 3.14Å; L84-I87 PolarHBondContact O-N 3.43Å; L84-Q88 WeakPolarHBondContact O-CB 3.27Å; L84-Q88 WeakPolarHBondContact O-CG 3.35Å; L84-Q88 PolarHBondContact O-N 3.27Å; L84-C144 HydrophobicContact CD1-CB 4.4Å; L84-C144 WeakPolarHBondContact CD1-SG 3.37Å; L84-C144 WeakPolarHBondContact CG-SG 3.41Å; L84-E148 WeakPolarHBondContact CD1-OE2 3.46Å; L84-E148 WeakPolarHBondContact CD2-OE2 3.48Å
85	S	63	Low	53.6	Low	59 Å²	59	81.6 Å²	81.6	41%	0.413	43%	0.431	S	S	.	.	H	α-helix	trans	-54	-40.1	-175.9	53.7	0	0	0	0	114.4	D82 P83 I87 H89	D82-S85 PolarHBondContact O-N 2.96Å; P83-S85 PolarHBondContact O-N 3.34Å; S85-I87 VanDerWaalsContact C-N 3.33Å; S85-H89 WeakPolarHBondContact O-CB 3.44Å; S85-H89 PolarHBondContact O-N 3.42Å
86	R	58.8	Low	55.8	Low	116 Å²	116	79.1 Å²	79.1	44%	0.438	42%	0.421	S	S	.	.	H	α-helix	trans	-76.2	-23.7	178.4	-58	-168.6	74.4	-173	7.8	112.8	P83 L84 Q91 V92 Y137	P83-R86 PolarHBondContact O-N 3.16Å; L84-R86 VanDerWaalsContact C-N 3.32Å; L84-R86 PolarHBondContact O-N 3.21Å; R86-Q91 WeakPolarHBondContact O-CB 3.44Å; R86-Q91 PolarHBondContact O-N 2.85Å; R86-V92 HydrophobicContact CB-CG2 4.47Å; R86-V92 PolarHBondContact O-N 3.35Å; R86-Y137 HydrophobicContact CB-CE1 4.28Å; R86-Y137 PolarHBondContact NH1-OH 3.05Å
87	I	63.1	Low	58.1	Low	20 Å²	20	73.2 Å²	73.2	10%	0.103	39%	0.393	C	S	.	.	H	α-helix	trans	-79.7	-46.3	175.5	-60.7	172.3	0	0	0	109.4	L84 S85 H89 G90 V92 Y137 C140 F141	L84-I87 CarbonylContact O-C 3.56Å; L84-I87 WeakPolarHBondContact O-CA 3.31Å; L84-I87 WeakPolarHBondContact O-CB 3.14Å; L84-I87 PolarHBondContact O-N 3.43Å; S85-I87 VanDerWaalsContact C-N 3.33Å; I87-H89 VanDerWaalsContact C-N 3.29Å; I87-H89 PolarHBondContact O-N 3.45Å; I87-G90 PolarHBondContact O-N 3.47Å; I87-V92 HydrophobicContact CG1-CB 4.46Å; I87-Y137 HydrophobicContact CG1-CD1 4.46Å; I87-C140 HydrophobicContact CD1-CB 3.59Å; I87-F141 HydrophobicContact CD1-CB 4.03Å; I87-F141 HydrophobicContact CG2-CD2 3.68Å; I87-F141 HydrophobicContact CG2-CE2 4.15Å
88	Q	61.3	Low	60.4	Low	120 Å²	120	72.4 Å²	72.4	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-60.3	-34.5	174.2	-71.6	175.4	-10.6	0	0	112.6	L84 G90	L84-Q88 WeakPolarHBondContact O-CB 3.27Å; L84-Q88 WeakPolarHBondContact O-CG 3.35Å; L84-Q88 PolarHBondContact O-N 3.27Å; Q88-G90 VanDerWaalsContact C-N 3.27Å; Q88-G90 PolarHBondContact O-N 3.19Å
89	H	64.3	Low	62.8	Low	146 Å²	146	73 Å²	73	68%	0.676	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	9.7	173	-67.9	1.3	0	0	0	114	S85 I87 Q91	S85-H89 WeakPolarHBondContact O-CB 3.44Å; S85-H89 PolarHBondContact O-N 3.42Å; I87-H89 VanDerWaalsContact C-N 3.29Å; I87-H89 PolarHBondContact O-N 3.45Å; H89-Q91 HydrophobicContact CB-CG 4.36Å; H89-Q91 PolarHBondContact O-N 2.78Å
90	G	65	Low	64.5	Low	49 Å²	49	73.3 Å²	73.3	51%	0.505	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.7	5.3	175.4	0	0	0	0	0	115.8	I87 Q88 V92	I87-G90 PolarHBondContact O-N 3.47Å; Q88-G90 VanDerWaalsContact C-N 3.27Å; Q88-G90 PolarHBondContact O-N 3.19Å; G90-V92 VanDerWaalsContact C-N 3.26Å; G90-V92 PolarHBondContact O-N 2.73Å
91	Q	62	Low	65.9	Low	118 Å²	118	70.6 Å²	70.6	55%	0.551	36%	0.358	S	S	*	.	S	Bend	trans	-67.9	-29	-179.8	-60.9	-173.7	-3.5	0	0	111.9	R86 H89	R86-Q91 WeakPolarHBondContact O-CB 3.44Å; R86-Q91 PolarHBondContact O-N 2.85Å; H89-Q91 HydrophobicContact CB-CG 4.36Å; H89-Q91 PolarHBondContact O-N 2.78Å
92	V	66.4	Low	67.4	Low	10 Å²	10	65.4 Å²	65.4	6%	0.061	33%	0.334	C	S	.	.	S	Bend	trans	-126.1	116.6	174.9	-177	0	0	0	0	108.5	R86 I87 G90 I97 W134 Y137	R86-V92 HydrophobicContact CB-CG2 4.47Å; R86-V92 PolarHBondContact O-N 3.35Å; I87-V92 HydrophobicContact CG1-CB 4.46Å; G90-V92 VanDerWaalsContact C-N 3.26Å; G90-V92 PolarHBondContact O-N 2.73Å; V92-I97 HydrophobicContact CG1-CD1 3.91Å; V92-I97 HydrophobicContact CG1-CG1 3.58Å; V92-W134 HydrophobicContact CG1-CZ3 4.18Å; V92-Y137 HydrophobicContact CB-CD1 4.23Å; V92-Y137 HydrophobicContact CG1-CD1 4.02Å; V92-Y137 HydrophobicContact CG1-CG 4.15Å; V92-Y137 HydrophobicContact CG2-CD1 4.06Å; V92-Y137 HydrophobicContact CG2-CE1 3.93Å
93	T	75.1	Confident	68.1	Low	60 Å²	60	68.1 Å²	68.1	37%	0.368	34%	0.343	S	S	.	.			trans	-103.9	161.1	177.5	74.8	0	0	0	0	110.6	K95 T96 I97	T93-K95 PolarHBondContact O-N 3.11Å; T93-K95 PolarHBondContact OG1-N 3.43Å; T93-T96 PolarHBondContact N-OG1 3.44Å; T93-T96 WeakPolarHBondContact O-CA 3.46Å; T93-T96 VanDerWaalsContact O-CB 3.24Å; T93-T96 WeakPolarHBondContact O-CB 3.41Å; T93-T96 PolarHBondContact O-N 3.15Å; T93-T96 PolarHBondContact OG1-N 2.97Å; T93-T96 VanDerWaalsContact OG1-N 3.08Å; T93-T96 PolarHBondContact OG1-OG1 3.17Å; T93-I97 WeakPolarHBondContact O-CG1 3.31Å; T93-I97 PolarHBondContact O-N 3.21Å
94	W	78.3	Confident	68.6	Low	46 Å²	46	67.2 Å²	67.2	17%	0.174	33%	0.334	C	S	.	.	H	α-helix	trans	-51	-39.9	168.2	178	-109.7	0	0	0	112.7	T96 I97 S98 F141 K163 F166 F167	W94-T96 PolarHBondContact O-N 2.8Å; W94-I97 PolarHBondContact O-N 2.82Å; W94-S98 VanDerWaalsContact O-CB 3.31Å; W94-S98 WeakPolarHBondContact O-CB 3.3Å; W94-S98 PolarHBondContact O-N 2.88Å; W94-S98 PolarHBondContact O-OG 3.47Å; W94-F141 HydrophobicContact CB-CD1 4.49Å; W94-F141 HydrophobicContact CB-CD2 4.41Å; W94-F141 HydrophobicContact CB-CE1 3.96Å; W94-F141 HydrophobicContact CB-CE2 3.85Å; W94-F141 HydrophobicContact CB-CZ 3.62Å; W94-F141 HydrophobicContact CD2-CE1 4.47Å; W94-F141 AromaticContact CE3-CD1 3.79Å; W94-F141 HydrophobicContact CE3-CD1 3.79Å; W94-F141 HydrophobicContact CE3-CE1 4.15Å; W94-F141 HydrophobicContact CE3-CG 4.24Å; W94-F141 HydrophobicContact CG-CE1 4.42Å; W94-F141 HydrophobicContact CZ3-CD1 4.5Å; W94-K163 VanDerWaalsContact CD1-NZ 3.3Å; W94-K163 HydrophobicContact CD2-CD 4.31Å; W94-K163 HydrophobicContact CD2-CG 4.31Å; W94-K163 VanDerWaalsContact CD2-NZ 3.33Å; W94-K163 HydrophobicContact CE3-CD 4.34Å; W94-K163 HydrophobicContact CH2-CB 3.89Å; W94-K163 HydrophobicContact CH2-CD 4.48Å; W94-K163 HydrophobicContact CH2-CG 4.02Å; W94-K163 HydrophobicContact CZ2-CB 3.91Å; W94-K163 HydrophobicContact CZ2-CD 4.44Å; W94-K163 HydrophobicContact CZ2-CG 3.7Å; W94-K163 HydrophobicContact CZ3-CD 4.43Å; W94-K163 HydrophobicContact CZ3-CG 4.44Å; W94-F166 HydrophobicContact CH2-CB 4.43Å; W94-F166 AromaticContact CH2-CD1 3.65Å; W94-F166 HydrophobicContact CH2-CD1 3.65Å; W94-F166 HydrophobicContact CH2-CE1 4.3Å; W94-F166 HydrophobicContact CH2-CG 4.22Å; W94-F166 HydrophobicContact CZ2-CB 3.88Å; W94-F166 AromaticContact CZ2-CD1 3.55Å; W94-F166 HydrophobicContact CZ2-CD1 3.55Å; W94-F166 HydrophobicContact CZ2-CD2 4.46Å; W94-F166 HydrophobicContact CZ2-CE1 4.27Å; W94-F166 AromaticContact CZ2-CG 3.69Å; W94-F166 HydrophobicContact CZ2-CG 3.69Å; W94-F167 HydrophobicContact CH2-CD2 4.32Å; W94-F167 HydrophobicContact CH2-CE1 4.36Å; W94-F167 AromaticContact CH2-CE2 3.44Å; W94-F167 HydrophobicContact CH2-CE2 3.44Å; W94-F167 VanDerWaalsContact CH2-CE2 3.44Å; W94-F167 AromaticContact CH2-CZ 3.46Å; W94-F167 HydrophobicContact CH2-CZ 3.46Å; W94-F167 VanDerWaalsContact CH2-CZ 3.46Å; W94-F167 AromaticContact CZ3-CE2 3.77Å; W94-F167 HydrophobicContact CZ3-CE2 3.77Å; W94-F167 AromaticContact CZ3-CZ 3.6Å; W94-F167 HydrophobicContact CZ3-CZ 3.6Å
95	K	77.7	Confident	68.9	Low	172 Å²	172	68 Å²	68	75%	0.748	34%	0.339	S	S	*	.	H	α-helix	trans	-70.1	-19.3	178.3	-165.2	172	-176.1	173.8	0	113	T93 K99	T93-K95 PolarHBondContact O-N 3.11Å; T93-K95 PolarHBondContact OG1-N 3.43Å; K95-K99 WeakPolarHBondContact O-CB 3.32Å
96	T	75.3	Confident	69	Low	51 Å²	51	69.5 Å²	69.5	31%	0.313	35%	0.345	S	S	.	.	H	α-helix	trans	-79.1	-51	169.5	-44.1	0	0	0	0	110.2	T93 W94 K99 Q100 W134	T93-T96 PolarHBondContact N-OG1 3.44Å; T93-T96 WeakPolarHBondContact O-CA 3.46Å; T93-T96 VanDerWaalsContact O-CB 3.24Å; T93-T96 WeakPolarHBondContact O-CB 3.41Å; T93-T96 PolarHBondContact O-N 3.15Å; T93-T96 PolarHBondContact OG1-N 2.97Å; T93-T96 VanDerWaalsContact OG1-N 3.08Å; T93-T96 PolarHBondContact OG1-OG1 3.17Å; W94-T96 PolarHBondContact O-N 2.8Å; T96-K99 PolarHBondContact O-N 3.02Å; T96-Q100 VanDerWaalsContact O-CG 3.27Å; T96-Q100 WeakPolarHBondContact O-CG 3.38Å; T96-Q100 PolarHBondContact O-N 2.67Å; T96-Q100 VanDerWaalsContact O-N 3.13Å; T96-W134 HydrophobicContact CG2-CH2 4.17Å; T96-W134 HydrophobicContact CG2-CZ3 4.42Å
97	I	73.4	Confident	69	Low	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.8	-54.9	-179.6	-62.2	162.1	0	0	0	110.2	V92 T93 W94 K99 Q100 I101 W134 Y137 A138 F141	V92-I97 HydrophobicContact CG1-CD1 3.91Å; V92-I97 HydrophobicContact CG1-CG1 3.58Å; T93-I97 WeakPolarHBondContact O-CG1 3.31Å; T93-I97 PolarHBondContact O-N 3.21Å; W94-I97 PolarHBondContact O-N 2.82Å; I97-K99 VanDerWaalsContact C-N 3.34Å; I97-K99 PolarHBondContact O-N 2.86Å; I97-Q100 PolarHBondContact O-N 3.38Å; I97-Q100 VanDerWaalsContact O-N 3.11Å; I97-I101 HydrophobicContact CG2-CD1 3.71Å; I97-I101 HydrophobicContact CG2-CG1 4.4Å; I97-I101 WeakPolarHBondContact O-CG1 3.47Å; I97-I101 PolarHBondContact O-N 3.4Å; I97-W134 HydrophobicContact CB-CE3 4.46Å; I97-W134 HydrophobicContact CG1-CE3 4.23Å; I97-W134 HydrophobicContact CG1-CZ3 4.15Å; I97-Y137 WeakPolarHBondContact CD1-O 3.2Å; I97-A138 HydrophobicContact CG2-CB 4.19Å; I97-F141 HydrophobicContact CD1-CB 3.93Å; I97-F141 HydrophobicContact CD1-CD2 4.12Å; I97-F141 HydrophobicContact CD1-CG 4.2Å
98	S	72.6	Confident	68.7	Low	19 Å²	19	68.5 Å²	68.5	13%	0.133	35%	0.349	C	S	.	.	H	α-helix	trans	-59.7	-43.9	-178	67.3	0	0	0	0	111.6	W94 Q100 I101 S102 F166	W94-S98 VanDerWaalsContact O-CB 3.31Å; W94-S98 WeakPolarHBondContact O-CB 3.3Å; W94-S98 PolarHBondContact O-N 2.88Å; W94-S98 PolarHBondContact O-OG 3.47Å; S98-Q100 VanDerWaalsContact C-N 3.3Å; S98-Q100 PolarHBondContact O-N 3.37Å; S98-I101 PolarHBondContact O-N 2.7Å; S98-S102 WeakPolarHBondContact O-CB 3.49Å; S98-S102 PolarHBondContact O-N 3.25Å; S98-S102 PolarHBondContact O-OG 2.61Å; S98-F166 VanDerWaalsContact CA-CZ 3.46Å
99	K	77.2	Confident	68.3	Low	156 Å²	156	67.7 Å²	67.7	68%	0.678	35%	0.354	S	S	*	.	H	α-helix	trans	-61.6	-36.1	177.2	-175.4	176.5	179.4	-177.2	0	112.9	K95 T96 I97 K103	K95-K99 WeakPolarHBondContact O-CB 3.32Å; T96-K99 PolarHBondContact O-N 3.02Å; I97-K99 VanDerWaalsContact C-N 3.34Å; I97-K99 PolarHBondContact O-N 2.86Å; K99-K103 VanDerWaalsContact O-CB 3.24Å; K99-K103 WeakPolarHBondContact O-CB 3.4Å; K99-K103 PolarHBondContact O-N 2.69Å
100	Q	69.9	Low	67.6	Low	76 Å²	76	65.6 Å²	65.6	36%	0.355	35%	0.351	S	S	.	.	H	α-helix	trans	-76.7	-43.7	179.7	-67.1	-79.9	42.4	0	0	111.7	T96 I97 S98 K103 F104 W134	T96-Q100 VanDerWaalsContact O-CG 3.27Å; T96-Q100 WeakPolarHBondContact O-CG 3.38Å; T96-Q100 PolarHBondContact O-N 2.67Å; T96-Q100 VanDerWaalsContact O-N 3.13Å; I97-Q100 PolarHBondContact O-N 3.38Å; I97-Q100 VanDerWaalsContact O-N 3.11Å; S98-Q100 VanDerWaalsContact C-N 3.3Å; S98-Q100 PolarHBondContact O-N 3.37Å; Q100-K103 PolarHBondContact O-N 2.67Å; Q100-F104 WeakPolarHBondContact O-CB 3.27Å; Q100-F104 PolarHBondContact O-N 3.39Å; Q100-W134 HydrophobicContact CB-CD2 3.88Å; Q100-W134 HydrophobicContact CB-CE3 4.24Å; Q100-W134 HydrophobicContact CB-CG 4.4Å; Q100-W134 HydrophobicContact CB-CH2 4.38Å; Q100-W134 HydrophobicContact CB-CZ2 4.01Å; Q100-W134 HydrophobicContact CB-CZ3 4.46Å; Q100-W134 HydrophobicContact CG-CD2 4.37Å; Q100-W134 HydrophobicContact CG-CH2 3.83Å; Q100-W134 HydrophobicContact CG-CZ2 3.59Å; Q100-W134 HydrophobicContact CG-CZ3 4.29Å
101	I	70.7	Confident	66.7	Low	13 Å²	13	65.7 Å²	65.7	7%	0.067	34%	0.34	C	S	.	.	H	α-helix	trans	-61.4	-48.8	173.4	-64.8	176	0	0	0	110.2	I97 S98 K103 F104 V105 W134 F166 F167 Y170	I97-I101 HydrophobicContact CG2-CD1 3.71Å; I97-I101 HydrophobicContact CG2-CG1 4.4Å; I97-I101 WeakPolarHBondContact O-CG1 3.47Å; I97-I101 PolarHBondContact O-N 3.4Å; S98-I101 PolarHBondContact O-N 2.7Å; I101-K103 PolarHBondContact O-N 3.45Å; I101-F104 PolarHBondContact O-N 3.18Å; I101-V105 HydrophobicContact CG2-CG2 4.45Å; I101-V105 WeakPolarHBondContact O-CG2 3.37Å; I101-V105 PolarHBondContact O-N 3.34Å; I101-W134 HydrophobicContact CG1-CB 4.26Å; I101-F166 HydrophobicContact CG2-CE1 4.39Å; I101-F167 HydrophobicContact CD1-CE1 4.04Å; I101-Y170 HydrophobicContact CG2-CD2 3.96Å; I101-Y170 HydrophobicContact CG2-CE2 4.04Å
102	S	72.6	Confident	66	Low	30 Å²	30	63.7 Å²	63.7	21%	0.21	34%	0.339	C	S	.	.	H	α-helix	trans	-57.8	-47.8	176.4	-67	0	0	0	0	111.8	S98 F104 V105 T106 F166 Y170	S98-S102 WeakPolarHBondContact O-CB 3.49Å; S98-S102 PolarHBondContact O-N 3.25Å; S98-S102 PolarHBondContact O-OG 2.61Å; S102-F104 VanDerWaalsContact C-N 3.34Å; S102-F104 PolarHBondContact O-N 3.23Å; S102-V105 PolarHBondContact O-N 3.25Å; S102-T106 WeakPolarHBondContact O-CB 3.47Å; S102-T106 WeakPolarHBondContact O-CG2 3.35Å; S102-T106 PolarHBondContact O-N 3.38Å; S102-T106 PolarHBondContact O-OG1 3.44Å; S102-F166 WeakPolarHBondContact OG-CE2 3.27Å; S102-Y170 WeakPolarHBondContact CA-OH 3.38Å; S102-Y170 VanDerWaalsContact CB-OH 3.32Å; S102-Y170 WeakPolarHBondContact CB-OH 3.47Å; S102-Y170 PolarHBondContact OG-OH 3.28Å
103	K	69.9	Low	65.3	Low	118 Å²	118	68 Å²	68	51%	0.513	37%	0.365	S	S	.	.	H	α-helix	trans	-57.1	-49.2	177.4	-172	-156.6	171.8	-153	0	111.1	K99 Q100 I101 V105 T106 D107	K99-K103 VanDerWaalsContact O-CB 3.24Å; K99-K103 WeakPolarHBondContact O-CB 3.4Å; K99-K103 PolarHBondContact O-N 2.69Å; Q100-K103 PolarHBondContact O-N 2.67Å; I101-K103 PolarHBondContact O-N 3.45Å; K103-V105 PolarHBondContact O-N 2.85Å; K103-T106 WeakPolarHBondContact CA-OG1 3.33Å; K103-T106 PolarHBondContact O-N 3.24Å; K103-T106 PolarHBondContact O-OG1 3.39Å; K103-D107 WeakPolarHBondContact CE-OD2 3.48Å; K103-D107 IonicContact NZ-OD2 3.04Å; K103-D107 PolarHBondContact O-N 3.09Å
104	F	65.1	Low	64	Low	32 Å²	32	69.6 Å²	69.6	14%	0.14	37%	0.374	C	S	.	.	H	α-helix	trans	-57.5	-47.8	179.8	-172.9	-77.3	0	0	0	111.8	Q100 I101 S102 D107 L108 L127 L131 L177	Q100-F104 WeakPolarHBondContact O-CB 3.27Å; Q100-F104 PolarHBondContact O-N 3.39Å; I101-F104 PolarHBondContact O-N 3.18Å; S102-F104 VanDerWaalsContact C-N 3.34Å; S102-F104 PolarHBondContact O-N 3.23Å; F104-D107 PolarHBondContact O-N 3.26Å; F104-L108 HydrophobicContact CD1-CD1 3.96Å; F104-L108 HydrophobicContact CE1-CD1 3.42Å; F104-L108 VanDerWaalsContact CE1-CD1 3.42Å; F104-L108 HydrophobicContact CZ-CD1 4.2Å; F104-L108 PolarHBondContact O-N 3.42Å; F104-L127 HydrophobicContact CD2-CD1 4.45Å; F104-L127 HydrophobicContact CE2-CD1 3.41Å; F104-L127 VanDerWaalsContact CE2-CD1 3.41Å; F104-L127 HydrophobicContact CE2-CD2 4.49Å; F104-L127 HydrophobicContact CE2-CG 3.64Å; F104-L127 HydrophobicContact CZ-CD1 3.73Å; F104-L127 HydrophobicContact CZ-CD2 4.01Å; F104-L127 HydrophobicContact CZ-CG 3.61Å; F104-L131 HydrophobicContact CD1-CD2 3.67Å; F104-L131 HydrophobicContact CD1-CG 4.25Å; F104-L131 HydrophobicContact CD2-CD2 4.15Å; F104-L131 HydrophobicContact CD2-CG 4.22Å; F104-L131 HydrophobicContact CE1-CD1 3.59Å; F104-L131 HydrophobicContact CE1-CD2 3.59Å; F104-L131 HydrophobicContact CE1-CG 3.73Å; F104-L131 HydrophobicContact CE2-CD1 4.09Å; F104-L131 HydrophobicContact CE2-CD2 4.06Å; F104-L131 HydrophobicContact CE2-CG 3.67Å; F104-L131 HydrophobicContact CG-CD2 3.97Å; F104-L131 HydrophobicContact CG-CG 4.49Å; F104-L131 HydrophobicContact CZ-CD1 3.34Å; F104-L131 HydrophobicContact CZ-CD2 3.8Å; F104-L131 HydrophobicContact CZ-CG 3.42Å; F104-L131 VanDerWaalsContact CZ-CG 3.42Å; F104-L177 HydrophobicContact CE1-CD1 4.36Å
105	V	65.3	Low	62.6	Low	18 Å²	18	71 Å²	71	11%	0.109	38%	0.384	C	S	.	.	H	α-helix	trans	-76.2	-23.8	-177.9	-174.5	0	0	0	0	112.4	I101 S102 K103 L108 P109 Y170 A173	I101-V105 HydrophobicContact CG2-CG2 4.45Å; I101-V105 WeakPolarHBondContact O-CG2 3.37Å; I101-V105 PolarHBondContact O-N 3.34Å; S102-V105 PolarHBondContact O-N 3.25Å; K103-V105 PolarHBondContact O-N 2.85Å; V105-L108 WeakPolarHBondContact O-CB 3.17Å; V105-P109 WeakPolarHBondContact O-CD 3.38Å; V105-Y170 HydrophobicContact CB-CD1 3.92Å; V105-Y170 HydrophobicContact CB-CE1 4Å; V105-Y170 HydrophobicContact CB-CG 4.46Å; V105-Y170 HydrophobicContact CG1-CD1 3.49Å; V105-Y170 VanDerWaalsContact CG1-CD1 3.49Å; V105-Y170 HydrophobicContact CG1-CE1 3.89Å; V105-Y170 HydrophobicContact CG1-CG 4.23Å; V105-Y170 HydrophobicContact CG2-CD1 4.27Å; V105-Y170 HydrophobicContact CG2-CG 4.31Å; V105-A173 HydrophobicContact CG1-CB 3.8Å
106	T	64.6	Low	61.4	Low	89 Å²	89	63.5 Å²	63.5	55%	0.546	35%	0.352	S	S	.	.	H	α-helix	trans	-77	-30	171.1	53	0	0	0	0	113.8	S102 K103 L108 P109	S102-T106 WeakPolarHBondContact O-CB 3.47Å; S102-T106 WeakPolarHBondContact O-CG2 3.35Å; S102-T106 PolarHBondContact O-N 3.38Å; S102-T106 PolarHBondContact O-OG1 3.44Å; K103-T106 WeakPolarHBondContact CA-OG1 3.33Å; K103-T106 PolarHBondContact O-N 3.24Å; K103-T106 PolarHBondContact O-OG1 3.39Å; T106-L108 PolarHBondContact O-N 3.29Å; T106-P109 WeakPolarHBondContact O-CD 3.45Å
107	D	60.3	Low	60.2	Low	83 Å²	83	67.3 Å²	67.3	44%	0.444	37%	0.366	S	S	.	.	H	α-helix	trans	-74.2	-17.1	175.2	-66.2	-14.6	0	0	0	111	K103 F104 V110	K103-D107 WeakPolarHBondContact CE-OD2 3.48Å; K103-D107 IonicContact NZ-OD2 3.04Å; K103-D107 PolarHBondContact O-N 3.09Å; F104-D107 PolarHBondContact O-N 3.26Å; D107-V110 WeakPolarHBondContact O-CB 3.46Å
108	L	55.4	Low	59.1	Low	32 Å²	32	75.1 Å²	75.1	17%	0.168	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-69.7	-42.9	-170.7	-145.9	98.3	0	0	0	116.7	F104 V105 T106 V110 L111 L177	F104-L108 HydrophobicContact CD1-CD1 3.96Å; F104-L108 HydrophobicContact CE1-CD1 3.42Å; F104-L108 VanDerWaalsContact CE1-CD1 3.42Å; F104-L108 HydrophobicContact CZ-CD1 4.2Å; F104-L108 PolarHBondContact O-N 3.42Å; V105-L108 WeakPolarHBondContact O-CB 3.17Å; T106-L108 PolarHBondContact O-N 3.29Å; L108-V110 PolarHBondContact O-N 2.77Å; L108-V110 VanDerWaalsContact O-N 3.1Å; L108-L111 WeakPolarHBondContact O-CB 3.16Å; L108-L111 PolarHBondContact O-N 3.08Å; L108-L177 HydrophobicContact CD1-CD1 3.97Å; L108-L177 HydrophobicContact CD1-CD2 4.11Å; L108-L177 HydrophobicContact CD1-CG 4.34Å; L108-L177 HydrophobicContact CD2-CD1 3.76Å; L108-L177 HydrophobicContact CD2-CD2 3.87Å; L108-L177 HydrophobicContact CD2-CG 3.56Å; L108-L177 HydrophobicContact CG-CD2 4.46Å
109	P	52.9	Low	58.1	Low	103 Å²	103	76.3 Å²	76.3	67%	0.669	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-65.1	-15.2	-179.2	-22.3	35.3	0	0	0	113.6	V105 T106 L111	V105-P109 WeakPolarHBondContact O-CD 3.38Å; T106-P109 WeakPolarHBondContact O-CD 3.45Å; P109-L111 VanDerWaalsContact C-N 3.29Å
110	V	50.6	Low	57.2	Low	103 Å²	103	72.5 Å²	72.5	62%	0.624	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-72.2	-26	173	-170.4	0	0	0	0	111	D107 L108 S112	D107-V110 WeakPolarHBondContact O-CB 3.46Å; L108-V110 PolarHBondContact O-N 2.77Å; L108-V110 VanDerWaalsContact O-N 3.1Å; V110-S112 PolarHBondContact O-N 3.41Å; V110-S112 VanDerWaalsContact O-N 3.08Å
111	L	45.9	Very low	56.8	Low	51 Å²	51	71.2 Å²	71.2	27%	0.267	40%	0.4	S	S	.	.	S	Bend	trans	-84.1	41.8	177	-60.5	176.3	0	0	0	112.9	L108 P109 I115 L119	L108-L111 WeakPolarHBondContact O-CB 3.16Å; L108-L111 PolarHBondContact O-N 3.08Å; P109-L111 VanDerWaalsContact C-N 3.29Å; L111-I115 HydrophobicContact CD2-CB 4.15Å; L111-I115 HydrophobicContact CD2-CG2 3.61Å; L111-L119 HydrophobicContact CD2-CD1 4.4Å
112	S	47.5	Very low	56.4	Low	76 Å²	76	74.2 Å²	74.2	53%	0.531	42%	0.42	S	S	.	.			trans	-53.1	149.8	168.5	69.6	0	0	0	0	111.2	V110 V114 I115	V110-S112 PolarHBondContact O-N 3.41Å; V110-S112 VanDerWaalsContact O-N 3.08Å; S112-V114 PolarHBondContact O-N 3.38Å; S112-I115 PolarHBondContact O-N 3.18Å
113	V	51.3	Low	56.1	Low	101 Å²	101	77 Å²	77	61%	0.612	43%	0.433	S	S	*	.	H	α-helix	trans	-29.8	-49.5	-163.7	-177.8	0	0	0	0	115.4	I115 F116 E117	V113-I115 PolarHBondContact O-N 3.12Å; V113-I115 VanDerWaalsContact O-N 3.14Å; V113-F116 CarbonylContact O-C 3.59Å; V113-F116 PolarHBondContact O-N 3.2Å; V113-E117 HydrophobicContact CG1-CG 4.22Å; V113-E117 PolarHBondContact O-N 3.38Å
114	V	47.7	Very low	56.1	Low	92 Å²	92	71.8 Å²	71.8	56%	0.558	41%	0.41	S	S	*	.	H	α-helix	trans	-52.4	-34.4	-178.3	-172.6	0	0	0	0	114.1	S112	S112-V114 PolarHBondContact O-N 3.38Å
115	I	49.9	Very low	56.6	Low	76 Å²	76	72.8 Å²	72.8	39%	0.39	41%	0.414	S	S	.	.	H	α-helix	trans	-85.8	-35.2	178	-53.6	-176.4	0	0	0	111	L111 S112 V113 E117 Q118 L119	L111-I115 HydrophobicContact CD2-CB 4.15Å; L111-I115 HydrophobicContact CD2-CG2 3.61Å; S112-I115 PolarHBondContact O-N 3.18Å; V113-I115 PolarHBondContact O-N 3.12Å; V113-I115 VanDerWaalsContact O-N 3.14Å; I115-E117 PolarHBondContact O-N 3.37Å; I115-Q118 PolarHBondContact O-N 3.13Å; I115-Q118 VanDerWaalsContact O-N 3.1Å; I115-L119 PolarHBondContact O-N 3.33Å
116	F	52.3	Low	56.9	Low	14 Å²	14	78.9 Å²	78.9	6%	0.061	44%	0.442	C	S	.	.	H	α-helix	trans	-65.9	-29.9	173.6	-138.7	-103.2	0	0	0	111.6	V113 L119 L124 I180 L181 K184	V113-F116 CarbonylContact O-C 3.59Å; V113-F116 PolarHBondContact O-N 3.2Å; F116-L119 HydrophobicContact CD2-CD1 4.09Å; F116-L119 HydrophobicContact CE2-CD1 4.5Å; F116-L124 HydrophobicContact CE1-CD1 4.15Å; F116-L124 HydrophobicContact CE2-CD1 4.14Å; F116-L124 HydrophobicContact CZ-CD1 3.52Å; F116-I180 HydrophobicContact CD1-CG2 3.54Å; F116-I180 HydrophobicContact CE1-CG2 3.62Å; F116-I180 HydrophobicContact CG-CG2 4.19Å; F116-I180 HydrophobicContact CZ-CG2 4.31Å; F116-L181 HydrophobicContact CE1-CD2 4.39Å; F116-L181 HydrophobicContact CZ-CD2 4.25Å; F116-K184 HydrophobicContact CD1-CG 3.96Å; F116-K184 HydrophobicContact CE1-CG 4.09Å; F116-K184 WeakPolarHBondContact O-CE 3.06Å; F116-K184 PolarHBondContact O-NZ 2.98Å
117	E	49.5	Very low	57.2	Low	131 Å²	131	77 Å²	77	61%	0.612	43%	0.428	S	S	*	.	H	α-helix	trans	-60.6	-41.4	168.2	-76.6	-170.4	126.4	0	0	112.9	V113 I115 K184	V113-E117 HydrophobicContact CG1-CG 4.22Å; V113-E117 PolarHBondContact O-N 3.38Å; I115-E117 PolarHBondContact O-N 3.37Å; E117-K184 PolarHBondContact O-NZ 3.48Å
118	Q	50	Low	57.9	Low	164 Å²	164	73.2 Å²	73.2	77%	0.766	41%	0.408	S	S	*	.	H	α-helix	trans	-90.5	-8.4	-175.7	-64	-166.7	0.7	0	0	115.4	I115 S120	I115-Q118 PolarHBondContact O-N 3.13Å; I115-Q118 VanDerWaalsContact O-N 3.1Å; Q118-S120 PolarHBondContact O-N 3.33Å
119	L	52.8	Low	59.1	Low	45 Å²	45	74.4 Å²	74.4	24%	0.236	41%	0.414	C	S	.	.			trans	-67.4	118	174.8	-84.2	168	0	0	0	111.6	L111 I115 F116 N123	L111-L119 HydrophobicContact CD2-CD1 4.4Å; I115-L119 PolarHBondContact O-N 3.33Å; F116-L119 HydrophobicContact CD2-CD1 4.09Å; F116-L119 HydrophobicContact CE2-CD1 4.5Å; L119-N123 HydrophobicContact CD2-CB 3.94Å
120	S	57.1	Low	60.2	Low	75 Å²	75	72 Å²	72	52%	0.524	40%	0.4	S	S	.	.			trans	-68.1	148.1	174.3	-60.1	0	0	0	0	111.6	Q118 P122 N123	Q118-S120 PolarHBondContact O-N 3.33Å; S120-P122 VanDerWaalsContact C-CD 3.44Å; S120-N123 PolarHBondContact O-N 3.43Å; S120-N123 VanDerWaalsContact O-N 3.13Å
121	S	62	Low	61.4	Low	49 Å²	49	67.8 Å²	67.8	34%	0.343	37%	0.374	S	S	.	.	H	α-helix	trans	-49.6	-40.4	-175	54.9	0	0	0	0	117	N123 L124 F125	S121-N123 PolarHBondContact O-N 3.09Å; S121-L124 PolarHBondContact O-N 3.32Å; S121-F125 PolarHBondContact O-N 2.93Å; S121-F125 VanDerWaalsContact O-N 3.13Å
122	P	62.6	Low	63.1	Low	76 Å²	76	65.7 Å²	65.7	49%	0.494	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-40.7	178.6	22.3	-34.5	0	0	0	113.1	S120 L124 F125 E126	S120-P122 VanDerWaalsContact C-CD 3.44Å; P122-L124 VanDerWaalsContact C-N 3.26Å; P122-L124 PolarHBondContact O-N 3.44Å; P122-F125 PolarHBondContact O-N 3.05Å; P122-E126 PolarHBondContact O-N 3.33Å
123	N	66.5	Low	64.6	Low	89 Å²	89	66.6 Å²	66.6	48%	0.476	36%	0.362	S	S	.	.	H	α-helix	trans	-63.3	-36.1	-179.5	-62.7	12.6	0	0	0	111.3	L119 S120 S121 L127	L119-N123 HydrophobicContact CD2-CB 3.94Å; S120-N123 PolarHBondContact O-N 3.43Å; S120-N123 VanDerWaalsContact O-N 3.13Å; S121-N123 PolarHBondContact O-N 3.09Å; N123-L127 VanDerWaalsContact O-CB 3.29Å; N123-L127 WeakPolarHBondContact O-CB 3.37Å; N123-L127 PolarHBondContact O-N 3.46Å
124	L	69	Low	66	Low	8 Å²	8	64.2 Å²	64.2	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-72.6	-33.5	178.4	-174.5	58.1	0	0	0	112	F116 S121 P122 L127 L128 L181 V194	F116-L124 HydrophobicContact CE1-CD1 4.15Å; F116-L124 HydrophobicContact CE2-CD1 4.14Å; F116-L124 HydrophobicContact CZ-CD1 3.52Å; S121-L124 PolarHBondContact O-N 3.32Å; P122-L124 VanDerWaalsContact C-N 3.26Å; P122-L124 PolarHBondContact O-N 3.44Å; L124-L127 HydrophobicContact CD1-CD2 4.27Å; L124-L128 HydrophobicContact CD1-CD1 4.4Å; L124-L128 HydrophobicContact CG-CD1 4.24Å; L124-L128 WeakPolarHBondContact O-CD1 3.32Å; L124-L128 VanDerWaalsContact O-CG 3.32Å; L124-L128 WeakPolarHBondContact O-CG 3.26Å; L124-L128 PolarHBondContact O-N 3.13Å; L124-L128 VanDerWaalsContact O-N 3.12Å; L124-L181 HydrophobicContact CD1-CD2 4.18Å; L124-V194 HydrophobicContact CB-CG2 4.41Å; L124-V194 HydrophobicContact CD2-CG1 3.61Å; L124-V194 HydrophobicContact CD2-CG2 4.47Å; L124-V194 HydrophobicContact CG-CG1 3.88Å; L124-V194 HydrophobicContact CG-CG2 4.45Å
125	F	75.1	Confident	67.6	Low	53 Å²	53	60 Å²	60	23%	0.232	32%	0.317	C	S	.	.	H	α-helix	trans	-70.5	-45.4	175.8	-179.2	-120.8	0	0	0	112.5	S121 P122 L127 L128 N129 Q193 V194 A197	S121-F125 PolarHBondContact O-N 2.93Å; S121-F125 VanDerWaalsContact O-N 3.13Å; P122-F125 PolarHBondContact O-N 3.05Å; F125-L127 VanDerWaalsContact C-N 3.31Å; F125-L127 PolarHBondContact O-N 3.17Å; F125-L128 PolarHBondContact O-N 3.26Å; F125-N129 WeakPolarHBondContact CE1-ND2 3.5Å; F125-N129 VanDerWaalsContact CE2-ND2 3.27Å; F125-N129 WeakPolarHBondContact CE2-ND2 3.24Å; F125-N129 WeakPolarHBondContact CZ-ND2 3.31Å; F125-N129 VanDerWaalsContact O-CG 3.3Å; F125-N129 PolarHBondContact O-N 2.79Å; F125-N129 PolarHBondContact O-ND2 3.26Å; F125-Q193 HydrophobicContact CD1-CB 4.5Å; F125-Q193 HydrophobicContact CD2-CB 3.82Å; F125-Q193 VanDerWaalsContact CD2-O 3.23Å; F125-Q193 WeakPolarHBondContact CD2-O 3.37Å; F125-Q193 HydrophobicContact CE1-CB 4.43Å; F125-Q193 HydrophobicContact CE2-CB 3.75Å; F125-Q193 VanDerWaalsContact CE2-O 3.29Å; F125-Q193 WeakPolarHBondContact CE2-O 3.23Å; F125-Q193 HydrophobicContact CG-CB 4.2Å; F125-Q193 HydrophobicContact CZ-CB 4.06Å; F125-V194 HydrophobicContact CB-CG2 4.22Å; F125-A197 HydrophobicContact CD2-CB 3.79Å; F125-A197 HydrophobicContact CE2-CB 3.95Å
126	E	71.8	Confident	69.1	Low	146 Å²	146	59.5 Å²	59.5	68%	0.682	31%	0.312	S	S	*	.	H	α-helix	trans	-60.5	-41.5	174.3	-71.3	-166.7	159.6	0	0	112	P122 L128 N129 S130	P122-E126 PolarHBondContact O-N 3.33Å; E126-L128 PolarHBondContact O-N 2.61Å; E126-N129 PolarHBondContact O-N 2.68Å; E126-S130 WeakPolarHBondContact O-CB 3.48Å; E126-S130 PolarHBondContact O-N 3.47Å
127	L	71.7	Confident	70.4	Confident	51 Å²	51	60.7 Å²	60.7	27%	0.267	32%	0.317	S	S	.	.	H	α-helix	trans	-57.6	-48.4	176.5	-169.3	84	0	0	0	111.8	F104 N123 L124 F125 L131	F104-L127 HydrophobicContact CD2-CD1 4.45Å; F104-L127 HydrophobicContact CE2-CD1 3.41Å; F104-L127 VanDerWaalsContact CE2-CD1 3.41Å; F104-L127 HydrophobicContact CE2-CD2 4.49Å; F104-L127 HydrophobicContact CE2-CG 3.64Å; F104-L127 HydrophobicContact CZ-CD1 3.73Å; F104-L127 HydrophobicContact CZ-CD2 4.01Å; F104-L127 HydrophobicContact CZ-CG 3.61Å; N123-L127 VanDerWaalsContact O-CB 3.29Å; N123-L127 WeakPolarHBondContact O-CB 3.37Å; N123-L127 PolarHBondContact O-N 3.46Å; L124-L127 HydrophobicContact CD1-CD2 4.27Å; F125-L127 VanDerWaalsContact C-N 3.31Å; F125-L127 PolarHBondContact O-N 3.17Å; L127-L131 PolarHBondContact O-N 2.69Å; L127-L131 VanDerWaalsContact O-N 3.16Å
128	L	75.2	Confident	71.9	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-70	-36.9	179.7	-73.4	165.5	0	0	0	112.7	L124 F125 E126 L131 N132 L181 V194 A197 A198 F201	L124-L128 HydrophobicContact CD1-CD1 4.4Å; L124-L128 HydrophobicContact CG-CD1 4.24Å; L124-L128 WeakPolarHBondContact O-CD1 3.32Å; L124-L128 VanDerWaalsContact O-CG 3.32Å; L124-L128 WeakPolarHBondContact O-CG 3.26Å; L124-L128 PolarHBondContact O-N 3.13Å; L124-L128 VanDerWaalsContact O-N 3.12Å; F125-L128 PolarHBondContact O-N 3.26Å; E126-L128 PolarHBondContact O-N 2.61Å; L128-L131 HydrophobicContact CD2-CD1 4.42Å; L128-L131 WeakPolarHBondContact O-CB 3.38Å; L128-L131 PolarHBondContact O-N 3.33Å; L128-N132 WeakPolarHBondContact O-CB 3.34Å; L128-N132 PolarHBondContact O-N 2.99Å; L128-N132 PolarHBondContact O-ND2 2.68Å; L128-L181 HydrophobicContact CD1-CD2 4.13Å; L128-L181 HydrophobicContact CD2-CD1 3.86Å; L128-L181 HydrophobicContact CD2-CD2 4.31Å; L128-V194 HydrophobicContact CD1-CG1 4Å; L128-A197 HydrophobicContact CB-CB 3.56Å; L128-A197 HydrophobicContact CD1-CB 4.1Å; L128-A197 HydrophobicContact CG-CB 4.45Å; L128-A198 HydrophobicContact CD1-CB 4.09Å; L128-F201 HydrophobicContact CD2-CB 4.32Å
129	N	79.3	Confident	73.5	Confident	56 Å²	56	46.9 Å²	46.9	30%	0.299	25%	0.253	S	S	.	.	H	α-helix	trans	-66.9	-41.5	176	-69.2	-27.1	0	0	0	111.5	F125 E126 L131 N132 D133	F125-N129 WeakPolarHBondContact CE1-ND2 3.5Å; F125-N129 VanDerWaalsContact CE2-ND2 3.27Å; F125-N129 WeakPolarHBondContact CE2-ND2 3.24Å; F125-N129 WeakPolarHBondContact CZ-ND2 3.31Å; F125-N129 VanDerWaalsContact O-CG 3.3Å; F125-N129 PolarHBondContact O-N 2.79Å; F125-N129 PolarHBondContact O-ND2 3.26Å; E126-N129 PolarHBondContact O-N 2.68Å; N129-L131 VanDerWaalsContact C-N 3.35Å; N129-L131 PolarHBondContact O-N 3.35Å; N129-N132 WeakPolarHBondContact O-CB 3.17Å; N129-N132 PolarHBondContact O-N 2.87Å; N129-N132 VanDerWaalsContact O-N 3.12Å; N129-D133 PolarHBondContact O-N 3.29Å
130	S	76	Confident	74.8	Confident	52 Å²	52	44.8 Å²	44.8	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-57.5	-45.8	173.8	-175.9	0	0	0	0	111.8	E126 N132 D133 W134	E126-S130 WeakPolarHBondContact O-CB 3.48Å; E126-S130 PolarHBondContact O-N 3.47Å; S130-N132 PolarHBondContact O-N 3.21Å; S130-D133 PolarHBondContact O-N 3.42Å; S130-W134 PolarHBondContact O-N 3.35Å
131	L	76	Confident	76	Confident	16 Å²	16	42 Å²	42	8%	0.084	22%	0.22	C	C	.	.	H	α-helix	trans	-56.8	-48.5	171.8	-84.9	172.6	0	0	0	112.4	F104 L127 L128 N129 D133 W134 L135 F201	F104-L131 HydrophobicContact CD1-CD2 3.67Å; F104-L131 HydrophobicContact CD1-CG 4.25Å; F104-L131 HydrophobicContact CD2-CD2 4.15Å; F104-L131 HydrophobicContact CD2-CG 4.22Å; F104-L131 HydrophobicContact CE1-CD1 3.59Å; F104-L131 HydrophobicContact CE1-CD2 3.59Å; F104-L131 HydrophobicContact CE1-CG 3.73Å; F104-L131 HydrophobicContact CE2-CD1 4.09Å; F104-L131 HydrophobicContact CE2-CD2 4.06Å; F104-L131 HydrophobicContact CE2-CG 3.67Å; F104-L131 HydrophobicContact CG-CD2 3.97Å; F104-L131 HydrophobicContact CG-CG 4.49Å; F104-L131 HydrophobicContact CZ-CD1 3.34Å; F104-L131 HydrophobicContact CZ-CD2 3.8Å; F104-L131 HydrophobicContact CZ-CG 3.42Å; F104-L131 VanDerWaalsContact CZ-CG 3.42Å; L127-L131 PolarHBondContact O-N 2.69Å; L127-L131 VanDerWaalsContact O-N 3.16Å; L128-L131 HydrophobicContact CD2-CD1 4.42Å; L128-L131 WeakPolarHBondContact O-CB 3.38Å; L128-L131 PolarHBondContact O-N 3.33Å; N129-L131 VanDerWaalsContact C-N 3.35Å; N129-L131 PolarHBondContact O-N 3.35Å; L131-D133 VanDerWaalsContact C-N 3.28Å; L131-D133 PolarHBondContact O-N 3.05Å; L131-W134 PolarHBondContact O-N 3.27Å; L131-W134 VanDerWaalsContact O-N 3.16Å; L131-L135 WeakPolarHBondContact O-CG 3.37Å; L131-L135 PolarHBondContact O-N 2.75Å; L131-F201 HydrophobicContact CB-CD2 3.77Å; L131-F201 HydrophobicContact CB-CE2 3.99Å; L131-F201 HydrophobicContact CD1-CD2 3.9Å; L131-F201 HydrophobicContact CD1-CE1 4.33Å; L131-F201 HydrophobicContact CD1-CE2 3.69Å; L131-F201 HydrophobicContact CD1-CG 4.32Å; L131-F201 HydrophobicContact CD1-CZ 3.91Å; L131-F201 HydrophobicContact CD2-CD2 4.49Å; L131-F201 HydrophobicContact CD2-CE2 3.84Å; L131-F201 HydrophobicContact CD2-CZ 4.42Å; L131-F201 HydrophobicContact CG-CD2 4.28Å; L131-F201 HydrophobicContact CG-CE2 4.06Å
132	N	82.7	Confident	76.9	Confident	6 Å²	6	39.6 Å²	39.6	3%	0.032	20%	0.204	C	C	.	.	H	α-helix	trans	-60.1	-35.6	-178.7	-87.9	-73.7	0	0	0	113.3	L128 N129 S130 E136 A197 S200 F201 K204	L128-N132 WeakPolarHBondContact O-CB 3.34Å; L128-N132 PolarHBondContact O-N 2.99Å; L128-N132 PolarHBondContact O-ND2 2.68Å; N129-N132 WeakPolarHBondContact O-CB 3.17Å; N129-N132 PolarHBondContact O-N 2.87Å; N129-N132 VanDerWaalsContact O-N 3.12Å; S130-N132 PolarHBondContact O-N 3.21Å; N132-E136 PolarHBondContact O-N 3.42Å; N132-A197 PolarHBondContact ND2-O 2.86Å; N132-S200 WeakPolarHBondContact OD1-CB 3.37Å; N132-S200 PolarHBondContact OD1-O 3.31Å; N132-S200 VanDerWaalsContact OD1-O 3.11Å; N132-S200 PolarHBondContact OD1-OG 3.22Å; N132-F201 WeakPolarHBondContact OD1-CA 3.42Å; N132-F201 PolarHBondContact OD1-N 3.36Å; N132-F201 VanDerWaalsContact OD1-N 3.09Å; N132-K204 HydrophobicContact CB-CD 4.28Å; N132-K204 VanDerWaalsContact O-CD 3.25Å; N132-K204 WeakPolarHBondContact O-CD 3.32Å; N132-K204 PolarHBondContact O-NZ 3.42Å; N132-K204 WeakPolarHBondContact OD1-CD 3.46Å; N132-K204 WeakPolarHBondContact OD1-CE 3.43Å
133	D	79.2	Confident	77.7	Confident	95 Å²	95	38.2 Å²	38.2	51%	0.508	19%	0.189	S	C	.	.	H	α-helix	trans	-69.2	-44.4	174.3	-77.6	-6.5	0	0	0	111.3	N129 S130 L131 L135 E136 Y137	N129-D133 PolarHBondContact O-N 3.29Å; S130-D133 PolarHBondContact O-N 3.42Å; L131-D133 VanDerWaalsContact C-N 3.28Å; L131-D133 PolarHBondContact O-N 3.05Å; D133-L135 VanDerWaalsContact C-N 3.32Å; D133-L135 PolarHBondContact O-N 3.1Å; D133-E136 WeakPolarHBondContact O-CB 3.43Å; D133-E136 PolarHBondContact O-N 3.14Å; D133-E136 VanDerWaalsContact O-N 3.13Å; D133-Y137 WeakPolarHBondContact O-CD2 3.41Å; D133-Y137 PolarHBondContact O-N 2.96Å; D133-Y137 VanDerWaalsContact O-N 3.1Å
134	W	79	Confident	78.1	Confident	51 Å²	51	34.5 Å²	34.5	19%	0.193	17%	0.17	C	C	.	.	H	α-helix	trans	-66.4	-31.2	180	-73.2	113.4	0	0	0	113.7	V92 T96 I97 Q100 I101 S130 L131 Y137 A138	V92-W134 HydrophobicContact CG1-CZ3 4.18Å; T96-W134 HydrophobicContact CG2-CH2 4.17Å; T96-W134 HydrophobicContact CG2-CZ3 4.42Å; I97-W134 HydrophobicContact CB-CE3 4.46Å; I97-W134 HydrophobicContact CG1-CE3 4.23Å; I97-W134 HydrophobicContact CG1-CZ3 4.15Å; Q100-W134 HydrophobicContact CB-CD2 3.88Å; Q100-W134 HydrophobicContact CB-CE3 4.24Å; Q100-W134 HydrophobicContact CB-CG 4.4Å; Q100-W134 HydrophobicContact CB-CH2 4.38Å; Q100-W134 HydrophobicContact CB-CZ2 4.01Å; Q100-W134 HydrophobicContact CB-CZ3 4.46Å; Q100-W134 HydrophobicContact CG-CD2 4.37Å; Q100-W134 HydrophobicContact CG-CH2 3.83Å; Q100-W134 HydrophobicContact CG-CZ2 3.59Å; Q100-W134 HydrophobicContact CG-CZ3 4.29Å; I101-W134 HydrophobicContact CG1-CB 4.26Å; S130-W134 PolarHBondContact O-N 3.35Å; L131-W134 PolarHBondContact O-N 3.27Å; L131-W134 VanDerWaalsContact O-N 3.16Å; W134-Y137 HydrophobicContact CE3-CD2 4.24Å; W134-Y137 HydrophobicContact CZ3-CD2 4.38Å; W134-A138 WeakPolarHBondContact O-CB 3.3Å; W134-A138 PolarHBondContact O-N 3.22Å
135	L	81.8	Confident	78.4	Confident	5 Å²	5	38.2 Å²	38.2	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-68.4	-36.7	171	-63.9	-177.9	0	0	0	112.3	L131 D133 A138 S139 F201 K204 W205 L208	L131-L135 WeakPolarHBondContact O-CG 3.37Å; L131-L135 PolarHBondContact O-N 2.75Å; D133-L135 VanDerWaalsContact C-N 3.32Å; D133-L135 PolarHBondContact O-N 3.1Å; L135-A138 WeakPolarHBondContact O-CB 3.31Å; L135-A138 PolarHBondContact O-N 3.04Å; L135-S139 PolarHBondContact O-N 2.92Å; L135-S139 PolarHBondContact O-OG 3.38Å; L135-F201 HydrophobicContact CD1-CD2 3.51Å; L135-F201 HydrophobicContact CD1-CE2 3.7Å; L135-F201 HydrophobicContact CG-CE2 4.49Å; L135-K204 HydrophobicContact CB-CB 3.88Å; L135-K204 HydrophobicContact CB-CD 4.28Å; L135-K204 HydrophobicContact CD1-CB 3.73Å; L135-K204 HydrophobicContact CG-CB 4.49Å; L135-W205 HydrophobicContact CD1-CB 4.07Å; L135-W205 HydrophobicContact CD2-CE3 3.76Å; L135-W205 HydrophobicContact CD2-CZ3 4.27Å; L135-L208 HydrophobicContact CD2-CD2 3.79Å
136	E	81.2	Confident	78.5	Confident	64 Å²	64	36.6 Å²	36.6	30%	0.299	18%	0.179	S	C	.	.	H	α-helix	trans	-63	-44.8	175.2	-153.2	69	-113.1	0	0	111.5	P83 N132 D133 A138 S139 C140 K204	P83-E136 HydrophobicContact CG-CG 4.33Å; N132-E136 PolarHBondContact O-N 3.42Å; D133-E136 WeakPolarHBondContact O-CB 3.43Å; D133-E136 PolarHBondContact O-N 3.14Å; D133-E136 VanDerWaalsContact O-N 3.13Å; E136-A138 VanDerWaalsContact C-N 3.3Å; E136-A138 PolarHBondContact O-N 3.2Å; E136-S139 PolarHBondContact O-N 3.3Å; E136-C140 WeakPolarHBondContact O-CB 3.5Å; E136-C140 PolarHBondContact O-N 3.28Å; E136-C140 PolarHBondContact O-SG 3.33Å; E136-K204 WeakPolarHBondContact OE2-CE 3.29Å; E136-K204 IonicContact OE2-NZ 2.63Å; E136-K204 PolarHBondContact OE2-NZ 3.45Å
137	Y	81.1	Confident	78.4	Confident	39 Å²	39	32.1 Å²	32.1	15%	0.153	16%	0.162	C	C	.	.	H	α-helix	trans	-64.2	-33.5	173.8	-70.3	-67.5	0	0	0	112.4	R86 I87 V92 I97 D133 W134 F141	R86-Y137 HydrophobicContact CB-CE1 4.28Å; R86-Y137 PolarHBondContact NH1-OH 3.05Å; I87-Y137 HydrophobicContact CG1-CD1 4.46Å; V92-Y137 HydrophobicContact CB-CD1 4.23Å; V92-Y137 HydrophobicContact CG1-CD1 4.02Å; V92-Y137 HydrophobicContact CG1-CG 4.15Å; V92-Y137 HydrophobicContact CG2-CD1 4.06Å; V92-Y137 HydrophobicContact CG2-CE1 3.93Å; I97-Y137 WeakPolarHBondContact CD1-O 3.2Å; D133-Y137 WeakPolarHBondContact O-CD2 3.41Å; D133-Y137 PolarHBondContact O-N 2.96Å; D133-Y137 VanDerWaalsContact O-N 3.1Å; W134-Y137 HydrophobicContact CE3-CD2 4.24Å; W134-Y137 HydrophobicContact CZ3-CD2 4.38Å; Y137-F141 VanDerWaalsContact O-CB 3.23Å; Y137-F141 WeakPolarHBondContact O-CB 3.38Å; Y137-F141 PolarHBondContact O-N 3.25Å
138	A	79.8	Confident	78.2	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66	-50.4	175.7	0	0	0	0	0	111.9	I97 W134 L135 E136 F141 I142 F167 L208	I97-A138 HydrophobicContact CG2-CB 4.19Å; W134-A138 WeakPolarHBondContact O-CB 3.3Å; W134-A138 PolarHBondContact O-N 3.22Å; L135-A138 WeakPolarHBondContact O-CB 3.31Å; L135-A138 PolarHBondContact O-N 3.04Å; E136-A138 VanDerWaalsContact C-N 3.3Å; E136-A138 PolarHBondContact O-N 3.2Å; A138-F141 WeakPolarHBondContact O-CB 3.44Å; A138-F141 PolarHBondContact O-N 3.33Å; A138-I142 PolarHBondContact O-N 3.44Å; A138-I142 VanDerWaalsContact O-N 3.14Å; A138-F167 HydrophobicContact CB-CE1 4.12Å; A138-F167 HydrophobicContact CB-CZ 3.77Å; A138-L208 HydrophobicContact CB-CD1 3.8Å; A138-L208 HydrophobicContact CB-CD2 3.95Å
139	S	82.9	Confident	77.4	Confident	6 Å²	6	34.6 Å²	34.6	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-48.1	179.2	-61.2	0	0	0	0	111.4	L135 E136 F141 I142 R143 L211	L135-S139 PolarHBondContact O-N 2.92Å; L135-S139 PolarHBondContact O-OG 3.38Å; E136-S139 PolarHBondContact O-N 3.3Å; S139-F141 VanDerWaalsContact C-N 3.27Å; S139-F141 PolarHBondContact O-N 3.21Å; S139-I142 PolarHBondContact O-N 3.32Å; S139-R143 PolarHBondContact O-N 3.27Å; S139-L211 VanDerWaalsContact O-CD2 3.23Å; S139-L211 WeakPolarHBondContact O-CD2 3.48Å
140	C	81.3	Confident	76.2	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.007	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-33.8	175.5	-75.1	0	0	0	0	113.1	D82 P83 I87 E136 C144	D82-C140 PolarHBondContact OD1-SG 3.48Å; D82-C140 PolarHBondContact OD2-SG 3.44Å; D82-C140 VanDerWaalsContact OD2-SG 3.38Å; P83-C140 HydrophobicContact CB-CB 4.45Å; I87-C140 HydrophobicContact CD1-CB 3.59Å; E136-C140 WeakPolarHBondContact O-CB 3.5Å; E136-C140 PolarHBondContact O-N 3.28Å; E136-C140 PolarHBondContact O-SG 3.33Å; C140-C144 VanDerWaalsContact O-CB 3.32Å; C140-C144 WeakPolarHBondContact O-CB 3.4Å; C140-C144 PolarHBondContact O-N 2.98Å; C140-C144 PolarHBondContact O-SG 2.74Å
141	F	81.8	Confident	75.1	Confident	15 Å²	15	38.1 Å²	38.1	7%	0.066	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-41.4	177	-171.2	-81.3	0	0	0	111.9	I87 W94 I97 Y137 A138 S139 C144 Q145 K163	I87-F141 HydrophobicContact CD1-CB 4.03Å; I87-F141 HydrophobicContact CG2-CD2 3.68Å; I87-F141 HydrophobicContact CG2-CE2 4.15Å; W94-F141 HydrophobicContact CB-CD1 4.49Å; W94-F141 HydrophobicContact CB-CD2 4.41Å; W94-F141 HydrophobicContact CB-CE1 3.96Å; W94-F141 HydrophobicContact CB-CE2 3.85Å; W94-F141 HydrophobicContact CB-CZ 3.62Å; W94-F141 HydrophobicContact CD2-CE1 4.47Å; W94-F141 AromaticContact CE3-CD1 3.79Å; W94-F141 HydrophobicContact CE3-CD1 3.79Å; W94-F141 HydrophobicContact CE3-CE1 4.15Å; W94-F141 HydrophobicContact CE3-CG 4.24Å; W94-F141 HydrophobicContact CG-CE1 4.42Å; W94-F141 HydrophobicContact CZ3-CD1 4.5Å; I97-F141 HydrophobicContact CD1-CB 3.93Å; I97-F141 HydrophobicContact CD1-CD2 4.12Å; I97-F141 HydrophobicContact CD1-CG 4.2Å; Y137-F141 VanDerWaalsContact O-CB 3.23Å; Y137-F141 WeakPolarHBondContact O-CB 3.38Å; Y137-F141 PolarHBondContact O-N 3.25Å; A138-F141 WeakPolarHBondContact O-CB 3.44Å; A138-F141 PolarHBondContact O-N 3.33Å; S139-F141 VanDerWaalsContact C-N 3.27Å; S139-F141 PolarHBondContact O-N 3.21Å; F141-C144 WeakPolarHBondContact O-CB 3.26Å; F141-Q145 HydrophobicContact CE1-CB 4.24Å; F141-Q145 HydrophobicContact CE1-CG 3.77Å; F141-Q145 HydrophobicContact CE2-CG 4.46Å; F141-Q145 VanDerWaalsContact CZ-CD 3.46Å; F141-Q145 HydrophobicContact CZ-CG 3.73Å; F141-Q145 PolarHBondContact O-N 3.09Å; F141-Q145 VanDerWaalsContact O-N 3.08Å; F141-K163 HydrophobicContact CE1-CD 4.19Å
142	I	81	Confident	74.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.4	-45.7	177.9	-70.7	152.7	0	0	0	110.6	A138 S139 C144 Q145 Y146 L160 F167 L208 L211 T212	A138-I142 PolarHBondContact O-N 3.44Å; A138-I142 VanDerWaalsContact O-N 3.14Å; S139-I142 PolarHBondContact O-N 3.32Å; I142-C144 PolarHBondContact O-N 2.9Å; I142-Q145 PolarHBondContact O-N 3.07Å; I142-Y146 PolarHBondContact O-N 3.48Å; I142-L160 HydrophobicContact CG2-CD1 4.49Å; I142-F167 HydrophobicContact CD1-CD2 4.39Å; I142-F167 HydrophobicContact CD1-CE2 3.67Å; I142-F167 HydrophobicContact CD1-CZ 4.41Å; I142-L208 HydrophobicContact CD1-CD1 3.5Å; I142-L208 VanDerWaalsContact CD1-CD1 3.5Å; I142-L211 HydrophobicContact CB-CD2 4.22Å; I142-L211 HydrophobicContact CG2-CD2 4.21Å; I142-L211 HydrophobicContact CG2-CG 3.99Å; I142-T212 HydrophobicContact CD1-CG2 3.39Å; I142-T212 HydrophobicContact CG1-CG2 4.26Å; I142-T212 HydrophobicContact CG2-CG2 4.4Å
143	R	80.1	Confident	73.4	Confident	47 Å²	47	44.9 Å²	44.9	18%	0.177	23%	0.228	C	C	.	.	I	π-helix	trans	-58.8	-47.7	176.8	-138.2	176.6	75.6	-120.9	-22.1	111	S80 L81 D82 S139 Q145 V147 E148 L211	S80-R143 PolarHBondContact OG-NE 3.33Å; L81-R143 PolarHBondContact O-NH2 3.33Å; L81-R143 VanDerWaalsContact O-NH2 3.07Å; D82-R143 IonicContact OD1-NH1 2.65Å; D82-R143 IonicContact OD2-CZ 2.56Å; D82-R143 IonicContact OD2-NH1 2.9Å; D82-R143 PolarHBondContact OD2-NH1 3.38Å; D82-R143 IonicContact OD2-NH2 3.67Å; D82-R143 PolarHBondContact OD2-NH2 3.2Å; S139-R143 PolarHBondContact O-N 3.27Å; R143-Q145 PolarHBondContact O-N 2.99Å; R143-V147 HydrophobicContact CG-CB 4.03Å; R143-V147 HydrophobicContact CG-CG1 4.39Å; R143-V147 HydrophobicContact CG-CG2 4.27Å; R143-V147 PolarHBondContact O-N 3.43Å; R143-E148 HydrophobicContact CG-CG 4.42Å; R143-E148 IonicContact CZ-OE1 2.71Å; R143-E148 IonicContact NE-OE1 3.88Å; R143-E148 PolarHBondContact NE-OE1 3.15Å; R143-E148 IonicContact NH2-OE1 2.78Å; R143-E148 PolarHBondContact NH2-OE1 3.24Å; R143-E148 WeakPolarHBondContact O-CB 3.37Å; R143-E148 VanDerWaalsContact O-CG 3.27Å; R143-E148 WeakPolarHBondContact O-CG 3.42Å; R143-E148 PolarHBondContact O-N 3.41Å; R143-L211 HydrophobicContact CB-CD2 4.33Å; R143-L211 HydrophobicContact CG-CD1 4.18Å
144	C	75.2	Confident	72.8	Confident	11 Å²	11	47.9 Å²	47.9	7%	0.074	24%	0.237	C	C	.	.	I	π-helix	trans	-49	-61.3	172	-79.4	0	0	0	0	113.2	L84 C140 F141 I142 T149	L84-C144 HydrophobicContact CD1-CB 4.4Å; L84-C144 WeakPolarHBondContact CD1-SG 3.37Å; L84-C144 WeakPolarHBondContact CG-SG 3.41Å; C140-C144 VanDerWaalsContact O-CB 3.32Å; C140-C144 WeakPolarHBondContact O-CB 3.4Å; C140-C144 PolarHBondContact O-N 2.98Å; C140-C144 PolarHBondContact O-SG 2.74Å; F141-C144 WeakPolarHBondContact O-CB 3.26Å; I142-C144 PolarHBondContact O-N 2.9Å; C144-T149 WeakPolarHBondContact O-CG2 3.49Å; C144-T149 PolarHBondContact O-N 3.48Å; C144-T149 PolarHBondContact O-OG1 3.13Å
145	Q	74.9	Confident	72.4	Confident	85 Å²	85	49.3 Å²	49.3	40%	0.397	25%	0.248	S	C	.	.	I	π-helix	trans	-84.1	-17.9	-164	-83.1	-140.8	-58.7	0	0	115.1	F141 I142 R143 T149	F141-Q145 HydrophobicContact CE1-CB 4.24Å; F141-Q145 HydrophobicContact CE1-CG 3.77Å; F141-Q145 HydrophobicContact CE2-CG 4.46Å; F141-Q145 VanDerWaalsContact CZ-CD 3.46Å; F141-Q145 HydrophobicContact CZ-CG 3.73Å; F141-Q145 PolarHBondContact O-N 3.09Å; F141-Q145 VanDerWaalsContact O-N 3.08Å; I142-Q145 PolarHBondContact O-N 3.07Å; R143-Q145 PolarHBondContact O-N 2.99Å; Q145-T149 VanDerWaalsContact C-OG1 3.32Å; Q145-T149 PolarHBondContact O-OG1 3.31Å; Q145-T149 VanDerWaalsContact O-OG1 3.04Å
146	Y	75.9	Confident	71.7	Confident	20 Å²	20	49.8 Å²	49.8	8%	0.078	25%	0.253	C	S	.	.	I	π-helix	trans	-132.1	-21.8	-168.1	-58.9	-72.3	0	0	0	114.8	I142 A156 K159 L160 K163 L219	I142-Y146 PolarHBondContact O-N 3.48Å; Y146-A156 HydrophobicContact CD1-CB 4.26Å; Y146-A156 HydrophobicContact CE1-CB 4.33Å; Y146-A156 VanDerWaalsContact CE1-O 3.28Å; Y146-A156 WeakPolarHBondContact CE1-O 3.48Å; Y146-K159 HydrophobicContact CE1-CB 4.27Å; Y146-K159 WeakPolarHBondContact OH-CB 3.33Å; Y146-K159 PolarHBondContact OH-O 3.01Å; Y146-L160 HydrophobicContact CD1-CB 3.65Å; Y146-L160 HydrophobicContact CD1-CD1 4.29Å; Y146-L160 HydrophobicContact CD1-CD2 4.4Å; Y146-L160 HydrophobicContact CD1-CG 4.32Å; Y146-L160 HydrophobicContact CD2-CD1 3.82Å; Y146-L160 HydrophobicContact CE1-CB 3.73Å; Y146-L160 HydrophobicContact CE2-CD1 4.28Å; Y146-L160 HydrophobicContact CG-CB 4.09Å; Y146-L160 HydrophobicContact CG-CD1 3.83Å; Y146-L160 HydrophobicContact CG-CD2 4.32Å; Y146-L160 HydrophobicContact CG-CG 4.29Å; Y146-K163 HydrophobicContact CE2-CD 3.59Å; Y146-K163 WeakPolarHBondContact OH-CE 3.26Å; Y146-L219 HydrophobicContact CD1-CD1 4.26Å
147	V	71.2	Confident	71.4	Confident	52 Å²	52	48.2 Å²	48.2	32%	0.315	25%	0.246	S	C	.	.	I	π-helix	trans	-104.2	-39.2	176.7	-171.8	0	0	0	0	110.7	T79 R143 L211 A215	T79-V147 WeakPolarHBondContact CA-O 3.29Å; R143-V147 HydrophobicContact CG-CB 4.03Å; R143-V147 HydrophobicContact CG-CG1 4.39Å; R143-V147 HydrophobicContact CG-CG2 4.27Å; R143-V147 PolarHBondContact O-N 3.43Å; V147-L211 HydrophobicContact CG2-CD1 4.35Å; V147-A215 HydrophobicContact CG2-CB 3.98Å
148	E	66.7	Low	71.4	Confident	26 Å²	26	50.4 Å²	50.4	12%	0.121	26%	0.263	C	S	.	.	I	π-helix	trans	-93	-37.7	-171.8	-65.7	178.6	-167.7	0	0	114.5	S80 L81 L84 R143	S80-E148 VanDerWaalsContact CA-CG 3.5Å; S80-E148 WeakPolarHBondContact O-CG 3.43Å; L81-E148 WeakPolarHBondContact CA-OE1 3.45Å; L81-E148 VanDerWaalsContact N-CD 3.32Å; L81-E148 PolarHBondContact N-OE1 3.11Å; L84-E148 WeakPolarHBondContact CD1-OE2 3.46Å; L84-E148 WeakPolarHBondContact CD2-OE2 3.48Å; R143-E148 HydrophobicContact CG-CG 4.42Å; R143-E148 IonicContact CZ-OE1 2.71Å; R143-E148 IonicContact NE-OE1 3.88Å; R143-E148 PolarHBondContact NE-OE1 3.15Å; R143-E148 IonicContact NH2-OE1 2.78Å; R143-E148 PolarHBondContact NH2-OE1 3.24Å; R143-E148 WeakPolarHBondContact O-CB 3.37Å; R143-E148 VanDerWaalsContact O-CG 3.27Å; R143-E148 WeakPolarHBondContact O-CG 3.42Å; R143-E148 PolarHBondContact O-N 3.41Å
149	T	57.4	Low	71.4	Confident	79 Å²	79	54.5 Å²	54.5	49%	0.485	28%	0.281	S	S	.	.			trans	-84.9	118.8	-175.2	47.3	0	0	0	0	113.7	C144 Q145 A151	C144-T149 WeakPolarHBondContact O-CG2 3.49Å; C144-T149 PolarHBondContact O-N 3.48Å; C144-T149 PolarHBondContact O-OG1 3.13Å; Q145-T149 VanDerWaalsContact C-OG1 3.32Å; Q145-T149 PolarHBondContact O-OG1 3.31Å; Q145-T149 VanDerWaalsContact O-OG1 3.04Å; T149-A151 PolarHBondContact O-N 2.64Å
150	K	54.7	Low	71.3	Confident	135 Å²	135	54.2 Å²	54.2	59%	0.587	28%	0.279	S	S	*	.			trans	-70.2	52.1	171.3	-57.4	-169.1	179.6	-168.7	0	113.7	E78 T79	E78-K150 VanDerWaalsContact CD-CE 3.41Å; E78-K150 WeakPolarHBondContact OE1-CE 3.23Å; E78-K150 IonicContact OE1-NZ 2.91Å; E78-K150 PolarHBondContact OE1-NZ 3.39Å; E78-K150 WeakPolarHBondContact OE2-CE 3.48Å; E78-K150 IonicContact OE2-NZ 3.86Å; E78-K150 PolarHBondContact OE2-NZ 3.44Å; T79-K150 HydrophobicContact CG2-CD 4.4Å; T79-K150 HydrophobicContact CG2-CG 3.88Å
151	A	54.1	Low	71.3	Confident	48 Å²	48	57.7 Å²	57.7	40%	0.397	30%	0.298	S	S	.	.			trans	-110.8	170.3	-173.4	0	0	0	0	0	111.4	T149 R153	T149-A151 PolarHBondContact O-N 2.64Å; A151-R153 PolarHBondContact O-N 3.02Å
152	P	56.9	Low	71.4	Confident	92 Å²	92	63.1 Å²	63.1	60%	0.597	32%	0.324	S	S	*	.			trans	-62.7	109.6	-154.8	23	-33.3	0	0	0	113.9	K154 D155 A156	P152-K154 PolarHBondContact O-N 2.8Å; P152-D155 PolarHBondContact O-N 3.36Å; P152-A156 WeakPolarHBondContact O-CB 3.28Å; P152-A156 PolarHBondContact O-N 3.42Å
153	R	64.2	Low	71.4	Confident	72 Å²	72	63.9 Å²	63.9	27%	0.272	33%	0.327	S	S	.	.	H	α-helix	trans	-66.3	-36.6	-159.4	-65.1	175.8	173.6	115.1	-21.2	114.8	G77 A151 A156 L157 L219 Y222 L223	G77-R153 PolarHBondContact O-NH2 3.33Å; G77-R153 VanDerWaalsContact O-NH2 3.12Å; A151-R153 PolarHBondContact O-N 3.02Å; R153-A156 PolarHBondContact O-N 3.39Å; R153-L157 PolarHBondContact O-N 3.39Å; R153-L219 HydrophobicContact CB-CD2 3.94Å; R153-L219 HydrophobicContact CG-CD2 3.99Å; R153-Y222 VanDerWaalsContact CD-CG 3.44Å; R153-Y222 VanDerWaalsContact CZ-CE1 3.42Å; R153-Y222 PolarHBondContact NH1-OH 3.39Å; R153-Y222 VanDerWaalsContact NH1-OH 3.12Å; R153-Y222 VanDerWaalsContact NH2-CZ 3.31Å; R153-L223 HydrophobicContact CB-CD2 4.41Å
154	K	66.7	Low	71.4	Confident	157 Å²	157	62.1 Å²	62.1	68%	0.683	32%	0.321	S	S	*	.	H	α-helix	trans	-65.9	-42	177.8	-157	170.5	-170.8	169.8	0	111.7	P152 L223	P152-K154 PolarHBondContact O-N 2.8Å; K154-L223 HydrophobicContact CB-CD1 4.47Å; K154-L223 HydrophobicContact CB-CD2 3.88Å; K154-L223 HydrophobicContact CG-CD1 4.39Å; K154-L223 HydrophobicContact CG-CD2 4.24Å
155	D	70.7	Confident	71.8	Confident	81 Å²	81	64.5 Å²	64.5	43%	0.433	34%	0.342	S	S	.	.	H	α-helix	trans	-76.7	-29.9	179	-156.9	42.5	0	0	0	111.4	P152 K159	P152-D155 PolarHBondContact O-N 3.36Å; D155-K159 VanDerWaalsContact CG-NZ 3.32Å; D155-K159 VanDerWaalsContact O-CD 3.31Å; D155-K159 WeakPolarHBondContact O-CD 3.43Å; D155-K159 VanDerWaalsContact O-CG 3.3Å; D155-K159 WeakPolarHBondContact O-CG 3.39Å; D155-K159 PolarHBondContact O-N 3.13Å; D155-K159 IonicContact OD1-NZ 2.76Å; D155-K159 WeakPolarHBondContact OD2-CE 3.28Å; D155-K159 IonicContact OD2-NZ 3.76Å; D155-K159 PolarHBondContact OD2-NZ 3.44Å
156	A	68.1	Low	72.2	Confident	15 Å²	15	62 Å²	62	12%	0.124	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-43.7	170.7	0	0	0	0	0	112.5	Y146 P152 R153 V158 K159 L160 L219	Y146-A156 HydrophobicContact CD1-CB 4.26Å; Y146-A156 HydrophobicContact CE1-CB 4.33Å; Y146-A156 VanDerWaalsContact CE1-O 3.28Å; Y146-A156 WeakPolarHBondContact CE1-O 3.48Å; P152-A156 WeakPolarHBondContact O-CB 3.28Å; P152-A156 PolarHBondContact O-N 3.42Å; R153-A156 PolarHBondContact O-N 3.39Å; A156-V158 VanDerWaalsContact C-N 3.31Å; A156-V158 PolarHBondContact O-N 3.03Å; A156-K159 CarbonylContact O-C 3.54Å; A156-K159 PolarHBondContact O-N 2.74Å; A156-K159 VanDerWaalsContact O-N 3.16Å; A156-L160 WeakPolarHBondContact O-CB 3.39Å; A156-L160 PolarHBondContact O-N 3.09Å; A156-L219 HydrophobicContact CB-CD1 4.27Å; A156-L219 HydrophobicContact CB-CD2 4.45Å
157	L	74.7	Confident	72.3	Confident	31 Å²	31	61.1 Å²	61.1	16%	0.162	33%	0.326	C	S	.	.	H	α-helix	trans	-57.9	-42.1	178.2	-176.3	69.7	0	0	0	111.9	R153 L160 N161 V216 L219 L223	R153-L157 PolarHBondContact O-N 3.39Å; L157-L160 PolarHBondContact O-N 2.97Å; L157-N161 PolarHBondContact O-N 3.12Å; L157-N161 VanDerWaalsContact O-N 3.14Å; L157-N161 PolarHBondContact O-ND2 3.22Å; L157-V216 HydrophobicContact CD1-CG1 4.21Å; L157-L219 HydrophobicContact CB-CB 4.44Å; L157-L219 HydrophobicContact CD1-CB 3.87Å; L157-L223 HydrophobicContact CD2-CD1 3.79Å
158	V	80.3	Confident	72.7	Confident	85 Å²	85	63 Å²	63	52%	0.515	33%	0.33	S	S	.	.	H	α-helix	trans	-60.6	-51.4	174.7	176.5	0	0	0	0	110.6	A156 L160 N161 E162	A156-V158 VanDerWaalsContact C-N 3.31Å; A156-V158 PolarHBondContact O-N 3.03Å; V158-L160 VanDerWaalsContact C-N 3.29Å; V158-L160 PolarHBondContact O-N 3.15Å; V158-N161 PolarHBondContact O-N 3.03Å; V158-E162 PolarHBondContact O-N 3.11Å
159	K	80.2	Confident	73.4	Confident	86 Å²	86	67.1 Å²	67.1	37%	0.374	35%	0.349	S	S	.	.	H	α-helix	trans	-69.4	-23.4	-177.2	-66.4	165.1	-170.8	172.7	0	113.6	Y146 D155 A156 K163	Y146-K159 HydrophobicContact CE1-CB 4.27Å; Y146-K159 WeakPolarHBondContact OH-CB 3.33Å; Y146-K159 PolarHBondContact OH-O 3.01Å; D155-K159 VanDerWaalsContact CG-NZ 3.32Å; D155-K159 VanDerWaalsContact O-CD 3.31Å; D155-K159 WeakPolarHBondContact O-CD 3.43Å; D155-K159 VanDerWaalsContact O-CG 3.3Å; D155-K159 WeakPolarHBondContact O-CG 3.39Å; D155-K159 PolarHBondContact O-N 3.13Å; D155-K159 IonicContact OD1-NZ 2.76Å; D155-K159 WeakPolarHBondContact OD2-CE 3.28Å; D155-K159 IonicContact OD2-NZ 3.76Å; D155-K159 PolarHBondContact OD2-NZ 3.44Å; A156-K159 CarbonylContact O-C 3.54Å; A156-K159 PolarHBondContact O-N 2.74Å; A156-K159 VanDerWaalsContact O-N 3.16Å; K159-K163 WeakPolarHBondContact O-CG 3.42Å
160	L	80.3	Confident	74.5	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-70.7	-50.9	170.5	178	54.8	0	0	0	110.1	I142 Y146 A156 L157 V158 E162 K163 V164 A215 V216 L219	I142-L160 HydrophobicContact CG2-CD1 4.49Å; Y146-L160 HydrophobicContact CD1-CB 3.65Å; Y146-L160 HydrophobicContact CD1-CD1 4.29Å; Y146-L160 HydrophobicContact CD1-CD2 4.4Å; Y146-L160 HydrophobicContact CD1-CG 4.32Å; Y146-L160 HydrophobicContact CD2-CD1 3.82Å; Y146-L160 HydrophobicContact CE1-CB 3.73Å; Y146-L160 HydrophobicContact CE2-CD1 4.28Å; Y146-L160 HydrophobicContact CG-CB 4.09Å; Y146-L160 HydrophobicContact CG-CD1 3.83Å; Y146-L160 HydrophobicContact CG-CD2 4.32Å; Y146-L160 HydrophobicContact CG-CG 4.29Å; A156-L160 WeakPolarHBondContact O-CB 3.39Å; A156-L160 PolarHBondContact O-N 3.09Å; L157-L160 PolarHBondContact O-N 2.97Å; V158-L160 VanDerWaalsContact C-N 3.29Å; V158-L160 PolarHBondContact O-N 3.15Å; L160-E162 VanDerWaalsContact C-N 3.26Å; L160-E162 PolarHBondContact O-N 3.26Å; L160-K163 WeakPolarHBondContact O-CA 3.09Å; L160-K163 WeakPolarHBondContact O-CB 3.32Å; L160-K163 PolarHBondContact O-N 3Å; L160-V164 HydrophobicContact CD1-CG2 4.11Å; L160-V164 HydrophobicContact CG-CG2 4.2Å; L160-V164 WeakPolarHBondContact O-CG2 3.2Å; L160-V164 PolarHBondContact O-N 3Å; L160-A215 HydrophobicContact CD2-CB 3.67Å; L160-V216 HydrophobicContact CD2-CB 4.34Å; L160-V216 HydrophobicContact CD2-CG2 3.54Å; L160-V216 HydrophobicContact CG-CG2 3.86Å; L160-L219 HydrophobicContact CD2-CD1 3.91Å
161	N	82.2	Confident	75.5	Confident	75 Å²	75	61 Å²	61	40%	0.401	32%	0.316	S	S	.	.	H	α-helix	trans	-57.9	-36.9	-179.6	-80.2	-63.5	0	0	0	112.7	L157 V158 K163 V164 A165	L157-N161 PolarHBondContact O-N 3.12Å; L157-N161 VanDerWaalsContact O-N 3.14Å; L157-N161 PolarHBondContact O-ND2 3.22Å; V158-N161 PolarHBondContact O-N 3.03Å; N161-K163 PolarHBondContact O-N 3.14Å; N161-V164 PolarHBondContact O-N 3.23Å; N161-A165 WeakPolarHBondContact O-CB 3.31Å; N161-A165 PolarHBondContact O-N 3.22Å
162	E	82.9	Confident	76.5	Confident	129 Å²	129	65.1 Å²	65.1	60%	0.603	33%	0.331	S	S	*	.	H	α-helix	trans	-55.6	-34.3	170.3	-69.5	179.3	165	0	0	113.4	V158 L160 F166	V158-E162 PolarHBondContact O-N 3.11Å; L160-E162 VanDerWaalsContact C-N 3.26Å; L160-E162 PolarHBondContact O-N 3.26Å; E162-F166 PolarHBondContact O-N 3.26Å
163	K	81.3	Confident	77.3	Confident	16 Å²	16	62.2 Å²	62.2	7%	0.07	32%	0.315	C	S	.	.	H	α-helix	trans	-85.7	-35.5	180	-61.3	172.9	-169.6	-68.5	0	112.4	W94 F141 Y146 K159 L160 N161 A165 F166 F167	W94-K163 VanDerWaalsContact CD1-NZ 3.3Å; W94-K163 HydrophobicContact CD2-CD 4.31Å; W94-K163 HydrophobicContact CD2-CG 4.31Å; W94-K163 VanDerWaalsContact CD2-NZ 3.33Å; W94-K163 HydrophobicContact CE3-CD 4.34Å; W94-K163 HydrophobicContact CH2-CB 3.89Å; W94-K163 HydrophobicContact CH2-CD 4.48Å; W94-K163 HydrophobicContact CH2-CG 4.02Å; W94-K163 HydrophobicContact CZ2-CB 3.91Å; W94-K163 HydrophobicContact CZ2-CD 4.44Å; W94-K163 HydrophobicContact CZ2-CG 3.7Å; W94-K163 HydrophobicContact CZ3-CD 4.43Å; W94-K163 HydrophobicContact CZ3-CG 4.44Å; F141-K163 HydrophobicContact CE1-CD 4.19Å; Y146-K163 HydrophobicContact CE2-CD 3.59Å; Y146-K163 WeakPolarHBondContact OH-CE 3.26Å; K159-K163 WeakPolarHBondContact O-CG 3.42Å; L160-K163 WeakPolarHBondContact O-CA 3.09Å; L160-K163 WeakPolarHBondContact O-CB 3.32Å; L160-K163 PolarHBondContact O-N 3Å; N161-K163 PolarHBondContact O-N 3.14Å; K163-A165 VanDerWaalsContact C-N 3.28Å; K163-A165 PolarHBondContact O-N 3.05Å; K163-F166 WeakPolarHBondContact O-CB 3.46Å; K163-F166 PolarHBondContact O-N 3.06Å; K163-F166 VanDerWaalsContact O-N 3.11Å; K163-F167 VanDerWaalsContact O-CD2 3.23Å; K163-F167 WeakPolarHBondContact O-CD2 3.43Å; K163-F167 PolarHBondContact O-N 3.17Å; K163-F167 VanDerWaalsContact O-N 3.14Å
164	V	81.6	Confident	77.8	Confident	9 Å²	9	59 Å²	59	6%	0.055	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-42.6	171.6	-174.6	0	0	0	0	109.9	L160 N161 F166 F167 K168 T212 V216	L160-V164 HydrophobicContact CD1-CG2 4.11Å; L160-V164 HydrophobicContact CG-CG2 4.2Å; L160-V164 WeakPolarHBondContact O-CG2 3.2Å; L160-V164 PolarHBondContact O-N 3Å; N161-V164 PolarHBondContact O-N 3.23Å; V164-F166 VanDerWaalsContact C-N 3.32Å; V164-F166 PolarHBondContact O-N 3.12Å; V164-F167 PolarHBondContact O-N 2.83Å; V164-K168 HydrophobicContact CG1-CD 3.91Å; V164-K168 HydrophobicContact CG1-CG 4.46Å; V164-K168 WeakPolarHBondContact O-CG 3.36Å; V164-K168 PolarHBondContact O-N 3.41Å; V164-T212 HydrophobicContact CG2-CG2 4.11Å; V164-V216 HydrophobicContact CG2-CG2 4.17Å
165	A	82.2	Confident	78.2	Confident	61 Å²	61	56.4 Å²	56.4	50%	0.504	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-39.7	172	0	0	0	0	0	112.7	N161 K163 F167 K168 Q169	N161-A165 WeakPolarHBondContact O-CB 3.31Å; N161-A165 PolarHBondContact O-N 3.22Å; K163-A165 VanDerWaalsContact C-N 3.28Å; K163-A165 PolarHBondContact O-N 3.05Å; A165-F167 VanDerWaalsContact C-N 3.32Å; A165-F167 PolarHBondContact O-N 2.94Å; A165-K168 PolarHBondContact O-N 3.1Å; A165-Q169 PolarHBondContact O-N 3.05Å
166	F	83.3	Confident	78.3	Confident	33 Å²	33	55.3 Å²	55.3	15%	0.145	29%	0.289	C	S	.	.	H	α-helix	trans	-62.9	-32.9	176.4	178.1	-87.8	0	0	0	113.5	W94 S98 I101 S102 E162 K163 V164 Q169 Y170	W94-F166 HydrophobicContact CH2-CB 4.43Å; W94-F166 AromaticContact CH2-CD1 3.65Å; W94-F166 HydrophobicContact CH2-CD1 3.65Å; W94-F166 HydrophobicContact CH2-CE1 4.3Å; W94-F166 HydrophobicContact CH2-CG 4.22Å; W94-F166 HydrophobicContact CZ2-CB 3.88Å; W94-F166 AromaticContact CZ2-CD1 3.55Å; W94-F166 HydrophobicContact CZ2-CD1 3.55Å; W94-F166 HydrophobicContact CZ2-CD2 4.46Å; W94-F166 HydrophobicContact CZ2-CE1 4.27Å; W94-F166 AromaticContact CZ2-CG 3.69Å; W94-F166 HydrophobicContact CZ2-CG 3.69Å; S98-F166 VanDerWaalsContact CA-CZ 3.46Å; I101-F166 HydrophobicContact CG2-CE1 4.39Å; S102-F166 WeakPolarHBondContact OG-CE2 3.27Å; E162-F166 PolarHBondContact O-N 3.26Å; K163-F166 WeakPolarHBondContact O-CB 3.46Å; K163-F166 PolarHBondContact O-N 3.06Å; K163-F166 VanDerWaalsContact O-N 3.11Å; V164-F166 VanDerWaalsContact C-N 3.32Å; V164-F166 PolarHBondContact O-N 3.12Å; F166-Q169 WeakPolarHBondContact O-CG 3.48Å; F166-Q169 PolarHBondContact O-NE2 3.29Å; F166-Y170 HydrophobicContact CE1-CD2 4.5Å; F166-Y170 HydrophobicContact CE1-CE2 4.06Å; F166-Y170 HydrophobicContact CE2-CE2 4.07Å; F166-Y170 AromaticContact CZ-CE2 3.68Å; F166-Y170 HydrophobicContact CZ-CE2 3.68Å
167	F	78.8	Confident	78.4	Confident	1 Å²	1	55.1 Å²	55.1	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-80.5	-43	175.1	-69	-62.6	0	0	0	112.6	W94 I101 A138 I142 K163 V164 A165 Q169 Y170 E171 W205 L208 T212	W94-F167 HydrophobicContact CH2-CD2 4.32Å; W94-F167 HydrophobicContact CH2-CE1 4.36Å; W94-F167 AromaticContact CH2-CE2 3.44Å; W94-F167 HydrophobicContact CH2-CE2 3.44Å; W94-F167 VanDerWaalsContact CH2-CE2 3.44Å; W94-F167 AromaticContact CH2-CZ 3.46Å; W94-F167 HydrophobicContact CH2-CZ 3.46Å; W94-F167 VanDerWaalsContact CH2-CZ 3.46Å; W94-F167 AromaticContact CZ3-CE2 3.77Å; W94-F167 HydrophobicContact CZ3-CE2 3.77Å; W94-F167 AromaticContact CZ3-CZ 3.6Å; W94-F167 HydrophobicContact CZ3-CZ 3.6Å; I101-F167 HydrophobicContact CD1-CE1 4.04Å; A138-F167 HydrophobicContact CB-CE1 4.12Å; A138-F167 HydrophobicContact CB-CZ 3.77Å; I142-F167 HydrophobicContact CD1-CD2 4.39Å; I142-F167 HydrophobicContact CD1-CE2 3.67Å; I142-F167 HydrophobicContact CD1-CZ 4.41Å; K163-F167 VanDerWaalsContact O-CD2 3.23Å; K163-F167 WeakPolarHBondContact O-CD2 3.43Å; K163-F167 PolarHBondContact O-N 3.17Å; K163-F167 VanDerWaalsContact O-N 3.14Å; V164-F167 PolarHBondContact O-N 2.83Å; A165-F167 VanDerWaalsContact C-N 3.32Å; A165-F167 PolarHBondContact O-N 2.94Å; F167-Q169 PolarHBondContact O-N 3.39Å; F167-Q169 VanDerWaalsContact O-N 3.15Å; F167-Y170 PolarHBondContact O-N 3.13Å; F167-E171 PolarHBondContact O-N 3.36Å; F167-W205 HydrophobicContact CB-CH2 4.39Å; F167-W205 HydrophobicContact CD1-CH2 4.35Å; F167-W205 HydrophobicContact CD1-CZ3 4.24Å; F167-L208 HydrophobicContact CD1-CD2 3.89Å; F167-L208 HydrophobicContact CE1-CD2 3.71Å; F167-L208 HydrophobicContact CE2-CD1 4.26Å; F167-L208 HydrophobicContact CG-CD2 4.45Å; F167-L208 HydrophobicContact CZ-CD1 4.2Å; F167-L208 HydrophobicContact CZ-CD2 4.09Å; F167-T212 HydrophobicContact CD2-CG2 4.35Å
168	K	79.6	Confident	78.4	Confident	92 Å²	92	55.2 Å²	55.2	40%	0.4	29%	0.286	S	S	.	.	H	α-helix	trans	-61.3	-25.3	-179.2	-70.2	-179.6	-179.1	171.2	0	112.6	V164 A165 Y170 E171 D213	V164-K168 HydrophobicContact CG1-CD 3.91Å; V164-K168 HydrophobicContact CG1-CG 4.46Å; V164-K168 WeakPolarHBondContact O-CG 3.36Å; V164-K168 PolarHBondContact O-N 3.41Å; A165-K168 PolarHBondContact O-N 3.1Å; K168-Y170 PolarHBondContact O-N 3.42Å; K168-E171 PolarHBondContact O-N 3.18Å; K168-D213 IonicContact NZ-OD1 3.8Å; K168-D213 PolarHBondContact NZ-OD1 3.46Å; K168-D213 IonicContact NZ-OD2 3.27Å
169	Q	81.9	Confident	78.1	Confident	112 Å²	112	56.9 Å²	56.9	52%	0.523	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-22.2	172.8	93.4	-167.4	-56.3	0	0	114.6	A165 F166 F167	A165-Q169 PolarHBondContact O-N 3.05Å; F166-Q169 WeakPolarHBondContact O-CG 3.48Å; F166-Q169 PolarHBondContact O-NE2 3.29Å; F167-Q169 PolarHBondContact O-N 3.39Å; F167-Q169 VanDerWaalsContact O-N 3.15Å
170	Y	79	Confident	77.6	Confident	27 Å²	27	56 Å²	56	11%	0.106	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-5.1	-177.4	-63	-48.5	0	0	0	113.8	I101 S102 V105 F166 F167 K168 L172 A173 V174	I101-Y170 HydrophobicContact CG2-CD2 3.96Å; I101-Y170 HydrophobicContact CG2-CE2 4.04Å; S102-Y170 WeakPolarHBondContact CA-OH 3.38Å; S102-Y170 VanDerWaalsContact CB-OH 3.32Å; S102-Y170 WeakPolarHBondContact CB-OH 3.47Å; S102-Y170 PolarHBondContact OG-OH 3.28Å; V105-Y170 HydrophobicContact CB-CD1 3.92Å; V105-Y170 HydrophobicContact CB-CE1 4Å; V105-Y170 HydrophobicContact CB-CG 4.46Å; V105-Y170 HydrophobicContact CG1-CD1 3.49Å; V105-Y170 VanDerWaalsContact CG1-CD1 3.49Å; V105-Y170 HydrophobicContact CG1-CE1 3.89Å; V105-Y170 HydrophobicContact CG1-CG 4.23Å; V105-Y170 HydrophobicContact CG2-CD1 4.27Å; V105-Y170 HydrophobicContact CG2-CG 4.31Å; F166-Y170 HydrophobicContact CE1-CD2 4.5Å; F166-Y170 HydrophobicContact CE1-CE2 4.06Å; F166-Y170 HydrophobicContact CE2-CE2 4.07Å; F166-Y170 AromaticContact CZ-CE2 3.68Å; F166-Y170 HydrophobicContact CZ-CE2 3.68Å; F167-Y170 PolarHBondContact O-N 3.13Å; K168-Y170 PolarHBondContact O-N 3.42Å; Y170-L172 VanDerWaalsContact C-N 3.29Å; Y170-L172 PolarHBondContact O-N 3.43Å; Y170-A173 PolarHBondContact O-N 3.14Å; Y170-V174 PolarHBondContact O-N 3.23Å
171	E	77	Confident	77.1	Confident	58 Å²	58	56.2 Å²	56.2	27%	0.271	29%	0.288	S	S	.	.	H	α-helix	trans	-54.8	-41.7	-175.7	-166	-164.2	129.6	0	0	113	F167 K168 V174 K175 W205	F167-E171 PolarHBondContact O-N 3.36Å; K168-E171 PolarHBondContact O-N 3.18Å; E171-V174 PolarHBondContact O-N 3.35Å; E171-K175 HydrophobicContact CG-CD 4.46Å; E171-K175 WeakPolarHBondContact O-CB 3.46Å; E171-K175 WeakPolarHBondContact O-CG 3.4Å; E171-K175 PolarHBondContact O-N 2.99Å; E171-K175 WeakPolarHBondContact OE1-CE 3.37Å; E171-K175 IonicContact OE1-NZ 3.99Å; E171-K175 PolarHBondContact OE1-NZ 2.97Å; E171-W205 HydrophobicContact CB-CZ2 4.39Å
172	L	75.7	Confident	76.6	Confident	135 Å²	135	57.8 Å²	57.8	71%	0.707	30%	0.296	S	S	*	.	H	α-helix	trans	-64.9	-43.5	176.3	-176.5	63.8	0	0	0	112.1	Y170 V174 K175 T176	Y170-L172 VanDerWaalsContact C-N 3.29Å; Y170-L172 PolarHBondContact O-N 3.43Å; L172-V174 VanDerWaalsContact C-N 3.34Å; L172-V174 PolarHBondContact O-N 3.26Å; L172-K175 PolarHBondContact O-N 3.46Å; L172-T176 PolarHBondContact O-N 3.44Å; L172-T176 PolarHBondContact O-OG1 3.11Å
173	A	71.9	Confident	76	Confident	32 Å²	32	57.7 Å²	57.7	26%	0.264	30%	0.3	S	S	.	.	H	α-helix	trans	-68.2	-33.9	179.3	0	0	0	0	0	112.3	V105 Y170 L177	V105-A173 HydrophobicContact CG1-CB 3.8Å; Y170-A173 PolarHBondContact O-N 3.14Å; A173-L177 WeakPolarHBondContact O-CB 3.39Å; A173-L177 PolarHBondContact O-N 3.44Å
174	V	76	Confident	75.1	Confident	5 Å²	5	59 Å²	59	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-70.9	-39	173.7	175.6	0	0	0	0	111.5	Y170 E171 L172 L177 L178 F201 W205	Y170-V174 PolarHBondContact O-N 3.23Å; E171-V174 PolarHBondContact O-N 3.35Å; L172-V174 VanDerWaalsContact C-N 3.34Å; L172-V174 PolarHBondContact O-N 3.26Å; V174-L177 WeakPolarHBondContact O-CB 3.35Å; V174-L177 PolarHBondContact O-N 3.02Å; V174-L178 HydrophobicContact CG1-CD1 4.2Å; V174-L178 WeakPolarHBondContact O-CG 3.48Å; V174-L178 PolarHBondContact O-N 3.33Å; V174-F201 HydrophobicContact CG1-CE1 3.9Å; V174-F201 HydrophobicContact CG1-CZ 3.73Å; V174-F201 HydrophobicContact CG2-CZ 4.23Å; V174-W205 HydrophobicContact CB-CD2 4.25Å; V174-W205 HydrophobicContact CB-CZ2 4.28Å; V174-W205 HydrophobicContact CG1-CB 4.42Å; V174-W205 HydrophobicContact CG1-CD2 3.74Å; V174-W205 HydrophobicContact CG1-CE3 4.37Å; V174-W205 HydrophobicContact CG1-CG 3.71Å; V174-W205 HydrophobicContact CG2-CD2 4.12Å; V174-W205 HydrophobicContact CG2-CE3 4.05Å; V174-W205 HydrophobicContact CG2-CH2 4.01Å; V174-W205 HydrophobicContact CG2-CZ2 4.06Å; V174-W205 HydrophobicContact CG2-CZ3 4Å
175	K	74	Confident	74.4	Confident	101 Å²	101	59.2 Å²	59.2	44%	0.439	31%	0.306	S	S	.	.	H	α-helix	trans	-59.4	-49.6	172.4	-77.8	169.3	172	173.6	0	111.6	E171 L172 L177 L178 E179	E171-K175 HydrophobicContact CG-CD 4.46Å; E171-K175 WeakPolarHBondContact O-CB 3.46Å; E171-K175 WeakPolarHBondContact O-CG 3.4Å; E171-K175 PolarHBondContact O-N 2.99Å; E171-K175 WeakPolarHBondContact OE1-CE 3.37Å; E171-K175 IonicContact OE1-NZ 3.99Å; E171-K175 PolarHBondContact OE1-NZ 2.97Å; L172-K175 PolarHBondContact O-N 3.46Å; K175-L177 VanDerWaalsContact C-N 3.29Å; K175-L177 PolarHBondContact O-N 3Å; K175-L178 PolarHBondContact O-N 3.29Å; K175-L178 VanDerWaalsContact O-N 3.1Å; K175-E179 WeakPolarHBondContact O-CG 3.39Å; K175-E179 PolarHBondContact O-N 3.34Å
176	T	72.9	Confident	73.6	Confident	59 Å²	59	60.3 Å²	60.3	36%	0.362	32%	0.315	S	S	.	.	H	α-helix	trans	-64.3	-30.7	175.9	-55.8	0	0	0	0	113.3	L172 E179 I180	L172-T176 PolarHBondContact O-N 3.44Å; L172-T176 PolarHBondContact O-OG1 3.11Å; T176-E179 WeakPolarHBondContact CA-OE2 3.5Å; T176-I180 HydrophobicContact CG2-CD1 3.94Å; T176-I180 WeakPolarHBondContact O-CB 3.16Å; T176-I180 WeakPolarHBondContact O-CD1 3.39Å; T176-I180 VanDerWaalsContact O-CG1 3.24Å; T176-I180 WeakPolarHBondContact O-CG1 3.4Å; T176-I180 PolarHBondContact O-N 2.69Å
177	L	71.8	Confident	72.6	Confident	10 Å²	10	62.2 Å²	62.2	5%	0.052	33%	0.332	C	S	.	.	H	α-helix	trans	-61.9	-46.5	169.8	-96.8	170.9	0	0	0	112.4	F104 L108 A173 V174 K175 I180 L181 F201	F104-L177 HydrophobicContact CE1-CD1 4.36Å; L108-L177 HydrophobicContact CD1-CD1 3.97Å; L108-L177 HydrophobicContact CD1-CD2 4.11Å; L108-L177 HydrophobicContact CD1-CG 4.34Å; L108-L177 HydrophobicContact CD2-CD1 3.76Å; L108-L177 HydrophobicContact CD2-CD2 3.87Å; L108-L177 HydrophobicContact CD2-CG 3.56Å; L108-L177 HydrophobicContact CG-CD2 4.46Å; A173-L177 WeakPolarHBondContact O-CB 3.39Å; A173-L177 PolarHBondContact O-N 3.44Å; V174-L177 WeakPolarHBondContact O-CB 3.35Å; V174-L177 PolarHBondContact O-N 3.02Å; K175-L177 VanDerWaalsContact C-N 3.29Å; K175-L177 PolarHBondContact O-N 3Å; L177-I180 PolarHBondContact O-N 3.5Å; L177-L181 WeakPolarHBondContact O-CB 3.42Å; L177-L181 WeakPolarHBondContact O-CD1 3.42Å; L177-L181 WeakPolarHBondContact O-CG 3.46Å; L177-L181 PolarHBondContact O-N 3.37Å; L177-F201 HydrophobicContact CB-CE1 4.43Å; L177-F201 HydrophobicContact CD1-CE1 4.38Å; L177-F201 HydrophobicContact CD1-CZ 4.35Å
178	L	72.8	Confident	71.6	Confident	34 Å²	34	65.3 Å²	65.3	18%	0.178	37%	0.365	C	S	.	.	H	α-helix	trans	-66.1	-41.6	-179.2	-68.4	169.4	0	0	0	111	V174 K175 I180 L181 D182 F201	V174-L178 HydrophobicContact CG1-CD1 4.2Å; V174-L178 WeakPolarHBondContact O-CG 3.48Å; V174-L178 PolarHBondContact O-N 3.33Å; K175-L178 PolarHBondContact O-N 3.29Å; K175-L178 VanDerWaalsContact O-N 3.1Å; L178-I180 PolarHBondContact O-N 3.21Å; L178-L181 PolarHBondContact O-N 2.77Å; L178-D182 WeakPolarHBondContact O-CB 3.5Å; L178-D182 PolarHBondContact O-N 3.38Å; L178-F201 HydrophobicContact CD2-CD1 3.82Å; L178-F201 HydrophobicContact CD2-CE1 4.16Å; L178-F201 HydrophobicContact CG-CE1 4.38Å
179	E	74.7	Confident	70.3	Confident	120 Å²	120	65 Å²	65	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-56.1	-49.7	172.2	-68.9	165.3	169	0	0	111.9	K175 T176 L181 D182 D183	K175-E179 WeakPolarHBondContact O-CG 3.39Å; K175-E179 PolarHBondContact O-N 3.34Å; T176-E179 WeakPolarHBondContact CA-OE2 3.5Å; E179-L181 VanDerWaalsContact C-N 3.34Å; E179-L181 PolarHBondContact O-N 2.99Å; E179-D182 PolarHBondContact O-N 2.97Å; E179-D183 PolarHBondContact O-N 3.5Å
180	I	69.5	Low	69.1	Low	67 Å²	67	61.4 Å²	61.4	34%	0.344	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-35.7	178.3	-68.7	167.7	0	0	0	112	F116 T176 L177 L178 K184	F116-I180 HydrophobicContact CD1-CG2 3.54Å; F116-I180 HydrophobicContact CE1-CG2 3.62Å; F116-I180 HydrophobicContact CG-CG2 4.19Å; F116-I180 HydrophobicContact CZ-CG2 4.31Å; T176-I180 HydrophobicContact CG2-CD1 3.94Å; T176-I180 WeakPolarHBondContact O-CB 3.16Å; T176-I180 WeakPolarHBondContact O-CD1 3.39Å; T176-I180 VanDerWaalsContact O-CG1 3.24Å; T176-I180 WeakPolarHBondContact O-CG1 3.4Å; T176-I180 PolarHBondContact O-N 2.69Å; L177-I180 PolarHBondContact O-N 3.5Å; L178-I180 PolarHBondContact O-N 3.21Å; I180-K184 WeakPolarHBondContact O-CB 3.41Å; I180-K184 PolarHBondContact O-N 2.9Å; I180-K184 VanDerWaalsContact O-N 3.09Å
181	L	70.4	Confident	68.4	Low	4 Å²	4	63.6 Å²	63.6	2%	0.021	38%	0.379	C	S	.	.	H	α-helix	trans	-68.7	-43.1	176.7	-76	164.1	0	0	0	111.4	F116 L124 L128 L177 L178 E179 K184 L185 A198 F201	F116-L181 HydrophobicContact CE1-CD2 4.39Å; F116-L181 HydrophobicContact CZ-CD2 4.25Å; L124-L181 HydrophobicContact CD1-CD2 4.18Å; L128-L181 HydrophobicContact CD1-CD2 4.13Å; L128-L181 HydrophobicContact CD2-CD1 3.86Å; L128-L181 HydrophobicContact CD2-CD2 4.31Å; L177-L181 WeakPolarHBondContact O-CB 3.42Å; L177-L181 WeakPolarHBondContact O-CD1 3.42Å; L177-L181 WeakPolarHBondContact O-CG 3.46Å; L177-L181 PolarHBondContact O-N 3.37Å; L178-L181 PolarHBondContact O-N 2.77Å; E179-L181 VanDerWaalsContact C-N 3.34Å; E179-L181 PolarHBondContact O-N 2.99Å; L181-K184 WeakPolarHBondContact O-CB 3.4Å; L181-K184 PolarHBondContact O-N 3.06Å; L181-L185 WeakPolarHBondContact O-CB 3.47Å; L181-L185 WeakPolarHBondContact O-CD1 3.5Å; L181-L185 WeakPolarHBondContact O-CG 3.48Å; L181-L185 PolarHBondContact O-N 3.08Å; L181-A198 HydrophobicContact CD1-CB 4.37Å; L181-A198 HydrophobicContact CD2-CB 4.5Å; L181-F201 HydrophobicContact CD1-CD1 4.48Å
182	D	72	Confident	68.1	Low	108 Å²	108	65.2 Å²	65.2	58%	0.578	40%	0.397	S	S	*	.	H	α-helix	trans	-66.9	-41	178.4	-79.3	-25	0	0	0	111.8	L178 E179 K184 L185 A186	L178-D182 WeakPolarHBondContact O-CB 3.5Å; L178-D182 PolarHBondContact O-N 3.38Å; E179-D182 PolarHBondContact O-N 2.97Å; D182-K184 PolarHBondContact O-N 3.44Å; D182-L185 CarbonylContact O-C 3.57Å; D182-L185 PolarHBondContact O-N 3.04Å; D182-L185 VanDerWaalsContact O-N 3.14Å; D182-A186 WeakPolarHBondContact O-CB 3.47Å; D182-A186 PolarHBondContact O-N 3.04Å
183	D	69	Low	68	Low	127 Å²	127	63.6 Å²	63.6	68%	0.679	39%	0.386	S	S	*	.	H	α-helix	trans	-58.5	-45.1	170.8	-95.1	-6.8	0	0	0	111.8	E179 L185 A186 S187	E179-D183 PolarHBondContact O-N 3.5Å; D183-L185 VanDerWaalsContact C-N 3.33Å; D183-L185 PolarHBondContact O-N 3.2Å; D183-A186 PolarHBondContact O-N 3.09Å; D183-S187 PolarHBondContact O-N 3.25Å
184	K	64.1	Low	68.1	Low	45 Å²	45	62.2 Å²	62.2	20%	0.196	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-38.3	173.9	-91	-74.5	-167.7	165.5	0	112.5	F116 E117 I180 L181 D182 S187 T190	F116-K184 HydrophobicContact CD1-CG 3.96Å; F116-K184 HydrophobicContact CE1-CG 4.09Å; F116-K184 WeakPolarHBondContact O-CE 3.06Å; F116-K184 PolarHBondContact O-NZ 2.98Å; E117-K184 PolarHBondContact O-NZ 3.48Å; I180-K184 WeakPolarHBondContact O-CB 3.41Å; I180-K184 PolarHBondContact O-N 2.9Å; I180-K184 VanDerWaalsContact O-N 3.09Å; L181-K184 WeakPolarHBondContact O-CB 3.4Å; L181-K184 PolarHBondContact O-N 3.06Å; D182-K184 PolarHBondContact O-N 3.44Å; K184-S187 PolarHBondContact O-N 3.18Å; K184-S187 PolarHBondContact O-OG 3.45Å; K184-T190 HydrophobicContact CD-CG2 4.48Å; K184-T190 PolarHBondContact O-OG1 2.83Å
185	L	64.9	Low	68.1	Low	13 Å²	13	67.8 Å²	67.8	7%	0.068	39%	0.394	C	S	.	.	H	α-helix	trans	-75.9	-23.8	179.2	-70.7	167.9	0	0	0	112.6	L181 D182 D183 V194 R195 A198	L181-L185 WeakPolarHBondContact O-CB 3.47Å; L181-L185 WeakPolarHBondContact O-CD1 3.5Å; L181-L185 WeakPolarHBondContact O-CG 3.48Å; L181-L185 PolarHBondContact O-N 3.08Å; D182-L185 CarbonylContact O-C 3.57Å; D182-L185 PolarHBondContact O-N 3.04Å; D182-L185 VanDerWaalsContact O-N 3.14Å; D183-L185 VanDerWaalsContact C-N 3.33Å; D183-L185 PolarHBondContact O-N 3.2Å; L185-V194 HydrophobicContact CD2-CG1 4.42Å; L185-R195 HydrophobicContact CD1-CG 4.3Å; L185-R195 HydrophobicContact CD2-CB 3.66Å; L185-R195 HydrophobicContact CD2-CG 3.93Å; L185-R195 PolarHBondContact O-NH2 3.04Å; L185-A198 HydrophobicContact CD1-CB 3.99Å
186	A	66	Low	68.4	Low	84 Å²	84	66.2 Å²	66.2	69%	0.694	40%	0.396	S	S	*	.	H	α-helix	trans	-77.4	-32.3	170.6	0	0	0	0	0	112.6	D182 D183 G188	D182-A186 WeakPolarHBondContact O-CB 3.47Å; D182-A186 PolarHBondContact O-N 3.04Å; D183-A186 PolarHBondContact O-N 3.09Å; A186-G188 PolarHBondContact O-N 3.07Å
187	S	61.7	Low	68.6	Low	72 Å²	72	63.6 Å²	63.6	50%	0.503	38%	0.38	S	S	.	.	S	Bend	trans	-62.8	-8.8	-177.7	76.8	0	0	0	0	116.2	D183 K184 A189	D183-S187 PolarHBondContact O-N 3.25Å; K184-S187 PolarHBondContact O-N 3.18Å; K184-S187 PolarHBondContact O-OG 3.45Å; S187-A189 PolarHBondContact O-N 3.49Å
188	G	58.4	Low	68.8	Low	67 Å²	67	63.3 Å²	63.3	69%	0.691	38%	0.379	S	S	*	.	S	Bend	trans	74.2	-2.4	177.2	0	0	0	0	0	115.9	A186	A186-G188 PolarHBondContact O-N 3.07Å
189	A	52.4	Low	69.2	Low	86 Å²	86	67.8 Å²	67.8	71%	0.711	40%	0.399	S	S	*	.			trans	-100	22.8	-173.3	0	0	0	0	0	114.7	S187	S187-A189 PolarHBondContact O-N 3.49Å
190	T	57.5	Low	69.6	Low	36 Å²	36	64 Å²	64	22%	0.221	39%	0.386	C	S	.	.	S	Bend	trans	-129.7	147.5	-171.5	45.4	0	0	0	0	113.5	K184	K184-T190 HydrophobicContact CD-CG2 4.48Å; K184-T190 PolarHBondContact O-OG1 2.83Å
191	D	63.2	Low	70.2	Confident	73 Å²	73	61 Å²	61	39%	0.39	37%	0.37	S	S	.	.			trans	-74	148.8	-176.7	-159.7	-39.4	0	0	0	112.4	Q193 V194 R195	D191-Q193 PolarHBondContact O-N 3.2Å; D191-Q193 PolarHBondContact OD1-N 2.98Å; D191-V194 HydrophobicContact CB-CG2 4.44Å; D191-V194 WeakPolarHBondContact O-CB 3.46Å; D191-V194 PolarHBondContact O-N 2.96Å; D191-R195 PolarHBondContact O-N 3.49Å
192	S	71.7	Confident	70.8	Confident	92 Å²	92	62.9 Å²	62.9	64%	0.643	38%	0.384	S	S	*	.	H	α-helix	trans	-44.4	-40.9	168	62.2	0	0	0	0	114.3	R195 S196	S192-R195 PolarHBondContact O-N 3.28Å; S192-S196 PolarHBondContact O-N 3.34Å
193	Q	73.9	Confident	71.4	Confident	101 Å²	101	61 Å²	61	47%	0.472	38%	0.38	S	S	.	.	H	α-helix	trans	-66.7	-36.9	-179.4	-63.9	-173.3	-11.1	0	0	112.5	F125 D191 R195 S196 A197	F125-Q193 HydrophobicContact CD1-CB 4.5Å; F125-Q193 HydrophobicContact CD2-CB 3.82Å; F125-Q193 VanDerWaalsContact CD2-O 3.23Å; F125-Q193 WeakPolarHBondContact CD2-O 3.37Å; F125-Q193 HydrophobicContact CE1-CB 4.43Å; F125-Q193 HydrophobicContact CE2-CB 3.75Å; F125-Q193 VanDerWaalsContact CE2-O 3.29Å; F125-Q193 WeakPolarHBondContact CE2-O 3.23Å; F125-Q193 HydrophobicContact CG-CB 4.2Å; F125-Q193 HydrophobicContact CZ-CB 4.06Å; D191-Q193 PolarHBondContact O-N 3.2Å; D191-Q193 PolarHBondContact OD1-N 2.98Å; Q193-R195 VanDerWaalsContact C-N 3.32Å; Q193-R195 PolarHBondContact O-N 3.26Å; Q193-S196 PolarHBondContact O-OG 3.06Å; Q193-A197 PolarHBondContact O-N 2.68Å
194	V	72.6	Confident	72.1	Confident	2 Å²	2	56.9 Å²	56.9	1%	0.012	36%	0.356	C	S	.	.	H	α-helix	trans	-63.8	-40.9	175.2	173.6	0	0	0	0	110.3	L124 F125 L128 L185 D191 A197 A198	L124-V194 HydrophobicContact CB-CG2 4.41Å; L124-V194 HydrophobicContact CD2-CG1 3.61Å; L124-V194 HydrophobicContact CD2-CG2 4.47Å; L124-V194 HydrophobicContact CG-CG1 3.88Å; L124-V194 HydrophobicContact CG-CG2 4.45Å; F125-V194 HydrophobicContact CB-CG2 4.22Å; L128-V194 HydrophobicContact CD1-CG1 4Å; L185-V194 HydrophobicContact CD2-CG1 4.42Å; D191-V194 HydrophobicContact CB-CG2 4.44Å; D191-V194 WeakPolarHBondContact O-CB 3.46Å; D191-V194 PolarHBondContact O-N 2.96Å; V194-A197 PolarHBondContact O-N 3.12Å; V194-A198 WeakPolarHBondContact O-CB 3.46Å; V194-A198 PolarHBondContact O-N 2.96Å
195	R	76.7	Confident	73.1	Confident	123 Å²	123	55.5 Å²	55.5	46%	0.464	35%	0.349	S	S	.	.	H	α-helix	trans	-63.5	-43.6	-178.6	-169.6	171.1	-77.2	171	-3.7	112.5	L185 D191 S192 Q193 A198 Q199	L185-R195 HydrophobicContact CD1-CG 4.3Å; L185-R195 HydrophobicContact CD2-CB 3.66Å; L185-R195 HydrophobicContact CD2-CG 3.93Å; L185-R195 PolarHBondContact O-NH2 3.04Å; D191-R195 PolarHBondContact O-N 3.49Å; S192-R195 PolarHBondContact O-N 3.28Å; Q193-R195 VanDerWaalsContact C-N 3.32Å; Q193-R195 PolarHBondContact O-N 3.26Å; R195-A198 PolarHBondContact O-N 3.28Å; R195-Q199 WeakPolarHBondContact O-CB 3.47Å; R195-Q199 WeakPolarHBondContact O-CG 3.46Å; R195-Q199 PolarHBondContact O-N 3.06Å
196	S	79.4	Confident	74	Confident	68 Å²	68	57.6 Å²	57.6	48%	0.476	37%	0.365	S	S	.	.	H	α-helix	trans	-69.1	-37	177.5	61.1	0	0	0	0	112.5	S192 Q193 Q199 S200	S192-S196 PolarHBondContact O-N 3.34Å; Q193-S196 PolarHBondContact O-OG 3.06Å; S196-Q199 PolarHBondContact O-N 3.32Å; S196-S200 WeakPolarHBondContact O-CB 3.42Å; S196-S200 PolarHBondContact O-N 3.02Å
197	A	78.1	Confident	74.9	Confident	3 Å²	3	58.2 Å²	58.2	3%	0.025	35%	0.353	C	S	.	.	H	α-helix	trans	-67.3	-36.8	176.6	0	0	0	0	0	112.5	F125 L128 N132 Q193 V194 F201	F125-A197 HydrophobicContact CD2-CB 3.79Å; F125-A197 HydrophobicContact CE2-CB 3.95Å; L128-A197 HydrophobicContact CB-CB 3.56Å; L128-A197 HydrophobicContact CD1-CB 4.1Å; L128-A197 HydrophobicContact CG-CB 4.45Å; N132-A197 PolarHBondContact ND2-O 2.86Å; Q193-A197 PolarHBondContact O-N 2.68Å; V194-A197 PolarHBondContact O-N 3.12Å; A197-F201 WeakPolarHBondContact O-CB 3.43Å; A197-F201 PolarHBondContact O-N 3.27Å
198	A	76.3	Confident	76	Confident	5 Å²	5	54.8 Å²	54.8	4%	0.041	33%	0.329	C	S	.	.	H	α-helix	trans	-67.3	-44.2	173.6	0	0	0	0	0	112.3	L128 L181 L185 V194 R195 S200 F201 S202	L128-A198 HydrophobicContact CD1-CB 4.09Å; L181-A198 HydrophobicContact CD1-CB 4.37Å; L181-A198 HydrophobicContact CD2-CB 4.5Å; L185-A198 HydrophobicContact CD1-CB 3.99Å; V194-A198 WeakPolarHBondContact O-CB 3.46Å; V194-A198 PolarHBondContact O-N 2.96Å; R195-A198 PolarHBondContact O-N 3.28Å; A198-S200 VanDerWaalsContact C-N 3.34Å; A198-S200 PolarHBondContact O-N 3.34Å; A198-F201 PolarHBondContact O-N 3.08Å; A198-S202 PolarHBondContact O-N 3.07Å
199	Q	81.4	Confident	77.2	Confident	128 Å²	128	53.1 Å²	53.1	60%	0.598	31%	0.305	S	S	*	.	H	α-helix	trans	-62.7	-40.8	175.3	-74.2	177.3	-30.2	0	0	112.1	R195 S196 S202 S203	R195-Q199 WeakPolarHBondContact O-CB 3.47Å; R195-Q199 WeakPolarHBondContact O-CG 3.46Å; R195-Q199 PolarHBondContact O-N 3.06Å; S196-Q199 PolarHBondContact O-N 3.32Å; Q199-S202 PolarHBondContact O-N 3.18Å; Q199-S203 PolarHBondContact O-N 3.2Å; Q199-S203 VanDerWaalsContact O-N 3.09Å; Q199-S203 PolarHBondContact O-OG 3.36Å
200	S	82.4	Confident	78.8	Confident	41 Å²	41	55.6 Å²	55.6	29%	0.287	30%	0.301	S	S	.	.	H	α-helix	trans	-62.8	-40	173.2	-176.9	0	0	0	0	112	N132 S196 A198 S203 K204	N132-S200 WeakPolarHBondContact OD1-CB 3.37Å; N132-S200 PolarHBondContact OD1-O 3.31Å; N132-S200 VanDerWaalsContact OD1-O 3.11Å; N132-S200 PolarHBondContact OD1-OG 3.22Å; S196-S200 WeakPolarHBondContact O-CB 3.42Å; S196-S200 PolarHBondContact O-N 3.02Å; A198-S200 VanDerWaalsContact C-N 3.34Å; A198-S200 PolarHBondContact O-N 3.34Å; S200-S203 PolarHBondContact O-N 3.06Å; S200-S203 PolarHBondContact O-OG 2.82Å; S200-S203 VanDerWaalsContact O-OG 3.1Å; S200-K204 WeakPolarHBondContact O-CB 3.4Å; S200-K204 WeakPolarHBondContact O-CG 3.44Å; S200-K204 PolarHBondContact O-N 2.96Å
201	F	82.6	Confident	80.1	Confident	2 Å²	2	55 Å²	55	1%	0.009	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-44.2	178.3	172.5	-116	0	0	0	111.5	L128 L131 N132 L135 V174 L177 L178 L181 A197 A198 W205	L128-F201 HydrophobicContact CD2-CB 4.32Å; L131-F201 HydrophobicContact CB-CD2 3.77Å; L131-F201 HydrophobicContact CB-CE2 3.99Å; L131-F201 HydrophobicContact CD1-CD2 3.9Å; L131-F201 HydrophobicContact CD1-CE1 4.33Å; L131-F201 HydrophobicContact CD1-CE2 3.69Å; L131-F201 HydrophobicContact CD1-CG 4.32Å; L131-F201 HydrophobicContact CD1-CZ 3.91Å; L131-F201 HydrophobicContact CD2-CD2 4.49Å; L131-F201 HydrophobicContact CD2-CE2 3.84Å; L131-F201 HydrophobicContact CD2-CZ 4.42Å; L131-F201 HydrophobicContact CG-CD2 4.28Å; L131-F201 HydrophobicContact CG-CE2 4.06Å; N132-F201 WeakPolarHBondContact OD1-CA 3.42Å; N132-F201 PolarHBondContact OD1-N 3.36Å; N132-F201 VanDerWaalsContact OD1-N 3.09Å; L135-F201 HydrophobicContact CD1-CD2 3.51Å; L135-F201 HydrophobicContact CD1-CE2 3.7Å; L135-F201 HydrophobicContact CG-CE2 4.49Å; V174-F201 HydrophobicContact CG1-CE1 3.9Å; V174-F201 HydrophobicContact CG1-CZ 3.73Å; V174-F201 HydrophobicContact CG2-CZ 4.23Å; L177-F201 HydrophobicContact CB-CE1 4.43Å; L177-F201 HydrophobicContact CD1-CE1 4.38Å; L177-F201 HydrophobicContact CD1-CZ 4.35Å; L178-F201 HydrophobicContact CD2-CD1 3.82Å; L178-F201 HydrophobicContact CD2-CE1 4.16Å; L178-F201 HydrophobicContact CG-CE1 4.38Å; L181-F201 HydrophobicContact CD1-CD1 4.48Å; A197-F201 WeakPolarHBondContact O-CB 3.43Å; A197-F201 PolarHBondContact O-N 3.27Å; A198-F201 PolarHBondContact O-N 3.08Å; F201-W205 WeakPolarHBondContact O-CB 3.31Å; F201-W205 PolarHBondContact O-N 3.1Å
202	S	82.1	Confident	81	Confident	44 Å²	44	51.5 Å²	51.5	31%	0.308	28%	0.278	S	S	.	.	H	α-helix	trans	-60.8	-46.6	176.5	-170.9	0	0	0	0	112.8	A198 Q199 S206	A198-S202 PolarHBondContact O-N 3.07Å; Q199-S202 PolarHBondContact O-N 3.18Å; S202-S206 WeakPolarHBondContact O-CB 3.44Å; S202-S206 PolarHBondContact O-N 3.36Å; S202-S206 VanDerWaalsContact O-N 3.08Å; S202-S206 PolarHBondContact O-OG 3.43Å
203	S	84.5	Confident	81.6	Confident	69 Å²	69	50.7 Å²	50.7	48%	0.483	27%	0.266	S	S	.	.	H	α-helix	trans	-69.6	-42.3	-179.7	60.9	0	0	0	0	112.6	Q199 S200 W205 S206 H207	Q199-S203 PolarHBondContact O-N 3.2Å; Q199-S203 VanDerWaalsContact O-N 3.09Å; Q199-S203 PolarHBondContact O-OG 3.36Å; S200-S203 PolarHBondContact O-N 3.06Å; S200-S203 PolarHBondContact O-OG 2.82Å; S200-S203 VanDerWaalsContact O-OG 3.1Å; S203-W205 PolarHBondContact O-N 3.3Å; S203-S206 PolarHBondContact O-N 3.35Å; S203-H207 WeakPolarHBondContact O-CB 3.32Å; S203-H207 PolarHBondContact O-N 3.07Å
204	K	84.6	Confident	82.1	Confident	41 Å²	41	49.3 Å²	49.3	18%	0.178	27%	0.268	C	S	.	.	H	α-helix	trans	-64.2	-37.5	175.7	-69.8	-167	-166.5	-159.4	0	112.9	N132 L135 E136 S200 L208	N132-K204 HydrophobicContact CB-CD 4.28Å; N132-K204 VanDerWaalsContact O-CD 3.25Å; N132-K204 WeakPolarHBondContact O-CD 3.32Å; N132-K204 PolarHBondContact O-NZ 3.42Å; N132-K204 WeakPolarHBondContact OD1-CD 3.46Å; N132-K204 WeakPolarHBondContact OD1-CE 3.43Å; L135-K204 HydrophobicContact CB-CB 3.88Å; L135-K204 HydrophobicContact CB-CD 4.28Å; L135-K204 HydrophobicContact CD1-CB 3.73Å; L135-K204 HydrophobicContact CG-CB 4.49Å; E136-K204 WeakPolarHBondContact OE2-CE 3.29Å; E136-K204 IonicContact OE2-NZ 2.63Å; E136-K204 PolarHBondContact OE2-NZ 3.45Å; S200-K204 WeakPolarHBondContact O-CB 3.4Å; S200-K204 WeakPolarHBondContact O-CG 3.44Å; S200-K204 PolarHBondContact O-N 2.96Å; K204-L208 WeakPolarHBondContact O-CB 3.42Å; K204-L208 PolarHBondContact O-N 3.11Å; K204-L208 VanDerWaalsContact O-N 3.07Å
205	W	84.3	Confident	82.4	Confident	15 Å²	15	49.3 Å²	49.3	6%	0.057	27%	0.268	C	S	.	.	H	α-helix	trans	-66.8	-41	176.2	178.5	-97.5	0	0	0	111.6	L135 F167 E171 V174 F201 S203 L208 L209	L135-W205 HydrophobicContact CD1-CB 4.07Å; L135-W205 HydrophobicContact CD2-CE3 3.76Å; L135-W205 HydrophobicContact CD2-CZ3 4.27Å; F167-W205 HydrophobicContact CB-CH2 4.39Å; F167-W205 HydrophobicContact CD1-CH2 4.35Å; F167-W205 HydrophobicContact CD1-CZ3 4.24Å; E171-W205 HydrophobicContact CB-CZ2 4.39Å; V174-W205 HydrophobicContact CB-CD2 4.25Å; V174-W205 HydrophobicContact CB-CZ2 4.28Å; V174-W205 HydrophobicContact CG1-CB 4.42Å; V174-W205 HydrophobicContact CG1-CD2 3.74Å; V174-W205 HydrophobicContact CG1-CE3 4.37Å; V174-W205 HydrophobicContact CG1-CG 3.71Å; V174-W205 HydrophobicContact CG2-CD2 4.12Å; V174-W205 HydrophobicContact CG2-CE3 4.05Å; V174-W205 HydrophobicContact CG2-CH2 4.01Å; V174-W205 HydrophobicContact CG2-CZ2 4.06Å; V174-W205 HydrophobicContact CG2-CZ3 4Å; F201-W205 WeakPolarHBondContact O-CB 3.31Å; F201-W205 PolarHBondContact O-N 3.1Å; S203-W205 PolarHBondContact O-N 3.3Å; W205-L208 HydrophobicContact CE3-CD2 4.28Å; W205-L208 HydrophobicContact CZ3-CD2 4.36Å; W205-L208 PolarHBondContact O-N 3.36Å; W205-L209 PolarHBondContact O-N 3.07Å
206	S	84.3	Confident	82.7	Confident	58 Å²	58	44.9 Å²	44.9	41%	0.406	26%	0.255	S	S	.	.	H	α-helix	trans	-63.7	-47.8	177.4	-54.8	0	0	0	0	111.4	S202 S203 L208 L209 E210	S202-S206 WeakPolarHBondContact O-CB 3.44Å; S202-S206 PolarHBondContact O-N 3.36Å; S202-S206 VanDerWaalsContact O-N 3.08Å; S202-S206 PolarHBondContact O-OG 3.43Å; S203-S206 PolarHBondContact O-N 3.35Å; S206-L208 VanDerWaalsContact C-N 3.32Å; S206-L208 PolarHBondContact O-N 3.43Å; S206-L209 PolarHBondContact O-N 2.99Å; S206-E210 PolarHBondContact O-N 3.11Å
207	H	85.5	Confident	82.8	Confident	96 Å²	96	48.6 Å²	48.6	44%	0.444	27%	0.265	S	S	.	.	H	α-helix	trans	-61.7	-37.8	178.1	-179.8	48.7	0	0	0	113.1	S203 L209 E210 L211	S203-H207 WeakPolarHBondContact O-CB 3.32Å; S203-H207 PolarHBondContact O-N 3.07Å; H207-L209 VanDerWaalsContact C-N 3.29Å; H207-L209 PolarHBondContact O-N 3.27Å; H207-E210 PolarHBondContact O-N 3.37Å; H207-L211 WeakPolarHBondContact O-CB 3.38Å; H207-L211 PolarHBondContact O-N 3.21Å
208	L	83.8	Confident	82.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-60.2	-37.5	176.3	175.6	62.6	0	0	0	112.4	L135 A138 I142 F167 K204 W205 S206 T212	L135-L208 HydrophobicContact CD2-CD2 3.79Å; A138-L208 HydrophobicContact CB-CD1 3.8Å; A138-L208 HydrophobicContact CB-CD2 3.95Å; I142-L208 HydrophobicContact CD1-CD1 3.5Å; I142-L208 VanDerWaalsContact CD1-CD1 3.5Å; F167-L208 HydrophobicContact CD1-CD2 3.89Å; F167-L208 HydrophobicContact CE1-CD2 3.71Å; F167-L208 HydrophobicContact CE2-CD1 4.26Å; F167-L208 HydrophobicContact CG-CD2 4.45Å; F167-L208 HydrophobicContact CZ-CD1 4.2Å; F167-L208 HydrophobicContact CZ-CD2 4.09Å; K204-L208 WeakPolarHBondContact O-CB 3.42Å; K204-L208 PolarHBondContact O-N 3.11Å; K204-L208 VanDerWaalsContact O-N 3.07Å; W205-L208 HydrophobicContact CE3-CD2 4.28Å; W205-L208 HydrophobicContact CZ3-CD2 4.36Å; W205-L208 PolarHBondContact O-N 3.36Å; S206-L208 VanDerWaalsContact C-N 3.32Å; S206-L208 PolarHBondContact O-N 3.43Å; L208-T212 PolarHBondContact O-N 3.04Å; L208-T212 PolarHBondContact O-OG1 2.93Å
209	L	84.6	Confident	82.6	Confident	33 Å²	33	52.7 Å²	52.7	17%	0.173	29%	0.292	C	S	.	.	H	α-helix	trans	-71.8	-47.8	177.8	-70.6	171.8	0	0	0	112	W205 S206 H207 L211 T212 D213	W205-L209 PolarHBondContact O-N 3.07Å; S206-L209 PolarHBondContact O-N 2.99Å; H207-L209 VanDerWaalsContact C-N 3.29Å; H207-L209 PolarHBondContact O-N 3.27Å; L209-L211 VanDerWaalsContact C-N 3.26Å; L209-L211 PolarHBondContact O-N 2.98Å; L209-T212 WeakPolarHBondContact CA-OG1 3.33Å; L209-T212 PolarHBondContact O-N 3.27Å; L209-T212 PolarHBondContact O-OG1 2.99Å; L209-D213 PolarHBondContact O-N 3.28Å; L209-D213 VanDerWaalsContact O-N 3.11Å
210	E	85.2	Confident	82.4	Confident	138 Å²	138	49.4 Å²	49.4	65%	0.645	28%	0.28	S	S	*	.	H	α-helix	trans	-55.6	-42.9	175.6	-67.3	178.3	148.8	0	0	111.6	S206 H207 T212 S214	S206-E210 PolarHBondContact O-N 3.11Å; H207-E210 PolarHBondContact O-N 3.37Å; E210-T212 VanDerWaalsContact C-N 3.33Å; E210-T212 PolarHBondContact O-N 2.71Å; E210-S214 WeakPolarHBondContact O-CB 3.15Å; E210-S214 PolarHBondContact O-N 3.46Å; E210-S214 VanDerWaalsContact O-N 3.13Å
211	L	85.5	Confident	82	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.12	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-35.3	177	-176	65.6	0	0	0	112.6	S139 I142 R143 V147 H207 L209 A215	S139-L211 VanDerWaalsContact O-CD2 3.23Å; S139-L211 WeakPolarHBondContact O-CD2 3.48Å; I142-L211 HydrophobicContact CB-CD2 4.22Å; I142-L211 HydrophobicContact CG2-CD2 4.21Å; I142-L211 HydrophobicContact CG2-CG 3.99Å; R143-L211 HydrophobicContact CB-CD2 4.33Å; R143-L211 HydrophobicContact CG-CD1 4.18Å; V147-L211 HydrophobicContact CG2-CD1 4.35Å; H207-L211 WeakPolarHBondContact O-CB 3.38Å; H207-L211 PolarHBondContact O-N 3.21Å; L209-L211 VanDerWaalsContact C-N 3.26Å; L209-L211 PolarHBondContact O-N 2.98Å; L211-A215 WeakPolarHBondContact O-CB 3.37Å; L211-A215 PolarHBondContact O-N 3.06Å
212	T	81.9	Confident	81.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-69.8	-46.9	176.3	43.5	0	0	0	0	113.6	I142 V164 F167 L208 L209 E210 A215 V216	I142-T212 HydrophobicContact CD1-CG2 3.39Å; I142-T212 HydrophobicContact CG1-CG2 4.26Å; I142-T212 HydrophobicContact CG2-CG2 4.4Å; V164-T212 HydrophobicContact CG2-CG2 4.11Å; F167-T212 HydrophobicContact CD2-CG2 4.35Å; L208-T212 PolarHBondContact O-N 3.04Å; L208-T212 PolarHBondContact O-OG1 2.93Å; L209-T212 WeakPolarHBondContact CA-OG1 3.33Å; L209-T212 PolarHBondContact O-N 3.27Å; L209-T212 PolarHBondContact O-OG1 2.99Å; E210-T212 VanDerWaalsContact C-N 3.33Å; E210-T212 PolarHBondContact O-N 2.71Å; T212-A215 PolarHBondContact O-N 2.98Å; T212-V216 PolarHBondContact O-N 2.7Å
213	D	84.6	Confident	80.7	Confident	74 Å²	74	53 Å²	53	40%	0.396	30%	0.295	S	S	.	.	H	α-helix	trans	-70.7	-39.4	-174.9	-68.7	-33.3	0	0	0	110.3	K168 L209 A215 V216 E217	K168-D213 IonicContact NZ-OD1 3.8Å; K168-D213 PolarHBondContact NZ-OD1 3.46Å; K168-D213 IonicContact NZ-OD2 3.27Å; L209-D213 PolarHBondContact O-N 3.28Å; L209-D213 VanDerWaalsContact O-N 3.11Å; D213-A215 VanDerWaalsContact C-N 3.32Å; D213-A215 PolarHBondContact O-N 2.74Å; D213-V216 PolarHBondContact O-N 2.73Å; D213-V216 VanDerWaalsContact O-N 3.1Å; D213-E217 PolarHBondContact O-N 3.26Å
214	S	83.6	Confident	79.9	Confident	73 Å²	73	56.2 Å²	56.2	51%	0.51	30%	0.302	S	S	.	.	H	α-helix	trans	-59.4	-37.2	174.2	-179.3	0	0	0	0	113.7	E210 V216 S218	E210-S214 WeakPolarHBondContact O-CB 3.15Å; E210-S214 PolarHBondContact O-N 3.46Å; E210-S214 VanDerWaalsContact O-N 3.13Å; S214-V216 VanDerWaalsContact C-N 3.33Å; S214-V216 PolarHBondContact O-N 3.12Å; S214-S218 PolarHBondContact O-N 3.12Å
215	A	79.5	Confident	79	Confident	2 Å²	2	56.9 Å²	56.9	2%	0.017	31%	0.308	C	S	.	.	H	α-helix	trans	-69.3	-28.6	177.1	0	0	0	0	0	113	V147 L160 L211 T212 D213 L219	V147-A215 HydrophobicContact CG2-CB 3.98Å; L160-A215 HydrophobicContact CD2-CB 3.67Å; L211-A215 WeakPolarHBondContact O-CB 3.37Å; L211-A215 PolarHBondContact O-N 3.06Å; T212-A215 PolarHBondContact O-N 2.98Å; D213-A215 VanDerWaalsContact C-N 3.32Å; D213-A215 PolarHBondContact O-N 2.74Å; A215-L219 PolarHBondContact O-N 3.18Å
216	V	82.8	Confident	77.9	Confident	30 Å²	30	57.2 Å²	57.2	18%	0.182	31%	0.314	C	S	.	.	H	α-helix	trans	-72.6	-44	176.4	174	0	0	0	0	110.9	L157 L160 V164 T212 D213 S214 T220	L157-V216 HydrophobicContact CD1-CG1 4.21Å; L160-V216 HydrophobicContact CD2-CB 4.34Å; L160-V216 HydrophobicContact CD2-CG2 3.54Å; L160-V216 HydrophobicContact CG-CG2 3.86Å; V164-V216 HydrophobicContact CG2-CG2 4.17Å; T212-V216 PolarHBondContact O-N 2.7Å; D213-V216 PolarHBondContact O-N 2.73Å; D213-V216 VanDerWaalsContact O-N 3.1Å; S214-V216 VanDerWaalsContact C-N 3.33Å; S214-V216 PolarHBondContact O-N 3.12Å; V216-T220 WeakPolarHBondContact O-CB 3.48Å; V216-T220 PolarHBondContact O-N 2.91Å; V216-T220 VanDerWaalsContact O-N 3.08Å; V216-T220 PolarHBondContact O-OG1 3.1Å
217	E	82.3	Confident	76.9	Confident	146 Å²	146	56.1 Å²	56.1	68%	0.682	31%	0.305	S	S	*	.	H	α-helix	trans	-61.1	-47.3	178	-66.6	-175.1	151.4	0	0	111.6	D213 L219 T220 S221	D213-E217 PolarHBondContact O-N 3.26Å; E217-L219 PolarHBondContact O-N 3.32Å; E217-T220 PolarHBondContact O-N 3.28Å; E217-S221 PolarHBondContact O-N 3.24Å
218	S	77.2	Confident	76	Confident	80 Å²	80	52.8 Å²	52.8	56%	0.559	29%	0.291	S	S	*	.	H	α-helix	trans	-58.8	-46.6	179.9	-175.8	0	0	0	0	112.8	S214 T220 Y222	S214-S218 PolarHBondContact O-N 3.12Å; S218-T220 VanDerWaalsContact C-N 3.33Å; S218-T220 PolarHBondContact O-N 3.45Å; S218-Y222 PolarHBondContact O-N 3.08Å
219	L	72.8	Confident	75.4	Confident	14 Å²	14	57.1 Å²	57.1	7%	0.073	31%	0.312	C	S	.	.	H	α-helix	trans	-68.4	-30.5	177.6	-77.5	170.5	0	0	0	113.1	Y146 R153 A156 L157 L160 A215 E217 L223	Y146-L219 HydrophobicContact CD1-CD1 4.26Å; R153-L219 HydrophobicContact CB-CD2 3.94Å; R153-L219 HydrophobicContact CG-CD2 3.99Å; A156-L219 HydrophobicContact CB-CD1 4.27Å; A156-L219 HydrophobicContact CB-CD2 4.45Å; L157-L219 HydrophobicContact CB-CB 4.44Å; L157-L219 HydrophobicContact CD1-CB 3.87Å; L160-L219 HydrophobicContact CD2-CD1 3.91Å; A215-L219 PolarHBondContact O-N 3.18Å; E217-L219 PolarHBondContact O-N 3.32Å; L219-L223 WeakPolarHBondContact O-CG 3.47Å
220	T	77.5	Confident	74.9	Confident	58 Å²	58	57 Å²	57	36%	0.356	31%	0.311	S	S	.	.	H	α-helix	trans	-71.5	-48.5	178.9	-55.7	0	0	0	0	110.9	V216 E217 S218 Y222 L223	V216-T220 WeakPolarHBondContact O-CB 3.48Å; V216-T220 PolarHBondContact O-N 2.91Å; V216-T220 VanDerWaalsContact O-N 3.08Å; V216-T220 PolarHBondContact O-OG1 3.1Å; E217-T220 PolarHBondContact O-N 3.28Å; S218-T220 VanDerWaalsContact C-N 3.33Å; S218-T220 PolarHBondContact O-N 3.45Å; T220-Y222 PolarHBondContact O-N 3.27Å; T220-L223 PolarHBondContact O-N 2.81Å
221	S	73.9	Confident	74.5	Confident	67 Å²	67	50.5 Å²	50.5	47%	0.469	28%	0.28	S	S	.	.	H	α-helix	trans	-55.5	-37.9	178	-178.5	0	0	0	0	112.8	E217 L223 N225	E217-S221 PolarHBondContact O-N 3.24Å; S221-L223 VanDerWaalsContact C-N 3.33Å; S221-L223 PolarHBondContact O-N 3.05Å; S221-N225 PolarHBondContact O-ND2 3.13Å
222	Y	69.8	Low	74.1	Confident	47 Å²	47	53.7 Å²	53.7	18%	0.184	30%	0.295	C	S	.	.	H	α-helix	trans	-66.3	-32.7	178.5	-159.8	-78.6	0	0	0	113.2	E76 G77 R153 S218 T220 N225 A226	E76-Y222 WeakPolarHBondContact OE1-CE2 3.25Å; E76-Y222 PolarHBondContact OE1-OH 2.88Å; G77-Y222 VanDerWaalsContact O-CE2 3.28Å; G77-Y222 WeakPolarHBondContact O-CE2 3.24Å; R153-Y222 VanDerWaalsContact CD-CG 3.44Å; R153-Y222 VanDerWaalsContact CZ-CE1 3.42Å; R153-Y222 PolarHBondContact NH1-OH 3.39Å; R153-Y222 VanDerWaalsContact NH1-OH 3.12Å; R153-Y222 VanDerWaalsContact NH2-CZ 3.31Å; S218-Y222 PolarHBondContact O-N 3.08Å; T220-Y222 PolarHBondContact O-N 3.27Å; Y222-N225 PolarHBondContact O-N 2.79Å; Y222-A226 PolarHBondContact O-N 3.38Å
223	L	67.7	Low	74.2	Confident	50 Å²	50	59.6 Å²	59.6	26%	0.262	32%	0.32	S	S	.	.	H	α-helix	trans	-76.2	-31.6	-174.7	-70	170	0	0	0	113.4	R153 K154 L157 L219 T220 S221 N225 A226	R153-L223 HydrophobicContact CB-CD2 4.41Å; K154-L223 HydrophobicContact CB-CD1 4.47Å; K154-L223 HydrophobicContact CB-CD2 3.88Å; K154-L223 HydrophobicContact CG-CD1 4.39Å; K154-L223 HydrophobicContact CG-CD2 4.24Å; L157-L223 HydrophobicContact CD2-CD1 3.79Å; L219-L223 WeakPolarHBondContact O-CG 3.47Å; T220-L223 PolarHBondContact O-N 2.81Å; S221-L223 VanDerWaalsContact C-N 3.33Å; S221-L223 PolarHBondContact O-N 3.05Å; L223-N225 VanDerWaalsContact C-N 3.27Å; L223-A226 WeakPolarHBondContact O-CB 3.2Å; L223-A226 PolarHBondContact O-N 2.95Å
224	E	66.8	Low	74.1	Confident	136 Å²	136	56.2 Å²	56.2	64%	0.636	30%	0.303	S	S	*	.	H	α-helix	trans	-71	-27.8	174.5	-61.5	-167.6	138	0	0	112.1
225	N	65	Low	74.1	Confident	54 Å²	54	52.8 Å²	52.8	29%	0.289	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	14.9	178.7	-68.9	-71.1	0	0	0	113.6	S221 Y222 L223	S221-N225 PolarHBondContact O-ND2 3.13Å; Y222-N225 PolarHBondContact O-N 2.79Å; L223-N225 VanDerWaalsContact C-N 3.27Å
226	A	62.3	Low	74.4	Confident	22 Å²	22	56.5 Å²	56.5	18%	0.182	30%	0.296	C	S	.	.			trans	-65.7	140.7	177.9	0	0	0	0	0	112.1	Y222 L223 D228	Y222-A226 PolarHBondContact O-N 3.38Å; L223-A226 WeakPolarHBondContact O-CB 3.2Å; L223-A226 PolarHBondContact O-N 2.95Å; A226-D228 PolarHBondContact O-N 3.15Å
227	P	63.9	Low	74.6	Confident	36 Å²	36	56.4 Å²	56.4	23%	0.234	30%	0.296	C	S	.	.	H	α-helix	trans	-68	-32.4	-175.2	27.8	-34.5	0	0	0	113.3	I75 Q230 L231 V290 M294	I75-P227 HydrophobicContact CD1-CB 3.8Å; P227-Q230 WeakPolarHBondContact O-CB 3.47Å; P227-Q230 PolarHBondContact O-N 3.07Å; P227-L231 PolarHBondContact O-N 3.47Å; P227-V290 HydrophobicContact CB-CG1 4.45Å; P227-M294 HydrophobicContact CB-CE 3.61Å; P227-M294 HydrophobicContact CG-CE 4.03Å
228	D	66.6	Low	74.9	Confident	26 Å²	26	49.5 Å²	49.5	14%	0.139	26%	0.264	C	S	.	.	H	α-helix	trans	-65.8	-48.6	-171.2	-43.3	-99.8	0	0	0	112.2	A226 Q230 L231 E232 M294 S299 E301	A226-D228 PolarHBondContact O-N 3.15Å; D228-Q230 PolarHBondContact O-N 3.06Å; D228-L231 PolarHBondContact O-N 3.28Å; D228-E232 PolarHBondContact O-N 3.28Å; D228-E232 VanDerWaalsContact O-N 3.12Å; D228-M294 VanDerWaalsContact CA-CE 3.43Å; D228-M294 HydrophobicContact CB-CE 4.11Å; D228-S299 PolarHBondContact OD1-OG 3.44Å; D228-E301 HydrophobicContact CB-CB 4.35Å; D228-E301 WeakPolarHBondContact CB-OE2 3.2Å
229	M	70.4	Confident	75.4	Confident	90 Å²	90	47.1 Å²	47.1	44%	0.443	25%	0.245	S	C	.	.	H	α-helix	trans	-63.3	-23.9	176.5	-177.9	173.9	61	0	0	112.9	K233	M229-K233 WeakPolarHBondContact O-CG 3.47Å; M229-K233 PolarHBondContact O-N 3.45Å
230	Q	74.3	Confident	76.2	Confident	32 Å²	32	50.6 Å²	50.6	15%	0.15	26%	0.26	C	S	.	.	H	α-helix	trans	-89.7	-33.2	-177.8	-73	-95.1	21.7	0	0	111.9	R73 N74 P227 D228 A234	R73-Q230 PolarHBondContact O-OE1 2.95Å; N74-Q230 HydrophobicContact CB-CB 3.75Å; N74-Q230 VanDerWaalsContact CB-CD 3.48Å; N74-Q230 HydrophobicContact CB-CG 3.91Å; N74-Q230 WeakPolarHBondContact ND2-CB 3.15Å; N74-Q230 WeakPolarHBondContact ND2-CG 3.32Å; N74-Q230 WeakPolarHBondContact OD1-CG 3.27Å; N74-Q230 PolarHBondContact OD1-NE2 3.46Å; P227-Q230 WeakPolarHBondContact O-CB 3.47Å; P227-Q230 PolarHBondContact O-N 3.07Å; D228-Q230 PolarHBondContact O-N 3.06Å; Q230-A234 PolarHBondContact O-N 3.14Å
231	L	77.1	Confident	76.9	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-49.6	166.6	176.4	59.8	0	0	0	110.7	P227 D228 K233 A234 M235 V287 V290 A291 M294 L305	P227-L231 PolarHBondContact O-N 3.47Å; D228-L231 PolarHBondContact O-N 3.28Å; L231-K233 PolarHBondContact O-N 3.31Å; L231-A234 PolarHBondContact O-N 3.32Å; L231-A234 VanDerWaalsContact O-N 3.15Å; L231-M235 HydrophobicContact CD1-CG 3.91Å; L231-M235 HydrophobicContact CD1-SD 3.68Å; L231-M235 HydrophobicContact CD2-SD 4.1Å; L231-M235 HydrophobicContact CG-CG 4.27Å; L231-M235 HydrophobicContact CG-SD 3.55Å; L231-M235 VanDerWaalsContact CG-SD 3.55Å; L231-M235 WeakPolarHBondContact O-CG 3.17Å; L231-M235 PolarHBondContact O-N 3.45Å; L231-V287 HydrophobicContact CD1-CB 4.15Å; L231-V287 HydrophobicContact CD1-CG1 4.01Å; L231-V287 HydrophobicContact CD1-CG2 4.12Å; L231-V287 WeakPolarHBondContact CD1-O 3.45Å; L231-V290 HydrophobicContact CB-CG1 3.94Å; L231-V290 HydrophobicContact CD1-CB 4.28Å; L231-V290 HydrophobicContact CD1-CG1 4.28Å; L231-V290 HydrophobicContact CD2-CG1 4.31Å; L231-V290 HydrophobicContact CG-CG1 4.39Å; L231-A291 HydrophobicContact CD1-CB 4.46Å; L231-A291 HydrophobicContact CD2-CB 4.16Å; L231-M294 HydrophobicContact CB-CE 4.03Å; L231-M294 HydrophobicContact CB-SD 4.5Å; L231-M294 HydrophobicContact CD2-CE 3.99Å; L231-M294 HydrophobicContact CD2-SD 3.37Å; L231-M294 WeakPolarHBondContact CD2-SD 3.37Å; L231-L305 HydrophobicContact CD2-CD1 3.75Å; L231-L305 HydrophobicContact CG-CD1 4.14Å
232	E	77.3	Confident	77.7	Confident	91 Å²	91	44.9 Å²	44.9	43%	0.425	22%	0.222	S	C	.	.	H	α-helix	trans	-62.1	-41.6	-177.3	-176.7	161.7	-132.3	0	0	112.7	D228 A234 M235 Q236 L305 K308	D228-E232 PolarHBondContact O-N 3.28Å; D228-E232 VanDerWaalsContact O-N 3.12Å; E232-A234 VanDerWaalsContact C-N 3.33Å; E232-A234 PolarHBondContact O-N 3.34Å; E232-M235 PolarHBondContact O-N 3.46Å; E232-Q236 WeakPolarHBondContact O-CB 3.44Å; E232-Q236 PolarHBondContact O-N 3.24Å; E232-L305 HydrophobicContact CB-CD2 4.25Å; E232-L305 HydrophobicContact CG-CD2 4.3Å; E232-K308 IonicContact OE1-NZ 3.98Å; E232-K308 PolarHBondContact OE1-NZ 3.46Å
233	K	82.1	Confident	78.7	Confident	124 Å²	124	46.2 Å²	46.2	54%	0.539	23%	0.232	S	C	.	.	H	α-helix	trans	-61.6	-37.2	175	-75.3	176	-178.5	175.9	0	113.2	M229 L231	M229-K233 WeakPolarHBondContact O-CG 3.47Å; M229-K233 PolarHBondContact O-N 3.45Å; L231-K233 PolarHBondContact O-N 3.31Å
234	A	83.2	Confident	79.7	Confident	3 Å²	3	47.1 Å²	47.1	3%	0.025	24%	0.242	C	C	.	.	H	α-helix	trans	-74.4	-37.1	177	0	0	0	0	0	112.1	Q230 L231 E232 L238 R283 F286 V287	Q230-A234 PolarHBondContact O-N 3.14Å; L231-A234 PolarHBondContact O-N 3.32Å; L231-A234 VanDerWaalsContact O-N 3.15Å; E232-A234 VanDerWaalsContact C-N 3.33Å; E232-A234 PolarHBondContact O-N 3.34Å; A234-L238 WeakPolarHBondContact O-CG 3.47Å; A234-L238 PolarHBondContact O-N 3.47Å; A234-R283 HydrophobicContact CB-CG 4.36Å; A234-F286 HydrophobicContact CB-CD1 3.6Å; A234-F286 HydrophobicContact CB-CE1 3.57Å; A234-V287 HydrophobicContact CB-CG2 3.58Å
235	M	83.4	Confident	80.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.2	-47.5	176	-74.3	172	60.6	0	0	112.9	L231 E232 S237 L238 L239 V287 L305 K308 V309 L312	L231-M235 HydrophobicContact CD1-CG 3.91Å; L231-M235 HydrophobicContact CD1-SD 3.68Å; L231-M235 HydrophobicContact CD2-SD 4.1Å; L231-M235 HydrophobicContact CG-CG 4.27Å; L231-M235 HydrophobicContact CG-SD 3.55Å; L231-M235 VanDerWaalsContact CG-SD 3.55Å; L231-M235 WeakPolarHBondContact O-CG 3.17Å; L231-M235 PolarHBondContact O-N 3.45Å; E232-M235 PolarHBondContact O-N 3.46Å; M235-S237 VanDerWaalsContact C-N 3.34Å; M235-S237 PolarHBondContact O-N 2.97Å; M235-L238 PolarHBondContact O-N 3.31Å; M235-L239 PolarHBondContact O-N 3.3Å; M235-V287 HydrophobicContact CG-CB 4.29Å; M235-V287 HydrophobicContact CG-CG1 3.46Å; M235-V287 VanDerWaalsContact CG-CG1 3.46Å; M235-V287 HydrophobicContact CG-CG2 3.8Å; M235-V287 HydrophobicContact SD-CG1 4.34Å; M235-L305 HydrophobicContact CE-CB 4.16Å; M235-L305 HydrophobicContact CE-CD2 4.08Å; M235-L305 HydrophobicContact SD-CB 4.31Å; M235-L305 HydrophobicContact SD-CD1 4.46Å; M235-L305 HydrophobicContact SD-CD2 4.17Å; M235-K308 HydrophobicContact CE-CB 3.25Å; M235-K308 HydrophobicContact CE-CD 3.98Å; M235-K308 HydrophobicContact CE-CG 4.26Å; M235-V309 HydrophobicContact CE-CB 4.47Å; M235-V309 HydrophobicContact CE-CG2 3.46Å; M235-V309 VanDerWaalsContact CE-CG2 3.46Å; M235-V309 HydrophobicContact SD-CG2 3.7Å; M235-L312 HydrophobicContact CG-CD1 4.22Å
236	Q	86	Confident	82	Confident	81 Å²	81	41 Å²	41	38%	0.379	21%	0.212	S	C	.	.	H	α-helix	trans	-57.9	-47.9	-176	176.8	55	36.9	0	0	111.3	E232 L238 L239 E240	E232-Q236 WeakPolarHBondContact O-CB 3.44Å; E232-Q236 PolarHBondContact O-N 3.24Å; Q236-L238 VanDerWaalsContact C-N 3.32Å; Q236-L238 PolarHBondContact O-N 3.09Å; Q236-L239 WeakPolarHBondContact O-CB 3.38Å; Q236-L239 PolarHBondContact O-N 3.43Å; Q236-L239 VanDerWaalsContact O-N 3.17Å; Q236-E240 WeakPolarHBondContact CG-OE1 3.33Å; Q236-E240 PolarHBondContact NE2-OE1 3.14Å; Q236-E240 WeakPolarHBondContact O-CG 3.44Å; Q236-E240 PolarHBondContact O-N 3.34Å; Q236-E240 VanDerWaalsContact O-N 3.11Å
237	S	86.9	Confident	83.2	Confident	27 Å²	27	45.2 Å²	45.2	19%	0.189	23%	0.232	C	C	.	.	H	α-helix	trans	-88.1	2.3	-177.9	167.1	0	0	0	0	113.5	M235 E240 R283	M235-S237 VanDerWaalsContact C-N 3.34Å; M235-S237 PolarHBondContact O-N 2.97Å; S237-E240 VanDerWaalsContact CA-OE2 3.27Å; S237-E240 WeakPolarHBondContact CA-OE2 3.47Å; S237-E240 VanDerWaalsContact CB-OE2 3.25Å; S237-E240 WeakPolarHBondContact CB-OE2 3.38Å; S237-R283 PolarHBondContact O-NH1 3.41Å; S237-R283 PolarHBondContact OG-NH1 2.81Å; S237-R283 PolarHBondContact OG-NH2 2.78Å
238	L	89.7	Confident	84.2	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-81.6	-40	155	-84.8	177.8	0	0	0	111.5	A234 M235 Q236 W241 L242 Q280 R283 L284 V287 L312	A234-L238 WeakPolarHBondContact O-CG 3.47Å; A234-L238 PolarHBondContact O-N 3.47Å; M235-L238 PolarHBondContact O-N 3.31Å; Q236-L238 VanDerWaalsContact C-N 3.32Å; Q236-L238 PolarHBondContact O-N 3.09Å; L238-W241 PolarHBondContact O-N 3.03Å; L238-L242 WeakPolarHBondContact O-CB 3.45Å; L238-L242 VanDerWaalsContact O-CG 3.29Å; L238-L242 WeakPolarHBondContact O-CG 3.05Å; L238-L242 PolarHBondContact O-N 3.39Å; L238-Q280 HydrophobicContact CD2-CB 4.04Å; L238-R283 HydrophobicContact CD1-CG 4.36Å; L238-R283 HydrophobicContact CD2-CB 4.11Å; L238-R283 HydrophobicContact CD2-CG 4.22Å; L238-R283 HydrophobicContact CG-CB 4.44Å; L238-R283 HydrophobicContact CG-CG 4.07Å; L238-L284 HydrophobicContact CD1-CB 4.33Å; L238-L284 HydrophobicContact CD1-CD1 4.41Å; L238-V287 HydrophobicContact CD1-CB 4.12Å; L238-V287 HydrophobicContact CD1-CG2 3.78Å; L238-L312 HydrophobicContact CB-CD2 4.11Å
239	L	87.1	Confident	85	Confident	30 Å²	30	44.2 Å²	44.2	16%	0.157	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-47.5	176.7	-70.1	166.6	0	0	0	110.7	M235 Q236 W241 L242 D243 L312	M235-L239 PolarHBondContact O-N 3.3Å; Q236-L239 WeakPolarHBondContact O-CB 3.38Å; Q236-L239 PolarHBondContact O-N 3.43Å; Q236-L239 VanDerWaalsContact O-N 3.17Å; L239-W241 VanDerWaalsContact C-N 3.25Å; L239-W241 PolarHBondContact O-N 3.23Å; L239-L242 WeakPolarHBondContact O-CB 3.39Å; L239-L242 PolarHBondContact O-N 2.81Å; L239-L242 VanDerWaalsContact O-N 3.09Å; L239-D243 PolarHBondContact O-N 2.99Å; L239-L312 HydrophobicContact CD2-CD2 3.55Å; L239-L312 HydrophobicContact CD2-CG 4.28Å; L239-L312 HydrophobicContact CG-CD2 3.88Å
240	E	88.4	Confident	85.5	Confident	86 Å²	86	44.8 Å²	44.8	40%	0.402	23%	0.234	S	C	.	.	H	α-helix	trans	-56.2	-38	176.8	-68.4	158	-177.4	0	0	112.7	Q236 S237 C244	Q236-E240 WeakPolarHBondContact CG-OE1 3.33Å; Q236-E240 PolarHBondContact NE2-OE1 3.14Å; Q236-E240 WeakPolarHBondContact O-CG 3.44Å; Q236-E240 PolarHBondContact O-N 3.34Å; Q236-E240 VanDerWaalsContact O-N 3.11Å; S237-E240 VanDerWaalsContact CA-OE2 3.27Å; S237-E240 WeakPolarHBondContact CA-OE2 3.47Å; S237-E240 VanDerWaalsContact CB-OE2 3.25Å; S237-E240 WeakPolarHBondContact CB-OE2 3.38Å; E240-C244 PolarHBondContact O-N 2.86Å; E240-C244 PolarHBondContact O-SG 3.42Å; E240-C244 VanDerWaalsContact O-SG 3.41Å
241	W	92.9	Very high	85.7	Confident	3 Å²	3	47.2 Å²	47.2	1%	0.011	25%	0.25	C	S	.	.	H	α-helix	trans	-76.6	-36.5	176.1	174.5	87.8	0	0	0	112.7	L238 L239 D243 C244 A245 L273 E276 M277 Q280 W316	L238-W241 PolarHBondContact O-N 3.03Å; L239-W241 VanDerWaalsContact C-N 3.25Å; L239-W241 PolarHBondContact O-N 3.23Å; W241-D243 VanDerWaalsContact C-N 3.29Å; W241-D243 PolarHBondContact O-N 3.05Å; W241-C244 PolarHBondContact O-N 2.98Å; W241-A245 HydrophobicContact CH2-CB 4.25Å; W241-A245 HydrophobicContact CZ2-CB 4.24Å; W241-A245 HydrophobicContact CZ3-CB 4.46Å; W241-A245 WeakPolarHBondContact O-CB 3.39Å; W241-A245 PolarHBondContact O-N 3.28Å; W241-L273 HydrophobicContact CZ2-CD1 4.18Å; W241-E276 HydrophobicContact CZ2-CB 3.91Å; W241-E276 PolarHBondContact NE1-OE2 3.24Å; W241-M277 HydrophobicContact CH2-CB 4.32Å; W241-M277 HydrophobicContact CH2-CE 3.98Å; W241-M277 HydrophobicContact CH2-CG 3.84Å; W241-M277 HydrophobicContact CZ2-CG 4.18Å; W241-Q280 HydrophobicContact CD2-CB 4.46Å; W241-Q280 HydrophobicContact CD2-CG 3.49Å; W241-Q280 VanDerWaalsContact CD2-CG 3.49Å; W241-Q280 HydrophobicContact CE3-CB 4.29Å; W241-Q280 HydrophobicContact CE3-CG 3.78Å; W241-Q280 HydrophobicContact CG-CG 3.91Å; W241-Q280 HydrophobicContact CH2-CB 4.48Å; W241-Q280 HydrophobicContact CH2-CG 4.21Å; W241-Q280 HydrophobicContact CZ2-CG 3.96Å; W241-Q280 HydrophobicContact CZ3-CB 4.3Å; W241-Q280 HydrophobicContact CZ3-CG 4.13Å; W241-W316 HydrophobicContact CE3-CZ3 4.43Å; W241-W316 HydrophobicContact CH2-CH2 4.43Å; W241-W316 AromaticContact CH2-CZ3 3.99Å; W241-W316 HydrophobicContact CH2-CZ3 3.99Å; W241-W316 AromaticContact CZ3-CE3 3.93Å; W241-W316 HydrophobicContact CZ3-CE3 3.93Å; W241-W316 HydrophobicContact CZ3-CH2 4.39Å; W241-W316 AromaticContact CZ3-CZ3 3.54Å; W241-W316 HydrophobicContact CZ3-CZ3 3.54Å
242	L	91.4	Very high	85	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-37.2	173.8	-74.1	165.9	0	0	0	111.6	L238 L239 A245 E246 L312 R315 W316 I319	L238-L242 WeakPolarHBondContact O-CB 3.45Å; L238-L242 VanDerWaalsContact O-CG 3.29Å; L238-L242 WeakPolarHBondContact O-CG 3.05Å; L238-L242 PolarHBondContact O-N 3.39Å; L239-L242 WeakPolarHBondContact O-CB 3.39Å; L239-L242 PolarHBondContact O-N 2.81Å; L239-L242 VanDerWaalsContact O-N 3.09Å; L242-A245 PolarHBondContact O-N 2.65Å; L242-E246 WeakPolarHBondContact O-CG 3.41Å; L242-E246 PolarHBondContact O-N 3.21Å; L242-L312 HydrophobicContact CD1-CD2 3.36Å; L242-R315 HydrophobicContact CD1-CB 4.39Å; L242-R315 HydrophobicContact CD2-CB 4.49Å; L242-W316 HydrophobicContact CD2-CB 4.41Å; L242-W316 HydrophobicContact CD2-CE3 4.19Å; L242-I319 HydrophobicContact CB-CD1 4.38Å; L242-I319 HydrophobicContact CD2-CD1 3.35Å; L242-I319 HydrophobicContact CG-CD1 4.47Å
243	D	89.3	Confident	84.7	Confident	75 Å²	75	56.5 Å²	56.5	40%	0.401	30%	0.298	S	S	.	.	H	α-helix	trans	-60.2	-49	174.1	-60.7	-23	0	0	0	110.3	L239 W241 A245 E246 D247 R315	L239-D243 PolarHBondContact O-N 2.99Å; W241-D243 VanDerWaalsContact C-N 3.29Å; W241-D243 PolarHBondContact O-N 3.05Å; D243-A245 PolarHBondContact O-N 3.37Å; D243-E246 PolarHBondContact O-N 2.64Å; D243-D247 PolarHBondContact O-N 2.89Å; D243-R315 IonicContact OD1-CZ 3.06Å; D243-R315 IonicContact OD1-NH1 2.58Å; D243-R315 PolarHBondContact OD1-NH1 3.41Å; D243-R315 IonicContact OD1-NH2 2.63Å; D243-R315 PolarHBondContact OD1-NH2 3.16Å
244	C	90.4	Very high	84.4	Confident	69 Å²	69	51.6 Å²	51.6	47%	0.466	28%	0.277	S	S	.	.	H	α-helix	trans	-63.2	-36.9	174.9	-64.5	0	0	0	0	113.7	E240 W241 D247 V248	E240-C244 PolarHBondContact O-N 2.86Å; E240-C244 PolarHBondContact O-SG 3.42Å; E240-C244 VanDerWaalsContact O-SG 3.41Å; W241-C244 PolarHBondContact O-N 2.98Å; C244-D247 PolarHBondContact O-N 3.4Å; C244-V248 WeakPolarHBondContact O-CG2 3.42Å; C244-V248 PolarHBondContact O-N 3.06Å; C244-V248 VanDerWaalsContact O-N 3.08Å
245	A	90.1	Very high	83.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-68.2	-36	177.4	0	0	0	0	0	112.2	W241 L242 D243 I249 L273 I319	W241-A245 HydrophobicContact CH2-CB 4.25Å; W241-A245 HydrophobicContact CZ2-CB 4.24Å; W241-A245 HydrophobicContact CZ3-CB 4.46Å; W241-A245 WeakPolarHBondContact O-CB 3.39Å; W241-A245 PolarHBondContact O-N 3.28Å; L242-A245 PolarHBondContact O-N 2.65Å; D243-A245 PolarHBondContact O-N 3.37Å; A245-I249 WeakPolarHBondContact O-CG1 3.31Å; A245-I249 PolarHBondContact O-N 3.42Å; A245-L273 HydrophobicContact CB-CD1 3.91Å; A245-I319 HydrophobicContact CB-CD1 4.16Å; A245-I319 HydrophobicContact CB-CG2 4.22Å
246	E	88.8	Confident	84	Confident	61 Å²	61	55.9 Å²	55.9	29%	0.285	30%	0.301	S	S	.	.	H	α-helix	trans	-69.9	-39.2	172.8	-76.2	173.2	-163	0	0	112	L242 D243 V248 I249 T250 R315 I319	L242-E246 WeakPolarHBondContact O-CG 3.41Å; L242-E246 PolarHBondContact O-N 3.21Å; D243-E246 PolarHBondContact O-N 2.64Å; E246-V248 VanDerWaalsContact C-N 3.33Å; E246-V248 PolarHBondContact O-N 2.88Å; E246-I249 PolarHBondContact O-N 3.07Å; E246-T250 WeakPolarHBondContact O-CB 3.26Å; E246-T250 VanDerWaalsContact O-CG2 3.29Å; E246-T250 WeakPolarHBondContact O-CG2 3.49Å; E246-T250 PolarHBondContact O-N 3.09Å; E246-T250 PolarHBondContact O-OG1 3.37Å; E246-R315 IonicContact OE1-CZ 3.69Å; E246-R315 IonicContact OE1-NE 2.65Å; E246-R315 PolarHBondContact OE1-NE 3.3Å; E246-R315 IonicContact OE1-NH2 3.5Å; E246-R315 PolarHBondContact OE1-NH2 3.44Å; E246-R315 IonicContact OE2-CZ 3.89Å; E246-R315 IonicContact OE2-NE 3.59Å; E246-R315 PolarHBondContact OE2-NE 3.17Å; E246-R315 IonicContact OE2-NH2 3.93Å; E246-R315 PolarHBondContact OE2-NH2 3.22Å; E246-I319 HydrophobicContact CG-CD1 3.75Å; E246-I319 HydrophobicContact CG-CG1 3.78Å
247	D	87.5	Confident	84.1	Confident	112 Å²	112	52.2 Å²	52.2	60%	0.599	28%	0.284	S	S	*	.	H	α-helix	trans	-59.6	-41.5	172.5	-84.2	-10.4	0	0	0	111.8	D243 C244 T250 T251	D243-D247 PolarHBondContact O-N 2.89Å; C244-D247 PolarHBondContact O-N 3.4Å; D247-T250 PolarHBondContact O-OG1 3.29Å; D247-T251 PolarHBondContact O-N 3.4Å; D247-T251 VanDerWaalsContact O-N 3.09Å; D247-T251 PolarHBondContact O-OG1 3.09Å
248	V	86	Confident	84.1	Confident	21 Å²	21	51.9 Å²	51.9	13%	0.127	28%	0.28	C	S	.	.	H	α-helix	trans	-64.5	-47.2	174.5	174.2	0	0	0	0	111.2	C244 E246 T250 T251 L254 L273	C244-V248 WeakPolarHBondContact O-CG2 3.42Å; C244-V248 PolarHBondContact O-N 3.06Å; C244-V248 VanDerWaalsContact O-N 3.08Å; E246-V248 VanDerWaalsContact C-N 3.33Å; E246-V248 PolarHBondContact O-N 2.88Å; V248-T250 VanDerWaalsContact C-N 3.34Å; V248-T250 PolarHBondContact O-N 3.07Å; V248-T251 WeakPolarHBondContact O-CB 3.37Å; V248-T251 PolarHBondContact O-N 2.91Å; V248-L254 HydrophobicContact CG1-CD1 4.47Å; V248-L254 WeakPolarHBondContact O-CD1 3.23Å; V248-L273 HydrophobicContact CB-CD2 4.24Å; V248-L273 HydrophobicContact CG1-CD2 3.96Å
249	I	82.8	Confident	83.9	Confident	20 Å²	20	55.6 Å²	55.6	10%	0.103	30%	0.297	C	S	.	.	H	α-helix	trans	-70.4	-28.8	-178	-72.8	179.6	0	0	0	113.1	A245 E246 L273 I319 V322 L323	A245-I249 WeakPolarHBondContact O-CG1 3.31Å; A245-I249 PolarHBondContact O-N 3.42Å; E246-I249 PolarHBondContact O-N 3.07Å; I249-L273 HydrophobicContact CD1-CD2 4.12Å; I249-L273 HydrophobicContact CG1-CD2 3.87Å; I249-I319 HydrophobicContact CD1-CB 4.18Å; I249-I319 HydrophobicContact CD1-CG2 3.62Å; I249-V322 HydrophobicContact CG2-CB 4.04Å; I249-V322 HydrophobicContact CG2-CG1 3.4Å; I249-V322 VanDerWaalsContact CG2-CG1 3.4Å; I249-L323 HydrophobicContact CD1-CB 4.02Å
250	T	81.2	Confident	83.9	Confident	102 Å²	102	55.3 Å²	55.3	63%	0.626	30%	0.297	S	S	*	.	H	α-helix	trans	-88.8	-8	178.8	58.3	0	0	0	0	114.1	E246 D247 V248 Q252	E246-T250 WeakPolarHBondContact O-CB 3.26Å; E246-T250 VanDerWaalsContact O-CG2 3.29Å; E246-T250 WeakPolarHBondContact O-CG2 3.49Å; E246-T250 PolarHBondContact O-N 3.09Å; E246-T250 PolarHBondContact O-OG1 3.37Å; D247-T250 PolarHBondContact O-OG1 3.29Å; V248-T250 VanDerWaalsContact C-N 3.34Å; V248-T250 PolarHBondContact O-N 3.07Å; T250-Q252 PolarHBondContact O-N 2.9Å
251	T	77.8	Confident	83.8	Confident	82 Å²	82	57.7 Å²	57.7	50%	0.503	31%	0.308	S	S	.	.	S	Bend	trans	-60	125.9	171.3	-69	0	0	0	0	109.9	D247 V248 L254	D247-T251 PolarHBondContact O-N 3.4Å; D247-T251 VanDerWaalsContact O-N 3.09Å; D247-T251 PolarHBondContact O-OG1 3.09Å; V248-T251 WeakPolarHBondContact O-CB 3.37Å; V248-T251 PolarHBondContact O-N 2.91Å; T251-L254 HydrophobicContact CG2-CD1 4.18Å
252	Q	62.8	Low	83.6	Confident	175 Å²	175	60.3 Å²	60.3	82%	0.818	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	162.5	-177.8	-65.8	-178.9	-1.2	0	0	111.5	T250 L254	T250-Q252 PolarHBondContact O-N 2.9Å; Q252-L254 PolarHBondContact O-N 3.02Å
253	D	70.7	Confident	83.4	Confident	112 Å²	112	60.2 Å²	60.2	60%	0.599	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	-1.2	-174.8	-55.9	-36.6	0	0	0	117.2	D255 V256 K266	D253-D255 PolarHBondContact O-N 3.46Å; D253-V256 HydrophobicContact CB-CG2 4.33Å; D253-V256 WeakPolarHBondContact O-CG2 3.47Å; D253-K266 WeakPolarHBondContact O-CE 3.32Å; D253-K266 PolarHBondContact O-NZ 3.28Å
254	L	75.4	Confident	83.5	Confident	20 Å²	20	58.2 Å²	58.2	11%	0.105	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-13.3	179.4	-84.1	169.6	0	0	0	116.2	V248 T251 Q252 K266 L330	V248-L254 HydrophobicContact CG1-CD1 4.47Å; V248-L254 WeakPolarHBondContact O-CD1 3.23Å; T251-L254 HydrophobicContact CG2-CD1 4.18Å; Q252-L254 PolarHBondContact O-N 3.02Å; L254-K266 HydrophobicContact CD2-CB 4.12Å; L254-K266 HydrophobicContact CD2-CG 4.1Å; L254-L330 WeakPolarHBondContact O-CD1 3.27Å
255	D	73.8	Confident	83.4	Confident	58 Å²	58	57.8 Å²	57.8	31%	0.31	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	6.5	-180	85.5	-50.4	0	0	0	114.9	D253 Q326 R329	D253-D255 PolarHBondContact O-N 3.46Å; D255-Q326 HydrophobicContact CB-CG 4.09Å; D255-R329 PolarHBondContact O-NH2 3.34Å; D255-R329 IonicContact OD2-CZ 2.71Å; D255-R329 IonicContact OD2-NH1 2.65Å; D255-R329 PolarHBondContact OD2-NH1 2.83Å; D255-R329 IonicContact OD2-NH2 3.39Å; D255-R329 PolarHBondContact OD2-NH2 3.18Å
256	V	84.6	Confident	83.4	Confident	36 Å²	36	58.9 Å²	58.9	22%	0.218	32%	0.324	C	S	.	.	S	Bend	trans	-116.8	143.9	-178.5	-69	0	0	0	0	112.3	D253 K266 T407	D253-V256 HydrophobicContact CB-CG2 4.33Å; D253-V256 WeakPolarHBondContact O-CG2 3.47Å; V256-K266 PolarHBondContact O-NZ 3.44Å; V256-T407 HydrophobicContact CB-CG2 4.2Å; V256-T407 HydrophobicContact CG2-CG2 3.71Å
257	I	87.7	Confident	83.4	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.015	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-85.8	140.2	-175.9	-62.5	-174.3	0	0	0	110.7	T263 L330 L337 I405 C406 T407	I257-T263 HydrophobicContact CG1-CG2 4.4Å; I257-T263 HydrophobicContact CG2-CG2 4.24Å; I257-L330 HydrophobicContact CG1-CD2 4.02Å; I257-L337 HydrophobicContact CG2-CD2 4.04Å; I257-I405 HydrophobicContact CD1-CD1 3.74Å; I257-I405 HydrophobicContact CD1-CG1 4.09Å; I257-I405 PolarHBondContact N-O 2.82Å; I257-C406 CarbonylContact O-C 3.55Å; I257-C406 WeakPolarHBondContact O-CA 3.4Å; I257-T407 PolarHBondContact O-N 3.4Å
258	D	87.8	Confident	83.6	Confident	21 Å²	21	54.7 Å²	54.7	11%	0.112	31%	0.309	C	S	.	.			trans	-133.1	-160.8	174.7	-148.4	-66	0	0	0	108.7	V262 T263 L337 T407	D258-V262 HydrophobicContact CB-CB 4.14Å; D258-V262 HydrophobicContact CB-CG1 3.85Å; D258-T263 PolarHBondContact N-OG1 3.37Å; D258-T263 PolarHBondContact O-OG1 2.95Å; D258-L337 WeakPolarHBondContact O-CD2 3.43Å; D258-T407 HydrophobicContact CB-CG2 4.2Å; D258-T407 WeakPolarHBondContact OD2-CB 3.4Å; D258-T407 WeakPolarHBondContact OD2-CG2 3.47Å; D258-T407 PolarHBondContact OD2-OG1 2.99Å
259	Q	85.8	Confident	83.7	Confident	80 Å²	80	56.4 Å²	56.4	37%	0.374	31%	0.313	S	S	.	.	S	Bend	trans	-47.6	149.8	173.4	-58.1	-173.9	-105.7	0	0	112.5	E261 V262 T263 M410	Q259-E261 VanDerWaalsContact C-N 3.31Å; Q259-E261 PolarHBondContact O-N 3.27Å; Q259-V262 HydrophobicContact CB-CG2 4.3Å; Q259-V262 WeakPolarHBondContact O-CB 3.47Å; Q259-V262 PolarHBondContact O-N 3.13Å; Q259-T263 PolarHBondContact O-N 3.16Å; Q259-T263 PolarHBondContact O-OG1 3.47Å; Q259-M410 HydrophobicContact CG-SD 4.41Å
260	V	86.2	Confident	84.1	Confident	24 Å²	24	55.4 Å²	55.4	15%	0.145	31%	0.308	C	S	.	.	H	α-helix	trans	-53	-43.7	-173.4	166.8	0	0	0	0	112.7	V262 T263 A264 F334 L337 E341	V260-V262 VanDerWaalsContact C-N 3.35Å; V260-V262 PolarHBondContact O-N 3.35Å; V260-T263 PolarHBondContact O-N 2.92Å; V260-A264 WeakPolarHBondContact O-CB 3.19Å; V260-A264 PolarHBondContact O-N 3.3Å; V260-F334 HydrophobicContact CB-CE2 4.4Å; V260-F334 HydrophobicContact CG1-CE2 3.82Å; V260-F334 HydrophobicContact CG1-CZ 4.18Å; V260-F334 WeakPolarHBondContact O-CE2 3.47Å; V260-L337 HydrophobicContact CG2-CD2 3.68Å; V260-L337 HydrophobicContact CG2-CG 3.85Å; V260-E341 WeakPolarHBondContact CG2-OE1 3.48Å; V260-E341 WeakPolarHBondContact CG2-OE2 3.23Å
261	E	87.5	Confident	84.5	Confident	135 Å²	135	53.8 Å²	53.8	63%	0.631	29%	0.292	S	S	*	.	H	α-helix	trans	-64.9	-39.6	179	-54.1	84.5	171.3	0	0	112.1	Q259 A265	Q259-E261 VanDerWaalsContact C-N 3.31Å; Q259-E261 PolarHBondContact O-N 3.27Å; E261-A265 WeakPolarHBondContact O-CB 3.43Å; E261-A265 PolarHBondContact O-N 3.44Å
262	V	87.8	Confident	85.2	Confident	59 Å²	59	53.7 Å²	53.7	36%	0.358	29%	0.286	S	S	.	.	H	α-helix	trans	-70.2	-45.3	179.9	177.6	0	0	0	0	110.2	D258 Q259 V260 A265 K266	D258-V262 HydrophobicContact CB-CB 4.14Å; D258-V262 HydrophobicContact CB-CG1 3.85Å; Q259-V262 HydrophobicContact CB-CG2 4.3Å; Q259-V262 WeakPolarHBondContact O-CB 3.47Å; Q259-V262 PolarHBondContact O-N 3.13Å; V260-V262 VanDerWaalsContact C-N 3.35Å; V260-V262 PolarHBondContact O-N 3.35Å; V262-A265 WeakPolarHBondContact O-CB 3.46Å; V262-A265 PolarHBondContact O-N 3.13Å; V262-K266 WeakPolarHBondContact O-CG 3.2Å; V262-K266 PolarHBondContact O-N 3Å
263	T	88.2	Confident	86.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.8	-39.3	177.5	-57.3	0	0	0	0	111.4	I257 D258 Q259 V260 A265 K266 I267 F334	I257-T263 HydrophobicContact CG1-CG2 4.4Å; I257-T263 HydrophobicContact CG2-CG2 4.24Å; D258-T263 PolarHBondContact N-OG1 3.37Å; D258-T263 PolarHBondContact O-OG1 2.95Å; Q259-T263 PolarHBondContact O-N 3.16Å; Q259-T263 PolarHBondContact O-OG1 3.47Å; V260-T263 PolarHBondContact O-N 2.92Å; T263-A265 VanDerWaalsContact C-N 3.31Å; T263-A265 PolarHBondContact O-N 3.12Å; T263-K266 PolarHBondContact O-N 3.2Å; T263-I267 HydrophobicContact CG2-CD1 4.02Å; T263-I267 WeakPolarHBondContact O-CB 3.42Å; T263-I267 WeakPolarHBondContact O-CG1 3.46Å; T263-I267 PolarHBondContact O-N 2.92Å; T263-F334 HydrophobicContact CG2-CB 3.96Å; T263-F334 HydrophobicContact CG2-CD2 3.59Å; T263-F334 HydrophobicContact CG2-CE2 4.5Å; T263-F334 HydrophobicContact CG2-CG 4.15Å
264	A	90.5	Very high	87.5	Confident	33 Å²	33	45 Å²	45	27%	0.273	24%	0.242	S	C	.	.	H	α-helix	trans	-61.8	-36.9	172.2	0	0	0	0	0	112.4	V260 S268 F334	V260-A264 WeakPolarHBondContact O-CB 3.19Å; V260-A264 PolarHBondContact O-N 3.3Å; A264-S268 VanDerWaalsContact O-CB 3.31Å; A264-S268 WeakPolarHBondContact O-CB 3.02Å; A264-S268 PolarHBondContact O-N 3.15Å; A264-S268 PolarHBondContact O-OG 3.11Å; A264-F334 HydrophobicContact CB-CE2 4.01Å; A264-F334 HydrophobicContact CB-CZ 3.96Å
265	A	89.2	Confident	88.2	Confident	60 Å²	60	49.2 Å²	49.2	50%	0.496	26%	0.26	S	S	.	.	H	α-helix	trans	-67.2	-43.2	173.8	0	0	0	0	0	112.4	E261 V262 T263 S268 R269	E261-A265 WeakPolarHBondContact O-CB 3.43Å; E261-A265 PolarHBondContact O-N 3.44Å; V262-A265 WeakPolarHBondContact O-CB 3.46Å; V262-A265 PolarHBondContact O-N 3.13Å; T263-A265 VanDerWaalsContact C-N 3.31Å; T263-A265 PolarHBondContact O-N 3.12Å; A265-S268 PolarHBondContact O-N 3.48Å; A265-R269 PolarHBondContact O-N 3.23Å
266	K	88.7	Confident	89	Confident	23 Å²	23	47.7 Å²	47.7	10%	0.1	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-49	173.5	-66.2	178.6	-172.1	-175.7	0	111.5	D253 L254 V256 V262 T263 S268 R269 L270 L330	D253-K266 WeakPolarHBondContact O-CE 3.32Å; D253-K266 PolarHBondContact O-NZ 3.28Å; L254-K266 HydrophobicContact CD2-CB 4.12Å; L254-K266 HydrophobicContact CD2-CG 4.1Å; V256-K266 PolarHBondContact O-NZ 3.44Å; V262-K266 WeakPolarHBondContact O-CG 3.2Å; V262-K266 PolarHBondContact O-N 3Å; T263-K266 PolarHBondContact O-N 3.2Å; K266-S268 VanDerWaalsContact C-N 3.32Å; K266-S268 PolarHBondContact O-N 3.19Å; K266-R269 PolarHBondContact O-N 3.41Å; K266-L270 PolarHBondContact O-N 3.38Å; K266-L270 VanDerWaalsContact O-N 3.08Å; K266-L330 HydrophobicContact CB-CD1 3.99Å
267	I	90.2	Very high	89.2	Confident	10 Å²	10	46.2 Å²	46.2	5%	0.051	24%	0.241	C	C	.	.	H	α-helix	trans	-58.9	-43.6	175.9	-71.2	167.4	0	0	0	110.9	T263 R269 L270 K271 L330 D331 F334	T263-I267 HydrophobicContact CG2-CD1 4.02Å; T263-I267 WeakPolarHBondContact O-CB 3.42Å; T263-I267 WeakPolarHBondContact O-CG1 3.46Å; T263-I267 PolarHBondContact O-N 2.92Å; I267-R269 PolarHBondContact O-N 2.9Å; I267-L270 PolarHBondContact O-N 3.4Å; I267-K271 HydrophobicContact CG2-CD 3.76Å; I267-K271 HydrophobicContact CG2-CG 4.47Å; I267-K271 WeakPolarHBondContact O-CB 3.49Å; I267-K271 WeakPolarHBondContact O-CG 3.47Å; I267-K271 PolarHBondContact O-N 3.35Å; I267-L330 HydrophobicContact CD1-CB 4.03Å; I267-L330 HydrophobicContact CG1-CB 3.63Å; I267-L330 HydrophobicContact CG1-CD1 3.9Å; I267-L330 HydrophobicContact CG1-CG 4.44Å; I267-D331 WeakPolarHBondContact CG2-OD1 3.45Å; I267-F334 HydrophobicContact CD1-CB 3.64Å; I267-F334 HydrophobicContact CD1-CD1 3.89Å; I267-F334 HydrophobicContact CD1-CD2 4.17Å; I267-F334 HydrophobicContact CD1-CG 3.64Å
268	S	91	Very high	89.3	Confident	75 Å²	75	48.6 Å²	48.6	52%	0.524	26%	0.261	S	S	.	.	H	α-helix	trans	-63.9	-40.3	178.4	-60.5	0	0	0	0	112.2	A264 A265 K266 K271 E272	A264-S268 VanDerWaalsContact O-CB 3.31Å; A264-S268 WeakPolarHBondContact O-CB 3.02Å; A264-S268 PolarHBondContact O-N 3.15Å; A264-S268 PolarHBondContact O-OG 3.11Å; A265-S268 PolarHBondContact O-N 3.48Å; K266-S268 VanDerWaalsContact C-N 3.32Å; K266-S268 PolarHBondContact O-N 3.19Å; S268-K271 PolarHBondContact O-N 2.88Å; S268-E272 PolarHBondContact O-N 3.39Å
269	R	89.3	Confident	89.4	Confident	56 Å²	56	52 Å²	52	21%	0.211	28%	0.282	C	S	.	.	H	α-helix	trans	-62.8	-46	177	-179.4	60.7	-174.9	153.1	8	112	D69 A265 K266 I267 E272 L273	D69-R269 IonicContact OD1-CZ 3.27Å; D69-R269 IonicContact OD1-NH1 3.5Å; D69-R269 PolarHBondContact OD1-NH1 3.11Å; D69-R269 IonicContact OD1-NH2 3.44Å; D69-R269 PolarHBondContact OD1-NH2 3.28Å; D69-R269 IonicContact OD2-CZ 2.74Å; D69-R269 IonicContact OD2-NH1 2.68Å; D69-R269 PolarHBondContact OD2-NH1 3.05Å; A265-R269 PolarHBondContact O-N 3.23Å; K266-R269 PolarHBondContact O-N 3.41Å; I267-R269 PolarHBondContact O-N 2.9Å; R269-E272 PolarHBondContact O-N 2.81Å; R269-L273 PolarHBondContact O-N 3.27Å
270	L	89.7	Confident	89.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68.9	-35	177.3	-66.5	-178.7	0	0	0	112.2	K266 I267 E272 L273 E274 L323 Q326 L327 L330	K266-L270 PolarHBondContact O-N 3.38Å; K266-L270 VanDerWaalsContact O-N 3.08Å; I267-L270 PolarHBondContact O-N 3.4Å; L270-E272 VanDerWaalsContact C-N 3.3Å; L270-E272 PolarHBondContact O-N 2.9Å; L270-L273 PolarHBondContact O-N 3.38Å; L270-E274 PolarHBondContact O-N 2.99Å; L270-L323 HydrophobicContact CB-CD1 3.79Å; L270-L323 HydrophobicContact CD2-CD1 3.85Å; L270-L323 HydrophobicContact CG-CD1 4.28Å; L270-Q326 HydrophobicContact CD1-CB 3.94Å; L270-L327 HydrophobicContact CB-CD2 3.42Å; L270-L327 VanDerWaalsContact CB-CD2 3.42Å; L270-L327 HydrophobicContact CB-CG 3.93Å; L270-L327 HydrophobicContact CD1-CD2 4.24Å; L270-L327 HydrophobicContact CD1-CG 4.46Å; L270-L327 HydrophobicContact CG-CD2 4.49Å; L270-L330 HydrophobicContact CD1-CD1 3.89Å
271	K	91.1	Very high	89.7	Confident	68 Å²	68	52.6 Å²	52.6	30%	0.296	28%	0.279	S	S	.	.	H	α-helix	trans	-71.9	-18.9	173.5	-74.8	175.5	-179.8	162.3	0	113.8	I267 S268 K275 L327 D331	I267-K271 HydrophobicContact CG2-CD 3.76Å; I267-K271 HydrophobicContact CG2-CG 4.47Å; I267-K271 WeakPolarHBondContact O-CB 3.49Å; I267-K271 WeakPolarHBondContact O-CG 3.47Å; I267-K271 PolarHBondContact O-N 3.35Å; S268-K271 PolarHBondContact O-N 2.88Å; K271-K275 WeakPolarHBondContact O-CE 3.2Å; K271-K275 WeakPolarHBondContact O-CG 3.46Å; K271-K275 PolarHBondContact O-N 3.25Å; K271-L327 HydrophobicContact CG-CD1 4.37Å; K271-L327 HydrophobicContact CG-CD2 3.78Å; K271-D331 VanDerWaalsContact CE-OD2 3.27Å; K271-D331 WeakPolarHBondContact CE-OD2 3.13Å; K271-D331 IonicContact NZ-OD1 3.89Å; K271-D331 PolarHBondContact NZ-OD1 3.27Å; K271-D331 IonicContact NZ-OD2 2.9Å; K271-D331 PolarHBondContact NZ-OD2 2.96Å
272	E	91.1	Very high	89.6	Confident	80 Å²	80	52.4 Å²	52.4	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-75.4	-44.3	166.7	-152.5	62.9	-139.1	0	0	110.8	S268 R269 L270 E274 K275 E276	S268-E272 PolarHBondContact O-N 3.39Å; R269-E272 PolarHBondContact O-N 2.81Å; L270-E272 VanDerWaalsContact C-N 3.3Å; L270-E272 PolarHBondContact O-N 2.9Å; E272-E274 PolarHBondContact O-N 2.98Å; E272-K275 WeakPolarHBondContact O-CA 3.36Å; E272-K275 WeakPolarHBondContact O-CB 3.37Å; E272-K275 PolarHBondContact O-N 3.18Å; E272-K275 WeakPolarHBondContact OE1-CD 3.3Å; E272-K275 IonicContact OE1-NZ 2.72Å; E272-K275 IonicContact OE2-NZ 3.55Å; E272-K275 PolarHBondContact OE2-NZ 3.43Å; E272-E276 PolarHBondContact O-N 2.94Å
273	L	90.6	Very high	89.6	Confident	3 Å²	3	50.3 Å²	50.3	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-36.3	174.1	-173.7	62.7	0	0	0	112.1	W241 A245 V248 I249 R269 L270 K275 E276 M277 L323	W241-L273 HydrophobicContact CZ2-CD1 4.18Å; A245-L273 HydrophobicContact CB-CD1 3.91Å; V248-L273 HydrophobicContact CB-CD2 4.24Å; V248-L273 HydrophobicContact CG1-CD2 3.96Å; I249-L273 HydrophobicContact CD1-CD2 4.12Å; I249-L273 HydrophobicContact CG1-CD2 3.87Å; R269-L273 PolarHBondContact O-N 3.27Å; L270-L273 PolarHBondContact O-N 3.38Å; L273-K275 PolarHBondContact O-N 2.94Å; L273-E276 WeakPolarHBondContact O-CB 3.48Å; L273-E276 PolarHBondContact O-N 3.4Å; L273-M277 WeakPolarHBondContact O-CG 3.38Å; L273-M277 PolarHBondContact O-N 3.44Å; L273-L323 HydrophobicContact CB-CD2 4.46Å; L273-L323 HydrophobicContact CD2-CD1 4.32Å; L273-L323 HydrophobicContact CD2-CD2 4.36Å; L273-L323 HydrophobicContact CG-CD2 4.18Å
274	E	90.9	Very high	89.6	Confident	101 Å²	101	51.3 Å²	51.3	47%	0.472	27%	0.269	S	S	.	.	H	α-helix	trans	-61.1	-39.2	173	-171.8	-177.2	-162	0	0	112.7	L270 E272 M277 A278 L323 L327	L270-E274 PolarHBondContact O-N 2.99Å; E272-E274 PolarHBondContact O-N 2.98Å; E274-M277 WeakPolarHBondContact O-CB 3.19Å; E274-M277 PolarHBondContact O-N 3.25Å; E274-A278 PolarHBondContact O-N 3.48Å; E274-L323 HydrophobicContact CB-CD2 4.18Å; E274-L327 HydrophobicContact CB-CD1 4.45Å
275	K	91.3	Very high	89.4	Confident	109 Å²	109	52.1 Å²	52.1	47%	0.474	27%	0.273	S	S	.	.	H	α-helix	trans	-69.2	-39.4	174.3	-62.1	162.8	-160.5	166.1	0	111.2	K271 E272 L273 M277 A278 V279	K271-K275 WeakPolarHBondContact O-CE 3.2Å; K271-K275 WeakPolarHBondContact O-CG 3.46Å; K271-K275 PolarHBondContact O-N 3.25Å; E272-K275 WeakPolarHBondContact O-CA 3.36Å; E272-K275 WeakPolarHBondContact O-CB 3.37Å; E272-K275 PolarHBondContact O-N 3.18Å; E272-K275 WeakPolarHBondContact OE1-CD 3.3Å; E272-K275 IonicContact OE1-NZ 2.72Å; E272-K275 IonicContact OE2-NZ 3.55Å; E272-K275 PolarHBondContact OE2-NZ 3.43Å; L273-K275 PolarHBondContact O-N 2.94Å; K275-M277 VanDerWaalsContact C-N 3.35Å; K275-A278 WeakPolarHBondContact O-CA 3.48Å; K275-A278 WeakPolarHBondContact O-CB 3.27Å; K275-A278 PolarHBondContact O-N 2.7Å; K275-A278 VanDerWaalsContact O-N 3.11Å; K275-V279 WeakPolarHBondContact O-CG2 3.48Å; K275-V279 PolarHBondContact O-N 2.63Å
276	E	90.2	Very high	89.2	Confident	26 Å²	26	50 Å²	50	12%	0.121	25%	0.252	C	S	.	.	H	α-helix	trans	-60.5	-44.5	173	-71.9	-172.3	-128.1	0	0	111.4	D69 W241 E272 L273 A278 V279 Q280	D69-E276 WeakPolarHBondContact CB-OE1 3.39Å; W241-E276 HydrophobicContact CZ2-CB 3.91Å; W241-E276 PolarHBondContact NE1-OE2 3.24Å; E272-E276 PolarHBondContact O-N 2.94Å; L273-E276 WeakPolarHBondContact O-CB 3.48Å; L273-E276 PolarHBondContact O-N 3.4Å; E276-A278 VanDerWaalsContact C-N 3.28Å; E276-A278 PolarHBondContact O-N 2.73Å; E276-V279 PolarHBondContact O-N 3Å; E276-V279 VanDerWaalsContact O-N 3.15Å; E276-Q280 WeakPolarHBondContact O-CG 3.38Å; E276-Q280 PolarHBondContact O-N 3.41Å
277	M	89	Confident	89.1	Confident	5 Å²	5	49 Å²	49	3%	0.025	25%	0.248	C	C	.	.	H	α-helix	trans	-55.9	-44.6	170.9	-57.6	-141.7	69	0	0	110.8	W241 L273 E274 K275 V279 Q280 R281 W316 I319 E320 L323	W241-M277 HydrophobicContact CH2-CB 4.32Å; W241-M277 HydrophobicContact CH2-CE 3.98Å; W241-M277 HydrophobicContact CH2-CG 3.84Å; W241-M277 HydrophobicContact CZ2-CG 4.18Å; L273-M277 WeakPolarHBondContact O-CG 3.38Å; L273-M277 PolarHBondContact O-N 3.44Å; E274-M277 WeakPolarHBondContact O-CB 3.19Å; E274-M277 PolarHBondContact O-N 3.25Å; K275-M277 VanDerWaalsContact C-N 3.35Å; M277-V279 VanDerWaalsContact C-N 3.3Å; M277-V279 PolarHBondContact O-N 3.43Å; M277-Q280 PolarHBondContact O-N 3.25Å; M277-R281 WeakPolarHBondContact O-CB 3.48Å; M277-R281 PolarHBondContact O-N 3.19Å; M277-W316 HydrophobicContact CB-CH2 4.34Å; M277-W316 HydrophobicContact CB-CZ2 4.33Å; M277-W316 HydrophobicContact CE-CD2 3.74Å; M277-W316 HydrophobicContact CE-CE3 4.07Å; M277-W316 HydrophobicContact CE-CG 4.31Å; M277-W316 HydrophobicContact CE-CH2 4.02Å; M277-W316 HydrophobicContact CE-CZ2 3.69Å; M277-W316 HydrophobicContact CE-CZ3 4.2Å; M277-W316 VanDerWaalsContact O-CH2 3.23Å; M277-W316 WeakPolarHBondContact O-CH2 3.18Å; M277-I319 HydrophobicContact CE-CB 4.35Å; M277-I319 HydrophobicContact CE-CG2 3.76Å; M277-I319 HydrophobicContact SD-CG2 3.77Å; M277-E320 HydrophobicContact CE-CB 4.04Å; M277-E320 HydrophobicContact SD-CB 4.19Å; M277-L323 HydrophobicContact CG-CD2 4.03Å; M277-L323 HydrophobicContact SD-CD2 3.76Å
278	A	89.4	Confident	88.8	Confident	52 Å²	52	51.1 Å²	51.1	43%	0.43	26%	0.261	S	S	.	.	H	α-helix	trans	-60.6	-37.9	178.6	0	0	0	0	0	112.9	E274 K275 E276	E274-A278 PolarHBondContact O-N 3.48Å; K275-A278 WeakPolarHBondContact O-CA 3.48Å; K275-A278 WeakPolarHBondContact O-CB 3.27Å; K275-A278 PolarHBondContact O-N 2.7Å; K275-A278 VanDerWaalsContact O-N 3.11Å; E276-A278 VanDerWaalsContact C-N 3.28Å; E276-A278 PolarHBondContact O-N 2.73Å
279	V	89.7	Confident	88.5	Confident	92 Å²	92	51.9 Å²	51.9	56%	0.558	26%	0.26	S	S	*	.	H	α-helix	trans	-72.6	-48.2	175.9	174.6	0	0	0	0	111.8	K275 E276 M277 R281 E282	K275-V279 WeakPolarHBondContact O-CG2 3.48Å; K275-V279 PolarHBondContact O-N 2.63Å; E276-V279 PolarHBondContact O-N 3Å; E276-V279 VanDerWaalsContact O-N 3.15Å; M277-V279 VanDerWaalsContact C-N 3.3Å; M277-V279 PolarHBondContact O-N 3.43Å; V279-R281 PolarHBondContact O-N 3.33Å; V279-E282 PolarHBondContact O-N 3.29Å
280	Q	88.8	Confident	88.2	Confident	3 Å²	3	49.8 Å²	49.8	1%	0.014	25%	0.253	C	S	.	.	H	α-helix	trans	-66.4	-20	179.5	-57.9	-46.3	-32.6	0	0	113.1	S70 S71 L238 W241 E276 M277 E282 R283 L284 W316	S70-Q280 PolarHBondContact O-NE2 3.47Å; S71-Q280 VanDerWaalsContact CB-NE2 3.27Å; S71-Q280 PolarHBondContact OG-NE2 3.09Å; S71-Q280 PolarHBondContact OG-OE1 3.27Å; L238-Q280 HydrophobicContact CD2-CB 4.04Å; W241-Q280 HydrophobicContact CD2-CB 4.46Å; W241-Q280 HydrophobicContact CD2-CG 3.49Å; W241-Q280 VanDerWaalsContact CD2-CG 3.49Å; W241-Q280 HydrophobicContact CE3-CB 4.29Å; W241-Q280 HydrophobicContact CE3-CG 3.78Å; W241-Q280 HydrophobicContact CG-CG 3.91Å; W241-Q280 HydrophobicContact CH2-CB 4.48Å; W241-Q280 HydrophobicContact CH2-CG 4.21Å; W241-Q280 HydrophobicContact CZ2-CG 3.96Å; W241-Q280 HydrophobicContact CZ3-CB 4.3Å; W241-Q280 HydrophobicContact CZ3-CG 4.13Å; E276-Q280 WeakPolarHBondContact O-CG 3.38Å; E276-Q280 PolarHBondContact O-N 3.41Å; M277-Q280 PolarHBondContact O-N 3.25Å; Q280-E282 PolarHBondContact O-N 2.97Å; Q280-R283 CarbonylContact O-C 3.58Å; Q280-R283 WeakPolarHBondContact O-CA 3.34Å; Q280-R283 WeakPolarHBondContact O-CB 3.49Å; Q280-R283 PolarHBondContact O-N 2.83Å; Q280-L284 PolarHBondContact O-N 3.36Å; Q280-W316 HydrophobicContact CB-CH2 3.9Å; Q280-W316 HydrophobicContact CB-CZ3 3.77Å
281	R	89.9	Confident	87.8	Confident	114 Å²	114	49.9 Å²	49.9	43%	0.43	25%	0.254	S	S	.	.	H	α-helix	trans	-58.7	-32.6	179.3	-165.7	178.8	-74.6	120.8	-8.8	112.2	M277 V279 R283 S285 W316 E320	M277-R281 WeakPolarHBondContact O-CB 3.48Å; M277-R281 PolarHBondContact O-N 3.19Å; V279-R281 PolarHBondContact O-N 3.33Å; R281-R283 VanDerWaalsContact C-N 3.34Å; R281-S285 WeakPolarHBondContact O-CB 3.41Å; R281-S285 PolarHBondContact O-N 3.15Å; R281-W316 HydrophobicContact CB-CH2 4.08Å; R281-W316 HydrophobicContact CB-CZ2 3.98Å; R281-W316 HydrophobicContact CG-CZ2 4.21Å; R281-E320 IonicContact CZ-OE1 3.2Å; R281-E320 IonicContact NE-OE1 2.75Å; R281-E320 IonicContact NH2-OE1 2.76Å; R281-E320 PolarHBondContact NH2-OE1 3.4Å
282	E	85.7	Confident	87.3	Confident	132 Å²	132	49 Å²	49	62%	0.617	25%	0.252	S	S	*	.	H	α-helix	trans	-63.2	-40.9	171.6	-69	-160.3	172.8	0	0	112.1	V279 Q280 S285 F286	V279-E282 PolarHBondContact O-N 3.29Å; Q280-E282 PolarHBondContact O-N 2.97Å; E282-S285 PolarHBondContact O-N 3.47Å; E282-S285 PolarHBondContact O-OG 3.36Å; E282-F286 PolarHBondContact O-N 3.07Å
283	R	86.7	Confident	86.6	Confident	14 Å²	14	49.3 Å²	49.3	5%	0.053	25%	0.253	C	S	.	.	H	α-helix	trans	-74	-37.1	-178.7	-162.9	-179.4	-164.5	-162	2.5	111.8	A72 A234 S237 L238 Q280 R281 S285 F286 V287	A72-R283 WeakPolarHBondContact O-CD 3.3Å; A72-R283 PolarHBondContact O-NE 3.26Å; A234-R283 HydrophobicContact CB-CG 4.36Å; S237-R283 PolarHBondContact O-NH1 3.41Å; S237-R283 PolarHBondContact OG-NH1 2.81Å; S237-R283 PolarHBondContact OG-NH2 2.78Å; L238-R283 HydrophobicContact CD1-CG 4.36Å; L238-R283 HydrophobicContact CD2-CB 4.11Å; L238-R283 HydrophobicContact CD2-CG 4.22Å; L238-R283 HydrophobicContact CG-CB 4.44Å; L238-R283 HydrophobicContact CG-CG 4.07Å; Q280-R283 CarbonylContact O-C 3.58Å; Q280-R283 WeakPolarHBondContact O-CA 3.34Å; Q280-R283 WeakPolarHBondContact O-CB 3.49Å; Q280-R283 PolarHBondContact O-N 2.83Å; R281-R283 VanDerWaalsContact C-N 3.34Å; R283-S285 VanDerWaalsContact C-N 3.33Å; R283-F286 PolarHBondContact O-N 2.97Å; R283-V287 WeakPolarHBondContact O-CB 3.38Å; R283-V287 WeakPolarHBondContact O-CG2 3.38Å; R283-V287 PolarHBondContact O-N 3.25Å
284	L	88.1	Confident	85.8	Confident	22 Å²	22	49.3 Å²	49.3	12%	0.115	25%	0.253	C	S	.	.	H	α-helix	trans	-59.7	-45	167.2	-179.6	66.7	0	0	0	110.5	L238 Q280 F286 V287 V288 W316	L238-L284 HydrophobicContact CD1-CB 4.33Å; L238-L284 HydrophobicContact CD1-CD1 4.41Å; Q280-L284 PolarHBondContact O-N 3.36Å; L284-F286 VanDerWaalsContact C-N 3.33Å; L284-F286 PolarHBondContact O-N 3.4Å; L284-V287 PolarHBondContact O-N 3.44Å; L284-V288 HydrophobicContact CD1-CG2 4.05Å; L284-V288 HydrophobicContact CG-CG2 4.29Å; L284-V288 WeakPolarHBondContact O-CB 3.47Å; L284-V288 WeakPolarHBondContact O-CG2 3.35Å; L284-V288 PolarHBondContact O-N 3.13Å; L284-W316 HydrophobicContact CB-CZ3 4.45Å; L284-W316 HydrophobicContact CD2-CB 4.44Å; L284-W316 HydrophobicContact CD2-CD2 3.53Å; L284-W316 HydrophobicContact CD2-CE3 3.86Å; L284-W316 HydrophobicContact CD2-CG 3.76Å; L284-W316 HydrophobicContact CD2-CZ2 4.31Å; L284-W316 HydrophobicContact CD2-CZ3 4.37Å
285	S	85.8	Confident	85.1	Confident	50 Å²	50	51.3 Å²	51.3	35%	0.35	26%	0.257	S	S	.	.	H	α-helix	trans	-63	-38.8	177.3	83.7	0	0	0	0	112.4	R281 E282 R283 N289	R281-S285 WeakPolarHBondContact O-CB 3.41Å; R281-S285 PolarHBondContact O-N 3.15Å; E282-S285 PolarHBondContact O-N 3.47Å; E282-S285 PolarHBondContact O-OG 3.36Å; R283-S285 VanDerWaalsContact C-N 3.33Å; S285-N289 WeakPolarHBondContact O-CB 3.5Å; S285-N289 PolarHBondContact O-N 2.79Å; S285-N289 PolarHBondContact O-ND2 3.45Å; S285-N289 VanDerWaalsContact O-ND2 3.15Å
286	F	86.4	Confident	84.4	Confident	16 Å²	16	53.8 Å²	53.8	7%	0.07	26%	0.263	C	S	.	.	H	α-helix	trans	-61.5	-50.3	173.1	172.2	-97.6	0	0	0	111.1	R73 N74 A234 E282 R283 L284 V288 N289 V290	R73-F286 HydrophobicContact CG-CD2 4.03Å; R73-F286 HydrophobicContact CG-CE2 4.11Å; R73-F286 HydrophobicContact CG-CG 4.27Å; R73-F286 HydrophobicContact CG-CZ 4.43Å; N74-F286 HydrophobicContact CB-CE2 3.91Å; N74-F286 HydrophobicContact CB-CZ 3.63Å; A234-F286 HydrophobicContact CB-CD1 3.6Å; A234-F286 HydrophobicContact CB-CE1 3.57Å; E282-F286 PolarHBondContact O-N 3.07Å; R283-F286 PolarHBondContact O-N 2.97Å; L284-F286 VanDerWaalsContact C-N 3.33Å; L284-F286 PolarHBondContact O-N 3.4Å; F286-V288 PolarHBondContact O-N 3.48Å; F286-N289 PolarHBondContact O-N 2.97Å; F286-V290 HydrophobicContact CD2-CG2 4.03Å; F286-V290 HydrophobicContact CE2-CG2 3.83Å; F286-V290 HydrophobicContact CZ-CG2 4.14Å; F286-V290 WeakPolarHBondContact O-CB 3.39Å; F286-V290 VanDerWaalsContact O-CG2 3.27Å; F286-V290 WeakPolarHBondContact O-CG2 3.31Å; F286-V290 PolarHBondContact O-N 2.94Å
287	V	85.6	Confident	83.3	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.3	-46.2	178.5	163.1	0	0	0	0	111.9	L231 A234 M235 L238 R283 L284 A291 L312	L231-V287 HydrophobicContact CD1-CB 4.15Å; L231-V287 HydrophobicContact CD1-CG1 4.01Å; L231-V287 HydrophobicContact CD1-CG2 4.12Å; L231-V287 WeakPolarHBondContact CD1-O 3.45Å; A234-V287 HydrophobicContact CB-CG2 3.58Å; M235-V287 HydrophobicContact CG-CB 4.29Å; M235-V287 HydrophobicContact CG-CG1 3.46Å; M235-V287 VanDerWaalsContact CG-CG1 3.46Å; M235-V287 HydrophobicContact CG-CG2 3.8Å; M235-V287 HydrophobicContact SD-CG1 4.34Å; L238-V287 HydrophobicContact CD1-CB 4.12Å; L238-V287 HydrophobicContact CD1-CG2 3.78Å; R283-V287 WeakPolarHBondContact O-CB 3.38Å; R283-V287 WeakPolarHBondContact O-CG2 3.38Å; R283-V287 PolarHBondContact O-N 3.25Å; L284-V287 PolarHBondContact O-N 3.44Å; V287-A291 WeakPolarHBondContact O-CB 3.05Å; V287-A291 PolarHBondContact O-N 3.01Å; V287-L312 HydrophobicContact CG1-CD1 3.75Å
288	V	84.9	Confident	82	Confident	56 Å²	56	62.5 Å²	62.5	34%	0.339	32%	0.319	S	S	.	.	H	α-helix	trans	-67.2	-45.1	179.5	170.3	0	0	0	0	111.5	L284 F286 D292 V313	L284-V288 HydrophobicContact CD1-CG2 4.05Å; L284-V288 HydrophobicContact CG-CG2 4.29Å; L284-V288 WeakPolarHBondContact O-CB 3.47Å; L284-V288 WeakPolarHBondContact O-CG2 3.35Å; L284-V288 PolarHBondContact O-N 3.13Å; F286-V288 PolarHBondContact O-N 3.48Å; V288-D292 WeakPolarHBondContact O-CB 3.49Å; V288-D292 PolarHBondContact O-N 3.35Å; V288-V313 HydrophobicContact CG2-CG2 4.27Å
289	N	84.8	Confident	80.8	Confident	91 Å²	91	61.6 Å²	61.6	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-64.3	-48	-179.9	-71.4	-20.8	0	0	0	111.5	S285 F286 D292 E293	S285-N289 WeakPolarHBondContact O-CB 3.5Å; S285-N289 PolarHBondContact O-N 2.79Å; S285-N289 PolarHBondContact O-ND2 3.45Å; S285-N289 VanDerWaalsContact O-ND2 3.15Å; F286-N289 PolarHBondContact O-N 2.97Å; N289-D292 PolarHBondContact O-N 3.44Å; N289-E293 VanDerWaalsContact O-CG 3.32Å; N289-E293 WeakPolarHBondContact O-CG 3.23Å; N289-E293 PolarHBondContact O-N 2.75Å
290	V	82.5	Confident	79.8	Confident	12 Å²	12	64 Å²	64	7%	0.073	32%	0.319	C	S	.	.	H	α-helix	trans	-68.6	-36.9	-179.7	175.2	0	0	0	0	111.3	P227 L231 F286 D292 E293 M294	P227-V290 HydrophobicContact CB-CG1 4.45Å; L231-V290 HydrophobicContact CB-CG1 3.94Å; L231-V290 HydrophobicContact CD1-CB 4.28Å; L231-V290 HydrophobicContact CD1-CG1 4.28Å; L231-V290 HydrophobicContact CD2-CG1 4.31Å; L231-V290 HydrophobicContact CG-CG1 4.39Å; F286-V290 HydrophobicContact CD2-CG2 4.03Å; F286-V290 HydrophobicContact CE2-CG2 3.83Å; F286-V290 HydrophobicContact CZ-CG2 4.14Å; F286-V290 WeakPolarHBondContact O-CB 3.39Å; F286-V290 VanDerWaalsContact O-CG2 3.27Å; F286-V290 WeakPolarHBondContact O-CG2 3.31Å; F286-V290 PolarHBondContact O-N 2.94Å; V290-D292 VanDerWaalsContact C-N 3.34Å; V290-D292 PolarHBondContact O-N 3.23Å; V290-E293 WeakPolarHBondContact O-CB 3.16Å; V290-E293 PolarHBondContact O-N 2.91Å; V290-M294 HydrophobicContact CG1-CE 3.48Å; V290-M294 VanDerWaalsContact CG1-CE 3.48Å; V290-M294 HydrophobicContact CG1-SD 4.32Å; V290-M294 WeakPolarHBondContact O-CG 3.5Å; V290-M294 PolarHBondContact O-N 2.99Å
291	A	81.2	Confident	78.7	Confident	2 Å²	2	69.1 Å²	69.1	2%	0.017	34%	0.343	C	S	.	.	H	α-helix	trans	-65.2	-36	172.6	0	0	0	0	0	112.5	L231 V287 R295 Y302 V309	L231-A291 HydrophobicContact CD1-CB 4.46Å; L231-A291 HydrophobicContact CD2-CB 4.16Å; V287-A291 WeakPolarHBondContact O-CB 3.05Å; V287-A291 PolarHBondContact O-N 3.01Å; A291-R295 WeakPolarHBondContact O-CB 3.39Å; A291-R295 PolarHBondContact O-N 3.25Å; A291-Y302 HydrophobicContact CB-CE2 4.15Å; A291-Y302 VanDerWaalsContact O-CD2 3.32Å; A291-Y302 WeakPolarHBondContact O-CD2 3.31Å; A291-Y302 WeakPolarHBondContact O-CE2 3.46Å; A291-V309 HydrophobicContact CB-CG1 3.95Å; A291-V309 HydrophobicContact CB-CG2 3.89Å
292	D	80.2	Confident	77.9	Confident	49 Å²	49	65 Å²	65	26%	0.262	33%	0.328	S	S	.	.	H	α-helix	trans	-77.4	-28.4	175	-155.7	68.3	0	0	0	112.4	V288 N289 V290 R295 R296	V288-D292 WeakPolarHBondContact O-CB 3.49Å; V288-D292 PolarHBondContact O-N 3.35Å; N289-D292 PolarHBondContact O-N 3.44Å; V290-D292 VanDerWaalsContact C-N 3.34Å; V290-D292 PolarHBondContact O-N 3.23Å; D292-R295 PolarHBondContact O-N 3.18Å; D292-R295 WeakPolarHBondContact OD1-CD 3.2Å; D292-R295 IonicContact OD1-CZ 3.47Å; D292-R295 IonicContact OD1-NE 2.68Å; D292-R295 IonicContact OD1-NH1 3.03Å; D292-R295 PolarHBondContact OD1-NH1 3.28Å; D292-R296 WeakPolarHBondContact O-CB 3.31Å; D292-R296 WeakPolarHBondContact O-CG 3.18Å; D292-R296 PolarHBondContact O-N 3.44Å; D292-R296 PolarHBondContact O-NE 2.94Å; D292-R296 IonicContact OD2-CZ 3.17Å; D292-R296 IonicContact OD2-NH1 3.99Å; D292-R296 PolarHBondContact OD2-NH1 3.36Å
293	E	77.3	Confident	77.2	Confident	86 Å²	86	66.2 Å²	66.2	40%	0.402	33%	0.333	S	S	.	.	H	α-helix	trans	-60.4	-53.1	166.6	-74.7	166.2	175	0	0	110.7	N289 V290 R295 R296 E297	N289-E293 VanDerWaalsContact O-CG 3.32Å; N289-E293 WeakPolarHBondContact O-CG 3.23Å; N289-E293 PolarHBondContact O-N 2.75Å; V290-E293 WeakPolarHBondContact O-CB 3.16Å; V290-E293 PolarHBondContact O-N 2.91Å; E293-R295 VanDerWaalsContact C-N 3.29Å; E293-R295 PolarHBondContact O-N 3.13Å; E293-R296 CarbonylContact O-C 3.59Å; E293-R296 PolarHBondContact O-N 3.24Å; E293-E297 WeakPolarHBondContact O-CG 3.2Å; E293-E297 PolarHBondContact O-N 3.24Å
294	M	72.5	Confident	76.5	Confident	3 Å²	3	69.4 Å²	69.4	2%	0.015	36%	0.363	C	S	.	.	H	α-helix	trans	-61.8	-34.7	177.1	-69.6	171.4	-173.1	0	0	113.3	P227 D228 L231 V290 G298 S299 Y302	P227-M294 HydrophobicContact CB-CE 3.61Å; P227-M294 HydrophobicContact CG-CE 4.03Å; D228-M294 VanDerWaalsContact CA-CE 3.43Å; D228-M294 HydrophobicContact CB-CE 4.11Å; L231-M294 HydrophobicContact CB-CE 4.03Å; L231-M294 HydrophobicContact CB-SD 4.5Å; L231-M294 HydrophobicContact CD2-CE 3.99Å; L231-M294 HydrophobicContact CD2-SD 3.37Å; L231-M294 WeakPolarHBondContact CD2-SD 3.37Å; V290-M294 HydrophobicContact CG1-CE 3.48Å; V290-M294 VanDerWaalsContact CG1-CE 3.48Å; V290-M294 HydrophobicContact CG1-SD 4.32Å; V290-M294 WeakPolarHBondContact O-CG 3.5Å; V290-M294 PolarHBondContact O-N 2.99Å; M294-G298 PolarHBondContact O-N 2.84Å; M294-S299 PolarHBondContact O-N 3.22Å; M294-Y302 HydrophobicContact CB-CD2 4.14Å; M294-Y302 HydrophobicContact CB-CG 4.49Å
295	R	77.9	Confident	75.8	Confident	143 Å²	143	68.9 Å²	68.9	54%	0.54	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-42	171.4	-179	-168.3	-76.9	163.6	-15.1	111.7	A291 D292 E293 Y302	A291-R295 WeakPolarHBondContact O-CB 3.39Å; A291-R295 PolarHBondContact O-N 3.25Å; D292-R295 PolarHBondContact O-N 3.18Å; D292-R295 WeakPolarHBondContact OD1-CD 3.2Å; D292-R295 IonicContact OD1-CZ 3.47Å; D292-R295 IonicContact OD1-NE 2.68Å; D292-R295 IonicContact OD1-NH1 3.03Å; D292-R295 PolarHBondContact OD1-NH1 3.28Å; E293-R295 VanDerWaalsContact C-N 3.29Å; E293-R295 PolarHBondContact O-N 3.13Å; R295-Y302 HydrophobicContact CB-CD1 4.4Å; R295-Y302 HydrophobicContact CB-CD2 4.31Å; R295-Y302 HydrophobicContact CB-CE1 4.14Å; R295-Y302 HydrophobicContact CB-CE2 4.05Å; R295-Y302 HydrophobicContact CB-CG 4.5Å; R295-Y302 HydrophobicContact CG-CE1 4.21Å; R295-Y302 VanDerWaalsContact CZ-OH 3.28Å; R295-Y302 PolarHBondContact NE-OH 2.7Å; R295-Y302 PolarHBondContact NH2-OH 2.92Å
296	R	75.5	Confident	75.5	Confident	161 Å²	161	68.1 Å²	68.1	61%	0.608	36%	0.355	S	S	*	.	H	α-helix	trans	-71.4	-34	178	-72.9	-178.9	-54.1	-121.4	12.1	112.6	D292 E293	D292-R296 WeakPolarHBondContact O-CB 3.31Å; D292-R296 WeakPolarHBondContact O-CG 3.18Å; D292-R296 PolarHBondContact O-N 3.44Å; D292-R296 PolarHBondContact O-NE 2.94Å; D292-R296 IonicContact OD2-CZ 3.17Å; D292-R296 IonicContact OD2-NH1 3.99Å; D292-R296 PolarHBondContact OD2-NH1 3.36Å; E293-R296 CarbonylContact O-C 3.59Å; E293-R296 PolarHBondContact O-N 3.24Å
297	E	66.7	Low	75.2	Confident	158 Å²	158	73.4 Å²	73.4	74%	0.738	38%	0.384	S	S	*	.	H	α-helix	trans	-81.5	-17.4	177.7	-68.3	-175.2	168.8	0	0	113.4	E293	E293-E297 WeakPolarHBondContact O-CG 3.2Å; E293-E297 PolarHBondContact O-N 3.24Å
298	G	63	Low	74.9	Confident	57 Å²	57	76.8 Å²	76.8	59%	0.588	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.7	35.7	-179.9	0	0	0	0	0	113.5	M294 N300	M294-G298 PolarHBondContact O-N 2.84Å; G298-N300 PolarHBondContact O-N 3.06Å
299	S	64.1	Low	74.7	Confident	32 Å²	32	74.9 Å²	74.9	22%	0.224	39%	0.387	C	S	.	.			trans	-63.3	129.3	176.2	179.2	0	0	0	0	110.8	D228 M294 E301 Y302	D228-S299 PolarHBondContact OD1-OG 3.44Å; M294-S299 PolarHBondContact O-N 3.22Å; S299-E301 PolarHBondContact O-N 3.17Å; S299-E301 PolarHBondContact OG-N 3.1Å; S299-Y302 WeakPolarHBondContact O-CB 3.46Å; S299-Y302 PolarHBondContact O-N 3.37Å; S299-Y302 VanDerWaalsContact O-N 3.08Å
300	N	68.3	Low	74.6	Confident	143 Å²	143	74 Å²	74	77%	0.765	39%	0.388	S	S	*	.	H	α-helix	trans	-61.4	-25.9	171.2	-69.3	-19.5	0	0	0	112	G298 Y302 E303	G298-N300 PolarHBondContact O-N 3.06Å; N300-Y302 PolarHBondContact O-N 3.24Å; N300-E303 PolarHBondContact O-N 3.44Å
301	E	65.3	Low	74.7	Confident	111 Å²	111	75.6 Å²	75.6	52%	0.519	40%	0.402	S	S	.	.	H	α-helix	trans	-73.7	-19.2	179.7	-51.9	-167	-167.7	0	0	110.9	D228 S299 A304 L305	D228-E301 HydrophobicContact CB-CB 4.35Å; D228-E301 WeakPolarHBondContact CB-OE2 3.2Å; S299-E301 PolarHBondContact O-N 3.17Å; S299-E301 PolarHBondContact OG-N 3.1Å; E301-A304 PolarHBondContact O-N 2.97Å; E301-L305 PolarHBondContact O-N 3.29Å
302	Y	72.7	Confident	74.9	Confident	27 Å²	27	75.5 Å²	75.5	11%	0.106	40%	0.402	C	S	.	.	H	α-helix	trans	-62.6	-40.5	169.4	-178.7	-101.8	0	0	0	112.9	A291 M294 R295 S299 N300 A304 L305 S306	A291-Y302 HydrophobicContact CB-CE2 4.15Å; A291-Y302 VanDerWaalsContact O-CD2 3.32Å; A291-Y302 WeakPolarHBondContact O-CD2 3.31Å; A291-Y302 WeakPolarHBondContact O-CE2 3.46Å; M294-Y302 HydrophobicContact CB-CD2 4.14Å; M294-Y302 HydrophobicContact CB-CG 4.49Å; R295-Y302 HydrophobicContact CB-CD1 4.4Å; R295-Y302 HydrophobicContact CB-CD2 4.31Å; R295-Y302 HydrophobicContact CB-CE1 4.14Å; R295-Y302 HydrophobicContact CB-CE2 4.05Å; R295-Y302 HydrophobicContact CB-CG 4.5Å; R295-Y302 HydrophobicContact CG-CE1 4.21Å; R295-Y302 VanDerWaalsContact CZ-OH 3.28Å; R295-Y302 PolarHBondContact NE-OH 2.7Å; R295-Y302 PolarHBondContact NH2-OH 2.92Å; S299-Y302 WeakPolarHBondContact O-CB 3.46Å; S299-Y302 PolarHBondContact O-N 3.37Å; S299-Y302 VanDerWaalsContact O-N 3.08Å; N300-Y302 PolarHBondContact O-N 3.24Å; Y302-A304 VanDerWaalsContact C-N 3.26Å; Y302-A304 PolarHBondContact O-N 3.32Å; Y302-L305 PolarHBondContact O-N 3.03Å; Y302-L305 VanDerWaalsContact O-N 3.12Å; Y302-S306 VanDerWaalsContact O-CB 3.3Å; Y302-S306 WeakPolarHBondContact O-CB 3.4Å; Y302-S306 PolarHBondContact O-N 3.03Å
303	E	70.9	Confident	75.2	Confident	157 Å²	157	76.4 Å²	76.4	73%	0.734	41%	0.409	S	S	*	.	H	α-helix	trans	-61.8	-36.4	-178	-69.7	-159.2	146.5	0	0	111.9	N300	N300-E303 PolarHBondContact O-N 3.44Å
304	A	73.4	Confident	75.8	Confident	81 Å²	81	75.5 Å²	75.5	67%	0.669	41%	0.41	S	S	*	.	H	α-helix	trans	-68.8	-34.4	176.3	0	0	0	0	0	112.9	E301 Y302	E301-A304 PolarHBondContact O-N 2.97Å; Y302-A304 VanDerWaalsContact C-N 3.26Å; Y302-A304 PolarHBondContact O-N 3.32Å
305	L	72.8	Confident	76.7	Confident	11 Å²	11	78.1 Å²	78.1	6%	0.058	42%	0.42	C	S	.	.	H	α-helix	trans	-89.2	-23.3	-178.3	-67	173.4	0	0	0	113.3	L231 E232 M235 E301 Y302 N307 K308 V309	L231-L305 HydrophobicContact CD2-CD1 3.75Å; L231-L305 HydrophobicContact CG-CD1 4.14Å; E232-L305 HydrophobicContact CB-CD2 4.25Å; E232-L305 HydrophobicContact CG-CD2 4.3Å; M235-L305 HydrophobicContact CE-CB 4.16Å; M235-L305 HydrophobicContact CE-CD2 4.08Å; M235-L305 HydrophobicContact SD-CB 4.31Å; M235-L305 HydrophobicContact SD-CD1 4.46Å; M235-L305 HydrophobicContact SD-CD2 4.17Å; E301-L305 PolarHBondContact O-N 3.29Å; Y302-L305 PolarHBondContact O-N 3.03Å; Y302-L305 VanDerWaalsContact O-N 3.12Å; L305-N307 VanDerWaalsContact C-N 3.32Å; L305-N307 PolarHBondContact O-N 3.18Å; L305-K308 HydrophobicContact CD2-CD 4.44Å; L305-K308 WeakPolarHBondContact O-CB 3.44Å; L305-K308 PolarHBondContact O-N 3.21Å; L305-V309 PolarHBondContact O-N 3.44Å
306	S	78.8	Confident	77.4	Confident	35 Å²	35	71.7 Å²	71.7	25%	0.245	40%	0.396	C	S	.	.	H	α-helix	trans	-48.8	-45.8	-173.9	-176.5	0	0	0	0	113.6	Y302 K308 V309 S310	Y302-S306 VanDerWaalsContact O-CB 3.3Å; Y302-S306 WeakPolarHBondContact O-CB 3.4Å; Y302-S306 PolarHBondContact O-N 3.03Å; S306-K308 PolarHBondContact O-N 3.35Å; S306-V309 PolarHBondContact O-N 3.19Å; S306-S310 WeakPolarHBondContact O-CB 3.12Å; S306-S310 PolarHBondContact O-N 2.99Å; S306-S310 PolarHBondContact O-OG 3.48Å
307	N	80.5	Confident	78.1	Confident	127 Å²	127	66.8 Å²	66.8	68%	0.679	39%	0.386	S	S	*	.	H	α-helix	trans	-60.8	-47.3	177.8	-71.3	-22	0	0	0	112.3	L305 S310 A311	L305-N307 VanDerWaalsContact C-N 3.32Å; L305-N307 PolarHBondContact O-N 3.18Å; N307-S310 PolarHBondContact O-N 3Å; N307-S310 PolarHBondContact O-OG 3.07Å; N307-A311 PolarHBondContact O-N 2.81Å
308	K	80.3	Confident	79.3	Confident	70 Å²	70	63 Å²	63	30%	0.304	37%	0.371	S	S	.	.	H	α-helix	trans	-61	-45.4	176.3	-69	-179.9	-176.4	179.5	0	110.5	E232 M235 L305 S306 S310 A311 L312	E232-K308 IonicContact OE1-NZ 3.98Å; E232-K308 PolarHBondContact OE1-NZ 3.46Å; M235-K308 HydrophobicContact CE-CB 3.25Å; M235-K308 HydrophobicContact CE-CD 3.98Å; M235-K308 HydrophobicContact CE-CG 4.26Å; L305-K308 HydrophobicContact CD2-CD 4.44Å; L305-K308 WeakPolarHBondContact O-CB 3.44Å; L305-K308 PolarHBondContact O-N 3.21Å; S306-K308 PolarHBondContact O-N 3.35Å; K308-S310 VanDerWaalsContact C-N 3.33Å; K308-S310 PolarHBondContact O-N 3.5Å; K308-A311 PolarHBondContact O-N 3.35Å; K308-L312 PolarHBondContact O-N 3.43Å
309	V	80.2	Confident	80.6	Confident	16 Å²	16	60.6 Å²	60.6	10%	0.097	34%	0.344	C	S	.	.	H	α-helix	trans	-60.5	-41.9	177.4	179.9	0	0	0	0	111.4	M235 A291 L305 S306 A311 L312	M235-V309 HydrophobicContact CE-CB 4.47Å; M235-V309 HydrophobicContact CE-CG2 3.46Å; M235-V309 VanDerWaalsContact CE-CG2 3.46Å; M235-V309 HydrophobicContact SD-CG2 3.7Å; A291-V309 HydrophobicContact CB-CG1 3.95Å; A291-V309 HydrophobicContact CB-CG2 3.89Å; L305-V309 PolarHBondContact O-N 3.44Å; S306-V309 PolarHBondContact O-N 3.19Å; V309-A311 VanDerWaalsContact C-N 3.26Å; V309-A311 PolarHBondContact O-N 2.89Å; V309-L312 PolarHBondContact O-N 2.99Å
310	S	82.1	Confident	81.9	Confident	74 Å²	74	62 Å²	62	52%	0.517	35%	0.348	S	S	.	.	H	α-helix	trans	-66.4	-25.5	-179.3	75.9	0	0	0	0	113.9	S306 N307 K308 P314	S306-S310 WeakPolarHBondContact O-CB 3.12Å; S306-S310 PolarHBondContact O-N 2.99Å; S306-S310 PolarHBondContact O-OG 3.48Å; N307-S310 PolarHBondContact O-N 3Å; N307-S310 PolarHBondContact O-OG 3.07Å; K308-S310 VanDerWaalsContact C-N 3.33Å; K308-S310 PolarHBondContact O-N 3.5Å; S310-P314 WeakPolarHBondContact O-CD 3.25Å; S310-P314 WeakPolarHBondContact O-CG 3.44Å
311	A	84.9	Confident	83	Confident	44 Å²	44	61.3 Å²	61.3	36%	0.364	33%	0.334	S	S	.	.	H	α-helix	trans	-86.3	-25.6	178.4	0	0	0	0	0	113.5	N307 K308 V309 R315	N307-A311 PolarHBondContact O-N 2.81Å; K308-A311 PolarHBondContact O-N 3.35Å; V309-A311 VanDerWaalsContact C-N 3.26Å; V309-A311 PolarHBondContact O-N 2.89Å; A311-R315 WeakPolarHBondContact O-CG 3.46Å; A311-R315 PolarHBondContact O-N 3.09Å
312	L	86.4	Confident	84.2	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-47.9	-179.7	-77	172	0	0	0	112.7	M235 L238 L239 L242 V287 K308 V309 R315 W316	M235-L312 HydrophobicContact CG-CD1 4.22Å; L238-L312 HydrophobicContact CB-CD2 4.11Å; L239-L312 HydrophobicContact CD2-CD2 3.55Å; L239-L312 HydrophobicContact CD2-CG 4.28Å; L239-L312 HydrophobicContact CG-CD2 3.88Å; L242-L312 HydrophobicContact CD1-CD2 3.36Å; V287-L312 HydrophobicContact CG1-CD1 3.75Å; K308-L312 PolarHBondContact O-N 3.43Å; V309-L312 PolarHBondContact O-N 2.99Å; L312-R315 PolarHBondContact O-N 3.12Å; L312-W316 WeakPolarHBondContact O-CB 3.48Å; L312-W316 PolarHBondContact O-N 3.37Å
313	V	86.6	Confident	85	Confident	68 Å²	68	56.8 Å²	56.8	41%	0.412	32%	0.317	S	S	.	.	H	α-helix	trans	-67.7	-42.6	-173	-178.6	0	0	0	0	112.8	V288 S317	V288-V313 HydrophobicContact CG2-CG2 4.27Å; V313-S317 WeakPolarHBondContact O-CB 3.33Å; V313-S317 PolarHBondContact O-N 3.48Å; V313-S317 PolarHBondContact O-OG 2.83Å
314	P	88.9	Confident	86	Confident	67 Å²	67	53.2 Å²	53.2	44%	0.435	31%	0.306	S	S	.	.	H	α-helix	trans	-60.2	-50.3	171.9	-26.1	36	0	0	0	113.5	S310 W316 S317 D318	S310-P314 WeakPolarHBondContact O-CD 3.25Å; S310-P314 WeakPolarHBondContact O-CG 3.44Å; P314-W316 PolarHBondContact O-N 2.79Å; P314-S317 PolarHBondContact O-N 3.06Å; P314-S317 VanDerWaalsContact O-N 3.08Å; P314-D318 PolarHBondContact O-N 2.95Å
315	R	92	Very high	86.7	Confident	57 Å²	57	53.7 Å²	53.7	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-56.2	-50.1	178.6	-70.9	-177.1	76.8	-172.9	10.7	111.3	L242 D243 E246 A311 L312 S317 D318 I319	L242-R315 HydrophobicContact CD1-CB 4.39Å; L242-R315 HydrophobicContact CD2-CB 4.49Å; D243-R315 IonicContact OD1-CZ 3.06Å; D243-R315 IonicContact OD1-NH1 2.58Å; D243-R315 PolarHBondContact OD1-NH1 3.41Å; D243-R315 IonicContact OD1-NH2 2.63Å; D243-R315 PolarHBondContact OD1-NH2 3.16Å; E246-R315 IonicContact OE1-CZ 3.69Å; E246-R315 IonicContact OE1-NE 2.65Å; E246-R315 PolarHBondContact OE1-NE 3.3Å; E246-R315 IonicContact OE1-NH2 3.5Å; E246-R315 PolarHBondContact OE1-NH2 3.44Å; E246-R315 IonicContact OE2-CZ 3.89Å; E246-R315 IonicContact OE2-NE 3.59Å; E246-R315 PolarHBondContact OE2-NE 3.17Å; E246-R315 IonicContact OE2-NH2 3.93Å; E246-R315 PolarHBondContact OE2-NH2 3.22Å; A311-R315 WeakPolarHBondContact O-CG 3.46Å; A311-R315 PolarHBondContact O-N 3.09Å; L312-R315 PolarHBondContact O-N 3.12Å; R315-S317 VanDerWaalsContact C-N 3.32Å; R315-S317 PolarHBondContact O-N 3.19Å; R315-D318 PolarHBondContact O-N 2.69Å; R315-I319 WeakPolarHBondContact O-CD1 3.37Å; R315-I319 VanDerWaalsContact O-CG1 3.27Å; R315-I319 WeakPolarHBondContact O-CG1 3.39Å; R315-I319 PolarHBondContact O-N 3.15Å
316	W	92	Very high	87.5	Confident	9 Å²	9	54.1 Å²	54.1	3%	0.034	30%	0.299	C	S	.	.	H	α-helix	trans	-53.2	-48.4	174.2	-178.5	-77.3	0	0	0	112.5	W241 L242 M277 Q280 R281 L284 L312 P314 D318 I319 E320	W241-W316 HydrophobicContact CE3-CZ3 4.43Å; W241-W316 HydrophobicContact CH2-CH2 4.43Å; W241-W316 AromaticContact CH2-CZ3 3.99Å; W241-W316 HydrophobicContact CH2-CZ3 3.99Å; W241-W316 AromaticContact CZ3-CE3 3.93Å; W241-W316 HydrophobicContact CZ3-CE3 3.93Å; W241-W316 HydrophobicContact CZ3-CH2 4.39Å; W241-W316 AromaticContact CZ3-CZ3 3.54Å; W241-W316 HydrophobicContact CZ3-CZ3 3.54Å; L242-W316 HydrophobicContact CD2-CB 4.41Å; L242-W316 HydrophobicContact CD2-CE3 4.19Å; M277-W316 HydrophobicContact CB-CH2 4.34Å; M277-W316 HydrophobicContact CB-CZ2 4.33Å; M277-W316 HydrophobicContact CE-CD2 3.74Å; M277-W316 HydrophobicContact CE-CE3 4.07Å; M277-W316 HydrophobicContact CE-CG 4.31Å; M277-W316 HydrophobicContact CE-CH2 4.02Å; M277-W316 HydrophobicContact CE-CZ2 3.69Å; M277-W316 HydrophobicContact CE-CZ3 4.2Å; M277-W316 VanDerWaalsContact O-CH2 3.23Å; M277-W316 WeakPolarHBondContact O-CH2 3.18Å; Q280-W316 HydrophobicContact CB-CH2 3.9Å; Q280-W316 HydrophobicContact CB-CZ3 3.77Å; R281-W316 HydrophobicContact CB-CH2 4.08Å; R281-W316 HydrophobicContact CB-CZ2 3.98Å; R281-W316 HydrophobicContact CG-CZ2 4.21Å; L284-W316 HydrophobicContact CB-CZ3 4.45Å; L284-W316 HydrophobicContact CD2-CB 4.44Å; L284-W316 HydrophobicContact CD2-CD2 3.53Å; L284-W316 HydrophobicContact CD2-CE3 3.86Å; L284-W316 HydrophobicContact CD2-CG 3.76Å; L284-W316 HydrophobicContact CD2-CZ2 4.31Å; L284-W316 HydrophobicContact CD2-CZ3 4.37Å; L312-W316 WeakPolarHBondContact O-CB 3.48Å; L312-W316 PolarHBondContact O-N 3.37Å; P314-W316 PolarHBondContact O-N 2.79Å; W316-D318 VanDerWaalsContact C-N 3.33Å; W316-D318 PolarHBondContact O-N 2.98Å; W316-I319 PolarHBondContact O-N 3.24Å; W316-E320 VanDerWaalsContact CD1-OE2 3.27Å; W316-E320 PolarHBondContact NE1-OE2 2.69Å; W316-E320 VanDerWaalsContact O-CB 3.25Å; W316-E320 WeakPolarHBondContact O-CB 3.47Å; W316-E320 PolarHBondContact O-N 2.99Å
317	S	90.7	Very high	88.1	Confident	57 Å²	57	53 Å²	53	40%	0.399	29%	0.29	S	S	.	.	H	α-helix	trans	-65.7	-35.7	-177.2	-56.7	0	0	0	0	112.3	V313 P314 R315 R321	V313-S317 WeakPolarHBondContact O-CB 3.33Å; V313-S317 PolarHBondContact O-N 3.48Å; V313-S317 PolarHBondContact O-OG 2.83Å; P314-S317 PolarHBondContact O-N 3.06Å; P314-S317 VanDerWaalsContact O-N 3.08Å; R315-S317 VanDerWaalsContact C-N 3.32Å; R315-S317 PolarHBondContact O-N 3.19Å; S317-R321 WeakPolarHBondContact O-CB 3.43Å; S317-R321 PolarHBondContact O-N 2.85Å
318	D	91	Very high	88.5	Confident	80 Å²	80	49.7 Å²	49.7	43%	0.428	28%	0.281	S	S	.	.	H	α-helix	trans	-74.9	-38.4	176.7	-87.9	-46.7	0	0	0	112.6	P314 R315 W316 R321 V322	P314-D318 PolarHBondContact O-N 2.95Å; R315-D318 PolarHBondContact O-N 2.69Å; W316-D318 VanDerWaalsContact C-N 3.33Å; W316-D318 PolarHBondContact O-N 2.98Å; D318-R321 PolarHBondContact O-N 3.16Å; D318-R321 IonicContact OD1-CZ 3.57Å; D318-R321 VanDerWaalsContact OD1-CZ 3.22Å; D318-R321 IonicContact OD1-NE 2.64Å; D318-R321 PolarHBondContact OD1-NE 2.95Å; D318-R321 IonicContact OD1-NH2 3.75Å; D318-R321 PolarHBondContact OD1-NH2 3.47Å; D318-V322 WeakPolarHBondContact O-CB 3.36Å; D318-V322 VanDerWaalsContact O-CG2 3.28Å; D318-V322 WeakPolarHBondContact O-CG2 3.43Å; D318-V322 PolarHBondContact O-N 3.26Å
319	I	90.4	Very high	88.8	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-60.3	-53.7	170.8	-67.5	163	0	0	0	109.8	L242 A245 E246 I249 M277 R315 W316 R321 V322 L323	L242-I319 HydrophobicContact CB-CD1 4.38Å; L242-I319 HydrophobicContact CD2-CD1 3.35Å; L242-I319 HydrophobicContact CG-CD1 4.47Å; A245-I319 HydrophobicContact CB-CD1 4.16Å; A245-I319 HydrophobicContact CB-CG2 4.22Å; E246-I319 HydrophobicContact CG-CD1 3.75Å; E246-I319 HydrophobicContact CG-CG1 3.78Å; I249-I319 HydrophobicContact CD1-CB 4.18Å; I249-I319 HydrophobicContact CD1-CG2 3.62Å; M277-I319 HydrophobicContact CE-CB 4.35Å; M277-I319 HydrophobicContact CE-CG2 3.76Å; M277-I319 HydrophobicContact SD-CG2 3.77Å; R315-I319 WeakPolarHBondContact O-CD1 3.37Å; R315-I319 VanDerWaalsContact O-CG1 3.27Å; R315-I319 WeakPolarHBondContact O-CG1 3.39Å; R315-I319 PolarHBondContact O-N 3.15Å; W316-I319 PolarHBondContact O-N 3.24Å; I319-R321 VanDerWaalsContact C-N 3.28Å; I319-R321 PolarHBondContact O-N 3.44Å; I319-V322 PolarHBondContact O-N 3.07Å; I319-L323 WeakPolarHBondContact O-CB 3.38Å; I319-L323 PolarHBondContact O-N 3Å
320	E	91.2	Very high	89.3	Confident	62 Å²	62	51.5 Å²	51.5	29%	0.29	28%	0.284	S	S	.	.	H	α-helix	trans	-58.6	-40.1	179.8	-171.3	162.9	-141.7	0	0	111.3	M277 R281 W316 T324	M277-E320 HydrophobicContact CE-CB 4.04Å; M277-E320 HydrophobicContact SD-CB 4.19Å; R281-E320 IonicContact CZ-OE1 3.2Å; R281-E320 IonicContact NE-OE1 2.75Å; R281-E320 IonicContact NH2-OE1 2.76Å; R281-E320 PolarHBondContact NH2-OE1 3.4Å; W316-E320 VanDerWaalsContact CD1-OE2 3.27Å; W316-E320 PolarHBondContact NE1-OE2 2.69Å; W316-E320 VanDerWaalsContact O-CB 3.25Å; W316-E320 WeakPolarHBondContact O-CB 3.47Å; W316-E320 PolarHBondContact O-N 2.99Å; E320-T324 VanDerWaalsContact O-CB 3.28Å; E320-T324 WeakPolarHBondContact O-CB 3.49Å; E320-T324 PolarHBondContact O-N 3.16Å; E320-T324 VanDerWaalsContact O-N 3.1Å; E320-T324 PolarHBondContact O-OG1 2.83Å
321	R	92.2	Very high	89.7	Confident	129 Å²	129	50.3 Å²	50.3	49%	0.487	27%	0.272	S	S	.	.	H	α-helix	trans	-66	-50.1	174	-178.4	-173.7	63.2	67.1	1.7	112.6	S317 D318 I319 N325	S317-R321 WeakPolarHBondContact O-CB 3.43Å; S317-R321 PolarHBondContact O-N 2.85Å; D318-R321 PolarHBondContact O-N 3.16Å; D318-R321 IonicContact OD1-CZ 3.57Å; D318-R321 VanDerWaalsContact OD1-CZ 3.22Å; D318-R321 IonicContact OD1-NE 2.64Å; D318-R321 PolarHBondContact OD1-NE 2.95Å; D318-R321 IonicContact OD1-NH2 3.75Å; D318-R321 PolarHBondContact OD1-NH2 3.47Å; I319-R321 VanDerWaalsContact C-N 3.28Å; I319-R321 PolarHBondContact O-N 3.44Å; R321-N325 PolarHBondContact O-N 3.43Å; R321-N325 VanDerWaalsContact O-N 3.13Å; R321-N325 PolarHBondContact O-ND2 3.15Å
322	V	90	Very high	90	Very high	38 Å²	38	51.2 Å²	51.2	23%	0.23	28%	0.279	C	S	.	.	H	α-helix	trans	-68.6	-43.9	-177.2	175.8	0	0	0	0	110.6	I249 D318 I319 T324 N325 Q326	I249-V322 HydrophobicContact CG2-CB 4.04Å; I249-V322 HydrophobicContact CG2-CG1 3.4Å; I249-V322 VanDerWaalsContact CG2-CG1 3.4Å; D318-V322 WeakPolarHBondContact O-CB 3.36Å; D318-V322 VanDerWaalsContact O-CG2 3.28Å; D318-V322 WeakPolarHBondContact O-CG2 3.43Å; D318-V322 PolarHBondContact O-N 3.26Å; I319-V322 PolarHBondContact O-N 3.07Å; V322-T324 PolarHBondContact O-N 3.38Å; V322-N325 PolarHBondContact O-N 2.82Å; V322-N325 VanDerWaalsContact O-N 3.14Å; V322-Q326 HydrophobicContact CG1-CG 4.14Å; V322-Q326 PolarHBondContact O-N 2.8Å
323	L	90.5	Very high	90.2	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.021	28%	0.28	C	S	.	.	H	α-helix	trans	-55.7	-50	175.7	-179.2	57.7	0	0	0	111.6	I249 L270 L273 E274 M277 I319 N325 Q326 L327	I249-L323 HydrophobicContact CD1-CB 4.02Å; L270-L323 HydrophobicContact CB-CD1 3.79Å; L270-L323 HydrophobicContact CD2-CD1 3.85Å; L270-L323 HydrophobicContact CG-CD1 4.28Å; L273-L323 HydrophobicContact CB-CD2 4.46Å; L273-L323 HydrophobicContact CD2-CD1 4.32Å; L273-L323 HydrophobicContact CD2-CD2 4.36Å; L273-L323 HydrophobicContact CG-CD2 4.18Å; E274-L323 HydrophobicContact CB-CD2 4.18Å; M277-L323 HydrophobicContact CG-CD2 4.03Å; M277-L323 HydrophobicContact SD-CD2 3.76Å; I319-L323 WeakPolarHBondContact O-CB 3.38Å; I319-L323 PolarHBondContact O-N 3Å; L323-N325 VanDerWaalsContact C-N 3.3Å; L323-N325 PolarHBondContact O-N 3.16Å; L323-Q326 PolarHBondContact O-N 3.14Å; L323-L327 HydrophobicContact CD1-CD1 3.92Å; L323-L327 HydrophobicContact CD1-CG 4.13Å; L323-L327 HydrophobicContact CG-CD1 4.01Å; L323-L327 WeakPolarHBondContact O-CB 3.11Å; L323-L327 WeakPolarHBondContact O-CG 3.31Å; L323-L327 PolarHBondContact O-N 2.83Å
324	T	90.4	Very high	90.4	Very high	82 Å²	82	49.3 Å²	49.3	50%	0.503	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-39.6	177.7	-56.9	0	0	0	0	111.8	E320 V322 A328	E320-T324 VanDerWaalsContact O-CB 3.28Å; E320-T324 WeakPolarHBondContact O-CB 3.49Å; E320-T324 PolarHBondContact O-N 3.16Å; E320-T324 VanDerWaalsContact O-N 3.1Å; E320-T324 PolarHBondContact O-OG1 2.83Å; V322-T324 PolarHBondContact O-N 3.38Å; T324-A328 WeakPolarHBondContact O-CB 3.22Å; T324-A328 PolarHBondContact O-N 3.26Å
325	N	89.2	Confident	90.6	Very high	91 Å²	91	48.9 Å²	48.9	49%	0.487	27%	0.265	S	S	.	.	H	α-helix	trans	-75.2	-36.2	179.2	-78.5	-76.7	0	0	0	113.2	R321 V322 L323 R329	R321-N325 PolarHBondContact O-N 3.43Å; R321-N325 VanDerWaalsContact O-N 3.13Å; R321-N325 PolarHBondContact O-ND2 3.15Å; V322-N325 PolarHBondContact O-N 2.82Å; V322-N325 VanDerWaalsContact O-N 3.14Å; L323-N325 VanDerWaalsContact C-N 3.3Å; L323-N325 PolarHBondContact O-N 3.16Å; N325-R329 WeakPolarHBondContact O-CB 3.36Å; N325-R329 VanDerWaalsContact O-CG 3.32Å; N325-R329 WeakPolarHBondContact O-CG 3.45Å; N325-R329 PolarHBondContact O-N 3.45Å
326	Q	89.3	Confident	90.6	Very high	21 Å²	21	47.8 Å²	47.8	10%	0.098	26%	0.263	C	S	.	.	H	α-helix	trans	-67	-47.3	173.7	-77.6	176.2	-26.1	0	0	110.6	D255 L270 V322 L323 R329 L330	D255-Q326 HydrophobicContact CB-CG 4.09Å; L270-Q326 HydrophobicContact CD1-CB 3.94Å; V322-Q326 HydrophobicContact CG1-CG 4.14Å; V322-Q326 PolarHBondContact O-N 2.8Å; L323-Q326 PolarHBondContact O-N 3.14Å; Q326-R329 PolarHBondContact O-N 3.27Å; Q326-L330 WeakPolarHBondContact O-CB 3.45Å; Q326-L330 WeakPolarHBondContact O-CG 3.45Å; Q326-L330 PolarHBondContact O-N 2.81Å
327	L	90.4	Very high	90.6	Very high	10 Å²	10	47.3 Å²	47.3	5%	0.052	26%	0.261	C	S	.	.	H	α-helix	trans	-58	-49.6	174.3	-76.9	174.7	0	0	0	111.7	L270 K271 E274 L323 R329 L330 D331	L270-L327 HydrophobicContact CB-CD2 3.42Å; L270-L327 VanDerWaalsContact CB-CD2 3.42Å; L270-L327 HydrophobicContact CB-CG 3.93Å; L270-L327 HydrophobicContact CD1-CD2 4.24Å; L270-L327 HydrophobicContact CD1-CG 4.46Å; L270-L327 HydrophobicContact CG-CD2 4.49Å; K271-L327 HydrophobicContact CG-CD1 4.37Å; K271-L327 HydrophobicContact CG-CD2 3.78Å; E274-L327 HydrophobicContact CB-CD1 4.45Å; L323-L327 HydrophobicContact CD1-CD1 3.92Å; L323-L327 HydrophobicContact CD1-CG 4.13Å; L323-L327 HydrophobicContact CG-CD1 4.01Å; L323-L327 WeakPolarHBondContact O-CB 3.11Å; L323-L327 WeakPolarHBondContact O-CG 3.31Å; L323-L327 PolarHBondContact O-N 2.83Å; L327-R329 VanDerWaalsContact C-N 3.33Å; L327-R329 PolarHBondContact O-N 2.93Å; L327-L330 PolarHBondContact O-N 3.32Å; L327-D331 WeakPolarHBondContact O-CB 3.39Å; L327-D331 PolarHBondContact O-N 3.3Å
328	A	89.7	Confident	90.7	Very high	59 Å²	59	49.1 Å²	49.1	49%	0.488	26%	0.263	S	S	.	.	H	α-helix	trans	-61.8	-37.4	178.8	0	0	0	0	0	113.1	T324 A332	T324-A328 WeakPolarHBondContact O-CB 3.22Å; T324-A328 PolarHBondContact O-N 3.26Å; A328-A332 WeakPolarHBondContact O-CB 3.27Å; A328-A332 PolarHBondContact O-N 3.32Å
329	R	87	Confident	90.8	Very high	123 Å²	123	49.1 Å²	49.1	46%	0.464	26%	0.263	S	S	.	.	H	α-helix	trans	-67.3	-47.5	174.3	-80.4	174.1	57.8	-158.7	-7.6	112.2	D255 N325 Q326 L327 G333	D255-R329 PolarHBondContact O-NH2 3.34Å; D255-R329 IonicContact OD2-CZ 2.71Å; D255-R329 IonicContact OD2-NH1 2.65Å; D255-R329 PolarHBondContact OD2-NH1 2.83Å; D255-R329 IonicContact OD2-NH2 3.39Å; D255-R329 PolarHBondContact OD2-NH2 3.18Å; N325-R329 WeakPolarHBondContact O-CB 3.36Å; N325-R329 VanDerWaalsContact O-CG 3.32Å; N325-R329 WeakPolarHBondContact O-CG 3.45Å; N325-R329 PolarHBondContact O-N 3.45Å; Q326-R329 PolarHBondContact O-N 3.27Å; L327-R329 VanDerWaalsContact C-N 3.33Å; L327-R329 PolarHBondContact O-N 2.93Å; R329-G333 PolarHBondContact O-N 2.81Å; R329-G333 VanDerWaalsContact O-N 3.14Å
330	L	90.2	Very high	90.9	Very high	1 Å²	1	49 Å²	49	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-51.1	-179.9	-71.3	-174.7	0	0	0	111.4	L254 I257 K266 I267 L270 Q326 L327 A332 G333 F334	L254-L330 WeakPolarHBondContact O-CD1 3.27Å; I257-L330 HydrophobicContact CG1-CD2 4.02Å; K266-L330 HydrophobicContact CB-CD1 3.99Å; I267-L330 HydrophobicContact CD1-CB 4.03Å; I267-L330 HydrophobicContact CG1-CB 3.63Å; I267-L330 HydrophobicContact CG1-CD1 3.9Å; I267-L330 HydrophobicContact CG1-CG 4.44Å; L270-L330 HydrophobicContact CD1-CD1 3.89Å; Q326-L330 WeakPolarHBondContact O-CB 3.45Å; Q326-L330 WeakPolarHBondContact O-CG 3.45Å; Q326-L330 PolarHBondContact O-N 2.81Å; L327-L330 PolarHBondContact O-N 3.32Å; L330-A332 VanDerWaalsContact C-N 3.28Å; L330-A332 PolarHBondContact O-N 3.31Å; L330-G333 PolarHBondContact O-N 2.63Å; L330-F334 WeakPolarHBondContact O-CA 3.34Å; L330-F334 WeakPolarHBondContact O-CB 3.39Å; L330-F334 PolarHBondContact O-N 3.05Å
331	D	90.8	Very high	90.9	Very high	49 Å²	49	49.4 Å²	49.4	26%	0.262	26%	0.264	S	S	.	.	H	α-helix	trans	-59.4	-39.1	-179.8	-81.6	-37.3	0	0	0	111.7	I267 K271 L327 S335	I267-D331 WeakPolarHBondContact CG2-OD1 3.45Å; K271-D331 VanDerWaalsContact CE-OD2 3.27Å; K271-D331 WeakPolarHBondContact CE-OD2 3.13Å; K271-D331 IonicContact NZ-OD1 3.89Å; K271-D331 PolarHBondContact NZ-OD1 3.27Å; K271-D331 IonicContact NZ-OD2 2.9Å; K271-D331 PolarHBondContact NZ-OD2 2.96Å; L327-D331 WeakPolarHBondContact O-CB 3.39Å; L327-D331 PolarHBondContact O-N 3.3Å; D331-S335 WeakPolarHBondContact O-CB 3.43Å; D331-S335 PolarHBondContact O-N 2.72Å; D331-S335 PolarHBondContact O-OG 3.12Å
332	A	90.4	Very high	91	Very high	63 Å²	63	47.7 Å²	47.7	52%	0.521	26%	0.264	S	S	.	.	H	α-helix	trans	-65.6	-52.1	177.9	0	0	0	0	0	112.4	A328 L330 S335 L336	A328-A332 WeakPolarHBondContact O-CB 3.27Å; A328-A332 PolarHBondContact O-N 3.32Å; L330-A332 VanDerWaalsContact C-N 3.28Å; L330-A332 PolarHBondContact O-N 3.31Å; A332-S335 WeakPolarHBondContact O-CB 3.26Å; A332-S335 PolarHBondContact O-N 3.24Å; A332-L336 PolarHBondContact O-N 3.1Å; A332-L336 VanDerWaalsContact O-N 3.09Å
333	G	90.6	Very high	91.1	Very high	3 Å²	3	50.3 Å²	50.3	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-75.2	-24.5	-179.9	0	0	0	0	0	113.7	R329 L330 L336 L337 L402	R329-G333 PolarHBondContact O-N 2.81Å; R329-G333 VanDerWaalsContact O-N 3.14Å; L330-G333 PolarHBondContact O-N 2.63Å; G333-L336 PolarHBondContact O-N 3.15Å; G333-L337 WeakPolarHBondContact O-CB 3.45Å; G333-L337 PolarHBondContact O-N 3.47Å; G333-L402 WeakPolarHBondContact O-CD2 3.49Å
334	F	92.1	Very high	91.3	Very high	25 Å²	25	50.4 Å²	50.4	11%	0.11	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-41.9	170.3	178.1	-106.4	0	0	0	110.9	V260 T263 A264 I267 L330 L336 L337 Q338	V260-F334 HydrophobicContact CB-CE2 4.4Å; V260-F334 HydrophobicContact CG1-CE2 3.82Å; V260-F334 HydrophobicContact CG1-CZ 4.18Å; V260-F334 WeakPolarHBondContact O-CE2 3.47Å; T263-F334 HydrophobicContact CG2-CB 3.96Å; T263-F334 HydrophobicContact CG2-CD2 3.59Å; T263-F334 HydrophobicContact CG2-CE2 4.5Å; T263-F334 HydrophobicContact CG2-CG 4.15Å; A264-F334 HydrophobicContact CB-CE2 4.01Å; A264-F334 HydrophobicContact CB-CZ 3.96Å; I267-F334 HydrophobicContact CD1-CB 3.64Å; I267-F334 HydrophobicContact CD1-CD1 3.89Å; I267-F334 HydrophobicContact CD1-CD2 4.17Å; I267-F334 HydrophobicContact CD1-CG 3.64Å; L330-F334 WeakPolarHBondContact O-CA 3.34Å; L330-F334 WeakPolarHBondContact O-CB 3.39Å; L330-F334 PolarHBondContact O-N 3.05Å; F334-L336 VanDerWaalsContact C-N 3.34Å; F334-L337 PolarHBondContact O-N 3.24Å; F334-Q338 VanDerWaalsContact CE1-CD 3.44Å; F334-Q338 HydrophobicContact CE1-CG 4.19Å; F334-Q338 HydrophobicContact CE2-CG 4.35Å; F334-Q338 HydrophobicContact CZ-CG 4.12Å; F334-Q338 WeakPolarHBondContact O-CG 3.27Å; F334-Q338 PolarHBondContact O-N 3.2Å
335	S	92.1	Very high	91.4	Very high	59 Å²	59	49.9 Å²	49.9	41%	0.413	27%	0.271	S	S	.	.	H	α-helix	trans	-59	-46.8	171.4	-55.4	0	0	0	0	110.7	D331 A332 L337 Q338 D339	D331-S335 WeakPolarHBondContact O-CB 3.43Å; D331-S335 PolarHBondContact O-N 2.72Å; D331-S335 PolarHBondContact O-OG 3.12Å; A332-S335 WeakPolarHBondContact O-CB 3.26Å; A332-S335 PolarHBondContact O-N 3.24Å; S335-L337 VanDerWaalsContact C-N 3.33Å; S335-L337 PolarHBondContact O-N 3.21Å; S335-Q338 PolarHBondContact O-N 3.32Å; S335-D339 WeakPolarHBondContact O-CB 3.35Å; S335-D339 PolarHBondContact O-N 3.49Å
336	L	92.6	Very high	91.6	Very high	33 Å²	33	50 Å²	50	17%	0.173	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-38.1	176.5	-173.8	63.9	0	0	0	112.9	A332 G333 F334 W340 W398 E401 L402	A332-L336 PolarHBondContact O-N 3.1Å; A332-L336 VanDerWaalsContact O-N 3.09Å; G333-L336 PolarHBondContact O-N 3.15Å; F334-L336 VanDerWaalsContact C-N 3.34Å; L336-W340 VanDerWaalsContact O-CB 3.28Å; L336-W340 WeakPolarHBondContact O-CB 3.39Å; L336-W340 PolarHBondContact O-N 3.45Å; L336-W398 HydrophobicContact CD1-CB 3.88Å; L336-W398 HydrophobicContact CD1-CD2 3.97Å; L336-W398 HydrophobicContact CD1-CG 3.63Å; L336-W398 HydrophobicContact CG-CB 4.41Å; L336-E401 HydrophobicContact CD2-CB 4Å; L336-L402 HydrophobicContact CB-CD2 4.15Å; L336-L402 HydrophobicContact CD2-CD2 4Å; L336-L402 HydrophobicContact CD2-CG 3.91Å; L336-L402 HydrophobicContact CG-CD1 4.37Å; L336-L402 HydrophobicContact CG-CD2 4.03Å; L336-L402 HydrophobicContact CG-CG 4.01Å
337	L	92.2	Very high	91.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-67.6	-43.9	175.5	177.8	60.9	0	0	0	111.7	I257 D258 V260 G333 F334 S335 W340 E341 L402 M410 L414	I257-L337 HydrophobicContact CG2-CD2 4.04Å; D258-L337 WeakPolarHBondContact O-CD2 3.43Å; V260-L337 HydrophobicContact CG2-CD2 3.68Å; V260-L337 HydrophobicContact CG2-CG 3.85Å; G333-L337 WeakPolarHBondContact O-CB 3.45Å; G333-L337 PolarHBondContact O-N 3.47Å; F334-L337 PolarHBondContact O-N 3.24Å; S335-L337 VanDerWaalsContact C-N 3.33Å; S335-L337 PolarHBondContact O-N 3.21Å; L337-W340 HydrophobicContact CD1-CE3 4.45Å; L337-W340 PolarHBondContact O-N 3.15Å; L337-E341 HydrophobicContact CD1-CG 4.21Å; L337-E341 WeakPolarHBondContact O-CG 3.31Å; L337-E341 PolarHBondContact O-N 2.92Å; L337-L402 HydrophobicContact CB-CD1 4.45Å; L337-L402 HydrophobicContact CB-CD2 3.98Å; L337-L402 HydrophobicContact CD1-CD1 4.21Å; L337-M410 HydrophobicContact CD1-CE 3.47Å; L337-M410 VanDerWaalsContact CD1-CE 3.47Å; L337-M410 HydrophobicContact CD2-CE 3.89Å; L337-M410 HydrophobicContact CG-CE 4.34Å; L337-L414 HydrophobicContact CD1-CD2 4.47Å
338	Q	93.1	Very high	92	Very high	94 Å²	94	51.7 Å²	51.7	44%	0.439	28%	0.276	S	S	.	.	H	α-helix	trans	-64.8	-41.8	176.6	-71.4	-167.6	-47.3	0	0	112.1	F334 S335 L342	F334-Q338 VanDerWaalsContact CE1-CD 3.44Å; F334-Q338 HydrophobicContact CE1-CG 4.19Å; F334-Q338 HydrophobicContact CE2-CG 4.35Å; F334-Q338 HydrophobicContact CZ-CG 4.12Å; F334-Q338 WeakPolarHBondContact O-CG 3.27Å; F334-Q338 PolarHBondContact O-N 3.2Å; S335-Q338 PolarHBondContact O-N 3.32Å; Q338-L342 VanDerWaalsContact O-CB 3.27Å; Q338-L342 WeakPolarHBondContact O-CB 3.3Å; Q338-L342 PolarHBondContact O-N 3.31Å
339	D	91.5	Very high	92.2	Very high	80 Å²	80	55.5 Å²	55.5	43%	0.428	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-41.1	174	-81.3	-33.7	0	0	0	111.3	S335 R343 W398	S335-D339 WeakPolarHBondContact O-CB 3.35Å; S335-D339 PolarHBondContact O-N 3.49Å; D339-R343 VanDerWaalsContact O-CG 3.31Å; D339-R343 WeakPolarHBondContact O-CG 3.12Å; D339-R343 PolarHBondContact O-N 3Å; D339-W398 HydrophobicContact CB-CH2 4.49Å; D339-W398 HydrophobicContact CB-CZ3 4.03Å
340	W	93.7	Very high	92.5	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.008	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-52.4	175.6	-176.5	86.3	0	0	0	112.1	L336 L337 L342 R343 V344 M395 W398 L402 L414 R417 M418	L336-W340 VanDerWaalsContact O-CB 3.28Å; L336-W340 WeakPolarHBondContact O-CB 3.39Å; L336-W340 PolarHBondContact O-N 3.45Å; L337-W340 HydrophobicContact CD1-CE3 4.45Å; L337-W340 PolarHBondContact O-N 3.15Å; W340-L342 VanDerWaalsContact C-N 3.28Å; W340-L342 PolarHBondContact O-N 3.02Å; W340-R343 PolarHBondContact O-N 2.88Å; W340-R343 VanDerWaalsContact O-N 3.16Å; W340-V344 HydrophobicContact CD2-CG2 3.91Å; W340-V344 HydrophobicContact CE3-CG2 4.16Å; W340-V344 HydrophobicContact CH2-CG2 4.07Å; W340-V344 HydrophobicContact CZ2-CG2 3.8Å; W340-V344 HydrophobicContact CZ3-CG2 4.23Å; W340-V344 WeakPolarHBondContact O-CG2 3.2Å; W340-V344 PolarHBondContact O-N 3.35Å; W340-M395 PolarHBondContact NE1-O 3.3Å; W340-W398 HydrophobicContact CB-CE3 4.27Å; W340-L402 HydrophobicContact CB-CD1 3.96Å; W340-L402 HydrophobicContact CG-CD1 4.11Å; W340-L414 HydrophobicContact CD2-CD2 4.17Å; W340-L414 HydrophobicContact CE3-CD2 3.86Å; W340-L414 HydrophobicContact CH2-CD2 3.72Å; W340-L414 HydrophobicContact CZ2-CD2 4.03Å; W340-L414 HydrophobicContact CZ3-CD2 3.63Å; W340-R417 HydrophobicContact CH2-CB 4.16Å; W340-R417 HydrophobicContact CH2-CG 3.83Å; W340-M418 HydrophobicContact CZ2-SD 4.27Å
341	E	91.8	Very high	92.7	Very high	71 Å²	71	51.4 Å²	51.4	33%	0.332	27%	0.266	S	S	.	.	H	α-helix	trans	-59.3	-38.6	178.6	-73.5	-173.8	-178.9	0	0	112.1	V260 L337 S345	V260-E341 WeakPolarHBondContact CG2-OE1 3.48Å; V260-E341 WeakPolarHBondContact CG2-OE2 3.23Å; L337-E341 HydrophobicContact CD1-CG 4.21Å; L337-E341 WeakPolarHBondContact O-CG 3.31Å; L337-E341 PolarHBondContact O-N 2.92Å; E341-S345 WeakPolarHBondContact O-CB 3.46Å; E341-S345 PolarHBondContact O-N 3.4Å
342	L	93	Very high	92.7	Very high	93 Å²	93	53 Å²	53	49%	0.487	28%	0.278	S	S	.	.	H	α-helix	trans	-63	-47.9	174.9	178.7	60.8	0	0	0	111.8	Q338 W340 S345 E346	Q338-L342 VanDerWaalsContact O-CB 3.27Å; Q338-L342 WeakPolarHBondContact O-CB 3.3Å; Q338-L342 PolarHBondContact O-N 3.31Å; W340-L342 VanDerWaalsContact C-N 3.28Å; W340-L342 PolarHBondContact O-N 3.02Å; L342-S345 PolarHBondContact O-N 2.73Å; L342-E346 WeakPolarHBondContact O-CG 3.49Å; L342-E346 PolarHBondContact O-N 2.76Å
343	R	93	Very high	92.5	Very high	94 Å²	94	55.6 Å²	55.6	36%	0.355	28%	0.279	S	S	.	.	H	α-helix	trans	-66.7	-35.6	178.9	-67.6	-54.5	-174.9	-153.8	-11	112.8	D339 W340 E346 L347 M395 W398	D339-R343 VanDerWaalsContact O-CG 3.31Å; D339-R343 WeakPolarHBondContact O-CG 3.12Å; D339-R343 PolarHBondContact O-N 3Å; W340-R343 PolarHBondContact O-N 2.88Å; W340-R343 VanDerWaalsContact O-N 3.16Å; R343-E346 WeakPolarHBondContact CD-OE2 3.34Å; R343-E346 IonicContact CZ-OE2 2.94Å; R343-E346 IonicContact NE-OE2 3.75Å; R343-E346 IonicContact NH1-OE1 2.73Å; R343-E346 PolarHBondContact NH1-OE1 3.19Å; R343-E346 IonicContact NH1-OE2 2.7Å; R343-E346 PolarHBondContact NH1-OE2 2.99Å; R343-E346 PolarHBondContact O-N 2.69Å; R343-L347 WeakPolarHBondContact O-CB 3.49Å; R343-L347 PolarHBondContact O-N 2.86Å; R343-M395 HydrophobicContact CB-CG 3.84Å; R343-M395 HydrophobicContact CB-SD 3.4Å; R343-M395 WeakPolarHBondContact CB-SD 3.46Å; R343-W398 HydrophobicContact CB-CZ3 4.42Å; R343-W398 HydrophobicContact CG-CH2 4.16Å; R343-W398 HydrophobicContact CG-CZ3 3.68Å
344	V	93.4	Very high	92.5	Very high	6 Å²	6	55.7 Å²	55.7	4%	0.036	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-49.2	172	166.9	0	0	0	0	110.3	W340 E346 L347 E348 M395 I421	W340-V344 HydrophobicContact CD2-CG2 3.91Å; W340-V344 HydrophobicContact CE3-CG2 4.16Å; W340-V344 HydrophobicContact CH2-CG2 4.07Å; W340-V344 HydrophobicContact CZ2-CG2 3.8Å; W340-V344 HydrophobicContact CZ3-CG2 4.23Å; W340-V344 WeakPolarHBondContact O-CG2 3.2Å; W340-V344 PolarHBondContact O-N 3.35Å; V344-E346 PolarHBondContact O-N 3.15Å; V344-L347 PolarHBondContact O-N 3.05Å; V344-E348 HydrophobicContact CG1-CG 4.49Å; V344-E348 WeakPolarHBondContact O-CG 3.42Å; V344-E348 PolarHBondContact O-N 3.17Å; V344-M395 HydrophobicContact CG2-SD 4.03Å; V344-I421 HydrophobicContact CB-CD1 4.19Å; V344-I421 HydrophobicContact CG1-CD1 3.47Å; V344-I421 VanDerWaalsContact CG1-CD1 3.47Å; V344-I421 HydrophobicContact CG1-CG1 4.33Å; V344-I421 HydrophobicContact CG2-CD1 3.66Å
345	S	93.5	Very high	92.3	Very high	71 Å²	71	56 Å²	56	50%	0.497	28%	0.283	S	S	.	.	H	α-helix	trans	-64.6	-38.2	179	-166.5	0	0	0	0	113.1	E341 L342 K349	E341-S345 WeakPolarHBondContact O-CB 3.46Å; E341-S345 PolarHBondContact O-N 3.4Å; L342-S345 PolarHBondContact O-N 2.73Å; S345-K349 VanDerWaalsContact O-CB 3.29Å; S345-K349 WeakPolarHBondContact O-CB 3.42Å; S345-K349 PolarHBondContact O-N 3.02Å; S345-K349 VanDerWaalsContact O-N 3.14Å
346	E	93.6	Very high	91.7	Very high	93 Å²	93	59.7 Å²	59.7	44%	0.435	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-45.8	171.8	-75.7	-177	159.7	0	0	112	L342 R343 V344 W350	L342-E346 WeakPolarHBondContact O-CG 3.49Å; L342-E346 PolarHBondContact O-N 2.76Å; R343-E346 WeakPolarHBondContact CD-OE2 3.34Å; R343-E346 IonicContact CZ-OE2 2.94Å; R343-E346 IonicContact NE-OE2 3.75Å; R343-E346 IonicContact NH1-OE1 2.73Å; R343-E346 PolarHBondContact NH1-OE1 3.19Å; R343-E346 IonicContact NH1-OE2 2.7Å; R343-E346 PolarHBondContact NH1-OE2 2.99Å; R343-E346 PolarHBondContact O-N 2.69Å; V344-E346 PolarHBondContact O-N 3.15Å; E346-W350 PolarHBondContact O-N 3.32Å; E346-W350 VanDerWaalsContact O-N 3.15Å
347	L	94.9	Very high	91.1	Very high	8 Å²	8	60 Å²	60	4%	0.042	29%	0.293	C	S	.	.	H	α-helix	trans	-67.9	-47.5	-178.9	-170.2	80.8	0	0	0	111.7	R343 V344 K349 W350 M351 L388 V392 M395 I421 W425	R343-L347 WeakPolarHBondContact O-CB 3.49Å; R343-L347 PolarHBondContact O-N 2.86Å; V344-L347 PolarHBondContact O-N 3.05Å; L347-K349 VanDerWaalsContact C-N 3.29Å; L347-K349 PolarHBondContact O-N 3.47Å; L347-W350 PolarHBondContact O-N 2.92Å; L347-W350 VanDerWaalsContact O-N 3.17Å; L347-M351 HydrophobicContact CD2-CE 3.78Å; L347-M351 HydrophobicContact CD2-SD 4.24Å; L347-M351 HydrophobicContact CG-CE 3.9Å; L347-M351 HydrophobicContact CG-CG 4.39Å; L347-M351 HydrophobicContact CG-SD 4.3Å; L347-M351 WeakPolarHBondContact O-CG 3.38Å; L347-M351 PolarHBondContact O-N 2.83Å; L347-L388 HydrophobicContact CD1-CD1 4.34Å; L347-V392 HydrophobicContact CD1-CG2 3.85Å; L347-V392 HydrophobicContact CD2-CG2 3.88Å; L347-M395 HydrophobicContact CB-CE 4.14Å; L347-M395 HydrophobicContact CD1-CE 4.43Å; L347-M395 HydrophobicContact CD2-CE 3.85Å; L347-M395 HydrophobicContact CG-CE 4.36Å; L347-I421 HydrophobicContact CD2-CG2 3.72Å; L347-W425 HydrophobicContact CD1-CE3 4.09Å; L347-W425 HydrophobicContact CD1-CZ3 4.12Å
348	E	93.6	Very high	90.6	Very high	58 Å²	58	60.5 Å²	60.5	27%	0.271	30%	0.296	S	S	.	.	H	α-helix	trans	-58.7	-42.2	178.1	-74.7	-175.6	123	0	0	111.9	V344 W350 M351 V352 R417	V344-E348 HydrophobicContact CG1-CG 4.49Å; V344-E348 WeakPolarHBondContact O-CG 3.42Å; V344-E348 PolarHBondContact O-N 3.17Å; E348-W350 PolarHBondContact O-N 3.38Å; E348-M351 HydrophobicContact CB-CE 4.49Å; E348-M351 HydrophobicContact CG-CE 4.03Å; E348-M351 PolarHBondContact O-N 3.44Å; E348-V352 WeakPolarHBondContact O-CG2 3.39Å; E348-V352 PolarHBondContact O-N 2.81Å; E348-R417 IonicContact OE1-CZ 3.45Å; E348-R417 IonicContact OE1-NH1 2.65Å; E348-R417 PolarHBondContact OE1-NH1 2.66Å; E348-R417 IonicContact OE1-NH2 2.75Å; E348-R417 PolarHBondContact OE1-NH2 2.95Å; E348-R417 IonicContact OE2-CZ 2.74Å; E348-R417 IonicContact OE2-NH2 3.91Å; E348-R417 PolarHBondContact OE2-NH2 3.36Å
349	K	92.9	Very high	90	Very high	140 Å²	140	63.1 Å²	63.1	61%	0.609	30%	0.303	S	S	*	.	H	α-helix	trans	-62.5	-40.9	176.6	-176.1	179.4	177.5	-176.8	0	112.3	S345 L347 Q353	S345-K349 VanDerWaalsContact O-CB 3.29Å; S345-K349 WeakPolarHBondContact O-CB 3.42Å; S345-K349 PolarHBondContact O-N 3.02Å; S345-K349 VanDerWaalsContact O-N 3.14Å; L347-K349 VanDerWaalsContact C-N 3.29Å; L347-K349 PolarHBondContact O-N 3.47Å; K349-Q353 WeakPolarHBondContact O-CG 3.42Å; K349-Q353 PolarHBondContact O-N 3.21Å
350	W	94.1	Very high	88.9	Confident	36 Å²	36	63.2 Å²	63.2	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-66.2	-44.5	173.5	174.8	89.9	0	0	0	111.2	E346 L347 E348 V352 Q353 V354 D384 V385 L388 W425 V428	E346-W350 PolarHBondContact O-N 3.32Å; E346-W350 VanDerWaalsContact O-N 3.15Å; L347-W350 PolarHBondContact O-N 2.92Å; L347-W350 VanDerWaalsContact O-N 3.17Å; E348-W350 PolarHBondContact O-N 3.38Å; W350-V352 VanDerWaalsContact C-N 3.34Å; W350-V352 PolarHBondContact O-N 3.16Å; W350-Q353 PolarHBondContact O-N 3.27Å; W350-V354 HydrophobicContact CD2-CG2 3.92Å; W350-V354 HydrophobicContact CE3-CG2 4.41Å; W350-V354 HydrophobicContact CG-CG2 4.38Å; W350-V354 HydrophobicContact CH2-CG2 4.19Å; W350-V354 HydrophobicContact CZ2-CG2 3.7Å; W350-V354 WeakPolarHBondContact O-CB 3.36Å; W350-V354 WeakPolarHBondContact O-CG2 3.3Å; W350-V354 PolarHBondContact O-N 3.1Å; W350-D384 HydrophobicContact CZ2-CB 3.84Å; W350-V385 HydrophobicContact CH2-CG2 3.81Å; W350-V385 HydrophobicContact CZ2-CG2 4.4Å; W350-L388 HydrophobicContact CD2-CD1 3.37Å; W350-L388 HydrophobicContact CE3-CD1 3.65Å; W350-L388 HydrophobicContact CG-CD1 3.9Å; W350-L388 HydrophobicContact CH2-CD1 4.01Å; W350-L388 HydrophobicContact CZ2-CD1 3.72Å; W350-L388 HydrophobicContact CZ3-CD1 3.98Å; W350-W425 HydrophobicContact CE3-CZ3 4.35Å; W350-W425 AromaticContact CH2-CZ3 3.95Å; W350-W425 HydrophobicContact CH2-CZ3 3.95Å; W350-W425 HydrophobicContact CZ3-CE3 4.04Å; W350-W425 AromaticContact CZ3-CZ3 3.54Å; W350-W425 HydrophobicContact CZ3-CZ3 3.54Å; W350-V428 HydrophobicContact CH2-CG1 4.13Å; W350-V428 HydrophobicContact CZ3-CG1 3.91Å
351	M	93.8	Very high	87.6	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-58.3	-44.5	178.1	-72.2	-171.2	-67.8	0	0	111.5	L347 E348 V354 T355 I421 H424 W425 V428	L347-M351 HydrophobicContact CD2-CE 3.78Å; L347-M351 HydrophobicContact CD2-SD 4.24Å; L347-M351 HydrophobicContact CG-CE 3.9Å; L347-M351 HydrophobicContact CG-CG 4.39Å; L347-M351 HydrophobicContact CG-SD 4.3Å; L347-M351 WeakPolarHBondContact O-CG 3.38Å; L347-M351 PolarHBondContact O-N 2.83Å; E348-M351 HydrophobicContact CB-CE 4.49Å; E348-M351 HydrophobicContact CG-CE 4.03Å; E348-M351 PolarHBondContact O-N 3.44Å; M351-V354 PolarHBondContact O-N 3.47Å; M351-T355 WeakPolarHBondContact O-CG2 3.46Å; M351-T355 PolarHBondContact O-N 3.06Å; M351-I421 HydrophobicContact CE-CG2 4.49Å; M351-H424 HydrophobicContact SD-CB 4.35Å; M351-W425 HydrophobicContact SD-CB 4Å; M351-W425 HydrophobicContact SD-CE3 4.44Å; M351-V428 HydrophobicContact CB-CG2 4.19Å; M351-V428 HydrophobicContact CG-CG2 4.25Å
352	V	89.8	Confident	86.6	Confident	83 Å²	83	73.2 Å²	73.2	50%	0.503	36%	0.359	S	S	.	.	H	α-helix	trans	-59.3	-50.1	174.7	171.3	0	0	0	0	111.5	E348 W350 V354 T355 E356	E348-V352 WeakPolarHBondContact O-CG2 3.39Å; E348-V352 PolarHBondContact O-N 2.81Å; W350-V352 VanDerWaalsContact C-N 3.34Å; W350-V352 PolarHBondContact O-N 3.16Å; V352-V354 PolarHBondContact O-N 3.11Å; V352-T355 PolarHBondContact O-N 2.86Å; V352-T355 VanDerWaalsContact O-N 3.14Å; V352-T355 PolarHBondContact O-OG1 3.33Å; V352-E356 PolarHBondContact O-N 3.2Å
353	Q	88.2	Confident	85.7	Confident	117 Å²	117	70.8 Å²	70.8	55%	0.547	35%	0.349	S	S	.	.	H	α-helix	trans	-58.6	-36.3	177.7	-72.3	177.4	-20.5	0	0	112.6	K349 W350	K349-Q353 WeakPolarHBondContact O-CG 3.42Å; K349-Q353 PolarHBondContact O-N 3.21Å; W350-Q353 PolarHBondContact O-N 3.27Å
354	V	90.1	Very high	84.7	Confident	6 Å²	6	67.3 Å²	67.3	4%	0.036	34%	0.34	C	S	.	.	H	α-helix	trans	-75.2	-34.3	177.9	170	0	0	0	0	112.2	W350 M351 V352 E356 F357 I358 L381 V428	W350-V354 HydrophobicContact CD2-CG2 3.92Å; W350-V354 HydrophobicContact CE3-CG2 4.41Å; W350-V354 HydrophobicContact CG-CG2 4.38Å; W350-V354 HydrophobicContact CH2-CG2 4.19Å; W350-V354 HydrophobicContact CZ2-CG2 3.7Å; W350-V354 WeakPolarHBondContact O-CB 3.36Å; W350-V354 WeakPolarHBondContact O-CG2 3.3Å; W350-V354 PolarHBondContact O-N 3.1Å; M351-V354 PolarHBondContact O-N 3.47Å; V352-V354 PolarHBondContact O-N 3.11Å; V354-E356 VanDerWaalsContact C-N 3.26Å; V354-E356 PolarHBondContact O-N 3.07Å; V354-F357 PolarHBondContact O-N 3.28Å; V354-I358 HydrophobicContact CG1-CD1 3.58Å; V354-I358 HydrophobicContact CG1-CG1 4.1Å; V354-I358 WeakPolarHBondContact O-CG1 3.42Å; V354-I358 PolarHBondContact O-N 2.98Å; V354-L381 HydrophobicContact CG1-CD1 4.32Å; V354-L381 HydrophobicContact CG1-CD2 4.39Å; V354-L381 HydrophobicContact CG2-CD2 3.67Å; V354-V428 HydrophobicContact CB-CG1 4.43Å; V354-V428 HydrophobicContact CG1-CG1 3.74Å
355	T	86.7	Confident	83.5	Confident	30 Å²	30	68.7 Å²	68.7	18%	0.184	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-32.6	174	57.5	0	0	0	0	113	M351 V352 I358 Y359 V428	M351-T355 WeakPolarHBondContact O-CG2 3.46Å; M351-T355 PolarHBondContact O-N 3.06Å; V352-T355 PolarHBondContact O-N 2.86Å; V352-T355 VanDerWaalsContact O-N 3.14Å; V352-T355 PolarHBondContact O-OG1 3.33Å; T355-I358 PolarHBondContact O-N 3.08Å; T355-Y359 HydrophobicContact CG2-CE2 4.25Å; T355-Y359 VanDerWaalsContact O-CD2 3.23Å; T355-Y359 WeakPolarHBondContact O-CD2 3.39Å; T355-Y359 PolarHBondContact O-N 3.41Å; T355-Y359 VanDerWaalsContact O-N 3.12Å; T355-V428 HydrophobicContact CG2-CG2 4.03Å
356	E	80.1	Confident	82.1	Confident	137 Å²	137	65.5 Å²	65.5	64%	0.64	33%	0.327	S	S	*	.	H	α-helix	trans	-57.5	-54.9	173.3	-66	-172	161.8	0	0	110.9	V352 V354 I358 Y359 A360	V352-E356 PolarHBondContact O-N 3.2Å; V354-E356 VanDerWaalsContact C-N 3.26Å; V354-E356 PolarHBondContact O-N 3.07Å; E356-I358 PolarHBondContact O-N 3.19Å; E356-Y359 PolarHBondContact O-N 2.75Å; E356-A360 WeakPolarHBondContact O-CB 3.15Å; E356-A360 PolarHBondContact O-N 3.34Å
357	F	79.1	Confident	81.1	Confident	39 Å²	39	63 Å²	63	17%	0.171	32%	0.316	C	S	.	.	H	α-helix	trans	-62.9	-41.6	179.1	175.9	-95.5	0	0	0	113.3	V354 Y359 Q377 L381 K435	V354-F357 PolarHBondContact O-N 3.28Å; F357-Y359 VanDerWaalsContact C-N 3.31Å; F357-Y359 PolarHBondContact O-N 2.79Å; F357-Q377 HydrophobicContact CE2-CB 4.03Å; F357-Q377 VanDerWaalsContact CE2-OE1 3.22Å; F357-Q377 HydrophobicContact CZ-CB 3.94Å; F357-L381 HydrophobicContact CB-CD1 4.37Å; F357-L381 HydrophobicContact CD1-CD1 3.26Å; F357-L381 HydrophobicContact CE1-CD1 3.75Å; F357-L381 HydrophobicContact CG-CD1 4.01Å; F357-K435 HydrophobicContact CE1-CG 4.47Å
358	I	83.5	Confident	80.3	Confident	11 Å²	11	64.7 Å²	64.7	6%	0.056	33%	0.326	C	S	.	.	H	α-helix	trans	-58.8	-43.9	-178.3	-74.8	174.1	0	0	0	111.2	V354 T355 E356 V428 V431 T432	V354-I358 HydrophobicContact CG1-CD1 3.58Å; V354-I358 HydrophobicContact CG1-CG1 4.1Å; V354-I358 WeakPolarHBondContact O-CG1 3.42Å; V354-I358 PolarHBondContact O-N 2.98Å; T355-I358 PolarHBondContact O-N 3.08Å; E356-I358 PolarHBondContact O-N 3.19Å; I358-V428 HydrophobicContact CD1-CG1 4.27Å; I358-V431 HydrophobicContact CG2-CB 3.82Å; I358-V431 HydrophobicContact CG2-CG1 3.28Å; I358-T432 WeakPolarHBondContact CD1-OG1 3.37Å
359	Y	80.7	Confident	79.7	Confident	149 Å²	149	68.9 Å²	68.9	58%	0.584	35%	0.346	S	S	*	.	H	α-helix	trans	-95.4	-22.9	-173.6	-67.5	-63.9	0	0	0	114.7	T355 E356 F357	T355-Y359 HydrophobicContact CG2-CE2 4.25Å; T355-Y359 VanDerWaalsContact O-CD2 3.23Å; T355-Y359 WeakPolarHBondContact O-CD2 3.39Å; T355-Y359 PolarHBondContact O-N 3.41Å; T355-Y359 VanDerWaalsContact O-N 3.12Å; E356-Y359 PolarHBondContact O-N 2.75Å; F357-Y359 VanDerWaalsContact C-N 3.31Å; F357-Y359 PolarHBondContact O-N 2.79Å
360	A	66.9	Low	79.2	Confident	82 Å²	82	65.1 Å²	65.1	68%	0.678	34%	0.335	S	S	*	.	H	α-helix	trans	-78.6	-21.8	-166.8	0	0	0	0	0	116.6	E356	E356-A360 WeakPolarHBondContact O-CB 3.15Å; E356-A360 PolarHBondContact O-N 3.34Å
361	E	66.3	Low	78.8	Confident	98 Å²	98	63.4 Å²	63.4	46%	0.458	33%	0.329	S	S	.	.			trans	-125.4	146.1	-175.1	-65.6	-164.2	157.2	0	0	114.5	Q374 K435	E361-Q374 PolarHBondContact OE2-NE2 3.35Å; E361-K435 PolarHBondContact O-NZ 2.77Å
362	K	71.7	Confident	78.5	Confident	185 Å²	185	67 Å²	67	80%	0.804	34%	0.344	S	S	*	.			trans	-87.4	155.9	162	-69.2	-179.2	-179.9	176.7	0	110.1	A364 Q374	K362-A364 PolarHBondContact O-N 2.9Å; K362-Q374 PolarHBondContact O-NE2 2.96Å
363	P	73.1	Confident	78.4	Confident	42 Å²	42	64.9 Å²	64.9	27%	0.273	34%	0.335	S	S	.	.			trans	-55.4	130.5	172.1	-25.5	35.6	0	0	0	111.6	V365 L371 L439 A442	P363-V365 HydrophobicContact CB-CG2 4.16Å; P363-V365 PolarHBondContact O-N 2.86Å; P363-L371 HydrophobicContact CB-CD1 4.05Å; P363-L439 HydrophobicContact CB-CD2 3.94Å; P363-L439 HydrophobicContact CG-CD2 4.11Å; P363-A442 HydrophobicContact CB-CB 4.09Å
364	A	72.6	Confident	78.5	Confident	21 Å²	21	59.6 Å²	59.6	17%	0.174	31%	0.31	C	S	.	.			trans	-76.7	57.4	-179.6	0	0	0	0	0	112.9	K362 G366 I367 T370 L371	K362-A364 PolarHBondContact O-N 2.9Å; A364-G366 PolarHBondContact O-N 3.37Å; A364-I367 PolarHBondContact O-N 2.89Å; A364-I367 VanDerWaalsContact O-N 3.08Å; A364-T370 HydrophobicContact CB-CG2 3.59Å; A364-L371 HydrophobicContact CB-CB 4.46Å
365	V	67.8	Low	78.5	Confident	36 Å²	36	60.5 Å²	60.5	22%	0.218	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	119.2	-176.5	-174.4	0	0	0	0	110.6	P363 A442 L506 V509 I510	P363-V365 HydrophobicContact CB-CG2 4.16Å; P363-V365 PolarHBondContact O-N 2.86Å; V365-A442 HydrophobicContact CG2-CB 4.36Å; V365-L506 HydrophobicContact CG1-CD1 3.71Å; V365-V509 HydrophobicContact CB-CG1 4.35Å; V365-V509 HydrophobicContact CG1-CG1 4Å; V365-I510 HydrophobicContact CG1-CG1 4.26Å
366	G	64.7	Low	78.8	Confident	4 Å²	4	64.3 Å²	64.3	4%	0.041	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	110.2	-28.4	-176.9	0	0	0	0	0	114.7	A364 L524	A364-G366 PolarHBondContact O-N 3.37Å; G366-L524 WeakPolarHBondContact O-CD2 3.5Å
367	I	73.6	Confident	79.3	Confident	40 Å²	40	62.6 Å²	62.6	21%	0.205	32%	0.322	C	S	.	.			trans	-101.5	92.9	178.3	-49.5	168.1	0	0	0	108.7	A364 E369 T370 L371 D518 T521	A364-I367 PolarHBondContact O-N 2.89Å; A364-I367 VanDerWaalsContact O-N 3.08Å; I367-E369 VanDerWaalsContact C-N 3.29Å; I367-E369 PolarHBondContact O-N 3.29Å; I367-T370 VanDerWaalsContact CG2-OG1 3.24Å; I367-T370 WeakPolarHBondContact CG2-OG1 3.29Å; I367-T370 PolarHBondContact O-N 3.42Å; I367-L371 VanDerWaalsContact O-CB 3.28Å; I367-L371 WeakPolarHBondContact O-CB 3.45Å; I367-L371 PolarHBondContact O-N 3.01Å; I367-D518 VanDerWaalsContact CG2-OD2 3.31Å; I367-D518 WeakPolarHBondContact CG2-OD2 3.43Å; I367-T521 WeakPolarHBondContact CG1-OG1 3.49Å
368	V	77.3	Confident	79.9	Confident	43 Å²	43	60.8 Å²	60.8	26%	0.261	32%	0.315	S	S	.	.	H	α-helix	trans	-53.8	-45.2	-176.4	178.2	0	0	0	0	112	K372 Y443 M447 F450	V368-K372 WeakPolarHBondContact O-CB 3.39Å; V368-K372 PolarHBondContact O-N 3.22Å; V368-Y443 HydrophobicContact CG1-CE2 4.02Å; V368-M447 HydrophobicContact CG1-SD 3.97Å; V368-M447 HydrophobicContact CG2-SD 4.45Å; V368-F450 HydrophobicContact CG2-CD2 3.75Å; V368-F450 HydrophobicContact CG2-CE2 3.43Å; V368-F450 VanDerWaalsContact CG2-CE2 3.43Å
369	E	80.7	Confident	80.4	Confident	146 Å²	146	63.9 Å²	63.9	68%	0.682	33%	0.329	S	S	*	.	H	α-helix	trans	-60.6	-51.4	179.6	-66.6	-66.4	128.4	0	0	112	I367 K372 A373	I367-E369 VanDerWaalsContact C-N 3.29Å; I367-E369 PolarHBondContact O-N 3.29Å; E369-K372 PolarHBondContact O-N 3.2Å; E369-A373 WeakPolarHBondContact O-CB 3.18Å; E369-A373 PolarHBondContact O-N 2.82Å
370	T	82.7	Confident	81	Confident	61 Å²	61	59 Å²	59	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-66.4	-41.7	179.7	-54	0	0	0	0	111.8	A364 I367 K372 A373 Q374	A364-T370 HydrophobicContact CB-CG2 3.59Å; I367-T370 VanDerWaalsContact CG2-OG1 3.24Å; I367-T370 WeakPolarHBondContact CG2-OG1 3.29Å; I367-T370 PolarHBondContact O-N 3.42Å; T370-K372 VanDerWaalsContact C-N 3.31Å; T370-K372 PolarHBondContact O-N 3.48Å; T370-A373 PolarHBondContact O-N 3.27Å; T370-Q374 WeakPolarHBondContact O-CG 3.2Å; T370-Q374 PolarHBondContact O-N 3.11Å
371	L	84.8	Confident	82.2	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-67.4	-34.3	179.1	-172.6	57.1	0	0	0	111.7	P363 A364 I367 L375 L439 A442 Y443	P363-L371 HydrophobicContact CB-CD1 4.05Å; A364-L371 HydrophobicContact CB-CB 4.46Å; I367-L371 VanDerWaalsContact O-CB 3.28Å; I367-L371 WeakPolarHBondContact O-CB 3.45Å; I367-L371 PolarHBondContact O-N 3.01Å; L371-L375 WeakPolarHBondContact O-CB 3.28Å; L371-L375 PolarHBondContact O-N 2.85Å; L371-L439 HydrophobicContact CD1-CD2 3.89Å; L371-A442 HydrophobicContact CD1-CB 4.19Å; L371-A442 HydrophobicContact CD2-CB 4.23Å; L371-Y443 HydrophobicContact CG-CD2 4.25Å
372	K	87.8	Confident	83.5	Confident	77 Å²	77	52.4 Å²	52.4	34%	0.335	28%	0.276	S	S	.	.	H	α-helix	trans	-67.4	-41.8	169.7	-177.9	173.4	170.8	-66.1	0	111.9	V368 E369 T370 L375 E376 Y443	V368-K372 WeakPolarHBondContact O-CB 3.39Å; V368-K372 PolarHBondContact O-N 3.22Å; E369-K372 PolarHBondContact O-N 3.2Å; T370-K372 VanDerWaalsContact C-N 3.31Å; T370-K372 PolarHBondContact O-N 3.48Å; K372-L375 WeakPolarHBondContact O-CB 3.15Å; K372-L375 PolarHBondContact O-N 2.98Å; K372-E376 WeakPolarHBondContact CE-OE1 3.25Å; K372-E376 IonicContact NZ-OE1 2.72Å; K372-E376 PolarHBondContact NZ-OE1 2.91Å; K372-E376 WeakPolarHBondContact O-CB 3.48Å; K372-E376 WeakPolarHBondContact O-CG 3.42Å; K372-E376 PolarHBondContact O-N 3.25Å; K372-Y443 HydrophobicContact CB-CD2 4.35Å; K372-Y443 HydrophobicContact CB-CE2 3.81Å; K372-Y443 HydrophobicContact CG-CE2 4.38Å
373	A	88.9	Confident	84.6	Confident	37 Å²	37	47.9 Å²	47.9	31%	0.306	26%	0.26	S	S	.	.	H	α-helix	trans	-65	-42.5	175.6	0	0	0	0	0	112.3	E369 T370 L375 E376 Q377	E369-A373 WeakPolarHBondContact O-CB 3.18Å; E369-A373 PolarHBondContact O-N 2.82Å; T370-A373 PolarHBondContact O-N 3.27Å; A373-L375 VanDerWaalsContact C-N 3.31Å; A373-L375 PolarHBondContact O-N 3.35Å; A373-E376 PolarHBondContact O-N 3.3Å; A373-Q377 WeakPolarHBondContact O-CB 3.48Å; A373-Q377 VanDerWaalsContact O-CG 3.27Å; A373-Q377 WeakPolarHBondContact O-CG 3.47Å; A373-Q377 PolarHBondContact O-N 2.96Å
374	Q	88.9	Confident	85.6	Confident	7 Å²	7	49.3 Å²	49.3	3%	0.033	27%	0.265	C	S	.	.	H	α-helix	trans	-59.4	-42	171.2	-73.8	179.6	-31.5	0	0	111.2	E361 K362 T370 Q377 S378 L439	E361-Q374 PolarHBondContact OE2-NE2 3.35Å; K362-Q374 PolarHBondContact O-NE2 2.96Å; T370-Q374 WeakPolarHBondContact O-CG 3.2Å; T370-Q374 PolarHBondContact O-N 3.11Å; Q374-Q377 PolarHBondContact O-N 2.84Å; Q374-S378 WeakPolarHBondContact O-CB 3.44Å; Q374-S378 PolarHBondContact O-N 3.33Å; Q374-S378 PolarHBondContact O-OG 3.48Å; Q374-L439 HydrophobicContact CB-CD1 4.08Å; Q374-L439 HydrophobicContact CB-CD2 3.77Å; Q374-L439 HydrophobicContact CG-CD2 4.49Å
375	L	91	Very high	86.7	Confident	25 Å²	25	48.4 Å²	48.4	13%	0.131	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-45.5	177.1	-176.1	60.5	0	0	0	111.8	L371 K372 A373 Q377 S378 Q379 L439 N440 Y443	L371-L375 WeakPolarHBondContact O-CB 3.28Å; L371-L375 PolarHBondContact O-N 2.85Å; K372-L375 WeakPolarHBondContact O-CB 3.15Å; K372-L375 PolarHBondContact O-N 2.98Å; A373-L375 VanDerWaalsContact C-N 3.31Å; A373-L375 PolarHBondContact O-N 3.35Å; L375-Q377 PolarHBondContact O-N 3.1Å; L375-S378 PolarHBondContact O-N 3.02Å; L375-S378 PolarHBondContact O-OG 3.41Å; L375-Q379 WeakPolarHBondContact O-CB 3.38Å; L375-Q379 PolarHBondContact O-N 3.24Å; L375-L439 HydrophobicContact CD1-CB 4.21Å; L375-N440 HydrophobicContact CD1-CB 3.83Å; L375-Y443 HydrophobicContact CD2-CD1 4.08Å; L375-Y443 HydrophobicContact CD2-CG 4.14Å
376	E	92.8	Very high	87.9	Confident	109 Å²	109	51.3 Å²	51.3	51%	0.509	27%	0.272	S	S	.	.	H	α-helix	trans	-60.9	-41.6	175.6	-75.3	171.4	-172.2	0	0	112.3	K372 A373 Q379 A380	K372-E376 WeakPolarHBondContact CE-OE1 3.25Å; K372-E376 IonicContact NZ-OE1 2.72Å; K372-E376 PolarHBondContact NZ-OE1 2.91Å; K372-E376 WeakPolarHBondContact O-CB 3.48Å; K372-E376 WeakPolarHBondContact O-CG 3.42Å; K372-E376 PolarHBondContact O-N 3.25Å; A373-E376 PolarHBondContact O-N 3.3Å; E376-Q379 PolarHBondContact O-N 3.33Å; E376-A380 PolarHBondContact O-N 3.49Å
377	Q	90.3	Very high	89.3	Confident	101 Å²	101	53.8 Å²	53.8	47%	0.472	29%	0.292	S	S	.	.	H	α-helix	trans	-64.4	-44.7	173.4	-71.2	170.8	19.8	0	0	111.8	F357 A373 Q374 L375 Q379 A380 L381	F357-Q377 HydrophobicContact CE2-CB 4.03Å; F357-Q377 VanDerWaalsContact CE2-OE1 3.22Å; F357-Q377 HydrophobicContact CZ-CB 3.94Å; A373-Q377 WeakPolarHBondContact O-CB 3.48Å; A373-Q377 VanDerWaalsContact O-CG 3.27Å; A373-Q377 WeakPolarHBondContact O-CG 3.47Å; A373-Q377 PolarHBondContact O-N 2.96Å; Q374-Q377 PolarHBondContact O-N 2.84Å; L375-Q377 PolarHBondContact O-N 3.1Å; Q377-Q379 VanDerWaalsContact C-N 3.3Å; Q377-Q379 PolarHBondContact O-N 2.79Å; Q377-A380 WeakPolarHBondContact O-CB 3.22Å; Q377-A380 PolarHBondContact O-N 2.95Å; Q377-L381 PolarHBondContact O-N 3.39Å; Q377-L381 VanDerWaalsContact O-N 3.08Å
378	S	91.9	Very high	90.3	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.007	29%	0.29	C	S	.	.	H	α-helix	trans	-63.7	-35.1	176	74.7	0	0	0	0	112.6	Q374 L375 L381 I382 H436	Q374-S378 WeakPolarHBondContact O-CB 3.44Å; Q374-S378 PolarHBondContact O-N 3.33Å; Q374-S378 PolarHBondContact O-OG 3.48Å; L375-S378 PolarHBondContact O-N 3.02Å; L375-S378 PolarHBondContact O-OG 3.41Å; S378-L381 PolarHBondContact O-N 2.97Å; S378-I382 WeakPolarHBondContact O-CG1 3.42Å; S378-I382 PolarHBondContact O-N 2.73Å; S378-H436 PolarHBondContact OG-ND1 3.19Å
379	Q	93.5	Very high	91.1	Very high	76 Å²	76	53 Å²	53	36%	0.355	29%	0.293	S	S	.	.	H	α-helix	trans	-67.6	-37.4	174.4	-177.3	62.4	71.2	0	0	111.7	L375 E376 Q377 L381 I382 N383 H436	L375-Q379 WeakPolarHBondContact O-CB 3.38Å; L375-Q379 PolarHBondContact O-N 3.24Å; E376-Q379 PolarHBondContact O-N 3.33Å; Q377-Q379 VanDerWaalsContact C-N 3.3Å; Q377-Q379 PolarHBondContact O-N 2.79Å; Q379-L381 VanDerWaalsContact C-N 3.32Å; Q379-L381 PolarHBondContact O-N 2.96Å; Q379-I382 PolarHBondContact O-N 3.35Å; Q379-N383 PolarHBondContact NE2-OD1 3.33Å; Q379-N383 PolarHBondContact O-N 2.83Å; Q379-N383 PolarHBondContact O-ND2 2.65Å; Q379-N383 PolarHBondContact O-OD1 3.42Å; Q379-N383 VanDerWaalsContact O-OD1 3.11Å; Q379-H436 PolarHBondContact OE1-CE1 3.24Å
380	A	93.6	Very high	91.7	Very high	46 Å²	46	49.9 Å²	49.9	38%	0.38	29%	0.285	S	S	.	.	H	α-helix	trans	-60.4	-42.9	172.1	0	0	0	0	0	111.3	E376 Q377 I382 N383 D384	E376-A380 PolarHBondContact O-N 3.49Å; Q377-A380 WeakPolarHBondContact O-CB 3.22Å; Q377-A380 PolarHBondContact O-N 2.95Å; A380-I382 PolarHBondContact O-N 2.89Å; A380-N383 WeakPolarHBondContact O-CB 3.43Å; A380-N383 PolarHBondContact O-N 3.37Å; A380-N383 VanDerWaalsContact O-N 3.14Å; A380-D384 PolarHBondContact O-N 3.37Å
381	L	92.3	Very high	92.2	Very high	24 Å²	24	51.6 Å²	51.6	13%	0.126	29%	0.287	C	S	.	.	H	α-helix	trans	-65.7	-33.8	175.5	-65.8	178.5	0	0	0	113.7	V354 F357 Q377 S378 Q379 D384 V385 T432	V354-L381 HydrophobicContact CG1-CD1 4.32Å; V354-L381 HydrophobicContact CG1-CD2 4.39Å; V354-L381 HydrophobicContact CG2-CD2 3.67Å; F357-L381 HydrophobicContact CB-CD1 4.37Å; F357-L381 HydrophobicContact CD1-CD1 3.26Å; F357-L381 HydrophobicContact CE1-CD1 3.75Å; F357-L381 HydrophobicContact CG-CD1 4.01Å; Q377-L381 PolarHBondContact O-N 3.39Å; Q377-L381 VanDerWaalsContact O-N 3.08Å; S378-L381 PolarHBondContact O-N 2.97Å; Q379-L381 VanDerWaalsContact C-N 3.32Å; Q379-L381 PolarHBondContact O-N 2.96Å; L381-D384 PolarHBondContact O-N 3.3Å; L381-V385 WeakPolarHBondContact O-CB 3.4Å; L381-V385 WeakPolarHBondContact O-CG2 3.43Å; L381-V385 PolarHBondContact O-N 3.1Å; L381-T432 HydrophobicContact CB-CG2 3.76Å
382	I	94.1	Very high	92.7	Very high	19 Å²	19	51.8 Å²	51.8	10%	0.097	29%	0.288	C	S	.	.	H	α-helix	trans	-63.8	-42.3	170.6	-67.5	-67.4	0	0	0	110.8	S378 Q379 A380 V385 D386 T432 K433 H436	S378-I382 WeakPolarHBondContact O-CG1 3.42Å; S378-I382 PolarHBondContact O-N 2.73Å; Q379-I382 PolarHBondContact O-N 3.35Å; A380-I382 PolarHBondContact O-N 2.89Å; I382-V385 WeakPolarHBondContact O-CB 3.33Å; I382-V385 PolarHBondContact O-N 2.88Å; I382-D386 PolarHBondContact O-N 2.87Å; I382-T432 HydrophobicContact CD1-CG2 3.79Å; I382-T432 HydrophobicContact CG1-CG2 4.23Å; I382-K433 HydrophobicContact CD1-CB 4.38Å; I382-K433 HydrophobicContact CD1-CD 4.46Å; I382-K433 HydrophobicContact CD1-CG 3.43Å; I382-K433 VanDerWaalsContact CD1-CG 3.43Å; I382-H436 HydrophobicContact CD1-CB 4.39Å; I382-H436 HydrophobicContact CG1-CB 4.14Å
383	N	95	Very high	92.9	Very high	89 Å²	89	54.6 Å²	54.6	48%	0.476	30%	0.3	S	S	.	.	H	α-helix	trans	-65.1	-40.1	177.1	-56.4	-17.4	0	0	0	111.5	Q379 A380 D386 A387	Q379-N383 PolarHBondContact NE2-OD1 3.33Å; Q379-N383 PolarHBondContact O-N 2.83Å; Q379-N383 PolarHBondContact O-ND2 2.65Å; Q379-N383 PolarHBondContact O-OD1 3.42Å; Q379-N383 VanDerWaalsContact O-OD1 3.11Å; A380-N383 WeakPolarHBondContact O-CB 3.43Å; A380-N383 PolarHBondContact O-N 3.37Å; A380-N383 VanDerWaalsContact O-N 3.14Å; N383-D386 PolarHBondContact O-N 3.49Å; N383-A387 VanDerWaalsContact O-CB 3.3Å; N383-A387 WeakPolarHBondContact O-CB 3.1Å; N383-A387 PolarHBondContact O-N 3.49Å
384	D	93.8	Very high	93.1	Very high	72 Å²	72	57.3 Å²	57.3	39%	0.385	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-42.4	174.3	-77.7	-4.3	0	0	0	111.5	W350 A380 L381 D386 A387 L388	W350-D384 HydrophobicContact CZ2-CB 3.84Å; A380-D384 PolarHBondContact O-N 3.37Å; L381-D384 PolarHBondContact O-N 3.3Å; D384-D386 PolarHBondContact O-N 2.95Å; D384-A387 CarbonylContact O-C 3.6Å; D384-A387 PolarHBondContact O-N 3.01Å; D384-L388 WeakPolarHBondContact O-CB 3.5Å; D384-L388 VanDerWaalsContact O-CG 3.31Å; D384-L388 WeakPolarHBondContact O-CG 3.31Å; D384-L388 PolarHBondContact O-N 3.35Å
385	V	94.1	Very high	93.3	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-56.1	-50.3	173.4	156.7	0	0	0	0	111	W350 L381 I382 A387 L388 A389 W425 V429	W350-V385 HydrophobicContact CH2-CG2 3.81Å; W350-V385 HydrophobicContact CZ2-CG2 4.4Å; L381-V385 WeakPolarHBondContact O-CB 3.4Å; L381-V385 WeakPolarHBondContact O-CG2 3.43Å; L381-V385 PolarHBondContact O-N 3.1Å; I382-V385 WeakPolarHBondContact O-CB 3.33Å; I382-V385 PolarHBondContact O-N 2.88Å; V385-A387 VanDerWaalsContact C-N 3.28Å; V385-A387 PolarHBondContact O-N 3.31Å; V385-L388 PolarHBondContact O-N 3.28Å; V385-A389 WeakPolarHBondContact O-CB 3.05Å; V385-A389 PolarHBondContact O-N 3.27Å; V385-W425 HydrophobicContact CG1-CH2 4.43Å; V385-W425 HydrophobicContact CG1-CZ2 4.47Å; V385-W425 HydrophobicContact CG2-CH2 4.5Å; V385-W425 WeakPolarHBondContact O-CH2 3.49Å; V385-V429 HydrophobicContact CG1-CB 4.45Å; V385-V429 HydrophobicContact CG1-CG1 4.07Å; V385-V429 HydrophobicContact CG1-CG2 3.76Å; V385-V429 HydrophobicContact CG2-CG2 4.11Å
386	D	93.7	Very high	93.4	Very high	96 Å²	96	59.3 Å²	59.3	51%	0.513	32%	0.315	S	S	.	.	H	α-helix	trans	-69.4	-27	-178.8	-70.4	-16.2	0	0	0	112	I382 N383 D384 P390 K433	I382-D386 PolarHBondContact O-N 2.87Å; N383-D386 PolarHBondContact O-N 3.49Å; D384-D386 PolarHBondContact O-N 2.95Å; D386-P390 WeakPolarHBondContact O-CD 3.15Å; D386-K433 IonicContact OD1-NZ 2.78Å
387	A	94.4	Very high	93.4	Very high	57 Å²	57	57.4 Å²	57.4	47%	0.471	31%	0.311	S	S	.	.	H	α-helix	trans	-80.7	-25.4	174.6	0	0	0	0	0	114.5	N383 D384 V385	N383-A387 VanDerWaalsContact O-CB 3.3Å; N383-A387 WeakPolarHBondContact O-CB 3.1Å; N383-A387 PolarHBondContact O-N 3.49Å; D384-A387 CarbonylContact O-C 3.6Å; D384-A387 PolarHBondContact O-N 3.01Å; V385-A387 VanDerWaalsContact C-N 3.28Å; V385-A387 PolarHBondContact O-N 3.31Å
388	L	94.2	Very high	93.6	Very high	28 Å²	28	54.6 Å²	54.6	15%	0.147	30%	0.297	C	S	.	.	H	α-helix	trans	-91.1	-29.8	177	-71	176.3	0	0	0	112.8	L347 W350 D384 V385 P390 K391 V392 W425	L347-L388 HydrophobicContact CD1-CD1 4.34Å; W350-L388 HydrophobicContact CD2-CD1 3.37Å; W350-L388 HydrophobicContact CE3-CD1 3.65Å; W350-L388 HydrophobicContact CG-CD1 3.9Å; W350-L388 HydrophobicContact CH2-CD1 4.01Å; W350-L388 HydrophobicContact CZ2-CD1 3.72Å; W350-L388 HydrophobicContact CZ3-CD1 3.98Å; D384-L388 WeakPolarHBondContact O-CB 3.5Å; D384-L388 VanDerWaalsContact O-CG 3.31Å; D384-L388 WeakPolarHBondContact O-CG 3.31Å; D384-L388 PolarHBondContact O-N 3.35Å; V385-L388 PolarHBondContact O-N 3.28Å; L388-P390 VanDerWaalsContact C-CD 3.47Å; L388-K391 HydrophobicContact CD2-CD 3.95Å; L388-K391 WeakPolarHBondContact O-CA 3.35Å; L388-K391 WeakPolarHBondContact O-CB 3.31Å; L388-K391 PolarHBondContact O-N 2.7Å; L388-V392 PolarHBondContact O-N 2.85Å; L388-W425 HydrophobicContact CB-CH2 3.65Å; L388-W425 HydrophobicContact CB-CZ3 3.86Å; L388-W425 HydrophobicContact CD1-CZ3 4.37Å
389	A	94	Very high	93.6	Very high	39 Å²	39	54.6 Å²	54.6	32%	0.322	30%	0.296	S	S	.	.	H	α-helix	trans	-44.7	-46.4	175.6	0	0	0	0	0	115.3	V385 K391 V392 K393 W425	V385-A389 WeakPolarHBondContact O-CB 3.05Å; V385-A389 PolarHBondContact O-N 3.27Å; A389-K391 VanDerWaalsContact C-N 3.32Å; A389-K391 PolarHBondContact O-N 3.26Å; A389-V392 PolarHBondContact O-N 3.21Å; A389-K393 PolarHBondContact O-N 3.47Å; A389-W425 HydrophobicContact CB-CZ2 3.99Å
390	P	94.3	Very high	93.6	Very high	80 Å²	80	56.6 Å²	56.6	52%	0.519	31%	0.306	S	S	.	.	H	α-helix	trans	-66	-30.9	175.8	25.4	-34.8	0	0	0	113.5	D386 L388 K393 E394	D386-P390 WeakPolarHBondContact O-CD 3.15Å; L388-P390 VanDerWaalsContact C-CD 3.47Å; P390-K393 PolarHBondContact O-N 3.37Å; P390-E394 PolarHBondContact O-N 3.27Å
391	K	92.7	Very high	93.5	Very high	97 Å²	97	59.9 Å²	59.9	42%	0.422	31%	0.313	S	S	.	.	H	α-helix	trans	-74.6	-34	177.5	-52.7	-174.9	-167	171.6	0	112.4	L388 A389 K393 E394 M395	L388-K391 HydrophobicContact CD2-CD 3.95Å; L388-K391 WeakPolarHBondContact O-CA 3.35Å; L388-K391 WeakPolarHBondContact O-CB 3.31Å; L388-K391 PolarHBondContact O-N 2.7Å; A389-K391 VanDerWaalsContact C-N 3.32Å; A389-K391 PolarHBondContact O-N 3.26Å; K391-K393 VanDerWaalsContact C-N 3.29Å; K391-E394 WeakPolarHBondContact O-CB 3.35Å; K391-E394 PolarHBondContact O-N 3Å; K391-M395 PolarHBondContact O-N 3.27Å
392	V	94.9	Very high	93.5	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.024	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-43.5	172.3	179.8	0	0	0	0	109.8	L347 L388 A389 E394 M395 E396 W425	L347-V392 HydrophobicContact CD1-CG2 3.85Å; L347-V392 HydrophobicContact CD2-CG2 3.88Å; L388-V392 PolarHBondContact O-N 2.85Å; A389-V392 PolarHBondContact O-N 3.21Å; V392-E394 VanDerWaalsContact C-N 3.34Å; V392-E394 PolarHBondContact O-N 3.19Å; V392-M395 HydrophobicContact CG2-CE 4.24Å; V392-M395 WeakPolarHBondContact O-CB 3.45Å; V392-M395 PolarHBondContact O-N 3.36Å; V392-E396 WeakPolarHBondContact O-CG 3.35Å; V392-E396 PolarHBondContact O-N 3.14Å; V392-W425 HydrophobicContact CG1-CG 4.22Å; V392-W425 HydrophobicContact CG2-CD2 3.76Å; V392-W425 HydrophobicContact CG2-CE3 3.9Å; V392-W425 HydrophobicContact CG2-CG 4.28Å; V392-W425 HydrophobicContact CG2-CH2 4.29Å; V392-W425 HydrophobicContact CG2-CZ2 4.16Å; V392-W425 HydrophobicContact CG2-CZ3 4.15Å
393	K	93.3	Very high	93.3	Very high	137 Å²	137	59.5 Å²	59.5	60%	0.596	31%	0.31	S	S	*	.	H	α-helix	trans	-66.6	-31.3	173.6	-172.2	172.4	-177.3	177.9	0	113.9	A389 P390 K391 E396 T397	A389-K393 PolarHBondContact O-N 3.47Å; P390-K393 PolarHBondContact O-N 3.37Å; K391-K393 VanDerWaalsContact C-N 3.29Å; K393-E396 WeakPolarHBondContact O-CB 3.07Å; K393-E396 PolarHBondContact O-N 3.21Å; K393-T397 PolarHBondContact O-N 3.41Å; K393-T397 VanDerWaalsContact O-N 3.12Å; K393-T397 PolarHBondContact O-OG1 3.49Å
394	E	92.6	Very high	93	Very high	93 Å²	93	59.2 Å²	59.2	44%	0.435	32%	0.32	S	S	.	.	H	α-helix	trans	-66.5	-42.7	172.4	-172.2	170.5	-148.9	0	0	111	P390 K391 V392 E396 T397 W398	P390-E394 PolarHBondContact O-N 3.27Å; K391-E394 WeakPolarHBondContact O-CB 3.35Å; K391-E394 PolarHBondContact O-N 3Å; V392-E394 VanDerWaalsContact C-N 3.34Å; V392-E394 PolarHBondContact O-N 3.19Å; E394-E396 VanDerWaalsContact C-N 3.35Å; E394-E396 PolarHBondContact O-N 3.09Å; E394-T397 WeakPolarHBondContact CA-OG1 3.44Å; E394-T397 PolarHBondContact O-N 3.43Å; E394-T397 VanDerWaalsContact O-N 3.14Å; E394-T397 PolarHBondContact O-OG1 3.05Å; E394-W398 HydrophobicContact CG-CD2 4.4Å; E394-W398 HydrophobicContact CG-CH2 4.42Å; E394-W398 HydrophobicContact CG-CZ2 3.59Å; E394-W398 PolarHBondContact O-N 2.99Å
395	M	93.5	Very high	92.8	Very high	5 Å²	5	58.8 Å²	58.8	3%	0.025	32%	0.317	C	S	.	.	H	α-helix	trans	-63.4	-34.7	171.3	-73.5	-176.9	-76.1	0	0	113.4	W340 R343 V344 L347 K391 V392 A399 M418	W340-M395 PolarHBondContact NE1-O 3.3Å; R343-M395 HydrophobicContact CB-CG 3.84Å; R343-M395 HydrophobicContact CB-SD 3.4Å; R343-M395 WeakPolarHBondContact CB-SD 3.46Å; V344-M395 HydrophobicContact CG2-SD 4.03Å; L347-M395 HydrophobicContact CB-CE 4.14Å; L347-M395 HydrophobicContact CD1-CE 4.43Å; L347-M395 HydrophobicContact CD2-CE 3.85Å; L347-M395 HydrophobicContact CG-CE 4.36Å; K391-M395 PolarHBondContact O-N 3.27Å; V392-M395 HydrophobicContact CG2-CE 4.24Å; V392-M395 WeakPolarHBondContact O-CB 3.45Å; V392-M395 PolarHBondContact O-N 3.36Å; M395-A399 VanDerWaalsContact O-CB 3.32Å; M395-A399 WeakPolarHBondContact O-CB 3.37Å; M395-A399 PolarHBondContact O-N 3.22Å; M395-M418 HydrophobicContact CB-CE 4.18Å
396	E	92.7	Very high	92.6	Very high	69 Å²	69	59.3 Å²	59.3	32%	0.322	32%	0.32	S	S	.	.	H	α-helix	trans	-58.9	-47.2	169.7	-69.2	174.9	160	0	0	110.8	V392 K393 E394 A399 E400 M418 I422	V392-E396 WeakPolarHBondContact O-CG 3.35Å; V392-E396 PolarHBondContact O-N 3.14Å; K393-E396 WeakPolarHBondContact O-CB 3.07Å; K393-E396 PolarHBondContact O-N 3.21Å; E394-E396 VanDerWaalsContact C-N 3.35Å; E394-E396 PolarHBondContact O-N 3.09Å; E396-A399 PolarHBondContact O-N 3.24Å; E396-E400 PolarHBondContact O-N 3.41Å; E396-E400 VanDerWaalsContact O-N 3.07Å; E396-M418 HydrophobicContact CG-CE 3.8Å; E396-I422 HydrophobicContact CG-CD1 4.08Å; E396-I422 WeakPolarHBondContact OE1-CD1 3.45Å
397	T	93.3	Very high	92.3	Very high	69 Å²	69	55.4 Å²	55.4	42%	0.423	30%	0.3	S	S	.	.	H	α-helix	trans	-65.6	-41.7	179.4	45.7	0	0	0	0	113	K393 E394 A399 E400 E401	K393-T397 PolarHBondContact O-N 3.41Å; K393-T397 VanDerWaalsContact O-N 3.12Å; K393-T397 PolarHBondContact O-OG1 3.49Å; E394-T397 WeakPolarHBondContact CA-OG1 3.44Å; E394-T397 PolarHBondContact O-N 3.43Å; E394-T397 VanDerWaalsContact O-N 3.14Å; E394-T397 PolarHBondContact O-OG1 3.05Å; T397-A399 VanDerWaalsContact C-N 3.32Å; T397-A399 PolarHBondContact O-N 2.8Å; T397-E400 PolarHBondContact O-N 2.76Å; T397-E401 WeakPolarHBondContact O-CG 3.27Å; T397-E401 PolarHBondContact O-N 3.12Å
398	W	93.2	Very high	92	Very high	43 Å²	43	58.2 Å²	58.2	16%	0.163	31%	0.314	C	S	.	.	H	α-helix	trans	-65	-36.5	175.2	-60.4	-10.7	0	0	0	111.9	L336 D339 W340 R343 E394 E401 L402	L336-W398 HydrophobicContact CD1-CB 3.88Å; L336-W398 HydrophobicContact CD1-CD2 3.97Å; L336-W398 HydrophobicContact CD1-CG 3.63Å; L336-W398 HydrophobicContact CG-CB 4.41Å; D339-W398 HydrophobicContact CB-CH2 4.49Å; D339-W398 HydrophobicContact CB-CZ3 4.03Å; W340-W398 HydrophobicContact CB-CE3 4.27Å; R343-W398 HydrophobicContact CB-CZ3 4.42Å; R343-W398 HydrophobicContact CG-CH2 4.16Å; R343-W398 HydrophobicContact CG-CZ3 3.68Å; E394-W398 HydrophobicContact CG-CD2 4.4Å; E394-W398 HydrophobicContact CG-CH2 4.42Å; E394-W398 HydrophobicContact CG-CZ2 3.59Å; E394-W398 PolarHBondContact O-N 2.99Å; W398-E401 PolarHBondContact O-N 3.37Å; W398-L402 WeakPolarHBondContact O-CB 3.37Å; W398-L402 VanDerWaalsContact O-CG 3.24Å; W398-L402 WeakPolarHBondContact O-CG 3.34Å; W398-L402 PolarHBondContact O-N 2.91Å
399	A	92.6	Very high	91.8	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-63.1	-41.2	174.3	0	0	0	0	0	112	M395 E396 T397 K403 M418	M395-A399 VanDerWaalsContact O-CB 3.32Å; M395-A399 WeakPolarHBondContact O-CB 3.37Å; M395-A399 PolarHBondContact O-N 3.22Å; E396-A399 PolarHBondContact O-N 3.24Å; T397-A399 VanDerWaalsContact C-N 3.32Å; T397-A399 PolarHBondContact O-N 2.8Å; A399-K403 WeakPolarHBondContact O-CB 3.42Å; A399-K403 WeakPolarHBondContact O-CD 3.46Å; A399-K403 WeakPolarHBondContact O-CG 3.31Å; A399-K403 PolarHBondContact O-N 3.46Å; A399-M418 HydrophobicContact CB-CG 4.32Å; A399-M418 HydrophobicContact CB-SD 4.02Å
400	E	92.4	Very high	91.7	Very high	119 Å²	119	62.9 Å²	62.9	56%	0.556	32%	0.321	S	S	*	.	H	α-helix	trans	-68	-38.1	174.6	-66.6	-53.2	132.7	0	0	113	E396 T397 K403	E396-E400 PolarHBondContact O-N 3.41Å; E396-E400 VanDerWaalsContact O-N 3.07Å; T397-E400 PolarHBondContact O-N 2.76Å; E400-K403 PolarHBondContact O-N 3.26Å; E400-K403 IonicContact OE1-NZ 2.93Å; E400-K403 PolarHBondContact OE1-NZ 3.27Å
401	E	91.8	Very high	91.6	Very high	115 Å²	115	60.7 Å²	60.7	54%	0.537	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-43.9	174.2	-73.3	177.7	-170.4	0	0	111.8	L336 T397 W398 A404	L336-E401 HydrophobicContact CD2-CB 4Å; T397-E401 WeakPolarHBondContact O-CG 3.27Å; T397-E401 PolarHBondContact O-N 3.12Å; W398-E401 PolarHBondContact O-N 3.37Å; E401-A404 PolarHBondContact O-N 2.65Å
402	L	92	Very high	91.5	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.6	-43.3	175.4	-72.9	167.5	0	0	0	112.2	G333 L336 L337 W340 W398 A404 I405 C406 L414	G333-L402 WeakPolarHBondContact O-CD2 3.49Å; L336-L402 HydrophobicContact CB-CD2 4.15Å; L336-L402 HydrophobicContact CD2-CD2 4Å; L336-L402 HydrophobicContact CD2-CG 3.91Å; L336-L402 HydrophobicContact CG-CD1 4.37Å; L336-L402 HydrophobicContact CG-CD2 4.03Å; L336-L402 HydrophobicContact CG-CG 4.01Å; L337-L402 HydrophobicContact CB-CD1 4.45Å; L337-L402 HydrophobicContact CB-CD2 3.98Å; L337-L402 HydrophobicContact CD1-CD1 4.21Å; W340-L402 HydrophobicContact CB-CD1 3.96Å; W340-L402 HydrophobicContact CG-CD1 4.11Å; W398-L402 WeakPolarHBondContact O-CB 3.37Å; W398-L402 VanDerWaalsContact O-CG 3.24Å; W398-L402 WeakPolarHBondContact O-CG 3.34Å; W398-L402 PolarHBondContact O-N 2.91Å; L402-A404 PolarHBondContact O-N 2.94Å; L402-I405 HydrophobicContact CD2-CD1 4.48Å; L402-I405 WeakPolarHBondContact O-CG1 3.4Å; L402-I405 PolarHBondContact O-N 3.22Å; L402-C406 VanDerWaalsContact O-CB 3.28Å; L402-C406 WeakPolarHBondContact O-CB 3.49Å; L402-C406 PolarHBondContact O-N 2.82Å; L402-C406 PolarHBondContact O-SG 2.87Å; L402-L414 HydrophobicContact CB-CD1 3.65Å; L402-L414 HydrophobicContact CD1-CD2 4.32Å
403	K	90.9	Very high	91.4	Very high	34 Å²	34	65.8 Å²	65.8	15%	0.148	33%	0.328	C	S	.	.	H	α-helix	trans	-56.2	-23.6	178.1	-76.4	166.5	-161.5	173.8	0	113.7	A399 E400 T411 L414	A399-K403 WeakPolarHBondContact O-CB 3.42Å; A399-K403 WeakPolarHBondContact O-CD 3.46Å; A399-K403 WeakPolarHBondContact O-CG 3.31Å; A399-K403 PolarHBondContact O-N 3.46Å; E400-K403 PolarHBondContact O-N 3.26Å; E400-K403 IonicContact OE1-NZ 2.93Å; E400-K403 PolarHBondContact OE1-NZ 3.27Å; K403-T411 HydrophobicContact CB-CG2 4Å; K403-T411 HydrophobicContact CG-CG2 4.02Å; K403-T411 PolarHBondContact O-OG1 3.23Å; K403-L414 HydrophobicContact CG-CB 4.15Å; K403-L414 HydrophobicContact CG-CD1 4.47Å
404	A	88.9	Confident	91.4	Very high	84 Å²	84	59.2 Å²	59.2	69%	0.694	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-14.2	178.1	0	0	0	0	0	114.8	E401 L402	E401-A404 PolarHBondContact O-N 2.65Å; L402-A404 PolarHBondContact O-N 2.94Å
405	I	88.7	Confident	91.5	Very high	62 Å²	62	58.9 Å²	58.9	32%	0.318	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	-3.3	-177.5	60.4	179.6	0	0	0	113.9	I257 L402	I257-I405 HydrophobicContact CD1-CD1 3.74Å; I257-I405 HydrophobicContact CD1-CG1 4.09Å; I257-I405 PolarHBondContact N-O 2.82Å; L402-I405 HydrophobicContact CD2-CD1 4.48Å; L402-I405 WeakPolarHBondContact O-CG1 3.4Å; L402-I405 PolarHBondContact O-N 3.22Å
406	C	89.6	Confident	91.5	Very high	14 Å²	14	61 Å²	61	10%	0.095	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-87.7	161	179.1	-82.2	0	0	0	0	114.1	I257 L402 M410 T411 L414	I257-C406 CarbonylContact O-C 3.55Å; I257-C406 WeakPolarHBondContact O-CA 3.4Å; L402-C406 VanDerWaalsContact O-CB 3.28Å; L402-C406 WeakPolarHBondContact O-CB 3.49Å; L402-C406 PolarHBondContact O-N 2.82Å; L402-C406 PolarHBondContact O-SG 2.87Å; C406-M410 HydrophobicContact CB-CB 3.97Å; C406-M410 HydrophobicContact CB-CG 4.03Å; C406-T411 WeakPolarHBondContact CB-OG1 3.36Å; C406-L414 HydrophobicContact CB-CD1 4.38Å
407	T	89.2	Confident	91.6	Very high	14 Å²	14	60 Å²	60	9%	0.086	31%	0.305	C	S	.	.			trans	-64.5	153.6	167.2	64.9	0	0	0	0	110.6	V256 I257 D258 R409 M410 T411	V256-T407 HydrophobicContact CB-CG2 4.2Å; V256-T407 HydrophobicContact CG2-CG2 3.71Å; I257-T407 PolarHBondContact O-N 3.4Å; D258-T407 HydrophobicContact CB-CG2 4.2Å; D258-T407 WeakPolarHBondContact OD2-CB 3.4Å; D258-T407 WeakPolarHBondContact OD2-CG2 3.47Å; D258-T407 PolarHBondContact OD2-OG1 2.99Å; T407-R409 PolarHBondContact O-N 3.14Å; T407-R409 VanDerWaalsContact O-N 3.08Å; T407-M410 PolarHBondContact O-N 3.31Å; T407-M410 PolarHBondContact OG1-N 3.09Å; T407-T411 PolarHBondContact O-N 3.05Å; T407-T411 PolarHBondContact O-OG1 2.91Å
408	P	88.1	Confident	91.6	Very high	117 Å²	117	57 Å²	57	76%	0.76	29%	0.287	S	S	*	.	H	α-helix	trans	-55.2	-32.6	-179.1	-28	35.8	0	0	0	114.1	E412	P408-E412 PolarHBondContact O-N 2.65Å
409	R	89.6	Confident	91.7	Very high	161 Å²	161	60.4 Å²	60.4	61%	0.608	30%	0.304	S	S	*	.	H	α-helix	trans	-67.2	-44.1	175	-178.3	-179.2	178.5	-122.4	-1.5	112	T407 E412 Y413	T407-R409 PolarHBondContact O-N 3.14Å; T407-R409 VanDerWaalsContact O-N 3.08Å; R409-E412 PolarHBondContact O-N 3.45Å; R409-Y413 PolarHBondContact O-N 3.26Å; R409-Y413 VanDerWaalsContact O-N 3.08Å
410	M	91.1	Very high	91.8	Very high	4 Å²	4	65.6 Å²	65.6	2%	0.02	33%	0.329	C	S	.	.	H	α-helix	trans	-71.8	-34	177.9	-172	62.7	176.6	0	0	111.5	Q259 L337 C406 T407 Y413 L414	Q259-M410 HydrophobicContact CG-SD 4.41Å; L337-M410 HydrophobicContact CD1-CE 3.47Å; L337-M410 VanDerWaalsContact CD1-CE 3.47Å; L337-M410 HydrophobicContact CD2-CE 3.89Å; L337-M410 HydrophobicContact CG-CE 4.34Å; C406-M410 HydrophobicContact CB-CB 3.97Å; C406-M410 HydrophobicContact CB-CG 4.03Å; T407-M410 PolarHBondContact O-N 3.31Å; T407-M410 PolarHBondContact OG1-N 3.09Å; M410-Y413 HydrophobicContact CE-CD1 4.06Å; M410-Y413 HydrophobicContact CE-CE1 4.34Å; M410-Y413 PolarHBondContact O-N 3.46Å; M410-Y413 HydrophobicContact SD-CD1 3.74Å; M410-Y413 HydrophobicContact SD-CG 4.46Å; M410-L414 HydrophobicContact CE-CD2 4.34Å; M410-L414 HydrophobicContact CE-CG 4.31Å; M410-L414 HydrophobicContact CG-CD1 4.18Å; M410-L414 HydrophobicContact CG-CG 4.46Å; M410-L414 WeakPolarHBondContact O-CB 3.38Å; M410-L414 VanDerWaalsContact O-CG 3.28Å; M410-L414 WeakPolarHBondContact O-CG 3.49Å; M410-L414 PolarHBondContact O-N 2.69Å
411	T	92.1	Very high	91.9	Very high	34 Å²	34	60.1 Å²	60.1	21%	0.209	30%	0.303	C	S	.	.	H	α-helix	trans	-65.2	-35.9	172	-68.8	0	0	0	0	112.9	K403 C406 T407 R415	K403-T411 HydrophobicContact CB-CG2 4Å; K403-T411 HydrophobicContact CG-CG2 4.02Å; K403-T411 PolarHBondContact O-OG1 3.23Å; C406-T411 WeakPolarHBondContact CB-OG1 3.36Å; T407-T411 PolarHBondContact O-N 3.05Å; T407-T411 PolarHBondContact O-OG1 2.91Å; T411-R415 PolarHBondContact O-N 3.38Å
412	E	91.9	Very high	92	Very high	99 Å²	99	56.8 Å²	56.8	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-49.7	169.6	-173.2	66.4	-129.2	0	0	111.2	P408 R409 R415 A416	P408-E412 PolarHBondContact O-N 2.65Å; R409-E412 PolarHBondContact O-N 3.45Å; E412-R415 PolarHBondContact O-N 2.99Å; E412-R415 IonicContact OE1-CZ 2.82Å; E412-R415 IonicContact OE1-NH1 3Å; E412-R415 PolarHBondContact OE1-NH1 3.05Å; E412-R415 IonicContact OE1-NH2 2.88Å; E412-R415 PolarHBondContact OE1-NH2 3.43Å; E412-R415 IonicContact OE2-CZ 2.69Å; E412-R415 IonicContact OE2-NH1 2.64Å; E412-R415 IonicContact OE2-NH2 2.65Å; E412-R415 PolarHBondContact OE2-NH2 3.22Å; E412-A416 PolarHBondContact O-N 3.44Å
413	Y	92.6	Very high	92.1	Very high	108 Å²	108	60.7 Å²	60.7	42%	0.424	32%	0.316	S	S	.	.	H	α-helix	trans	-57.8	-51.7	178.1	172.1	-101.5	0	0	0	112.5	R409 M410 R415 A416 R417	R409-Y413 PolarHBondContact O-N 3.26Å; R409-Y413 VanDerWaalsContact O-N 3.08Å; M410-Y413 HydrophobicContact CE-CD1 4.06Å; M410-Y413 HydrophobicContact CE-CE1 4.34Å; M410-Y413 PolarHBondContact O-N 3.46Å; M410-Y413 HydrophobicContact SD-CD1 3.74Å; M410-Y413 HydrophobicContact SD-CG 4.46Å; Y413-R415 PolarHBondContact O-N 2.91Å; Y413-A416 PolarHBondContact O-N 2.94Å; Y413-R417 WeakPolarHBondContact O-CB 3.35Å; Y413-R417 PolarHBondContact O-N 2.85Å
414	L	93.3	Very high	92.3	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-58.6	-35.1	178.9	-74.6	167.1	0	0	0	112.3	L337 W340 L402 K403 C406 M410 M418	L337-L414 HydrophobicContact CD1-CD2 4.47Å; W340-L414 HydrophobicContact CD2-CD2 4.17Å; W340-L414 HydrophobicContact CE3-CD2 3.86Å; W340-L414 HydrophobicContact CH2-CD2 3.72Å; W340-L414 HydrophobicContact CZ2-CD2 4.03Å; W340-L414 HydrophobicContact CZ3-CD2 3.63Å; L402-L414 HydrophobicContact CB-CD1 3.65Å; L402-L414 HydrophobicContact CD1-CD2 4.32Å; K403-L414 HydrophobicContact CG-CB 4.15Å; K403-L414 HydrophobicContact CG-CD1 4.47Å; C406-L414 HydrophobicContact CB-CD1 4.38Å; M410-L414 HydrophobicContact CE-CD2 4.34Å; M410-L414 HydrophobicContact CE-CG 4.31Å; M410-L414 HydrophobicContact CG-CD1 4.18Å; M410-L414 HydrophobicContact CG-CG 4.46Å; M410-L414 WeakPolarHBondContact O-CB 3.38Å; M410-L414 VanDerWaalsContact O-CG 3.28Å; M410-L414 WeakPolarHBondContact O-CG 3.49Å; M410-L414 PolarHBondContact O-N 2.69Å; L414-M418 VanDerWaalsContact O-CB 3.24Å; L414-M418 WeakPolarHBondContact O-CB 3.4Å; L414-M418 PolarHBondContact O-N 3.01Å; L414-M418 VanDerWaalsContact O-N 3.11Å
415	R	93.3	Very high	92.6	Very high	85 Å²	85	59.5 Å²	59.5	32%	0.321	30%	0.296	S	S	.	.	H	α-helix	trans	-70.8	-55.3	174.8	171.3	165.7	37.7	64.3	4.5	111.6	T411 E412 Y413 R417 M418 E419	T411-R415 PolarHBondContact O-N 3.38Å; E412-R415 PolarHBondContact O-N 2.99Å; E412-R415 IonicContact OE1-CZ 2.82Å; E412-R415 IonicContact OE1-NH1 3Å; E412-R415 PolarHBondContact OE1-NH1 3.05Å; E412-R415 IonicContact OE1-NH2 2.88Å; E412-R415 PolarHBondContact OE1-NH2 3.43Å; E412-R415 IonicContact OE2-CZ 2.69Å; E412-R415 IonicContact OE2-NH1 2.64Å; E412-R415 IonicContact OE2-NH2 2.65Å; E412-R415 PolarHBondContact OE2-NH2 3.22Å; Y413-R415 PolarHBondContact O-N 2.91Å; R415-R417 VanDerWaalsContact C-N 3.26Å; R415-R417 PolarHBondContact O-N 2.79Å; R415-M418 PolarHBondContact O-N 3.14Å; R415-E419 WeakPolarHBondContact CD-OE1 3.42Å; R415-E419 HydrophobicContact CG-CG 4.43Å; R415-E419 WeakPolarHBondContact CG-OE1 3.45Å; R415-E419 WeakPolarHBondContact O-CG 3.47Å; R415-E419 PolarHBondContact O-N 3.2Å
416	A	93.9	Very high	92.9	Very high	50 Å²	50	60.8 Å²	60.8	41%	0.413	30%	0.303	S	S	.	.	H	α-helix	trans	-58.6	-39.6	-178.4	0	0	0	0	0	112.1	E412 Y413 E419 E420	E412-A416 PolarHBondContact O-N 3.44Å; Y413-A416 PolarHBondContact O-N 2.94Å; A416-E419 PolarHBondContact O-N 2.93Å; A416-E420 PolarHBondContact O-N 3.17Å
417	R	94.4	Very high	93.1	Very high	47 Å²	47	63.3 Å²	63.3	18%	0.177	31%	0.314	C	S	.	.	H	α-helix	trans	-69.4	-40.4	177.8	-168.1	57.2	163.8	138.3	11.7	112.3	W340 E348 Y413 R415 E420 I421	W340-R417 HydrophobicContact CH2-CB 4.16Å; W340-R417 HydrophobicContact CH2-CG 3.83Å; E348-R417 IonicContact OE1-CZ 3.45Å; E348-R417 IonicContact OE1-NH1 2.65Å; E348-R417 PolarHBondContact OE1-NH1 2.66Å; E348-R417 IonicContact OE1-NH2 2.75Å; E348-R417 PolarHBondContact OE1-NH2 2.95Å; E348-R417 IonicContact OE2-CZ 2.74Å; E348-R417 IonicContact OE2-NH2 3.91Å; E348-R417 PolarHBondContact OE2-NH2 3.36Å; Y413-R417 WeakPolarHBondContact O-CB 3.35Å; Y413-R417 PolarHBondContact O-N 2.85Å; R415-R417 VanDerWaalsContact C-N 3.26Å; R415-R417 PolarHBondContact O-N 2.79Å; R417-E420 VanDerWaalsContact CD-OE2 3.24Å; R417-E420 WeakPolarHBondContact CD-OE2 3.46Å; R417-E420 IonicContact CZ-OE2 2.8Å; R417-E420 IonicContact NE-OE2 3.17Å; R417-E420 IonicContact NH1-OE1 3.75Å; R417-E420 IonicContact NH1-OE2 4Å; R417-E420 PolarHBondContact NH1-OE2 3.34Å; R417-E420 PolarHBondContact O-N 2.94Å; R417-I421 HydrophobicContact CG-CD1 4.03Å; R417-I421 VanDerWaalsContact O-CD1 3.24Å; R417-I421 WeakPolarHBondContact O-CD1 3.28Å; R417-I421 WeakPolarHBondContact O-CG1 3.41Å; R417-I421 PolarHBondContact O-N 3.19Å
418	M	94.6	Very high	93.3	Very high	6 Å²	6	62.8 Å²	62.8	3%	0.03	31%	0.311	C	S	.	.	H	α-helix	trans	-66.5	-38.6	174	-161.7	76.8	-136.4	0	0	111.8	W340 M395 E396 A399 L414 R415 I421 I422	W340-M418 HydrophobicContact CZ2-SD 4.27Å; M395-M418 HydrophobicContact CB-CE 4.18Å; E396-M418 HydrophobicContact CG-CE 3.8Å; A399-M418 HydrophobicContact CB-CG 4.32Å; A399-M418 HydrophobicContact CB-SD 4.02Å; L414-M418 VanDerWaalsContact O-CB 3.24Å; L414-M418 WeakPolarHBondContact O-CB 3.4Å; L414-M418 PolarHBondContact O-N 3.01Å; L414-M418 VanDerWaalsContact O-N 3.11Å; R415-M418 PolarHBondContact O-N 3.14Å; M418-I421 HydrophobicContact CE-CG2 4.31Å; M418-I421 PolarHBondContact O-N 3.45Å; M418-I422 HydrophobicContact CE-CD1 4.17Å; M418-I422 HydrophobicContact CE-CG1 3.88Å; M418-I422 HydrophobicContact CG-CD1 3.77Å; M418-I422 HydrophobicContact CG-CG1 4.3Å; M418-I422 WeakPolarHBondContact O-CB 3.18Å; M418-I422 WeakPolarHBondContact O-CD1 3.43Å; M418-I422 WeakPolarHBondContact O-CG1 3.2Å; M418-I422 PolarHBondContact O-N 3.36Å
419	E	94.3	Very high	93.6	Very high	115 Å²	115	58.3 Å²	58.3	54%	0.537	28%	0.281	S	S	.	.	H	α-helix	trans	-61.2	-42.7	174.7	-73.6	170.9	-160.8	0	0	112.1	R415 A416 S423	R415-E419 WeakPolarHBondContact CD-OE1 3.42Å; R415-E419 HydrophobicContact CG-CG 4.43Å; R415-E419 WeakPolarHBondContact CG-OE1 3.45Å; R415-E419 WeakPolarHBondContact O-CG 3.47Å; R415-E419 PolarHBondContact O-N 3.2Å; A416-E419 PolarHBondContact O-N 2.93Å; E419-S423 VanDerWaalsContact O-CB 3.27Å; E419-S423 WeakPolarHBondContact O-CB 3.3Å; E419-S423 PolarHBondContact O-N 3.32Å
420	E	94.6	Very high	93.8	Very high	110 Å²	110	57.4 Å²	57.4	51%	0.514	28%	0.278	S	S	.	.	H	α-helix	trans	-59.8	-49.5	172.9	-178.7	-177	-149.9	0	0	112	A416 R417 S423 H424	A416-E420 PolarHBondContact O-N 3.17Å; R417-E420 VanDerWaalsContact CD-OE2 3.24Å; R417-E420 WeakPolarHBondContact CD-OE2 3.46Å; R417-E420 IonicContact CZ-OE2 2.8Å; R417-E420 IonicContact NE-OE2 3.17Å; R417-E420 IonicContact NH1-OE1 3.75Å; R417-E420 IonicContact NH1-OE2 4Å; R417-E420 PolarHBondContact NH1-OE2 3.34Å; R417-E420 PolarHBondContact O-N 2.94Å; E420-S423 WeakPolarHBondContact O-CB 3.43Å; E420-S423 PolarHBondContact O-N 3Å; E420-H424 PolarHBondContact O-N 3.37Å
421	I	94.5	Very high	93.9	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-45.9	-178.9	-67.2	158.7	0	0	0	111.2	V344 L347 M351 R417 M418 S423 H424 W425	V344-I421 HydrophobicContact CB-CD1 4.19Å; V344-I421 HydrophobicContact CG1-CD1 3.47Å; V344-I421 VanDerWaalsContact CG1-CD1 3.47Å; V344-I421 HydrophobicContact CG1-CG1 4.33Å; V344-I421 HydrophobicContact CG2-CD1 3.66Å; L347-I421 HydrophobicContact CD2-CG2 3.72Å; M351-I421 HydrophobicContact CE-CG2 4.49Å; R417-I421 HydrophobicContact CG-CD1 4.03Å; R417-I421 VanDerWaalsContact O-CD1 3.24Å; R417-I421 WeakPolarHBondContact O-CD1 3.28Å; R417-I421 WeakPolarHBondContact O-CG1 3.41Å; R417-I421 PolarHBondContact O-N 3.19Å; M418-I421 HydrophobicContact CE-CG2 4.31Å; M418-I421 PolarHBondContact O-N 3.45Å; I421-S423 VanDerWaalsContact C-N 3.29Å; I421-S423 PolarHBondContact O-N 3.15Å; I421-H424 PolarHBondContact O-N 3.3Å; I421-W425 WeakPolarHBondContact O-CB 3.39Å; I421-W425 PolarHBondContact O-N 3.47Å
422	I	95	Very high	93.9	Very high	46 Å²	46	56.9 Å²	56.9	24%	0.236	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-39.6	176.4	-69.9	166.2	0	0	0	110.4	E396 M418 N426	E396-I422 HydrophobicContact CG-CD1 4.08Å; E396-I422 WeakPolarHBondContact OE1-CD1 3.45Å; M418-I422 HydrophobicContact CE-CD1 4.17Å; M418-I422 HydrophobicContact CE-CG1 3.88Å; M418-I422 HydrophobicContact CG-CD1 3.77Å; M418-I422 HydrophobicContact CG-CG1 4.3Å; M418-I422 WeakPolarHBondContact O-CB 3.18Å; M418-I422 WeakPolarHBondContact O-CD1 3.43Å; M418-I422 WeakPolarHBondContact O-CG1 3.2Å; M418-I422 PolarHBondContact O-N 3.36Å; I422-N426 VanDerWaalsContact CG2-ND2 3.29Å; I422-N426 WeakPolarHBondContact CG2-ND2 3.11Å; I422-N426 WeakPolarHBondContact O-CB 3.26Å; I422-N426 VanDerWaalsContact O-CG 3.3Å; I422-N426 PolarHBondContact O-N 3.25Å; I422-N426 PolarHBondContact O-ND2 3.49Å
423	S	94.6	Very high	93.9	Very high	82 Å²	82	56 Å²	56	57%	0.573	27%	0.269	S	S	*	.	H	α-helix	trans	-62.7	-50.6	176.8	-172.1	0	0	0	0	111.7	E419 E420 I421 N426 E427	E419-S423 VanDerWaalsContact O-CB 3.27Å; E419-S423 WeakPolarHBondContact O-CB 3.3Å; E419-S423 PolarHBondContact O-N 3.32Å; E420-S423 WeakPolarHBondContact O-CB 3.43Å; E420-S423 PolarHBondContact O-N 3Å; I421-S423 VanDerWaalsContact C-N 3.29Å; I421-S423 PolarHBondContact O-N 3.15Å; S423-N426 PolarHBondContact O-N 3.16Å; S423-E427 PolarHBondContact O-N 3.43Å; S423-E427 VanDerWaalsContact O-N 3.11Å
424	H	93.9	Very high	93.9	Very high	73 Å²	73	53 Å²	53	34%	0.338	27%	0.267	S	S	.	.	H	α-helix	trans	-67.3	-40.6	-180	-167.2	50.7	0	0	0	112.4	M351 E420 I421 E427 V428	M351-H424 HydrophobicContact SD-CB 4.35Å; E420-H424 PolarHBondContact O-N 3.37Å; I421-H424 PolarHBondContact O-N 3.3Å; H424-E427 PolarHBondContact O-N 3.37Å; H424-V428 WeakPolarHBondContact O-CG2 3.46Å; H424-V428 PolarHBondContact O-N 3.12Å
425	W	95.5	Very high	93.7	Very high	19 Å²	19	54 Å²	54	7%	0.072	27%	0.271	C	S	.	.	H	α-helix	trans	-57.5	-49.7	173.5	167.7	-102.1	0	0	0	112	L347 W350 M351 V385 L388 A389 V392 I421 E427 V428 V429	L347-W425 HydrophobicContact CD1-CE3 4.09Å; L347-W425 HydrophobicContact CD1-CZ3 4.12Å; W350-W425 HydrophobicContact CE3-CZ3 4.35Å; W350-W425 AromaticContact CH2-CZ3 3.95Å; W350-W425 HydrophobicContact CH2-CZ3 3.95Å; W350-W425 HydrophobicContact CZ3-CE3 4.04Å; W350-W425 AromaticContact CZ3-CZ3 3.54Å; W350-W425 HydrophobicContact CZ3-CZ3 3.54Å; M351-W425 HydrophobicContact SD-CB 4Å; M351-W425 HydrophobicContact SD-CE3 4.44Å; V385-W425 HydrophobicContact CG1-CH2 4.43Å; V385-W425 HydrophobicContact CG1-CZ2 4.47Å; V385-W425 HydrophobicContact CG2-CH2 4.5Å; V385-W425 WeakPolarHBondContact O-CH2 3.49Å; L388-W425 HydrophobicContact CB-CH2 3.65Å; L388-W425 HydrophobicContact CB-CZ3 3.86Å; L388-W425 HydrophobicContact CD1-CZ3 4.37Å; A389-W425 HydrophobicContact CB-CZ2 3.99Å; V392-W425 HydrophobicContact CG1-CG 4.22Å; V392-W425 HydrophobicContact CG2-CD2 3.76Å; V392-W425 HydrophobicContact CG2-CE3 3.9Å; V392-W425 HydrophobicContact CG2-CG 4.28Å; V392-W425 HydrophobicContact CG2-CH2 4.29Å; V392-W425 HydrophobicContact CG2-CZ2 4.16Å; V392-W425 HydrophobicContact CG2-CZ3 4.15Å; I421-W425 WeakPolarHBondContact O-CB 3.39Å; I421-W425 PolarHBondContact O-N 3.47Å; W425-E427 VanDerWaalsContact C-N 3.29Å; W425-E427 PolarHBondContact O-N 3.38Å; W425-V428 PolarHBondContact O-N 3.35Å; W425-V429 HydrophobicContact CD2-CG2 3.93Å; W425-V429 HydrophobicContact CE3-CG2 4.37Å; W425-V429 HydrophobicContact CG-CG2 4.47Å; W425-V429 HydrophobicContact CH2-CG2 4.07Å; W425-V429 HydrophobicContact CZ2-CG2 3.58Å; W425-V429 HydrophobicContact CZ3-CG2 4.45Å; W425-V429 WeakPolarHBondContact O-CB 3.45Å; W425-V429 VanDerWaalsContact O-CG2 3.3Å; W425-V429 WeakPolarHBondContact O-CG2 3.43Å; W425-V429 PolarHBondContact O-N 3.29Å
426	N	95.3	Very high	93.7	Very high	90 Å²	90	51.6 Å²	51.6	48%	0.481	26%	0.263	S	S	.	.	H	α-helix	trans	-62.2	-36.8	179.2	-78.8	-50.1	0	0	0	112.2	I422 S423 R430	I422-N426 VanDerWaalsContact CG2-ND2 3.29Å; I422-N426 WeakPolarHBondContact CG2-ND2 3.11Å; I422-N426 WeakPolarHBondContact O-CB 3.26Å; I422-N426 VanDerWaalsContact O-CG 3.3Å; I422-N426 PolarHBondContact O-N 3.25Å; I422-N426 PolarHBondContact O-ND2 3.49Å; S423-N426 PolarHBondContact O-N 3.16Å; N426-R430 VanDerWaalsContact O-CB 3.23Å; N426-R430 WeakPolarHBondContact O-CB 3.14Å; N426-R430 PolarHBondContact O-N 3.38Å
427	E	93.1	Very high	93.6	Very high	66 Å²	66	55.2 Å²	55.2	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-66.1	-48	173.6	179	62.9	179.3	0	0	111.8	S423 H424 W425 V429 R430 V431	S423-E427 PolarHBondContact O-N 3.43Å; S423-E427 VanDerWaalsContact O-N 3.11Å; H424-E427 PolarHBondContact O-N 3.37Å; W425-E427 VanDerWaalsContact C-N 3.29Å; W425-E427 PolarHBondContact O-N 3.38Å; E427-V429 VanDerWaalsContact C-N 3.32Å; E427-V429 PolarHBondContact O-N 3.16Å; E427-R430 PolarHBondContact O-N 3.32Å; E427-R430 VanDerWaalsContact O-N 3.16Å; E427-R430 IonicContact OE1-CZ 3.69Å; E427-R430 IonicContact OE1-NE 3.99Å; E427-R430 IonicContact OE1-NH2 3.86Å; E427-R430 PolarHBondContact OE1-NH2 3.22Å; E427-R430 IonicContact OE2-CZ 3.98Å; E427-R430 IonicContact OE2-NE 2.71Å; E427-R430 PolarHBondContact OE2-NE 3.21Å; E427-R430 IonicContact OE2-NH2 3.28Å; E427-R430 PolarHBondContact OE2-NH2 3.22Å; E427-V431 HydrophobicContact CG-CG2 4.39Å; E427-V431 WeakPolarHBondContact O-CG2 3.33Å; E427-V431 PolarHBondContact O-N 3.15Å; E427-V431 WeakPolarHBondContact OE1-CG2 3.43Å
428	V	93.3	Very high	93.4	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.024	28%	0.283	C	S	.	.	H	α-helix	trans	-57.2	-45.9	176.1	169.9	0	0	0	0	110.8	W350 M351 V354 T355 I358 H424 W425 R430 V431 T432	W350-V428 HydrophobicContact CH2-CG1 4.13Å; W350-V428 HydrophobicContact CZ3-CG1 3.91Å; M351-V428 HydrophobicContact CB-CG2 4.19Å; M351-V428 HydrophobicContact CG-CG2 4.25Å; V354-V428 HydrophobicContact CB-CG1 4.43Å; V354-V428 HydrophobicContact CG1-CG1 3.74Å; T355-V428 HydrophobicContact CG2-CG2 4.03Å; I358-V428 HydrophobicContact CD1-CG1 4.27Å; H424-V428 WeakPolarHBondContact O-CG2 3.46Å; H424-V428 PolarHBondContact O-N 3.12Å; W425-V428 PolarHBondContact O-N 3.35Å; V428-R430 PolarHBondContact O-N 3Å; V428-V431 PolarHBondContact O-N 3.37Å; V428-T432 VanDerWaalsContact O-CB 3.31Å; V428-T432 WeakPolarHBondContact O-CB 3.46Å; V428-T432 PolarHBondContact O-N 2.76Å; V428-T432 PolarHBondContact O-OG1 3.19Å
429	V	94.3	Very high	93.2	Very high	22 Å²	22	55.5 Å²	55.5	13%	0.133	28%	0.281	C	S	.	.	H	α-helix	trans	-61	-45.1	176.3	171.2	0	0	0	0	111.7	V385 W425 E427 K433	V385-V429 HydrophobicContact CG1-CB 4.45Å; V385-V429 HydrophobicContact CG1-CG1 4.07Å; V385-V429 HydrophobicContact CG1-CG2 3.76Å; V385-V429 HydrophobicContact CG2-CG2 4.11Å; W425-V429 HydrophobicContact CD2-CG2 3.93Å; W425-V429 HydrophobicContact CE3-CG2 4.37Å; W425-V429 HydrophobicContact CG-CG2 4.47Å; W425-V429 HydrophobicContact CH2-CG2 4.07Å; W425-V429 HydrophobicContact CZ2-CG2 3.58Å; W425-V429 HydrophobicContact CZ3-CG2 4.45Å; W425-V429 WeakPolarHBondContact O-CB 3.45Å; W425-V429 VanDerWaalsContact O-CG2 3.3Å; W425-V429 WeakPolarHBondContact O-CG2 3.43Å; W425-V429 PolarHBondContact O-N 3.29Å; E427-V429 VanDerWaalsContact C-N 3.32Å; E427-V429 PolarHBondContact O-N 3.16Å; V429-K433 HydrophobicContact CG1-CD 4.1Å; V429-K433 WeakPolarHBondContact O-CG 3.43Å; V429-K433 PolarHBondContact O-N 2.93Å; V429-K433 VanDerWaalsContact O-N 3.1Å
430	R	94	Very high	93	Very high	143 Å²	143	53.3 Å²	53.3	54%	0.54	27%	0.273	S	S	.	.	H	α-helix	trans	-62	-49.1	180	-174.5	-169.5	70.3	78	-4.3	111.5	N426 E427 V428 K433 A434	N426-R430 VanDerWaalsContact O-CB 3.23Å; N426-R430 WeakPolarHBondContact O-CB 3.14Å; N426-R430 PolarHBondContact O-N 3.38Å; E427-R430 PolarHBondContact O-N 3.32Å; E427-R430 VanDerWaalsContact O-N 3.16Å; E427-R430 IonicContact OE1-CZ 3.69Å; E427-R430 IonicContact OE1-NE 3.99Å; E427-R430 IonicContact OE1-NH2 3.86Å; E427-R430 PolarHBondContact OE1-NH2 3.22Å; E427-R430 IonicContact OE2-CZ 3.98Å; E427-R430 IonicContact OE2-NE 2.71Å; E427-R430 PolarHBondContact OE2-NE 3.21Å; E427-R430 IonicContact OE2-NH2 3.28Å; E427-R430 PolarHBondContact OE2-NH2 3.22Å; V428-R430 PolarHBondContact O-N 3Å; R430-K433 PolarHBondContact O-N 3.31Å; R430-A434 PolarHBondContact O-N 2.94Å
431	V	92.7	Very high	92.8	Very high	24 Å²	24	54.1 Å²	54.1	15%	0.145	28%	0.277	C	S	.	.	H	α-helix	trans	-76.5	-31.2	-177.3	-162.8	0	0	0	0	111.4	I358 E427 V428 K433 A434 K435	I358-V431 HydrophobicContact CG2-CB 3.82Å; I358-V431 HydrophobicContact CG2-CG1 3.28Å; E427-V431 HydrophobicContact CG-CG2 4.39Å; E427-V431 WeakPolarHBondContact O-CG2 3.33Å; E427-V431 PolarHBondContact O-N 3.15Å; E427-V431 WeakPolarHBondContact OE1-CG2 3.43Å; V428-V431 PolarHBondContact O-N 3.37Å; V431-K433 VanDerWaalsContact C-N 3.33Å; V431-K433 PolarHBondContact O-N 3.49Å; V431-A434 PolarHBondContact O-N 3.13Å; V431-K435 WeakPolarHBondContact O-CB 3.33Å; V431-K435 PolarHBondContact O-N 3.19Å
432	T	92.3	Very high	92.3	Very high	3 Å²	3	54.7 Å²	54.7	2%	0.018	28%	0.283	C	S	.	.	H	α-helix	trans	-57	-46.9	169.5	-54.8	0	0	0	0	111.1	I358 L381 I382 V428 K435 H436	I358-T432 WeakPolarHBondContact CD1-OG1 3.37Å; L381-T432 HydrophobicContact CB-CG2 3.76Å; I382-T432 HydrophobicContact CD1-CG2 3.79Å; I382-T432 HydrophobicContact CG1-CG2 4.23Å; V428-T432 VanDerWaalsContact O-CB 3.31Å; V428-T432 WeakPolarHBondContact O-CB 3.46Å; V428-T432 PolarHBondContact O-N 2.76Å; V428-T432 PolarHBondContact O-OG1 3.19Å; T432-K435 PolarHBondContact O-N 3.22Å; T432-H436 WeakPolarHBondContact O-CB 3.46Å; T432-H436 PolarHBondContact O-N 3.26Å
433	K	92.8	Very high	91.9	Very high	80 Å²	80	55.1 Å²	55.1	35%	0.348	28%	0.282	S	S	.	.	H	α-helix	trans	-65.2	-49.2	179.9	-76	172.8	179.8	178.9	0	111.8	I382 D386 V429 R430 V431 K435 H436 E437	I382-K433 HydrophobicContact CD1-CB 4.38Å; I382-K433 HydrophobicContact CD1-CD 4.46Å; I382-K433 HydrophobicContact CD1-CG 3.43Å; I382-K433 VanDerWaalsContact CD1-CG 3.43Å; D386-K433 IonicContact OD1-NZ 2.78Å; V429-K433 HydrophobicContact CG1-CD 4.1Å; V429-K433 WeakPolarHBondContact O-CG 3.43Å; V429-K433 PolarHBondContact O-N 2.93Å; V429-K433 VanDerWaalsContact O-N 3.1Å; R430-K433 PolarHBondContact O-N 3.31Å; V431-K433 VanDerWaalsContact C-N 3.33Å; V431-K433 PolarHBondContact O-N 3.49Å; K433-K435 VanDerWaalsContact C-N 3.3Å; K433-K435 PolarHBondContact O-N 3.15Å; K433-H436 PolarHBondContact O-N 3.17Å; K433-E437 WeakPolarHBondContact O-CB 3.45Å; K433-E437 WeakPolarHBondContact O-CG 3.39Å; K433-E437 PolarHBondContact O-N 3.32Å
434	A	91.8	Very high	91.6	Very high	45 Å²	45	54.1 Å²	54.1	37%	0.372	28%	0.275	S	S	.	.	H	α-helix	trans	-61.2	-35.4	175.3	0	0	0	0	0	113.4	R430 V431 S438	R430-A434 PolarHBondContact O-N 2.94Å; V431-A434 PolarHBondContact O-N 3.13Å; A434-S438 VanDerWaalsContact O-CB 3.3Å; A434-S438 WeakPolarHBondContact O-CB 3.49Å; A434-S438 PolarHBondContact O-N 3.48Å
435	K	90.5	Very high	91.1	Very high	22 Å²	22	56.5 Å²	56.5	10%	0.096	28%	0.281	C	S	.	.	H	α-helix	trans	-67	-45.6	176	177.8	63.5	167.9	174.5	0	111.4	F357 E361 V431 T432 K433 S438 L439	F357-K435 HydrophobicContact CE1-CG 4.47Å; E361-K435 PolarHBondContact O-NZ 2.77Å; V431-K435 WeakPolarHBondContact O-CB 3.33Å; V431-K435 PolarHBondContact O-N 3.19Å; T432-K435 PolarHBondContact O-N 3.22Å; K433-K435 VanDerWaalsContact C-N 3.3Å; K433-K435 PolarHBondContact O-N 3.15Å; K435-S438 PolarHBondContact O-N 3.37Å; K435-L439 HydrophobicContact CD-CD1 4.23Å; K435-L439 HydrophobicContact CG-CD1 4.22Å; K435-L439 WeakPolarHBondContact O-CB 3.31Å; K435-L439 VanDerWaalsContact O-CG 3.28Å; K435-L439 WeakPolarHBondContact O-CG 3.31Å; K435-L439 PolarHBondContact O-N 2.78Å
436	H	92.4	Very high	90.5	Very high	33 Å²	33	55.8 Å²	55.8	15%	0.153	28%	0.278	C	S	.	.	H	α-helix	trans	-62.4	-47.1	174.9	176.9	78.9	0	0	0	111.7	S378 Q379 I382 T432 K433 S438 L439 N440	S378-H436 PolarHBondContact OG-ND1 3.19Å; Q379-H436 PolarHBondContact OE1-CE1 3.24Å; I382-H436 HydrophobicContact CD1-CB 4.39Å; I382-H436 HydrophobicContact CG1-CB 4.14Å; T432-H436 WeakPolarHBondContact O-CB 3.46Å; T432-H436 PolarHBondContact O-N 3.26Å; K433-H436 PolarHBondContact O-N 3.17Å; H436-S438 PolarHBondContact O-N 3.27Å; H436-L439 PolarHBondContact O-N 3.4Å; H436-N440 VanDerWaalsContact O-CB 3.32Å; H436-N440 WeakPolarHBondContact O-CB 3.44Å; H436-N440 PolarHBondContact O-N 3.28Å
437	E	92.4	Very high	90	Very high	127 Å²	127	54.4 Å²	54.4	59%	0.593	27%	0.27	S	S	*	.	H	α-helix	trans	-57.9	-46.7	176.5	-73.3	167.7	-176.2	0	0	111.8	K433 N440 E441	K433-E437 WeakPolarHBondContact O-CB 3.45Å; K433-E437 WeakPolarHBondContact O-CG 3.39Å; K433-E437 PolarHBondContact O-N 3.32Å; E437-N440 PolarHBondContact O-N 3.41Å; E437-E441 PolarHBondContact O-N 2.87Å
438	S	89.7	Confident	89.6	Confident	59 Å²	59	57.8 Å²	57.8	41%	0.413	28%	0.283	S	S	.	.	H	α-helix	trans	-63.4	-40.9	177.8	-179.3	0	0	0	0	113.1	A434 K435 H436 A442	A434-S438 VanDerWaalsContact O-CB 3.3Å; A434-S438 WeakPolarHBondContact O-CB 3.49Å; A434-S438 PolarHBondContact O-N 3.48Å; K435-S438 PolarHBondContact O-N 3.37Å; H436-S438 PolarHBondContact O-N 3.27Å; S438-A442 VanDerWaalsContact O-CB 3.3Å; S438-A442 WeakPolarHBondContact O-CB 3.49Å; S438-A442 PolarHBondContact O-N 3.15Å
439	L	90.3	Very high	89	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-40.5	174.8	-72.9	168	0	0	0	111.7	P363 L371 Q374 L375 K435 H436 A442 Y443	P363-L439 HydrophobicContact CB-CD2 3.94Å; P363-L439 HydrophobicContact CG-CD2 4.11Å; L371-L439 HydrophobicContact CD1-CD2 3.89Å; Q374-L439 HydrophobicContact CB-CD1 4.08Å; Q374-L439 HydrophobicContact CB-CD2 3.77Å; Q374-L439 HydrophobicContact CG-CD2 4.49Å; L375-L439 HydrophobicContact CD1-CB 4.21Å; K435-L439 HydrophobicContact CD-CD1 4.23Å; K435-L439 HydrophobicContact CG-CD1 4.22Å; K435-L439 WeakPolarHBondContact O-CB 3.31Å; K435-L439 VanDerWaalsContact O-CG 3.28Å; K435-L439 WeakPolarHBondContact O-CG 3.31Å; K435-L439 PolarHBondContact O-N 2.78Å; H436-L439 PolarHBondContact O-N 3.4Å; L439-A442 PolarHBondContact O-N 3.49Å; L439-Y443 VanDerWaalsContact O-CB 3.3Å; L439-Y443 WeakPolarHBondContact O-CB 3.3Å; L439-Y443 PolarHBondContact O-N 2.92Å
440	N	91.2	Very high	88.3	Confident	68 Å²	68	57.5 Å²	57.5	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-68.9	-39.9	179.1	-171.9	33.4	0	0	0	112.4	L375 H436 E437 S444	L375-N440 HydrophobicContact CD1-CB 3.83Å; H436-N440 VanDerWaalsContact O-CB 3.32Å; H436-N440 WeakPolarHBondContact O-CB 3.44Å; H436-N440 PolarHBondContact O-N 3.28Å; E437-N440 PolarHBondContact O-N 3.41Å; N440-S444 WeakPolarHBondContact O-CB 3.49Å; N440-S444 PolarHBondContact O-N 2.93Å; N440-S444 PolarHBondContact O-OG 3.21Å
441	E	88.7	Confident	87.8	Confident	127 Å²	127	54.8 Å²	54.8	59%	0.593	28%	0.277	S	S	*	.	H	α-helix	trans	-63.2	-48.5	172.7	-167.7	-163.9	156.7	0	0	110.5	E437 Y443 S444 R445	E437-E441 PolarHBondContact O-N 2.87Å; E441-Y443 VanDerWaalsContact C-N 3.32Å; E441-Y443 PolarHBondContact O-N 2.59Å; E441-S444 PolarHBondContact O-N 3.3Å; E441-R445 WeakPolarHBondContact O-CB 3.29Å; E441-R445 PolarHBondContact O-N 3.47Å
442	A	85	Confident	87.4	Confident	16 Å²	16	55.8 Å²	55.8	13%	0.132	28%	0.281	C	S	.	.	H	α-helix	trans	-58.5	-43.5	177.9	0	0	0	0	0	111.9	P363 V365 L371 S438 L439 S446	P363-A442 HydrophobicContact CB-CB 4.09Å; V365-A442 HydrophobicContact CG2-CB 4.36Å; L371-A442 HydrophobicContact CD1-CB 4.19Å; L371-A442 HydrophobicContact CD2-CB 4.23Å; S438-A442 VanDerWaalsContact O-CB 3.3Å; S438-A442 WeakPolarHBondContact O-CB 3.49Å; S438-A442 PolarHBondContact O-N 3.15Å; L439-A442 PolarHBondContact O-N 3.49Å; A442-S446 VanDerWaalsContact O-CB 3.23Å; A442-S446 WeakPolarHBondContact O-CB 3.33Å; A442-S446 PolarHBondContact O-N 3.02Å; A442-S446 PolarHBondContact O-OG 2.79Å
443	Y	87.3	Confident	87	Confident	55 Å²	55	55.8 Å²	55.8	22%	0.216	28%	0.281	C	S	.	.	H	α-helix	trans	-64.5	-51.1	176.7	-178.2	-100.2	0	0	0	111.7	V368 L371 K372 L375 L439 E441 R445 S446 M447	V368-Y443 HydrophobicContact CG1-CE2 4.02Å; L371-Y443 HydrophobicContact CG-CD2 4.25Å; K372-Y443 HydrophobicContact CB-CD2 4.35Å; K372-Y443 HydrophobicContact CB-CE2 3.81Å; K372-Y443 HydrophobicContact CG-CE2 4.38Å; L375-Y443 HydrophobicContact CD2-CD1 4.08Å; L375-Y443 HydrophobicContact CD2-CG 4.14Å; L439-Y443 VanDerWaalsContact O-CB 3.3Å; L439-Y443 WeakPolarHBondContact O-CB 3.3Å; L439-Y443 PolarHBondContact O-N 2.92Å; E441-Y443 VanDerWaalsContact C-N 3.32Å; E441-Y443 PolarHBondContact O-N 2.59Å; Y443-R445 PolarHBondContact O-N 3.23Å; Y443-S446 PolarHBondContact O-N 3.37Å; Y443-M447 HydrophobicContact CD1-CG 4.36Å; Y443-M447 HydrophobicContact CE1-CG 3.91Å; Y443-M447 HydrophobicContact CE2-CG 4.09Å; Y443-M447 WeakPolarHBondContact O-CB 3.25Å; Y443-M447 PolarHBondContact O-N 3.48Å
444	S	87.7	Confident	86.6	Confident	61 Å²	61	55.3 Å²	55.3	43%	0.427	28%	0.282	S	S	.	.	H	α-helix	trans	-62.1	-42.2	-178.7	-61.7	0	0	0	0	112.3	N440 E441 K448	N440-S444 WeakPolarHBondContact O-CB 3.49Å; N440-S444 PolarHBondContact O-N 2.93Å; N440-S444 PolarHBondContact O-OG 3.21Å; E441-S444 PolarHBondContact O-N 3.3Å; S444-K448 WeakPolarHBondContact O-CB 3.41Å; S444-K448 PolarHBondContact O-N 3.4Å
445	R	84	Confident	86.4	Confident	123 Å²	123	59.4 Å²	59.4	46%	0.464	30%	0.295	S	S	.	.	H	α-helix	trans	-64.5	-45.5	175.1	-177.4	173.8	178.7	166.5	-2.7	111.2	E441 Y443 K448 T449	E441-R445 WeakPolarHBondContact O-CB 3.29Å; E441-R445 PolarHBondContact O-N 3.47Å; Y443-R445 PolarHBondContact O-N 3.23Å; R445-K448 PolarHBondContact O-N 3.04Å; R445-T449 PolarHBondContact O-N 2.84Å; R445-T449 PolarHBondContact O-OG1 3.28Å
446	S	82	Confident	86.2	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-53.5	179	-60.2	0	0	0	0	111.2	A442 Y443 K448 T449 F450	A442-S446 VanDerWaalsContact O-CB 3.23Å; A442-S446 WeakPolarHBondContact O-CB 3.33Å; A442-S446 PolarHBondContact O-N 3.02Å; A442-S446 PolarHBondContact O-OG 2.79Å; Y443-S446 PolarHBondContact O-N 3.37Å; S446-K448 PolarHBondContact O-N 2.94Å; S446-T449 PolarHBondContact O-N 3.11Å; S446-F450 WeakPolarHBondContact O-CD1 3.26Å; S446-F450 WeakPolarHBondContact O-CD2 3.42Å; S446-F450 WeakPolarHBondContact O-CE2 3.13Å; S446-F450 WeakPolarHBondContact O-CG 3.46Å; S446-F450 PolarHBondContact O-N 3.15Å
447	M	84.5	Confident	85.9	Confident	62 Å²	62	59.3 Å²	59.3	31%	0.305	30%	0.299	S	S	.	.	H	α-helix	trans	-54.9	-49.3	176.9	-80.2	-60.5	-55.1	0	0	112.5	V368 Y443 T449 F450 D451	V368-M447 HydrophobicContact CG1-SD 3.97Å; V368-M447 HydrophobicContact CG2-SD 4.45Å; Y443-M447 HydrophobicContact CD1-CG 4.36Å; Y443-M447 HydrophobicContact CE1-CG 3.91Å; Y443-M447 HydrophobicContact CE2-CG 4.09Å; Y443-M447 WeakPolarHBondContact O-CB 3.25Å; Y443-M447 PolarHBondContact O-N 3.48Å; M447-T449 VanDerWaalsContact C-N 3.35Å; M447-T449 PolarHBondContact O-N 2.85Å; M447-F450 PolarHBondContact O-N 3.42Å; M447-F450 VanDerWaalsContact O-N 3.11Å; M447-D451 PolarHBondContact O-N 2.86Å
448	K	84.9	Confident	85.8	Confident	136 Å²	136	60.2 Å²	60.2	59%	0.591	30%	0.301	S	S	*	.	H	α-helix	trans	-57.8	-47.6	178	-173.1	-162.7	168.6	-169.7	0	111.3	S444 R445 S446 F450 D451 D452	S444-K448 WeakPolarHBondContact O-CB 3.41Å; S444-K448 PolarHBondContact O-N 3.4Å; R445-K448 PolarHBondContact O-N 3.04Å; S446-K448 PolarHBondContact O-N 2.94Å; K448-F450 VanDerWaalsContact C-N 3.28Å; K448-F450 PolarHBondContact O-N 3.46Å; K448-D451 PolarHBondContact O-N 3.34Å; K448-D452 WeakPolarHBondContact CE-OD2 3.33Å; K448-D452 WeakPolarHBondContact O-CB 3.41Å; K448-D452 PolarHBondContact O-N 2.87Å
449	T	80.4	Confident	85.9	Confident	5 Å²	5	60.4 Å²	60.4	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-63.5	-34.6	178.6	-61.6	0	0	0	0	111.7	R445 S446 M447 D452 I453 A503 L506 F528	R445-T449 PolarHBondContact O-N 2.84Å; R445-T449 PolarHBondContact O-OG1 3.28Å; S446-T449 PolarHBondContact O-N 3.11Å; M447-T449 VanDerWaalsContact C-N 3.35Å; M447-T449 PolarHBondContact O-N 2.85Å; T449-D452 PolarHBondContact O-N 3.44Å; T449-I453 HydrophobicContact CG2-CD1 4.36Å; T449-I453 WeakPolarHBondContact O-CD1 3.47Å; T449-I453 WeakPolarHBondContact O-CG1 3.48Å; T449-I453 PolarHBondContact O-N 2.9Å; T449-A503 HydrophobicContact CG2-CB 4.11Å; T449-L506 HydrophobicContact CG2-CB 4.09Å; T449-L506 HydrophobicContact CG2-CD2 3.68Å; T449-F528 HydrophobicContact CG2-CE1 3.83Å; T449-F528 HydrophobicContact CG2-CZ 4.1Å
450	F	79.1	Confident	86	Confident	16 Å²	16	60.4 Å²	60.4	7%	0.07	29%	0.292	C	S	.	.	H	α-helix	trans	-69.2	-37.8	176	-53.9	-29.1	0	0	0	112.7	V368 S446 M447 K448 I453 N454 L506 I510 L524 F528	V368-F450 HydrophobicContact CG2-CD2 3.75Å; V368-F450 HydrophobicContact CG2-CE2 3.43Å; V368-F450 VanDerWaalsContact CG2-CE2 3.43Å; S446-F450 WeakPolarHBondContact O-CD1 3.26Å; S446-F450 WeakPolarHBondContact O-CD2 3.42Å; S446-F450 WeakPolarHBondContact O-CE2 3.13Å; S446-F450 WeakPolarHBondContact O-CG 3.46Å; S446-F450 PolarHBondContact O-N 3.15Å; M447-F450 PolarHBondContact O-N 3.42Å; M447-F450 VanDerWaalsContact O-N 3.11Å; K448-F450 VanDerWaalsContact C-N 3.28Å; K448-F450 PolarHBondContact O-N 3.46Å; F450-I453 HydrophobicContact CD1-CD1 4Å; F450-N454 WeakPolarHBondContact O-CB 3.24Å; F450-N454 PolarHBondContact O-N 3.09Å; F450-N454 PolarHBondContact O-ND2 2.9Å; F450-L506 HydrophobicContact CE1-CD2 3.82Å; F450-L506 HydrophobicContact CZ-CD2 4.21Å; F450-I510 HydrophobicContact CE1-CD1 4Å; F450-I510 HydrophobicContact CZ-CD1 4.09Å; F450-L524 HydrophobicContact CD1-CD1 3.67Å; F450-L524 HydrophobicContact CD1-CD2 4.23Å; F450-L524 HydrophobicContact CD1-CG 4.48Å; F450-L524 HydrophobicContact CE1-CD1 3.81Å; F450-L524 HydrophobicContact CE1-CD2 3.57Å; F450-L524 HydrophobicContact CE1-CG 4.13Å; F450-L524 HydrophobicContact CE2-CD2 4.25Å; F450-L524 HydrophobicContact CG-CD1 4.33Å; F450-L524 HydrophobicContact CZ-CD2 3.59Å; F450-F528 HydrophobicContact CD1-CE2 4.44Å; F450-F528 HydrophobicContact CD1-CZ 4.13Å; F450-F528 AromaticContact CE1-CE2 3.99Å; F450-F528 HydrophobicContact CE1-CE2 3.99Å; F450-F528 AromaticContact CE1-CZ 3.82Å; F450-F528 HydrophobicContact CE1-CZ 3.82Å
451	D	84.8	Confident	86	Confident	85 Å²	85	64.4 Å²	64.4	46%	0.455	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-44.5	170	-76.1	-33.6	0	0	0	111.3	M447 K448 I453 N454 M455	M447-D451 PolarHBondContact O-N 2.86Å; K448-D451 PolarHBondContact O-N 3.34Å; D451-I453 PolarHBondContact O-N 2.89Å; D451-N454 PolarHBondContact O-N 3.39Å; D451-N454 VanDerWaalsContact O-N 3.11Å; D451-M455 WeakPolarHBondContact O-CG 3.24Å; D451-M455 PolarHBondContact O-N 3.46Å
452	D	84.9	Confident	86.1	Confident	46 Å²	46	60 Å²	60	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-58.4	-44.4	176.5	-78.3	-29.8	0	0	0	111.5	K448 T449 M455 L456 T499	K448-D452 WeakPolarHBondContact CE-OD2 3.33Å; K448-D452 WeakPolarHBondContact O-CB 3.41Å; K448-D452 PolarHBondContact O-N 2.87Å; T449-D452 PolarHBondContact O-N 3.44Å; D452-M455 PolarHBondContact O-N 3.18Å; D452-L456 WeakPolarHBondContact O-CB 3.48Å; D452-L456 PolarHBondContact O-N 3.07Å; D452-T499 HydrophobicContact CB-CG2 3.83Å
453	I	82.2	Confident	86.5	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.015	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-47.6	172.2	-59.7	154.3	0	0	0	110.4	T449 F450 D451 M455 L456 T457 A503 L524 F528	T449-I453 HydrophobicContact CG2-CD1 4.36Å; T449-I453 WeakPolarHBondContact O-CD1 3.47Å; T449-I453 WeakPolarHBondContact O-CG1 3.48Å; T449-I453 PolarHBondContact O-N 2.9Å; F450-I453 HydrophobicContact CD1-CD1 4Å; D451-I453 PolarHBondContact O-N 2.89Å; I453-M455 VanDerWaalsContact C-N 3.26Å; I453-M455 PolarHBondContact O-N 3.23Å; I453-L456 PolarHBondContact O-N 3.48Å; I453-L456 VanDerWaalsContact O-N 3.15Å; I453-T457 WeakPolarHBondContact O-CB 3.44Å; I453-T457 PolarHBondContact O-N 3.24Å; I453-T457 PolarHBondContact O-OG1 3.13Å; I453-A503 HydrophobicContact CG1-CB 4.13Å; I453-L524 HydrophobicContact CD1-CD1 4.47Å; I453-F528 HydrophobicContact CD1-CD1 3.49Å; I453-F528 VanDerWaalsContact CD1-CD1 3.49Å; I453-F528 HydrophobicContact CD1-CD2 4.2Å; I453-F528 HydrophobicContact CD1-CE1 3.14Å; I453-F528 HydrophobicContact CD1-CE2 3.91Å; I453-F528 HydrophobicContact CD1-CG 4.01Å; I453-F528 HydrophobicContact CD1-CZ 3.39Å; I453-F528 HydrophobicContact CG1-CD1 3.98Å; I453-F528 HydrophobicContact CG1-CE1 3.84Å
454	N	84	Confident	86.6	Confident	69 Å²	69	58.4 Å²	58.4	37%	0.369	28%	0.283	S	S	.	.	H	α-helix	trans	-64.6	-32.1	-176	-88.3	-73.8	0	0	0	112.4	F450 D451 K458	F450-N454 WeakPolarHBondContact O-CB 3.24Å; F450-N454 PolarHBondContact O-N 3.09Å; F450-N454 PolarHBondContact O-ND2 2.9Å; D451-N454 PolarHBondContact O-N 3.39Å; D451-N454 VanDerWaalsContact O-N 3.11Å; N454-K458 WeakPolarHBondContact O-CD 3.45Å; N454-K458 WeakPolarHBondContact O-CE 3.39Å; N454-K458 VanDerWaalsContact O-CG 3.22Å; N454-K458 WeakPolarHBondContact O-CG 3.33Å
455	M	87.7	Confident	86.8	Confident	131 Å²	131	60 Å²	60	65%	0.645	28%	0.283	S	S	*	.	H	α-helix	trans	-74.7	-44.7	170.2	-65.3	-167.6	-159.1	0	0	111.5	D451 D452 I453 K458 W459	D451-M455 WeakPolarHBondContact O-CG 3.24Å; D451-M455 PolarHBondContact O-N 3.46Å; D452-M455 PolarHBondContact O-N 3.18Å; I453-M455 VanDerWaalsContact C-N 3.26Å; I453-M455 PolarHBondContact O-N 3.23Å; M455-K458 PolarHBondContact O-N 2.93Å; M455-W459 WeakPolarHBondContact O-CB 3.3Å; M455-W459 PolarHBondContact O-N 3.05Å
456	L	87.1	Confident	87.1	Confident	10 Å²	10	56.9 Å²	56.9	5%	0.052	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-49	179.6	-178.8	76.9	0	0	0	111.9	D452 I453 K458 W459 L460 K496 I500 A531	D452-L456 WeakPolarHBondContact O-CB 3.48Å; D452-L456 PolarHBondContact O-N 3.07Å; I453-L456 PolarHBondContact O-N 3.48Å; I453-L456 VanDerWaalsContact O-N 3.15Å; L456-K458 VanDerWaalsContact C-N 3.33Å; L456-K458 PolarHBondContact O-N 3.33Å; L456-W459 HydrophobicContact CD1-CE3 4.03Å; L456-W459 HydrophobicContact CD1-CZ3 4.36Å; L456-W459 CarbonylContact O-C 3.52Å; L456-W459 PolarHBondContact O-N 3.33Å; L456-W459 VanDerWaalsContact O-N 3.16Å; L456-L460 HydrophobicContact CD1-CD1 4.4Å; L456-L460 HydrophobicContact CD1-CG 4.33Å; L456-L460 HydrophobicContact CD2-CD1 4.17Å; L456-L460 HydrophobicContact CG-CD1 3.85Å; L456-L460 HydrophobicContact CG-CG 4.17Å; L456-L460 WeakPolarHBondContact O-CB 3.46Å; L456-L460 WeakPolarHBondContact O-CG 3.27Å; L456-L460 PolarHBondContact O-N 3.27Å; L456-K496 HydrophobicContact CD1-CB 3.95Å; L456-K496 HydrophobicContact CD1-CG 4.22Å; L456-I500 HydrophobicContact CD1-CD1 4.3Å; L456-I500 HydrophobicContact CD1-CG1 4.19Å; L456-I500 HydrophobicContact CD2-CD1 4.16Å; L456-I500 HydrophobicContact CD2-CG1 3.46Å; L456-I500 VanDerWaalsContact CD2-CG1 3.46Å; L456-I500 HydrophobicContact CG-CG1 4.47Å; L456-A531 HydrophobicContact CD2-CB 4.43Å
457	T	86.9	Confident	87.4	Confident	44 Å²	44	56.8 Å²	56.8	27%	0.27	27%	0.274	S	S	.	.	H	α-helix	trans	-63.3	-38.1	-178.9	-54.5	0	0	0	0	111.7	I453 W461	I453-T457 WeakPolarHBondContact O-CB 3.44Å; I453-T457 PolarHBondContact O-N 3.24Å; I453-T457 PolarHBondContact O-OG1 3.13Å; T457-W461 WeakPolarHBondContact O-CB 3.47Å; T457-W461 PolarHBondContact O-N 3.32Å
458	K	89.4	Confident	87.5	Confident	146 Å²	146	60.1 Å²	60.1	64%	0.635	29%	0.288	S	S	*	.	H	α-helix	trans	-67.6	-39.2	174	-69.6	169.7	-166.7	162.7	0	111.9	N454 M455 L456 G462	N454-K458 WeakPolarHBondContact O-CD 3.45Å; N454-K458 WeakPolarHBondContact O-CE 3.39Å; N454-K458 VanDerWaalsContact O-CG 3.22Å; N454-K458 WeakPolarHBondContact O-CG 3.33Å; M455-K458 PolarHBondContact O-N 2.93Å; L456-K458 VanDerWaalsContact C-N 3.33Å; L456-K458 PolarHBondContact O-N 3.33Å; K458-G462 PolarHBondContact O-N 2.93Å; K458-G462 VanDerWaalsContact O-N 3.09Å
459	W	92.7	Very high	87.7	Confident	63 Å²	63	57.7 Å²	57.7	24%	0.239	29%	0.288	C	S	.	.	H	α-helix	trans	-69.6	-44.9	176.7	174	78.4	0	0	0	112	M455 L456 W461 G462 I463 E492 L493 K496	M455-W459 WeakPolarHBondContact O-CB 3.3Å; M455-W459 PolarHBondContact O-N 3.05Å; L456-W459 HydrophobicContact CD1-CE3 4.03Å; L456-W459 HydrophobicContact CD1-CZ3 4.36Å; L456-W459 CarbonylContact O-C 3.52Å; L456-W459 PolarHBondContact O-N 3.33Å; L456-W459 VanDerWaalsContact O-N 3.16Å; W459-W461 PolarHBondContact O-N 3.37Å; W459-G462 CarbonylContact O-C 3.57Å; W459-G462 WeakPolarHBondContact O-CA 3.33Å; W459-G462 PolarHBondContact O-N 3.36Å; W459-I463 HydrophobicContact CD2-CG1 4.16Å; W459-I463 HydrophobicContact CH2-CG1 3.95Å; W459-I463 HydrophobicContact CZ2-CD1 3.81Å; W459-I463 HydrophobicContact CZ2-CG1 3.5Å; W459-I463 HydrophobicContact CZ3-CG1 4.45Å; W459-I463 PolarHBondContact O-N 3.03Å; W459-E492 HydrophobicContact CH2-CB 4.5Å; W459-E492 HydrophobicContact CZ2-CB 3.91Å; W459-L493 HydrophobicContact CH2-CD2 3.72Å; W459-L493 HydrophobicContact CH2-CG 4.06Å; W459-L493 HydrophobicContact CZ3-CD2 4Å; W459-K496 HydrophobicContact CE3-CG 3.98Å; W459-K496 HydrophobicContact CH2-CG 3.81Å; W459-K496 HydrophobicContact CZ2-CG 4.34Å; W459-K496 HydrophobicContact CZ3-CB 4.18Å; W459-K496 HydrophobicContact CZ3-CG 3.59Å
460	L	91.8	Very high	88.1	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57	-47.6	173.4	-78.1	173.3	0	0	0	111	L456 G462 I463 E464 L493 A531 Q534 W535	L456-L460 HydrophobicContact CD1-CD1 4.4Å; L456-L460 HydrophobicContact CD1-CG 4.33Å; L456-L460 HydrophobicContact CD2-CD1 4.17Å; L456-L460 HydrophobicContact CG-CD1 3.85Å; L456-L460 HydrophobicContact CG-CG 4.17Å; L456-L460 WeakPolarHBondContact O-CB 3.46Å; L456-L460 WeakPolarHBondContact O-CG 3.27Å; L456-L460 PolarHBondContact O-N 3.27Å; L460-G462 VanDerWaalsContact C-N 3.27Å; L460-G462 PolarHBondContact O-N 3.46Å; L460-I463 CarbonylContact O-C 3.3Å; L460-I463 PolarHBondContact O-N 3.02Å; L460-I463 VanDerWaalsContact O-N 3.16Å; L460-E464 WeakPolarHBondContact O-CG 3.45Å; L460-E464 PolarHBondContact O-N 3Å; L460-L493 HydrophobicContact CD2-CD2 4.19Å; L460-A531 HydrophobicContact CD1-CB 4.38Å; L460-A531 VanDerWaalsContact CD1-O 3.27Å; L460-A531 WeakPolarHBondContact CD1-O 3.03Å; L460-Q534 HydrophobicContact CD1-CB 4.39Å; L460-W535 HydrophobicContact CD1-CB 4.08Å; L460-W535 HydrophobicContact CD2-CB 3.78Å; L460-W535 HydrophobicContact CD2-CG 4.29Å
461	W	90.2	Very high	88.4	Confident	151 Å²	151	60.4 Å²	60.4	57%	0.572	31%	0.314	S	S	*	.	H	α-helix	trans	-59.5	-38.1	174.5	-179.3	76.7	0	0	0	112.2	T457 W459 E464 Q465	T457-W461 WeakPolarHBondContact O-CB 3.47Å; T457-W461 PolarHBondContact O-N 3.32Å; W459-W461 PolarHBondContact O-N 3.37Å; W461-E464 WeakPolarHBondContact O-CB 3.43Å; W461-E464 PolarHBondContact O-N 3.46Å; W461-Q465 HydrophobicContact CD2-CG 4.14Å; W461-Q465 HydrophobicContact CE3-CG 4.39Å; W461-Q465 HydrophobicContact CH2-CG 4.03Å; W461-Q465 HydrophobicContact CZ2-CG 3.73Å; W461-Q465 HydrophobicContact CZ3-CG 4.34Å; W461-Q465 WeakPolarHBondContact O-CG 3.36Å; W461-Q465 PolarHBondContact O-N 3.5Å
462	G	92	Very high	88.4	Confident	34 Å²	34	59.3 Å²	59.3	35%	0.351	31%	0.312	S	S	.	.	H	α-helix	trans	-61.5	-45.7	172.7	0	0	0	0	0	113.2	K458 W459 L460 Q465 E466	K458-G462 PolarHBondContact O-N 2.93Å; K458-G462 VanDerWaalsContact O-N 3.09Å; W459-G462 CarbonylContact O-C 3.57Å; W459-G462 WeakPolarHBondContact O-CA 3.33Å; W459-G462 PolarHBondContact O-N 3.36Å; L460-G462 VanDerWaalsContact C-N 3.27Å; L460-G462 PolarHBondContact O-N 3.46Å; G462-Q465 PolarHBondContact O-N 3.43Å; G462-E466 PolarHBondContact O-N 2.95Å; G462-E466 VanDerWaalsContact O-N 3.08Å
463	I	92.3	Very high	88.6	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.036	30%	0.301	C	S	.	.	H	α-helix	trans	-64.3	-42.3	173.6	-61.6	-64	0	0	0	110.7	W459 L460 Q465 E466 V467 I489 V538	W459-I463 HydrophobicContact CD2-CG1 4.16Å; W459-I463 HydrophobicContact CH2-CG1 3.95Å; W459-I463 HydrophobicContact CZ2-CD1 3.81Å; W459-I463 HydrophobicContact CZ2-CG1 3.5Å; W459-I463 HydrophobicContact CZ3-CG1 4.45Å; W459-I463 PolarHBondContact O-N 3.03Å; L460-I463 CarbonylContact O-C 3.3Å; L460-I463 PolarHBondContact O-N 3.02Å; L460-I463 VanDerWaalsContact O-N 3.16Å; I463-Q465 VanDerWaalsContact C-N 3.33Å; I463-Q465 PolarHBondContact O-N 2.98Å; I463-E466 PolarHBondContact O-N 3.32Å; I463-E466 VanDerWaalsContact O-N 3.16Å; I463-V467 HydrophobicContact CG2-CG2 4.06Å; I463-V467 WeakPolarHBondContact O-CB 3.44Å; I463-V467 VanDerWaalsContact O-CG2 3.27Å; I463-V467 WeakPolarHBondContact O-CG2 3.37Å; I463-V467 PolarHBondContact O-N 3.05Å; I463-I489 HydrophobicContact CG2-CG2 3.71Å; I463-V538 HydrophobicContact CG2-CG1 3.74Å
464	E	90.7	Very high	88.8	Confident	32 Å²	32	61 Å²	61	15%	0.15	32%	0.322	C	S	.	.	H	α-helix	trans	-55.8	-46.9	174.1	-75.9	174.6	172.9	0	0	110.8	L460 W461 E466 V467 H468 Q534 V538	L460-E464 WeakPolarHBondContact O-CG 3.45Å; L460-E464 PolarHBondContact O-N 3Å; W461-E464 WeakPolarHBondContact O-CB 3.43Å; W461-E464 PolarHBondContact O-N 3.46Å; E464-E466 PolarHBondContact O-N 3.31Å; E464-V467 PolarHBondContact O-N 3.39Å; E464-H468 WeakPolarHBondContact O-CB 3.25Å; E464-H468 PolarHBondContact O-N 3.32Å; E464-H468 PolarHBondContact O-ND1 3.15Å; E464-Q534 WeakPolarHBondContact OE1-CB 3.39Å; E464-Q534 WeakPolarHBondContact OE1-CG 3.46Å; E464-Q534 PolarHBondContact OE1-NE2 2.9Å; E464-Q534 PolarHBondContact OE2-NE2 3.06Å; E464-V538 HydrophobicContact CG-CG2 3.51Å
465	Q	90.8	Very high	89	Confident	93 Å²	93	59.5 Å²	59.5	44%	0.435	32%	0.316	S	S	.	.	H	α-helix	trans	-62.7	-40	176.9	-64.8	-43.2	-70.1	0	0	112.1	W461 G462 I463 S469	W461-Q465 HydrophobicContact CD2-CG 4.14Å; W461-Q465 HydrophobicContact CE3-CG 4.39Å; W461-Q465 HydrophobicContact CH2-CG 4.03Å; W461-Q465 HydrophobicContact CZ2-CG 3.73Å; W461-Q465 HydrophobicContact CZ3-CG 4.34Å; W461-Q465 WeakPolarHBondContact O-CG 3.36Å; W461-Q465 PolarHBondContact O-N 3.5Å; G462-Q465 PolarHBondContact O-N 3.43Å; I463-Q465 VanDerWaalsContact C-N 3.33Å; I463-Q465 PolarHBondContact O-N 2.98Å; Q465-S469 WeakPolarHBondContact O-CB 3.3Å; Q465-S469 PolarHBondContact O-N 3.45Å
466	E	91	Very high	89.1	Confident	58 Å²	58	53.8 Å²	53.8	27%	0.271	29%	0.292	S	S	.	.	H	α-helix	trans	-64.4	-43.9	174.5	-168.6	178.7	179.9	0	0	111.6	G462 I463 E464 H468 S469 F470 R485 I489	G462-E466 PolarHBondContact O-N 2.95Å; G462-E466 VanDerWaalsContact O-N 3.08Å; I463-E466 PolarHBondContact O-N 3.32Å; I463-E466 VanDerWaalsContact O-N 3.16Å; E464-E466 PolarHBondContact O-N 3.31Å; E466-H468 PolarHBondContact O-N 3.46Å; E466-S469 WeakPolarHBondContact O-CA 3.31Å; E466-S469 WeakPolarHBondContact O-CB 3.34Å; E466-S469 PolarHBondContact O-N 3.07Å; E466-S469 PolarHBondContact O-OG 2.87Å; E466-F470 HydrophobicContact CG-CE1 4.29Å; E466-F470 HydrophobicContact CG-CZ 4.05Å; E466-F470 PolarHBondContact O-N 3.34Å; E466-R485 IonicContact OE1-CZ 3.89Å; E466-R485 IonicContact OE1-NE 2.67Å; E466-R485 PolarHBondContact OE1-NE 3.16Å; E466-R485 IonicContact OE1-NH2 2.67Å; E466-R485 IonicContact OE2-CZ 3.84Å; E466-R485 IonicContact OE2-NE 3.7Å; E466-R485 PolarHBondContact OE2-NE 3.36Å; E466-R485 IonicContact OE2-NH2 2.79Å; E466-R485 PolarHBondContact OE2-NH2 3.04Å; E466-I489 HydrophobicContact CG-CD1 4.4Å
467	V	88.9	Confident	89.2	Confident	2 Å²	2	62 Å²	62	1%	0.012	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-41.4	177.9	167.4	0	0	0	0	112	I463 E464 S469 F470 I489 V538 Q541 M542	I463-V467 HydrophobicContact CG2-CG2 4.06Å; I463-V467 WeakPolarHBondContact O-CB 3.44Å; I463-V467 VanDerWaalsContact O-CG2 3.27Å; I463-V467 WeakPolarHBondContact O-CG2 3.37Å; I463-V467 PolarHBondContact O-N 3.05Å; E464-V467 PolarHBondContact O-N 3.39Å; V467-S469 VanDerWaalsContact C-N 3.27Å; V467-S469 PolarHBondContact O-N 3.24Å; V467-F470 HydrophobicContact CG2-CE2 4.26Å; V467-F470 PolarHBondContact O-N 3.03Å; V467-I489 HydrophobicContact CG2-CD1 4.47Å; V467-V538 HydrophobicContact CG2-CG1 4.37Å; V467-Q541 HydrophobicContact CG1-CG 4.21Å; V467-Q541 VanDerWaalsContact CG1-OE1 3.3Å; V467-M542 HydrophobicContact CB-CE 4.16Å; V467-M542 HydrophobicContact CG1-CE 3.65Å; V467-M542 HydrophobicContact CG2-CE 3.6Å; V467-M542 HydrophobicContact CG2-CG 4.05Å; V467-M542 HydrophobicContact CG2-SD 3.69Å
468	H	86.5	Confident	89.4	Confident	132 Å²	132	63.5 Å²	63.5	61%	0.611	33%	0.331	S	S	*	.	H	α-helix	trans	-68.7	-24.6	173.7	-74	84.5	0	0	0	112.7	E464 E466 F470	E464-H468 WeakPolarHBondContact O-CB 3.25Å; E464-H468 PolarHBondContact O-N 3.32Å; E464-H468 PolarHBondContact O-ND1 3.15Å; E466-H468 PolarHBondContact O-N 3.46Å; H468-F470 VanDerWaalsContact C-N 3.31Å; H468-F470 PolarHBondContact O-N 3.43Å
469	S	88.2	Confident	89.6	Confident	84 Å²	84	56.5 Å²	56.5	59%	0.587	30%	0.3	S	S	*	.	H	α-helix	trans	-75.6	-14.5	177.4	83	0	0	0	0	114.3	Q465 E466 V467 G471	Q465-S469 WeakPolarHBondContact O-CB 3.3Å; Q465-S469 PolarHBondContact O-N 3.45Å; E466-S469 WeakPolarHBondContact O-CA 3.31Å; E466-S469 WeakPolarHBondContact O-CB 3.34Å; E466-S469 PolarHBondContact O-N 3.07Å; E466-S469 PolarHBondContact O-OG 2.87Å; V467-S469 VanDerWaalsContact C-N 3.27Å; V467-S469 PolarHBondContact O-N 3.24Å; S469-G471 PolarHBondContact O-N 3.16Å
470	F	88.4	Confident	89.6	Confident	30 Å²	30	56 Å²	56	13%	0.132	31%	0.306	C	S	.	.			trans	-70.6	95.4	-178.8	-68.8	-39.5	0	0	0	112.8	E466 V467 H468 M482 R485 H486 I489 M542 R545	E466-F470 HydrophobicContact CG-CE1 4.29Å; E466-F470 HydrophobicContact CG-CZ 4.05Å; E466-F470 PolarHBondContact O-N 3.34Å; V467-F470 HydrophobicContact CG2-CE2 4.26Å; V467-F470 PolarHBondContact O-N 3.03Å; H468-F470 VanDerWaalsContact C-N 3.31Å; H468-F470 PolarHBondContact O-N 3.43Å; F470-M482 HydrophobicContact CB-CE 3.69Å; F470-M482 HydrophobicContact CD1-CE 4Å; F470-M482 HydrophobicContact CG-CE 3.98Å; F470-R485 HydrophobicContact CE1-CG 4.08Å; F470-R485 HydrophobicContact CZ-CG 3.78Å; F470-H486 AromaticContact CD2-CE1 3.33Å; F470-H486 WeakPolarHBondContact CD2-CE1 3.39Å; F470-H486 AromaticContact CD2-NE2 3.67Å; F470-H486 AromaticContact CE2-CE1 3.48Å; F470-H486 VanDerWaalsContact CE2-CE1 3.48Å; F470-H486 WeakPolarHBondContact CE2-CE1 3.29Å; F470-H486 AromaticContact CE2-ND1 3.91Å; F470-H486 AromaticContact CE2-NE2 3.97Å; F470-H486 AromaticContact CG-CE1 3.73Å; F470-H486 AromaticContact CZ-CE1 3.99Å; F470-I489 HydrophobicContact CE2-CD1 3.74Å; F470-I489 HydrophobicContact CZ-CD1 3.59Å; F470-M542 HydrophobicContact CD2-CE 3.97Å; F470-M542 HydrophobicContact CE2-CE 3.96Å; F470-M542 HydrophobicContact CE2-SD 4.07Å; F470-R545 VanDerWaalsContact O-CZ 3.23Å; F470-R545 PolarHBondContact O-NH1 3.36Å; F470-R545 PolarHBondContact O-NH2 3.47Å
471	G	85.2	Confident	89.6	Confident	49 Å²	49	58.9 Å²	58.9	51%	0.505	33%	0.329	S	S	.	.			trans	-67.9	-177.6	167	0	0	0	0	0	114	S469 M482 R545	S469-G471 PolarHBondContact O-N 3.16Å; G471-M482 WeakPolarHBondContact O-CE 3.22Å; G471-R545 PolarHBondContact O-NH2 3.11Å
472	S	86.1	Confident	89.8	Confident	61 Å²	61	52.8 Å²	52.8	43%	0.427	31%	0.308	S	S	.	.			trans	-75.2	137.5	172	-71.9	0	0	0	0	111.3	N474 K621	S472-N474 PolarHBondContact O-ND2 3.24Å; S472-K621 WeakPolarHBondContact CB-O 3.47Å; S472-K621 PolarHBondContact OG-O 3.24Å
473	P	89.2	Confident	89.9	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.013	30%	0.296	C	S	.	.			trans	-70	131.6	172	27	-29.9	0	0	0	110.7	E478 L479 M482 L549 L622 L623	P473-E478 HydrophobicContact CB-CB 3.86Å; P473-L479 HydrophobicContact CB-CB 4.08Å; P473-L479 HydrophobicContact CB-CD1 4.45Å; P473-L479 HydrophobicContact CG-CB 4.26Å; P473-L479 HydrophobicContact CG-CD1 3.77Å; P473-M482 HydrophobicContact CB-SD 3.81Å; P473-M482 HydrophobicContact CG-SD 3.99Å; P473-L549 HydrophobicContact CG-CD2 4Å; P473-L622 HydrophobicContact CG-CD2 4.12Å; P473-L623 WeakPolarHBondContact O-CA 3.29Å; P473-L623 PolarHBondContact O-N 3.41Å
474	N	85.6	Confident	90	Very high	83 Å²	83	58.3 Å²	58.3	44%	0.444	32%	0.323	S	S	.	.			trans	-96.1	-19.8	-177.4	-64.1	-82.2	0	0	0	113	S472 E478 S625 A626	S472-N474 PolarHBondContact O-ND2 3.24Å; N474-E478 WeakPolarHBondContact CB-OE2 3.26Å; N474-E478 PolarHBondContact N-OE2 3.08Å; N474-E478 PolarHBondContact ND2-OE2 3.49Å; N474-S625 WeakPolarHBondContact CB-OG 3.4Å; N474-S625 PolarHBondContact O-OG 3.44Å; N474-S625 PolarHBondContact OD1-OG 2.88Å; N474-A626 WeakPolarHBondContact O-CB 3.3Å; N474-A626 PolarHBondContact O-N 3.38Å
475	S	88.4	Confident	90.2	Very high	37 Å²	37	59.4 Å²	59.4	26%	0.259	33%	0.325	S	S	.	.	S	Bend	trans	-135.5	156.9	178.2	70.7	0	0	0	0	112.1	K477 E478 L479 L623	S475-K477 PolarHBondContact O-N 3.45Å; S475-K477 VanDerWaalsContact O-N 3.14Å; S475-E478 VanDerWaalsContact CB-OE1 3.26Å; S475-E478 WeakPolarHBondContact CB-OE1 3.31Å; S475-E478 PolarHBondContact N-OE1 3.02Å; S475-E478 WeakPolarHBondContact O-CB 3.35Å; S475-E478 PolarHBondContact O-N 3.31Å; S475-E478 PolarHBondContact OG-N 2.9Å; S475-E478 PolarHBondContact OG-OE1 3.43Å; S475-L479 PolarHBondContact O-N 3.42Å; S475-L623 WeakPolarHBondContact O-CD2 3.32Å
476	G	89.6	Confident	90.3	Very high	12 Å²	12	55 Å²	55	12%	0.124	30%	0.304	C	S	.	.	H	α-helix	trans	-57.4	-28.2	176.8	0	0	0	0	0	113.5	L479 C480	G476-L479 PolarHBondContact O-N 3.31Å; G476-C480 PolarHBondContact O-N 3.44Å; G476-C480 PolarHBondContact O-SG 3.2Å
477	K	89.9	Confident	90.5	Very high	183 Å²	183	57.6 Å²	57.6	80%	0.796	32%	0.315	S	S	*	.	H	α-helix	trans	-70.4	-41.9	174.9	-68.1	-177.1	179.4	178.4	0	112.4	S475 L479 A481	S475-K477 PolarHBondContact O-N 3.45Å; S475-K477 VanDerWaalsContact O-N 3.14Å; K477-L479 VanDerWaalsContact C-N 3.32Å; K477-A481 WeakPolarHBondContact O-CB 3.09Å; K477-A481 PolarHBondContact O-N 3.01Å; K477-A481 VanDerWaalsContact O-N 3.1Å
478	E	91.5	Very high	90.8	Very high	74 Å²	74	61.3 Å²	61.3	35%	0.346	33%	0.332	S	S	.	.	H	α-helix	trans	-62	-42.9	171	-72.2	152.6	-107.5	0	0	110.6	P473 N474 S475 C480 A481 M482	P473-E478 HydrophobicContact CB-CB 3.86Å; N474-E478 WeakPolarHBondContact CB-OE2 3.26Å; N474-E478 PolarHBondContact N-OE2 3.08Å; N474-E478 PolarHBondContact ND2-OE2 3.49Å; S475-E478 VanDerWaalsContact CB-OE1 3.26Å; S475-E478 WeakPolarHBondContact CB-OE1 3.31Å; S475-E478 PolarHBondContact N-OE1 3.02Å; S475-E478 WeakPolarHBondContact O-CB 3.35Å; S475-E478 PolarHBondContact O-N 3.31Å; S475-E478 PolarHBondContact OG-N 2.9Å; S475-E478 PolarHBondContact OG-OE1 3.43Å; E478-C480 PolarHBondContact O-N 3.12Å; E478-A481 PolarHBondContact O-N 3.44Å; E478-A481 VanDerWaalsContact O-N 3.13Å; E478-M482 WeakPolarHBondContact O-CB 3.38Å; E478-M482 WeakPolarHBondContact O-CG 3.33Å; E478-M482 PolarHBondContact O-N 3.14Å
479	L	92.5	Very high	91.2	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-48.7	178.7	-176.6	56.2	0	0	0	111.9	P473 S475 G476 K477 A481 M482 I483 L549 A552 Y553 L623	P473-L479 HydrophobicContact CB-CB 4.08Å; P473-L479 HydrophobicContact CB-CD1 4.45Å; P473-L479 HydrophobicContact CG-CB 4.26Å; P473-L479 HydrophobicContact CG-CD1 3.77Å; S475-L479 PolarHBondContact O-N 3.42Å; G476-L479 PolarHBondContact O-N 3.31Å; K477-L479 VanDerWaalsContact C-N 3.32Å; L479-A481 VanDerWaalsContact C-N 3.32Å; L479-A481 PolarHBondContact O-N 3.31Å; L479-M482 PolarHBondContact O-N 3.04Å; L479-I483 HydrophobicContact CD1-CD1 4.16Å; L479-I483 HydrophobicContact CD1-CG1 4.36Å; L479-I483 HydrophobicContact CG-CD1 4.01Å; L479-I483 VanDerWaalsContact O-CG1 3.26Å; L479-I483 WeakPolarHBondContact O-CG1 3.41Å; L479-I483 PolarHBondContact O-N 2.96Å; L479-L549 HydrophobicContact CD1-CB 3.86Å; L479-L549 HydrophobicContact CD1-CD2 3.53Å; L479-L549 HydrophobicContact CD1-CG 4.27Å; L479-L549 WeakPolarHBondContact CD1-O 3.44Å; L479-A552 HydrophobicContact CD2-CB 4.32Å; L479-Y553 HydrophobicContact CD2-CD2 4.17Å; L479-Y553 HydrophobicContact CG-CD2 4.35Å; L479-L623 HydrophobicContact CB-CD2 4.28Å; L479-L623 HydrophobicContact CD2-CD1 3.72Å; L479-L623 HydrophobicContact CD2-CD2 4.34Å; L479-L623 HydrophobicContact CD2-CG 4.16Å
480	C	93.1	Very high	91.4	Very high	52 Å²	52	51.7 Å²	51.7	35%	0.351	28%	0.279	S	S	.	.	H	α-helix	trans	-56.4	-43.9	172.6	-65.1	0	0	0	0	112.9	G476 E478 K484 Y553	G476-C480 PolarHBondContact O-N 3.44Å; G476-C480 PolarHBondContact O-SG 3.2Å; E478-C480 PolarHBondContact O-N 3.12Å; C480-K484 WeakPolarHBondContact O-CB 3.45Å; C480-K484 PolarHBondContact O-N 3.23Å; C480-Y553 WeakPolarHBondContact SG-CE2 3.46Å
481	A	92.6	Very high	91.7	Very high	60 Å²	60	57.2 Å²	57.2	50%	0.496	31%	0.305	S	S	.	.	H	α-helix	trans	-65.9	-40.8	-179.6	0	0	0	0	0	111.8	K477 E478 L479 K484 R485	K477-A481 WeakPolarHBondContact O-CB 3.09Å; K477-A481 PolarHBondContact O-N 3.01Å; K477-A481 VanDerWaalsContact O-N 3.1Å; E478-A481 PolarHBondContact O-N 3.44Å; E478-A481 VanDerWaalsContact O-N 3.13Å; L479-A481 VanDerWaalsContact C-N 3.32Å; L479-A481 PolarHBondContact O-N 3.31Å; A481-K484 PolarHBondContact O-N 2.9Å; A481-R485 PolarHBondContact O-N 2.78Å
482	M	93.1	Very high	92.1	Very high	24 Å²	24	57.8 Å²	57.8	12%	0.118	29%	0.294	C	S	.	.	H	α-helix	trans	-65.2	-47.1	175.5	-70.6	-167.7	75.5	0	0	111.9	F470 G471 P473 E478 L479 K484 R485 H486 L549	F470-M482 HydrophobicContact CB-CE 3.69Å; F470-M482 HydrophobicContact CD1-CE 4Å; F470-M482 HydrophobicContact CG-CE 3.98Å; G471-M482 WeakPolarHBondContact O-CE 3.22Å; P473-M482 HydrophobicContact CB-SD 3.81Å; P473-M482 HydrophobicContact CG-SD 3.99Å; E478-M482 WeakPolarHBondContact O-CB 3.38Å; E478-M482 WeakPolarHBondContact O-CG 3.33Å; E478-M482 PolarHBondContact O-N 3.14Å; L479-M482 PolarHBondContact O-N 3.04Å; M482-K484 VanDerWaalsContact C-N 3.27Å; M482-K484 PolarHBondContact O-N 2.92Å; M482-R485 PolarHBondContact O-N 3.5Å; M482-R485 VanDerWaalsContact O-N 3.15Å; M482-H486 PolarHBondContact O-N 3.32Å; M482-H486 PolarHBondContact O-ND1 3.22Å; M482-L549 HydrophobicContact CB-CD1 4.19Å
483	I	94.7	Very high	92.4	Very high	19 Å²	19	54.9 Å²	54.9	10%	0.097	27%	0.274	C	S	.	.	H	α-helix	trans	-54.8	-45.1	174.3	-69.1	164.5	0	0	0	110.3	L479 K487 L546 L549 Y553	L479-I483 HydrophobicContact CD1-CD1 4.16Å; L479-I483 HydrophobicContact CD1-CG1 4.36Å; L479-I483 HydrophobicContact CG-CD1 4.01Å; L479-I483 VanDerWaalsContact O-CG1 3.26Å; L479-I483 WeakPolarHBondContact O-CG1 3.41Å; L479-I483 PolarHBondContact O-N 2.96Å; I483-K487 HydrophobicContact CG2-CD 4.36Å; I483-K487 WeakPolarHBondContact O-CG 3.21Å; I483-K487 PolarHBondContact O-N 2.99Å; I483-K487 VanDerWaalsContact O-N 3.09Å; I483-L546 HydrophobicContact CB-CD1 4.43Å; I483-L546 HydrophobicContact CG2-CD1 3.94Å; I483-L549 HydrophobicContact CD1-CB 4.47Å; I483-L549 WeakPolarHBondContact CD1-O 3.24Å; I483-L549 HydrophobicContact CG1-CB 3.78Å; I483-Y553 HydrophobicContact CD1-CG 4.24Å
484	K	94.3	Very high	92.5	Very high	138 Å²	138	62.5 Å²	62.5	60%	0.6	30%	0.303	S	S	*	.	H	α-helix	trans	-62.5	-46.6	176.9	-173.7	177.4	178.2	-179.5	0	111.9	C480 A481 M482 K487 Q488	C480-K484 WeakPolarHBondContact O-CB 3.45Å; C480-K484 PolarHBondContact O-N 3.23Å; A481-K484 PolarHBondContact O-N 2.9Å; M482-K484 VanDerWaalsContact C-N 3.27Å; M482-K484 PolarHBondContact O-N 2.92Å; K484-K487 PolarHBondContact O-N 3.21Å; K484-Q488 WeakPolarHBondContact O-CG 3.35Å; K484-Q488 PolarHBondContact O-N 3.21Å
485	R	94.4	Very high	92.8	Very high	54 Å²	54	62.4 Å²	62.4	20%	0.204	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-39.5	179.7	-175.4	65.1	-166.3	127.4	0.2	112.4	E466 F470 A481 M482 K487 Q488 I489 E492	E466-R485 IonicContact OE1-CZ 3.89Å; E466-R485 IonicContact OE1-NE 2.67Å; E466-R485 PolarHBondContact OE1-NE 3.16Å; E466-R485 IonicContact OE1-NH2 2.67Å; E466-R485 IonicContact OE2-CZ 3.84Å; E466-R485 IonicContact OE2-NE 3.7Å; E466-R485 PolarHBondContact OE2-NE 3.36Å; E466-R485 IonicContact OE2-NH2 2.79Å; E466-R485 PolarHBondContact OE2-NH2 3.04Å; F470-R485 HydrophobicContact CE1-CG 4.08Å; F470-R485 HydrophobicContact CZ-CG 3.78Å; A481-R485 PolarHBondContact O-N 2.78Å; M482-R485 PolarHBondContact O-N 3.5Å; M482-R485 VanDerWaalsContact O-N 3.15Å; R485-K487 VanDerWaalsContact C-N 3.35Å; R485-K487 PolarHBondContact O-N 2.89Å; R485-Q488 WeakPolarHBondContact O-CB 3.26Å; R485-Q488 PolarHBondContact O-N 3Å; R485-I489 HydrophobicContact CG-CD1 4.21Å; R485-I489 HydrophobicContact CG-CG1 4.49Å; R485-I489 WeakPolarHBondContact O-CG1 3.5Å; R485-I489 PolarHBondContact O-N 2.8Å; R485-E492 IonicContact CZ-OE1 3.13Å; R485-E492 IonicContact NH1-OE1 2.67Å; R485-E492 PolarHBondContact NH1-OE1 3.2Å; R485-E492 IonicContact NH2-OE1 3.34Å; R485-E492 PolarHBondContact NH2-OE1 2.89Å; R485-E492 IonicContact NH2-OE2 2.75Å
486	H	94.2	Very high	92.8	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-42.4	175.8	-75.4	57	0	0	0	111.3	F470 M482 Q488 I489 L490 M542 R545 L546	F470-H486 AromaticContact CD2-CE1 3.33Å; F470-H486 WeakPolarHBondContact CD2-CE1 3.39Å; F470-H486 AromaticContact CD2-NE2 3.67Å; F470-H486 AromaticContact CE2-CE1 3.48Å; F470-H486 VanDerWaalsContact CE2-CE1 3.48Å; F470-H486 WeakPolarHBondContact CE2-CE1 3.29Å; F470-H486 AromaticContact CE2-ND1 3.91Å; F470-H486 AromaticContact CE2-NE2 3.97Å; F470-H486 AromaticContact CG-CE1 3.73Å; F470-H486 AromaticContact CZ-CE1 3.99Å; M482-H486 PolarHBondContact O-N 3.32Å; M482-H486 PolarHBondContact O-ND1 3.22Å; H486-Q488 VanDerWaalsContact C-N 3.34Å; H486-Q488 PolarHBondContact O-N 2.77Å; H486-I489 PolarHBondContact O-N 2.74Å; H486-L490 WeakPolarHBondContact O-CG 3.29Å; H486-L490 PolarHBondContact O-N 3.27Å; H486-M542 HydrophobicContact CB-SD 4.49Å; H486-M542 VanDerWaalsContact CD2-CE 3.49Å; H486-M542 WeakPolarHBondContact CD2-CE 3.27Å; H486-M542 WeakPolarHBondContact NE2-CE 3.47Å; H486-R545 VanDerWaalsContact NE2-CD 3.33Å; H486-R545 WeakPolarHBondContact NE2-CD 3.22Å; H486-L546 HydrophobicContact CB-CB 4.31Å; H486-L546 HydrophobicContact CB-CD1 4.03Å
487	K	94.8	Very high	92.7	Very high	114 Å²	114	65.6 Å²	65.6	50%	0.496	32%	0.319	S	S	.	.	H	α-helix	trans	-61.2	-40.6	173.3	-73.2	179	-178.8	-176.2	0	112.3	I483 K484 R485 L490 E491 L546	I483-K487 HydrophobicContact CG2-CD 4.36Å; I483-K487 WeakPolarHBondContact O-CG 3.21Å; I483-K487 PolarHBondContact O-N 2.99Å; I483-K487 VanDerWaalsContact O-N 3.09Å; K484-K487 PolarHBondContact O-N 3.21Å; R485-K487 VanDerWaalsContact C-N 3.35Å; R485-K487 PolarHBondContact O-N 2.89Å; K487-L490 PolarHBondContact O-N 3.06Å; K487-E491 PolarHBondContact O-N 3.03Å; K487-L546 HydrophobicContact CG-CD1 3.93Å; K487-L546 HydrophobicContact CG-CD2 3.59Å; K487-L546 HydrophobicContact CG-CG 4.44Å
488	Q	94.8	Very high	92.5	Very high	80 Å²	80	64.9 Å²	64.9	37%	0.374	32%	0.319	S	S	.	.	H	α-helix	trans	-65.8	-44.4	175.8	-69.6	173.4	-53.5	0	0	112.6	K484 R485 H486 L490 E491 E492	K484-Q488 WeakPolarHBondContact O-CG 3.35Å; K484-Q488 PolarHBondContact O-N 3.21Å; R485-Q488 WeakPolarHBondContact O-CB 3.26Å; R485-Q488 PolarHBondContact O-N 3Å; H486-Q488 VanDerWaalsContact C-N 3.34Å; H486-Q488 PolarHBondContact O-N 2.77Å; Q488-L490 VanDerWaalsContact C-N 3.29Å; Q488-L490 PolarHBondContact O-N 2.96Å; Q488-E491 WeakPolarHBondContact O-CB 3.23Å; Q488-E491 PolarHBondContact O-N 3.46Å; Q488-E491 VanDerWaalsContact O-N 3.14Å; Q488-E492 WeakPolarHBondContact O-CG 3.4Å; Q488-E492 PolarHBondContact O-N 2.95Å
489	I	93.8	Very high	92.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-40	176.1	-71.5	176.7	0	0	0	110.9	I463 E466 V467 F470 R485 H486 E492 L493 M542	I463-I489 HydrophobicContact CG2-CG2 3.71Å; E466-I489 HydrophobicContact CG-CD1 4.4Å; V467-I489 HydrophobicContact CG2-CD1 4.47Å; F470-I489 HydrophobicContact CE2-CD1 3.74Å; F470-I489 HydrophobicContact CZ-CD1 3.59Å; R485-I489 HydrophobicContact CG-CD1 4.21Å; R485-I489 HydrophobicContact CG-CG1 4.49Å; R485-I489 WeakPolarHBondContact O-CG1 3.5Å; R485-I489 PolarHBondContact O-N 2.8Å; H486-I489 PolarHBondContact O-N 2.74Å; I489-E492 PolarHBondContact O-N 3.21Å; I489-L493 HydrophobicContact CG2-CD1 3.61Å; I489-L493 HydrophobicContact CG2-CG 4.24Å; I489-L493 WeakPolarHBondContact O-CB 3.37Å; I489-L493 WeakPolarHBondContact O-CD1 3.33Å; I489-L493 WeakPolarHBondContact O-CG 3.48Å; I489-L493 PolarHBondContact O-N 3.16Å; I489-M542 HydrophobicContact CB-SD 4.25Å; I489-M542 HydrophobicContact CD1-SD 4.26Å; I489-M542 HydrophobicContact CG2-CG 3.85Å; I489-M542 HydrophobicContact CG2-SD 3.9Å
490	L	94.1	Very high	91.7	Very high	14 Å²	14	63.3 Å²	63.3	7%	0.073	31%	0.314	C	S	.	.	H	α-helix	trans	-66.1	-35.4	175.7	-72.5	169.2	0	0	0	113.2	H486 K487 Q488 L493 R494 M542 E543 L546	H486-L490 WeakPolarHBondContact O-CG 3.29Å; H486-L490 PolarHBondContact O-N 3.27Å; K487-L490 PolarHBondContact O-N 3.06Å; Q488-L490 VanDerWaalsContact C-N 3.29Å; Q488-L490 PolarHBondContact O-N 2.96Å; L490-L493 HydrophobicContact CD2-CD1 4.29Å; L490-R494 WeakPolarHBondContact O-CB 3.33Å; L490-R494 VanDerWaalsContact O-CD 3.31Å; L490-R494 WeakPolarHBondContact O-CD 3.39Å; L490-R494 WeakPolarHBondContact O-CG 3.42Å; L490-R494 PolarHBondContact O-N 3.39Å; L490-M542 HydrophobicContact CD1-CB 4.32Å; L490-M542 HydrophobicContact CD2-CB 3.54Å; L490-M542 HydrophobicContact CG-CB 3.85Å; L490-E543 HydrophobicContact CD1-CG 3.82Å; L490-E543 HydrophobicContact CD2-CG 3.49Å; L490-E543 VanDerWaalsContact CD2-CG 3.49Å; L490-E543 HydrophobicContact CG-CG 4.32Å; L490-L546 HydrophobicContact CD1-CD2 3.66Å
491	E	93.8	Very high	91.1	Very high	145 Å²	145	65.3 Å²	65.3	68%	0.678	32%	0.318	S	S	*	.	H	α-helix	trans	-67.5	-42.8	173.3	-170.1	168.6	-156.5	0	0	111.3	K487 Q488 R494 S495	K487-E491 PolarHBondContact O-N 3.03Å; Q488-E491 WeakPolarHBondContact O-CB 3.23Å; Q488-E491 PolarHBondContact O-N 3.46Å; Q488-E491 VanDerWaalsContact O-N 3.14Å; E491-R494 PolarHBondContact O-N 3.14Å; E491-S495 PolarHBondContact O-N 3.41Å
492	E	94	Very high	90.5	Very high	62 Å²	62	64.9 Å²	64.9	29%	0.29	31%	0.312	S	S	.	.	H	α-helix	trans	-61.6	-46.3	172.9	-67.4	172.1	-125.6	0	0	112	W459 R485 Q488 I489 R494 S495 K496	W459-E492 HydrophobicContact CH2-CB 4.5Å; W459-E492 HydrophobicContact CZ2-CB 3.91Å; R485-E492 IonicContact CZ-OE1 3.13Å; R485-E492 IonicContact NH1-OE1 2.67Å; R485-E492 PolarHBondContact NH1-OE1 3.2Å; R485-E492 IonicContact NH2-OE1 3.34Å; R485-E492 PolarHBondContact NH2-OE1 2.89Å; R485-E492 IonicContact NH2-OE2 2.75Å; Q488-E492 WeakPolarHBondContact O-CG 3.4Å; Q488-E492 PolarHBondContact O-N 2.95Å; I489-E492 PolarHBondContact O-N 3.21Å; E492-R494 VanDerWaalsContact C-N 3.34Å; E492-R494 PolarHBondContact O-N 3.19Å; E492-S495 WeakPolarHBondContact O-CB 3.39Å; E492-S495 PolarHBondContact O-N 3.48Å; E492-S495 VanDerWaalsContact O-N 3.16Å; E492-S495 PolarHBondContact O-OG 2.71Å; E492-K496 PolarHBondContact O-N 2.96Å
493	L	92.9	Very high	89.8	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-41.2	176	-73.9	160.6	0	0	0	112.2	W459 L460 I489 L490 S495 K496 W535 V538 M542	W459-L493 HydrophobicContact CH2-CD2 3.72Å; W459-L493 HydrophobicContact CH2-CG 4.06Å; W459-L493 HydrophobicContact CZ3-CD2 4Å; L460-L493 HydrophobicContact CD2-CD2 4.19Å; I489-L493 HydrophobicContact CG2-CD1 3.61Å; I489-L493 HydrophobicContact CG2-CG 4.24Å; I489-L493 WeakPolarHBondContact O-CB 3.37Å; I489-L493 WeakPolarHBondContact O-CD1 3.33Å; I489-L493 WeakPolarHBondContact O-CG 3.48Å; I489-L493 PolarHBondContact O-N 3.16Å; L490-L493 HydrophobicContact CD2-CD1 4.29Å; L493-S495 VanDerWaalsContact C-N 3.34Å; L493-K496 PolarHBondContact O-N 2.95Å; L493-W535 VanDerWaalsContact CD2-CD1 3.49Å; L493-W535 PolarHBondContact O-NE1 3.3Å; L493-V538 HydrophobicContact CD1-CG1 3.82Å; L493-V538 HydrophobicContact CD2-CG1 3.99Å; L493-M542 HydrophobicContact CD1-CG 4.4Å
494	R	91.3	Very high	88.9	Confident	162 Å²	162	65.2 Å²	65.2	61%	0.611	32%	0.316	S	S	*	.	H	α-helix	trans	-66.2	-36.4	175.4	-73.7	164	-179.7	-107.4	-2.5	111.5	L490 E491 E492 K496 S497 E543	L490-R494 WeakPolarHBondContact O-CB 3.33Å; L490-R494 VanDerWaalsContact O-CD 3.31Å; L490-R494 WeakPolarHBondContact O-CD 3.39Å; L490-R494 WeakPolarHBondContact O-CG 3.42Å; L490-R494 PolarHBondContact O-N 3.39Å; E491-R494 PolarHBondContact O-N 3.14Å; E492-R494 VanDerWaalsContact C-N 3.34Å; E492-R494 PolarHBondContact O-N 3.19Å; R494-K496 PolarHBondContact O-N 3.47Å; R494-K496 VanDerWaalsContact O-N 3.16Å; R494-S497 WeakPolarHBondContact O-CB 3.28Å; R494-S497 PolarHBondContact O-N 3.15Å; R494-S497 VanDerWaalsContact O-N 3.14Å; R494-E543 IonicContact CZ-OE1 3.62Å; R494-E543 IonicContact NE-OE1 3.65Å; R494-E543 IonicContact NH2-OE1 2.73Å; R494-E543 PolarHBondContact NH2-OE1 3.46Å
495	S	91.6	Very high	88.2	Confident	80 Å²	80	61.7 Å²	61.7	56%	0.559	31%	0.309	S	S	*	.	H	α-helix	trans	-62.7	-18.7	174.9	84.1	0	0	0	0	114.5	E491 E492 L493	E491-S495 PolarHBondContact O-N 3.41Å; E492-S495 WeakPolarHBondContact O-CB 3.39Å; E492-S495 PolarHBondContact O-N 3.48Å; E492-S495 VanDerWaalsContact O-N 3.16Å; E492-S495 PolarHBondContact O-OG 2.71Å; L493-S495 VanDerWaalsContact C-N 3.34Å
496	K	88.7	Confident	87.3	Confident	76 Å²	76	59.5 Å²	59.5	33%	0.33	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-2.2	177.5	-60.4	-52	-175.1	-177.9	0	114.6	L456 W459 E492 L493 R494 E498 T499 I500	L456-K496 HydrophobicContact CD1-CB 3.95Å; L456-K496 HydrophobicContact CD1-CG 4.22Å; W459-K496 HydrophobicContact CE3-CG 3.98Å; W459-K496 HydrophobicContact CH2-CG 3.81Å; W459-K496 HydrophobicContact CZ2-CG 4.34Å; W459-K496 HydrophobicContact CZ3-CB 4.18Å; W459-K496 HydrophobicContact CZ3-CG 3.59Å; E492-K496 PolarHBondContact O-N 2.96Å; L493-K496 PolarHBondContact O-N 2.95Å; R494-K496 PolarHBondContact O-N 3.47Å; R494-K496 VanDerWaalsContact O-N 3.16Å; K496-E498 VanDerWaalsContact C-N 3.33Å; K496-E498 PolarHBondContact O-N 3.2Å; K496-T499 WeakPolarHBondContact O-CB 3.45Å; K496-T499 PolarHBondContact O-N 2.75Å; K496-I500 WeakPolarHBondContact O-CG1 3.38Å; K496-I500 PolarHBondContact O-N 2.93Å; K496-I500 VanDerWaalsContact O-N 3.1Å
497	S	87.7	Confident	86.4	Confident	41 Å²	41	59.7 Å²	59.7	29%	0.287	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-39.3	-175.4	-162.8	0	0	0	0	112.9	R494 I500 E501	R494-S497 WeakPolarHBondContact O-CB 3.28Å; R494-S497 PolarHBondContact O-N 3.15Å; R494-S497 VanDerWaalsContact O-N 3.14Å; S497-I500 PolarHBondContact O-N 3.49Å; S497-E501 WeakPolarHBondContact O-CG 3.48Å; S497-E501 PolarHBondContact O-N 3.09Å
498	E	84.6	Confident	85.4	Confident	167 Å²	167	55.3 Å²	55.3	78%	0.78	29%	0.29	S	S	*	.	H	α-helix	trans	-67.6	-39.7	178.9	-173.8	179.9	-170.4	0	0	112.3	K496 I500 E501 S502	K496-E498 VanDerWaalsContact C-N 3.33Å; K496-E498 PolarHBondContact O-N 3.2Å; E498-I500 VanDerWaalsContact C-N 3.26Å; E498-I500 PolarHBondContact O-N 3.4Å; E498-E501 PolarHBondContact O-N 3.47Å; E498-S502 VanDerWaalsContact O-CB 3.25Å; E498-S502 WeakPolarHBondContact O-CB 3.34Å; E498-S502 PolarHBondContact O-N 2.9Å
499	T	84.5	Confident	84.6	Confident	39 Å²	39	55 Å²	55	24%	0.239	29%	0.294	C	S	.	.	H	α-helix	trans	-60.5	-39.4	173.7	-45.8	0	0	0	0	111	D452 K496 A503	D452-T499 HydrophobicContact CB-CG2 3.83Å; K496-T499 WeakPolarHBondContact O-CB 3.45Å; K496-T499 PolarHBondContact O-N 2.75Å; T499-A503 VanDerWaalsContact O-CB 3.32Å; T499-A503 WeakPolarHBondContact O-CB 3.48Å; T499-A503 PolarHBondContact O-N 3.36Å
500	I	82.6	Confident	83.5	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.015	29%	0.294	C	S	.	.	H	α-helix	trans	-68.4	-48.8	177.6	-71.1	165.8	0	0	0	111.4	L456 K496 S497 E498 S502 A503 V504 R532 W535	L456-I500 HydrophobicContact CD1-CD1 4.3Å; L456-I500 HydrophobicContact CD1-CG1 4.19Å; L456-I500 HydrophobicContact CD2-CD1 4.16Å; L456-I500 HydrophobicContact CD2-CG1 3.46Å; L456-I500 VanDerWaalsContact CD2-CG1 3.46Å; L456-I500 HydrophobicContact CG-CG1 4.47Å; K496-I500 WeakPolarHBondContact O-CG1 3.38Å; K496-I500 PolarHBondContact O-N 2.93Å; K496-I500 VanDerWaalsContact O-N 3.1Å; S497-I500 PolarHBondContact O-N 3.49Å; E498-I500 VanDerWaalsContact C-N 3.26Å; E498-I500 PolarHBondContact O-N 3.4Å; I500-S502 VanDerWaalsContact C-N 3.34Å; I500-S502 PolarHBondContact O-N 3.13Å; I500-A503 CarbonylContact O-C 3.55Å; I500-A503 WeakPolarHBondContact O-CB 3.47Å; I500-A503 PolarHBondContact O-N 3.17Å; I500-A503 VanDerWaalsContact O-N 3.16Å; I500-V504 HydrophobicContact CG2-CG2 4.33Å; I500-V504 VanDerWaalsContact O-CG2 3.31Å; I500-V504 WeakPolarHBondContact O-CG2 3.49Å; I500-V504 PolarHBondContact O-N 3.37Å; I500-R532 HydrophobicContact CG2-CG 4.26Å; I500-W535 HydrophobicContact CD1-CB 3.71Å; I500-W535 HydrophobicContact CD1-CD2 3.37Å; I500-W535 HydrophobicContact CD1-CE3 4.02Å; I500-W535 HydrophobicContact CD1-CG 3.19Å; I500-W535 HydrophobicContact CD1-CZ2 4.44Å
501	E	81.1	Confident	82.3	Confident	94 Å²	94	57.2 Å²	57.2	44%	0.439	31%	0.305	S	S	.	.	H	α-helix	trans	-67.8	-33.9	-179.9	-65.7	-54.8	144.9	0	0	112.2	S497 E498 V504 C505	S497-E501 WeakPolarHBondContact O-CG 3.48Å; S497-E501 PolarHBondContact O-N 3.09Å; E498-E501 PolarHBondContact O-N 3.47Å; E501-V504 PolarHBondContact O-N 3.38Å; E501-C505 VanDerWaalsContact O-CB 3.27Å; E501-C505 WeakPolarHBondContact O-CB 3.44Å; E501-C505 PolarHBondContact O-N 3.16Å
502	S	80.3	Confident	81.3	Confident	51 Å²	51	56.9 Å²	56.9	36%	0.357	31%	0.308	S	S	.	.	H	α-helix	trans	-60.8	-44.3	169.3	-177.5	0	0	0	0	111.9	E498 I500 C505 L506	E498-S502 VanDerWaalsContact O-CB 3.25Å; E498-S502 WeakPolarHBondContact O-CB 3.34Å; E498-S502 PolarHBondContact O-N 2.9Å; I500-S502 VanDerWaalsContact C-N 3.34Å; I500-S502 PolarHBondContact O-N 3.13Å; S502-C505 PolarHBondContact O-N 2.87Å; S502-L506 PolarHBondContact O-N 3.45Å; S502-L506 VanDerWaalsContact O-N 3.08Å
503	A	77.9	Confident	79.9	Confident	7 Å²	7	57 Å²	57	6%	0.058	32%	0.319	C	S	.	.	H	α-helix	trans	-65.1	-43.4	174.8	0	0	0	0	0	112	T449 I453 T499 I500 C505 L506 G507 F528	T449-A503 HydrophobicContact CG2-CB 4.11Å; I453-A503 HydrophobicContact CG1-CB 4.13Å; T499-A503 VanDerWaalsContact O-CB 3.32Å; T499-A503 WeakPolarHBondContact O-CB 3.48Å; T499-A503 PolarHBondContact O-N 3.36Å; I500-A503 CarbonylContact O-C 3.55Å; I500-A503 WeakPolarHBondContact O-CB 3.47Å; I500-A503 PolarHBondContact O-N 3.17Å; I500-A503 VanDerWaalsContact O-N 3.16Å; A503-C505 VanDerWaalsContact C-N 3.31Å; A503-C505 PolarHBondContact O-N 2.81Å; A503-L506 PolarHBondContact O-N 3.05Å; A503-G507 PolarHBondContact O-N 3.19Å; A503-F528 HydrophobicContact CB-CD1 3.88Å; A503-F528 HydrophobicContact CB-CE1 3.79Å; A503-F528 WeakPolarHBondContact O-CD1 3.36Å; A503-F528 WeakPolarHBondContact O-CE1 3.44Å
504	V	75.9	Confident	78.3	Confident	42 Å²	42	58.7 Å²	58.7	26%	0.255	33%	0.33	S	S	.	.	H	α-helix	trans	-63.1	-37.4	175.7	171.3	0	0	0	0	111.6	I500 E501 G507 G508 R532	I500-V504 HydrophobicContact CG2-CG2 4.33Å; I500-V504 VanDerWaalsContact O-CG2 3.31Å; I500-V504 WeakPolarHBondContact O-CG2 3.49Å; I500-V504 PolarHBondContact O-N 3.37Å; E501-V504 PolarHBondContact O-N 3.38Å; V504-G507 PolarHBondContact O-N 3.36Å; V504-G508 PolarHBondContact O-N 3.14Å; V504-R532 HydrophobicContact CG2-CB 4.36Å; V504-R532 VanDerWaalsContact CG2-CD 3.46Å; V504-R532 HydrophobicContact CG2-CG 3.91Å
505	C	79.7	Confident	76.7	Confident	65 Å²	65	58.9 Å²	58.9	44%	0.439	34%	0.343	S	S	.	.	H	α-helix	trans	-63.4	-50.3	175.6	178.4	0	0	0	0	112	E501 S502 A503 G508 V509	E501-C505 VanDerWaalsContact O-CB 3.27Å; E501-C505 WeakPolarHBondContact O-CB 3.44Å; E501-C505 PolarHBondContact O-N 3.16Å; S502-C505 PolarHBondContact O-N 2.87Å; A503-C505 VanDerWaalsContact C-N 3.31Å; A503-C505 PolarHBondContact O-N 2.81Å; C505-G508 PolarHBondContact O-N 3.25Å; C505-V509 PolarHBondContact O-N 3.07Å; C505-V509 VanDerWaalsContact O-N 3.11Å
506	L	75.7	Confident	74.9	Confident	8 Å²	8	64.3 Å²	64.3	4%	0.042	36%	0.359	C	S	.	.	H	α-helix	trans	-65.2	-41.5	175.7	-172.4	70	0	0	0	111.2	V365 T449 F450 S502 A503 G508 V509 I510 F528	V365-L506 HydrophobicContact CG1-CD1 3.71Å; T449-L506 HydrophobicContact CG2-CB 4.09Å; T449-L506 HydrophobicContact CG2-CD2 3.68Å; F450-L506 HydrophobicContact CE1-CD2 3.82Å; F450-L506 HydrophobicContact CZ-CD2 4.21Å; S502-L506 PolarHBondContact O-N 3.45Å; S502-L506 VanDerWaalsContact O-N 3.08Å; A503-L506 PolarHBondContact O-N 3.05Å; L506-G508 PolarHBondContact O-N 3.23Å; L506-V509 PolarHBondContact O-N 3.21Å; L506-I510 HydrophobicContact CD2-CD1 4.27Å; L506-I510 HydrophobicContact CG-CD1 3.92Å; L506-I510 HydrophobicContact CG-CG1 4.41Å; L506-I510 VanDerWaalsContact O-CG1 3.26Å; L506-I510 WeakPolarHBondContact O-CG1 3.4Å; L506-I510 PolarHBondContact O-N 3.25Å; L506-F528 HydrophobicContact CB-CZ 4.37Å; L506-F528 HydrophobicContact CD2-CZ 4.22Å; L506-F528 HydrophobicContact CG-CZ 4.43Å
507	G	74	Confident	73.2	Confident	3 Å²	3	61.3 Å²	61.3	3%	0.031	35%	0.348	C	S	.	.	H	α-helix	trans	-55.9	-38.7	173.7	0	0	0	0	0	112.3	A503 V504 I510 I511	A503-G507 PolarHBondContact O-N 3.19Å; V504-G507 PolarHBondContact O-N 3.36Å; G507-I510 PolarHBondContact O-N 3.06Å; G507-I511 WeakPolarHBondContact O-CB 3.42Å; G507-I511 WeakPolarHBondContact O-CD1 3.24Å; G507-I511 WeakPolarHBondContact O-CG1 3.4Å; G507-I511 PolarHBondContact O-N 3.1Å
508	G	75	Confident	72	Confident	23 Å²	23	61.9 Å²	61.9	24%	0.237	35%	0.348	C	S	.	.	H	α-helix	trans	-61.3	-53.9	171.8	0	0	0	0	0	112.7	V504 C505 L506 I510 I511 D512	V504-G508 PolarHBondContact O-N 3.14Å; C505-G508 PolarHBondContact O-N 3.25Å; L506-G508 PolarHBondContact O-N 3.23Å; G508-I510 PolarHBondContact O-N 3.01Å; G508-I511 WeakPolarHBondContact O-CA 3.45Å; G508-I511 WeakPolarHBondContact O-CB 3.42Å; G508-I511 PolarHBondContact O-N 3.44Å; G508-D512 VanDerWaalsContact O-CG 3.28Å; G508-D512 PolarHBondContact O-N 3.44Å
509	V	77.1	Confident	71.2	Confident	74 Å²	74	58.4 Å²	58.4	45%	0.448	33%	0.332	S	S	.	.	H	α-helix	trans	-56.4	-38	177.2	175.5	0	0	0	0	112	V365 C505 L506 A513	V365-V509 HydrophobicContact CB-CG1 4.35Å; V365-V509 HydrophobicContact CG1-CG1 4Å; C505-V509 PolarHBondContact O-N 3.07Å; C505-V509 VanDerWaalsContact O-N 3.11Å; L506-V509 PolarHBondContact O-N 3.21Å; V509-A513 PolarHBondContact O-N 2.98Å
510	I	71.1	Confident	70.3	Confident	1 Å²	1	61 Å²	61	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-67	-47.8	174.1	-65.9	169.4	0	0	0	110.2	V365 F450 L506 G507 G508 D512 A513 V514 T521 L524 F528	V365-I510 HydrophobicContact CG1-CG1 4.26Å; F450-I510 HydrophobicContact CE1-CD1 4Å; F450-I510 HydrophobicContact CZ-CD1 4.09Å; L506-I510 HydrophobicContact CD2-CD1 4.27Å; L506-I510 HydrophobicContact CG-CD1 3.92Å; L506-I510 HydrophobicContact CG-CG1 4.41Å; L506-I510 VanDerWaalsContact O-CG1 3.26Å; L506-I510 WeakPolarHBondContact O-CG1 3.4Å; L506-I510 PolarHBondContact O-N 3.25Å; G507-I510 PolarHBondContact O-N 3.06Å; G508-I510 PolarHBondContact O-N 3.01Å; I510-D512 VanDerWaalsContact C-N 3.29Å; I510-D512 PolarHBondContact O-N 3.41Å; I510-A513 PolarHBondContact O-N 2.99Å; I510-A513 VanDerWaalsContact O-N 3.12Å; I510-V514 HydrophobicContact CG2-CG2 4.27Å; I510-V514 WeakPolarHBondContact O-CG2 3.41Å; I510-V514 PolarHBondContact O-N 3.23Å; I510-T521 HydrophobicContact CG2-CG2 3.43Å; I510-T521 VanDerWaalsContact CG2-CG2 3.43Å; I510-L524 HydrophobicContact CD1-CD2 4.25Å; I510-F528 HydrophobicContact CD1-CE2 3.76Å; I510-F528 HydrophobicContact CD1-CZ 4.14Å
511	I	69.1	Low	69.5	Low	58 Å²	58	61 Å²	61	30%	0.297	35%	0.348	S	S	.	.	H	α-helix	trans	-56.8	-41.8	178.1	-74.9	164.6	0	0	0	112	G507 G508 A513 V514 K525	G507-I511 WeakPolarHBondContact O-CB 3.42Å; G507-I511 WeakPolarHBondContact O-CD1 3.24Å; G507-I511 WeakPolarHBondContact O-CG1 3.4Å; G507-I511 PolarHBondContact O-N 3.1Å; G508-I511 WeakPolarHBondContact O-CA 3.45Å; G508-I511 WeakPolarHBondContact O-CB 3.42Å; G508-I511 PolarHBondContact O-N 3.44Å; I511-A513 PolarHBondContact O-N 3.48Å; I511-V514 WeakPolarHBondContact O-CB 3.46Å; I511-V514 PolarHBondContact O-N 3.32Å; I511-K525 HydrophobicContact CD1-CD 4.36Å; I511-K525 HydrophobicContact CD1-CG 4.17Å; I511-K525 HydrophobicContact CG1-CD 3.67Å; I511-K525 HydrophobicContact CG1-CG 3.86Å
512	D	72.1	Confident	68.9	Low	138 Å²	138	62.5 Å²	62.5	74%	0.738	35%	0.35	S	S	*	.	H	α-helix	trans	-72.9	-14.3	-178.1	-62	-20.2	0	0	0	112.7	G508 I510	G508-D512 VanDerWaalsContact O-CG 3.28Å; G508-D512 PolarHBondContact O-N 3.44Å; I510-D512 VanDerWaalsContact C-N 3.29Å; I510-D512 PolarHBondContact O-N 3.41Å
513	A	65.8	Low	68.5	Low	64 Å²	64	64.4 Å²	64.4	53%	0.529	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-4	172.9	0	0	0	0	0	113.9	V509 I510 I511 D515	V509-A513 PolarHBondContact O-N 2.98Å; I510-A513 PolarHBondContact O-N 2.99Å; I510-A513 VanDerWaalsContact O-N 3.12Å; I511-A513 PolarHBondContact O-N 3.48Å; A513-D515 VanDerWaalsContact C-N 3.26Å; A513-D515 PolarHBondContact O-N 3.07Å; A513-D515 VanDerWaalsContact O-N 3.08Å
514	V	58	Low	68.1	Low	37 Å²	37	65.2 Å²	65.2	22%	0.224	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	31.6	-167	163.2	0	0	0	0	114.5	I510 I511 Q516 A517 T521	I510-V514 HydrophobicContact CG2-CG2 4.27Å; I510-V514 WeakPolarHBondContact O-CG2 3.41Å; I510-V514 PolarHBondContact O-N 3.23Å; I511-V514 WeakPolarHBondContact O-CB 3.46Å; I511-V514 PolarHBondContact O-N 3.32Å; V514-Q516 VanDerWaalsContact C-N 3.31Å; V514-A517 HydrophobicContact CB-CB 3.98Å; V514-A517 HydrophobicContact CG1-CB 4.03Å; V514-A517 HydrophobicContact CG2-CB 3.5Å; V514-T521 HydrophobicContact CG2-CG2 3.66Å
515	D	57.7	Low	67.9	Low	166 Å²	166	66.1 Å²	66.1	89%	0.888	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-18.8	167.4	-91.8	-13.2	0	0	0	113.3	A513	A513-D515 VanDerWaalsContact C-N 3.26Å; A513-D515 PolarHBondContact O-N 3.07Å; A513-D515 VanDerWaalsContact O-N 3.08Å
516	Q	53.4	Low	67.9	Low	194 Å²	194	68.6 Å²	68.6	91%	0.907	36%	0.362	S	S	*	.	S	Bend	trans	-130.9	9.4	-179.9	-61.4	-170.6	4.4	0	0	114.3	V514	V514-Q516 VanDerWaalsContact C-N 3.31Å
517	A	53.4	Low	68	Low	12 Å²	12	72.3 Å²	72.3	10%	0.099	38%	0.379	C	S	.	.			trans	-77.5	148.4	-163.5	0	0	0	0	0	115.4	V514 T521 R522	V514-A517 HydrophobicContact CB-CB 3.98Å; V514-A517 HydrophobicContact CG1-CB 4.03Å; V514-A517 HydrophobicContact CG2-CB 3.5Å; A517-T521 HydrophobicContact CB-CG2 3.86Å; A517-R522 PolarHBondContact O-NH2 3.01Å
518	D	63.6	Low	68.3	Low	53 Å²	53	72.8 Å²	72.8	28%	0.283	38%	0.38	S	S	.	.			trans	-69.5	175.2	177.3	58.5	45.4	0	0	0	114.1	I367 T520 T521 R522	I367-D518 VanDerWaalsContact CG2-OD2 3.31Å; I367-D518 WeakPolarHBondContact CG2-OD2 3.43Å; D518-T520 WeakPolarHBondContact OD1-CB 3.37Å; D518-T520 PolarHBondContact OD1-N 2.94Å; D518-T520 PolarHBondContact OD1-OG1 2.88Å; D518-T521 PolarHBondContact O-N 3.32Å; D518-T521 WeakPolarHBondContact OD1-CB 3.28Å; D518-T521 PolarHBondContact OD1-N 3.27Å; D518-T521 PolarHBondContact OD1-OG1 2.59Å; D518-R522 PolarHBondContact O-N 3.18Å
519	E	67.3	Low	68.5	Low	95 Å²	95	74.8 Å²	74.8	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-68.1	-34.8	-179.3	-180	55.1	-158.1	0	0	112.7	T521 R522 Q523	E519-T521 VanDerWaalsContact C-N 3.33Å; E519-T521 PolarHBondContact O-N 2.79Å; E519-R522 PolarHBondContact O-N 2.97Å; E519-R522 IonicContact OE2-CZ 3.42Å; E519-R522 IonicContact OE2-NH1 3.18Å; E519-R522 PolarHBondContact OE2-NH1 2.74Å; E519-Q523 WeakPolarHBondContact O-CG 3.45Å; E519-Q523 PolarHBondContact O-N 3.31Å; E519-Q523 PolarHBondContact OE1-NE2 3.44Å
520	T	65	Low	68.9	Low	93 Å²	93	75.2 Å²	75.2	57%	0.571	39%	0.385	S	S	*	.	H	α-helix	trans	-58.1	-43.4	173.9	20.4	0	0	0	0	112	D518 R522 Q523 L524	D518-T520 WeakPolarHBondContact OD1-CB 3.37Å; D518-T520 PolarHBondContact OD1-N 2.94Å; D518-T520 PolarHBondContact OD1-OG1 2.88Å; T520-R522 VanDerWaalsContact C-N 3.34Å; T520-R522 PolarHBondContact O-N 2.8Å; T520-Q523 PolarHBondContact O-N 2.75Å; T520-L524 WeakPolarHBondContact O-CB 3.33Å; T520-L524 PolarHBondContact O-N 3.1Å
521	T	66.1	Low	69.5	Low	3 Å²	3	75.3 Å²	75.3	2%	0.018	39%	0.386	C	S	.	.	H	α-helix	trans	-67.3	-34.3	178.2	-51.3	0	0	0	0	111.7	I367 I510 V514 A517 D518 E519 K525	I367-T521 WeakPolarHBondContact CG1-OG1 3.49Å; I510-T521 HydrophobicContact CG2-CG2 3.43Å; I510-T521 VanDerWaalsContact CG2-CG2 3.43Å; V514-T521 HydrophobicContact CG2-CG2 3.66Å; A517-T521 HydrophobicContact CB-CG2 3.86Å; D518-T521 PolarHBondContact O-N 3.32Å; D518-T521 WeakPolarHBondContact OD1-CB 3.28Å; D518-T521 PolarHBondContact OD1-N 3.27Å; D518-T521 PolarHBondContact OD1-OG1 2.59Å; E519-T521 VanDerWaalsContact C-N 3.33Å; E519-T521 PolarHBondContact O-N 2.79Å; T521-K525 VanDerWaalsContact O-CB 3.26Å; T521-K525 WeakPolarHBondContact O-CB 3.49Å; T521-K525 PolarHBondContact O-N 3.19Å
522	R	68.7	Low	70.3	Confident	125 Å²	125	75.5 Å²	75.5	47%	0.472	38%	0.383	S	S	.	.	H	α-helix	trans	-69	-45	174.3	-64.8	176	-145.4	132.1	4.9	112.2	A517 D518 E519 T520 L524 K525 Q526	A517-R522 PolarHBondContact O-NH2 3.01Å; D518-R522 PolarHBondContact O-N 3.18Å; E519-R522 PolarHBondContact O-N 2.97Å; E519-R522 IonicContact OE2-CZ 3.42Å; E519-R522 IonicContact OE2-NH1 3.18Å; E519-R522 PolarHBondContact OE2-NH1 2.74Å; T520-R522 VanDerWaalsContact C-N 3.34Å; T520-R522 PolarHBondContact O-N 2.8Å; R522-L524 VanDerWaalsContact C-N 3.31Å; R522-L524 PolarHBondContact O-N 2.89Å; R522-K525 WeakPolarHBondContact O-CB 3.49Å; R522-K525 PolarHBondContact O-N 2.92Å; R522-Q526 WeakPolarHBondContact O-CB 3.33Å; R522-Q526 PolarHBondContact O-N 3.07Å
523	Q	71.3	Confident	71	Confident	92 Å²	92	73.7 Å²	73.7	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-63.1	-40.5	176.7	-69.5	176.2	14.3	0	0	111.1	E519 T520 Q526 Q527	E519-Q523 WeakPolarHBondContact O-CG 3.45Å; E519-Q523 PolarHBondContact O-N 3.31Å; E519-Q523 PolarHBondContact OE1-NE2 3.44Å; T520-Q523 PolarHBondContact O-N 2.75Å; Q523-Q526 WeakPolarHBondContact O-CB 3.48Å; Q523-Q526 PolarHBondContact O-N 2.84Å; Q523-Q527 WeakPolarHBondContact O-CG 3.38Å; Q523-Q527 PolarHBondContact O-N 2.96Å
524	L	70	Confident	72.1	Confident	23 Å²	23	73.1 Å²	73.1	12%	0.12	36%	0.356	C	S	.	.	H	α-helix	trans	-62.3	-49.7	173.6	177.4	60.9	0	0	0	112.1	G366 F450 I453 I510 T520 R522 Q526 Q527 F528	G366-L524 WeakPolarHBondContact O-CD2 3.5Å; F450-L524 HydrophobicContact CD1-CD1 3.67Å; F450-L524 HydrophobicContact CD1-CD2 4.23Å; F450-L524 HydrophobicContact CD1-CG 4.48Å; F450-L524 HydrophobicContact CE1-CD1 3.81Å; F450-L524 HydrophobicContact CE1-CD2 3.57Å; F450-L524 HydrophobicContact CE1-CG 4.13Å; F450-L524 HydrophobicContact CE2-CD2 4.25Å; F450-L524 HydrophobicContact CG-CD1 4.33Å; F450-L524 HydrophobicContact CZ-CD2 3.59Å; I453-L524 HydrophobicContact CD1-CD1 4.47Å; I510-L524 HydrophobicContact CD1-CD2 4.25Å; T520-L524 WeakPolarHBondContact O-CB 3.33Å; T520-L524 PolarHBondContact O-N 3.1Å; R522-L524 VanDerWaalsContact C-N 3.31Å; R522-L524 PolarHBondContact O-N 2.89Å; L524-Q526 PolarHBondContact O-N 3.25Å; L524-Q527 WeakPolarHBondContact O-CB 3.31Å; L524-Q527 PolarHBondContact O-N 3.38Å; L524-F528 HydrophobicContact CD1-CD2 4.26Å; L524-F528 HydrophobicContact CD1-CE2 3.87Å; L524-F528 HydrophobicContact CD2-CE2 4.43Å; L524-F528 HydrophobicContact CG-CD2 4.16Å; L524-F528 HydrophobicContact CG-CE2 3.8Å; L524-F528 VanDerWaalsContact O-CD2 3.22Å; L524-F528 WeakPolarHBondContact O-CD2 3.25Å; L524-F528 PolarHBondContact O-N 2.92Å
525	K	72.3	Confident	73.7	Confident	62 Å²	62	73 Å²	73	27%	0.27	35%	0.352	S	S	.	.	H	α-helix	trans	-52.5	-40.5	170.6	169.7	178.3	179.2	159.1	0	111.9	I511 T521 R522 L529	I511-K525 HydrophobicContact CD1-CD 4.36Å; I511-K525 HydrophobicContact CD1-CG 4.17Å; I511-K525 HydrophobicContact CG1-CD 3.67Å; I511-K525 HydrophobicContact CG1-CG 3.86Å; T521-K525 VanDerWaalsContact O-CB 3.26Å; T521-K525 WeakPolarHBondContact O-CB 3.49Å; T521-K525 PolarHBondContact O-N 3.19Å; R522-K525 WeakPolarHBondContact O-CB 3.49Å; R522-K525 PolarHBondContact O-N 2.92Å; K525-L529 HydrophobicContact CG-CD1 4.14Å; K525-L529 WeakPolarHBondContact O-CG 3.03Å; K525-L529 PolarHBondContact O-N 3.47Å; K525-L529 VanDerWaalsContact O-N 3.16Å
526	Q	78.8	Confident	75.3	Confident	116 Å²	116	69.2 Å²	69.2	54%	0.542	33%	0.325	S	S	.	.	H	α-helix	trans	-69.2	-38.8	177.2	-166.2	175.4	12.1	0	0	112.1	R522 Q523 L524 L529 N530	R522-Q526 WeakPolarHBondContact O-CB 3.33Å; R522-Q526 PolarHBondContact O-N 3.07Å; Q523-Q526 WeakPolarHBondContact O-CB 3.48Å; Q523-Q526 PolarHBondContact O-N 2.84Å; L524-Q526 PolarHBondContact O-N 3.25Å; Q526-L529 PolarHBondContact O-N 3.45Å; Q526-N530 VanDerWaalsContact O-CB 3.29Å; Q526-N530 WeakPolarHBondContact O-CB 3.5Å; Q526-N530 PolarHBondContact O-N 3.44Å; Q526-N530 PolarHBondContact O-OD1 3.31Å
527	Q	78.8	Confident	77.1	Confident	86 Å²	86	62.6 Å²	62.6	40%	0.402	30%	0.304	S	S	.	.	H	α-helix	trans	-62	-45	174	-70.9	175.9	20.1	0	0	112.2	Q523 L524 L529 N530 A531	Q523-Q527 WeakPolarHBondContact O-CG 3.38Å; Q523-Q527 PolarHBondContact O-N 2.96Å; L524-Q527 WeakPolarHBondContact O-CB 3.31Å; L524-Q527 PolarHBondContact O-N 3.38Å; Q527-L529 PolarHBondContact O-N 3.25Å; Q527-N530 PolarHBondContact O-N 3.43Å; Q527-A531 WeakPolarHBondContact O-CB 3.46Å; Q527-A531 PolarHBondContact O-N 3.2Å
528	F	78.8	Confident	79	Confident	13 Å²	13	62.2 Å²	62.2	6%	0.057	30%	0.3	C	S	.	.	H	α-helix	trans	-54	-50.9	173.1	-81.4	-73.2	0	0	0	112.1	T449 F450 I453 A503 L506 I510 L524 R532	T449-F528 HydrophobicContact CG2-CE1 3.83Å; T449-F528 HydrophobicContact CG2-CZ 4.1Å; F450-F528 HydrophobicContact CD1-CE2 4.44Å; F450-F528 HydrophobicContact CD1-CZ 4.13Å; F450-F528 AromaticContact CE1-CE2 3.99Å; F450-F528 HydrophobicContact CE1-CE2 3.99Å; F450-F528 AromaticContact CE1-CZ 3.82Å; F450-F528 HydrophobicContact CE1-CZ 3.82Å; I453-F528 HydrophobicContact CD1-CD1 3.49Å; I453-F528 VanDerWaalsContact CD1-CD1 3.49Å; I453-F528 HydrophobicContact CD1-CD2 4.2Å; I453-F528 HydrophobicContact CD1-CE1 3.14Å; I453-F528 HydrophobicContact CD1-CE2 3.91Å; I453-F528 HydrophobicContact CD1-CG 4.01Å; I453-F528 HydrophobicContact CD1-CZ 3.39Å; I453-F528 HydrophobicContact CG1-CD1 3.98Å; I453-F528 HydrophobicContact CG1-CE1 3.84Å; A503-F528 HydrophobicContact CB-CD1 3.88Å; A503-F528 HydrophobicContact CB-CE1 3.79Å; A503-F528 WeakPolarHBondContact O-CD1 3.36Å; A503-F528 WeakPolarHBondContact O-CE1 3.44Å; L506-F528 HydrophobicContact CB-CZ 4.37Å; L506-F528 HydrophobicContact CD2-CZ 4.22Å; L506-F528 HydrophobicContact CG-CZ 4.43Å; I510-F528 HydrophobicContact CD1-CE2 3.76Å; I510-F528 HydrophobicContact CD1-CZ 4.14Å; L524-F528 HydrophobicContact CD1-CD2 4.26Å; L524-F528 HydrophobicContact CD1-CE2 3.87Å; L524-F528 HydrophobicContact CD2-CE2 4.43Å; L524-F528 HydrophobicContact CG-CD2 4.16Å; L524-F528 HydrophobicContact CG-CE2 3.8Å; L524-F528 VanDerWaalsContact O-CD2 3.22Å; L524-F528 WeakPolarHBondContact O-CD2 3.25Å; L524-F528 PolarHBondContact O-N 2.92Å; F528-R532 WeakPolarHBondContact O-CB 3.34Å; F528-R532 PolarHBondContact O-N 3.32Å; F528-R532 VanDerWaalsContact O-N 3.16Å
529	L	80.1	Confident	80.4	Confident	65 Å²	65	60.5 Å²	60.5	34%	0.34	29%	0.292	S	S	.	.	H	α-helix	trans	-68.3	-41.5	-176.6	-68.9	170.9	0	0	0	111.9	K525 Q526 Q527 R532 E533	K525-L529 HydrophobicContact CG-CD1 4.14Å; K525-L529 WeakPolarHBondContact O-CG 3.03Å; K525-L529 PolarHBondContact O-N 3.47Å; K525-L529 VanDerWaalsContact O-N 3.16Å; Q526-L529 PolarHBondContact O-N 3.45Å; Q527-L529 PolarHBondContact O-N 3.25Å; L529-R532 PolarHBondContact O-N 2.64Å; L529-E533 WeakPolarHBondContact O-CB 3.45Å; L529-E533 PolarHBondContact O-N 3.23Å
530	N	84.6	Confident	81.6	Confident	83 Å²	83	62.4 Å²	62.4	44%	0.444	30%	0.301	S	S	.	.	H	α-helix	trans	-60.9	-50.8	176.4	-71.1	-2.6	0	0	0	111.2	Q526 Q527 R532 E533 Q534	Q526-N530 VanDerWaalsContact O-CB 3.29Å; Q526-N530 WeakPolarHBondContact O-CB 3.5Å; Q526-N530 PolarHBondContact O-N 3.44Å; Q526-N530 PolarHBondContact O-OD1 3.31Å; Q527-N530 PolarHBondContact O-N 3.43Å; N530-R532 VanDerWaalsContact C-N 3.31Å; N530-R532 PolarHBondContact O-N 3.32Å; N530-E533 PolarHBondContact O-N 2.9Å; N530-E533 VanDerWaalsContact O-N 3.15Å; N530-Q534 WeakPolarHBondContact O-CB 3.38Å; N530-Q534 VanDerWaalsContact O-CG 3.29Å; N530-Q534 WeakPolarHBondContact O-CG 3.49Å; N530-Q534 PolarHBondContact O-N 2.96Å
531	A	83.8	Confident	82.9	Confident	3 Å²	3	61.7 Å²	61.7	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-61.3	-38.8	-178.9	0	0	0	0	0	112.4	L456 L460 Q527 W535	L456-A531 HydrophobicContact CD2-CB 4.43Å; L460-A531 HydrophobicContact CD1-CB 4.38Å; L460-A531 VanDerWaalsContact CD1-O 3.27Å; L460-A531 WeakPolarHBondContact CD1-O 3.03Å; Q527-A531 WeakPolarHBondContact O-CB 3.46Å; Q527-A531 PolarHBondContact O-N 3.2Å; A531-W535 PolarHBondContact O-N 3Å; A531-W535 VanDerWaalsContact O-N 3.12Å
532	R	86	Confident	84.2	Confident	63 Å²	63	61.6 Å²	61.6	24%	0.238	29%	0.29	C	S	.	.	H	α-helix	trans	-63.1	-44.2	174.9	-169.7	-168.1	76.2	179.6	0.6	112	I500 V504 F528 L529 N530 R536	I500-R532 HydrophobicContact CG2-CG 4.26Å; V504-R532 HydrophobicContact CG2-CB 4.36Å; V504-R532 VanDerWaalsContact CG2-CD 3.46Å; V504-R532 HydrophobicContact CG2-CG 3.91Å; F528-R532 WeakPolarHBondContact O-CB 3.34Å; F528-R532 PolarHBondContact O-N 3.32Å; F528-R532 VanDerWaalsContact O-N 3.16Å; L529-R532 PolarHBondContact O-N 2.64Å; N530-R532 VanDerWaalsContact C-N 3.31Å; N530-R532 PolarHBondContact O-N 3.32Å; R532-R536 WeakPolarHBondContact O-CG 3.42Å; R532-R536 PolarHBondContact O-N 3.39Å
533	E	88.6	Confident	85.4	Confident	100 Å²	100	59.8 Å²	59.8	47%	0.467	29%	0.287	S	S	.	.	H	α-helix	trans	-74.8	-36.1	-176.2	-148.3	60.3	-152.5	0	0	111.9	L529 N530 R536 A537	L529-E533 WeakPolarHBondContact O-CB 3.45Å; L529-E533 PolarHBondContact O-N 3.23Å; N530-E533 PolarHBondContact O-N 2.9Å; N530-E533 VanDerWaalsContact O-N 3.15Å; E533-R536 PolarHBondContact O-N 2.82Å; E533-R536 IonicContact OE2-NH1 2.73Å; E533-A537 WeakPolarHBondContact O-CB 3.33Å; E533-A537 PolarHBondContact O-N 3.35Å
534	Q	88.4	Confident	86.5	Confident	51 Å²	51	58.7 Å²	58.7	24%	0.238	29%	0.29	C	S	.	.	H	α-helix	trans	-56.8	-51.8	169.6	-74.2	179.4	-68.9	0	0	111.6	L460 E464 N530 R536 A537 V538	L460-Q534 HydrophobicContact CD1-CB 4.39Å; E464-Q534 WeakPolarHBondContact OE1-CB 3.39Å; E464-Q534 WeakPolarHBondContact OE1-CG 3.46Å; E464-Q534 PolarHBondContact OE1-NE2 2.9Å; E464-Q534 PolarHBondContact OE2-NE2 3.06Å; N530-Q534 WeakPolarHBondContact O-CB 3.38Å; N530-Q534 VanDerWaalsContact O-CG 3.29Å; N530-Q534 WeakPolarHBondContact O-CG 3.49Å; N530-Q534 PolarHBondContact O-N 2.96Å; Q534-R536 VanDerWaalsContact C-N 3.31Å; Q534-R536 PolarHBondContact O-N 3.23Å; Q534-A537 PolarHBondContact O-N 2.89Å; Q534-V538 WeakPolarHBondContact O-CB 3.5Å; Q534-V538 VanDerWaalsContact O-CG2 3.29Å; Q534-V538 WeakPolarHBondContact O-CG2 3.49Å; Q534-V538 PolarHBondContact O-N 2.85Å
535	W	91.4	Very high	87.6	Confident	35 Å²	35	60.5 Å²	60.5	13%	0.133	30%	0.295	C	S	.	.	H	α-helix	trans	-57.1	-42.9	177	176	83.3	0	0	0	112.5	L460 L493 I500 A531 V538 C539	L460-W535 HydrophobicContact CD1-CB 4.08Å; L460-W535 HydrophobicContact CD2-CB 3.78Å; L460-W535 HydrophobicContact CD2-CG 4.29Å; L493-W535 VanDerWaalsContact CD2-CD1 3.49Å; L493-W535 PolarHBondContact O-NE1 3.3Å; I500-W535 HydrophobicContact CD1-CB 3.71Å; I500-W535 HydrophobicContact CD1-CD2 3.37Å; I500-W535 HydrophobicContact CD1-CE3 4.02Å; I500-W535 HydrophobicContact CD1-CG 3.19Å; I500-W535 HydrophobicContact CD1-CZ2 4.44Å; A531-W535 PolarHBondContact O-N 3Å; A531-W535 VanDerWaalsContact O-N 3.12Å; W535-V538 PolarHBondContact O-N 3.16Å; W535-C539 WeakPolarHBondContact O-CB 3.38Å; W535-C539 PolarHBondContact O-N 3.07Å; W535-C539 PolarHBondContact O-SG 2.88Å
536	R	91.1	Very high	88.6	Confident	86 Å²	86	58.7 Å²	58.7	33%	0.325	29%	0.288	S	S	.	.	H	α-helix	trans	-63	-46.5	177.4	-72.2	174.8	178.9	177.2	-4.9	112.4	R532 E533 Q534 C539 Q540	R532-R536 WeakPolarHBondContact O-CG 3.42Å; R532-R536 PolarHBondContact O-N 3.39Å; E533-R536 PolarHBondContact O-N 2.82Å; E533-R536 IonicContact OE2-NH1 2.73Å; Q534-R536 VanDerWaalsContact C-N 3.31Å; Q534-R536 PolarHBondContact O-N 3.23Å; R536-C539 PolarHBondContact O-N 3.09Å; R536-Q540 WeakPolarHBondContact O-CG 3.17Å; R536-Q540 PolarHBondContact O-N 3.08Å
537	A	91.8	Very high	89.4	Confident	56 Å²	56	56 Å²	56	46%	0.463	28%	0.282	S	S	.	.	H	α-helix	trans	-61.1	-45.3	178.2	0	0	0	0	0	111.5	E533 Q534 Q540 Q541	E533-A537 WeakPolarHBondContact O-CB 3.33Å; E533-A537 PolarHBondContact O-N 3.35Å; Q534-A537 PolarHBondContact O-N 2.89Å; A537-Q540 PolarHBondContact O-N 3.34Å; A537-Q541 VanDerWaalsContact O-CB 3.29Å; A537-Q541 WeakPolarHBondContact O-CB 3.37Å; A537-Q541 PolarHBondContact O-N 2.86Å
538	V	92.4	Very high	90	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.018	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-44.4	177.4	174.2	0	0	0	0	111.6	I463 E464 V467 L493 Q534 W535 Q541 M542	I463-V538 HydrophobicContact CG2-CG1 3.74Å; E464-V538 HydrophobicContact CG-CG2 3.51Å; V467-V538 HydrophobicContact CG2-CG1 4.37Å; L493-V538 HydrophobicContact CD1-CG1 3.82Å; L493-V538 HydrophobicContact CD2-CG1 3.99Å; Q534-V538 WeakPolarHBondContact O-CB 3.5Å; Q534-V538 VanDerWaalsContact O-CG2 3.29Å; Q534-V538 WeakPolarHBondContact O-CG2 3.49Å; Q534-V538 PolarHBondContact O-N 2.85Å; W535-V538 PolarHBondContact O-N 3.16Å; V538-Q541 PolarHBondContact O-N 3.19Å; V538-M542 HydrophobicContact CG1-CG 4.48Å; V538-M542 WeakPolarHBondContact O-CB 3.27Å; V538-M542 WeakPolarHBondContact O-CG 3.4Å; V538-M542 PolarHBondContact O-N 3.12Å
539	C	92.8	Very high	90.7	Very high	17 Å²	17	55.4 Å²	55.4	12%	0.115	28%	0.281	C	S	.	.	H	α-helix	trans	-57.2	-51.7	174.2	-75.9	0	0	0	0	111.6	W535 R536 Q541 M542 E543	W535-C539 WeakPolarHBondContact O-CB 3.38Å; W535-C539 PolarHBondContact O-N 3.07Å; W535-C539 PolarHBondContact O-SG 2.88Å; R536-C539 PolarHBondContact O-N 3.09Å; C539-Q541 PolarHBondContact O-N 3.13Å; C539-M542 PolarHBondContact O-N 3.29Å; C539-E543 WeakPolarHBondContact O-CG 3.35Å; C539-E543 PolarHBondContact O-N 3.4Å
540	Q	93	Very high	91.4	Very high	136 Å²	136	54.5 Å²	54.5	64%	0.636	28%	0.279	S	S	*	.	H	α-helix	trans	-62.3	-40.3	179.7	-70.4	174.4	4	0	0	112.4	R536 A537 M542 S544	R536-Q540 WeakPolarHBondContact O-CG 3.17Å; R536-Q540 PolarHBondContact O-N 3.08Å; A537-Q540 PolarHBondContact O-N 3.34Å; Q540-M542 VanDerWaalsContact C-N 3.34Å; Q540-S544 WeakPolarHBondContact O-CB 3.38Å; Q540-S544 PolarHBondContact O-N 2.69Å; Q540-S544 PolarHBondContact O-OG 2.82Å
541	Q	93	Very high	91.8	Very high	78 Å²	78	54.5 Å²	54.5	36%	0.364	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-37.2	176.3	-170.6	179	19.5	0	0	112	V467 A537 V538 C539 S544 R545	V467-Q541 HydrophobicContact CG1-CG 4.21Å; V467-Q541 VanDerWaalsContact CG1-OE1 3.3Å; A537-Q541 VanDerWaalsContact O-CB 3.29Å; A537-Q541 WeakPolarHBondContact O-CB 3.37Å; A537-Q541 PolarHBondContact O-N 2.86Å; V538-Q541 PolarHBondContact O-N 3.19Å; C539-Q541 PolarHBondContact O-N 3.13Å; Q541-S544 PolarHBondContact O-OG 2.64Å; Q541-R545 WeakPolarHBondContact O-CB 3.15Å; Q541-R545 PolarHBondContact O-N 3.26Å
542	M	93.4	Very high	92.2	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-73.4	-43.6	176.7	-76.1	-70.1	91.1	0	0	113.2	V467 F470 H486 I489 L490 L493 V538 C539 Q540 L546	V467-M542 HydrophobicContact CB-CE 4.16Å; V467-M542 HydrophobicContact CG1-CE 3.65Å; V467-M542 HydrophobicContact CG2-CE 3.6Å; V467-M542 HydrophobicContact CG2-CG 4.05Å; V467-M542 HydrophobicContact CG2-SD 3.69Å; F470-M542 HydrophobicContact CD2-CE 3.97Å; F470-M542 HydrophobicContact CE2-CE 3.96Å; F470-M542 HydrophobicContact CE2-SD 4.07Å; H486-M542 HydrophobicContact CB-SD 4.49Å; H486-M542 VanDerWaalsContact CD2-CE 3.49Å; H486-M542 WeakPolarHBondContact CD2-CE 3.27Å; H486-M542 WeakPolarHBondContact NE2-CE 3.47Å; I489-M542 HydrophobicContact CB-SD 4.25Å; I489-M542 HydrophobicContact CD1-SD 4.26Å; I489-M542 HydrophobicContact CG2-CG 3.85Å; I489-M542 HydrophobicContact CG2-SD 3.9Å; L490-M542 HydrophobicContact CD1-CB 4.32Å; L490-M542 HydrophobicContact CD2-CB 3.54Å; L490-M542 HydrophobicContact CG-CB 3.85Å; L493-M542 HydrophobicContact CD1-CG 4.4Å; V538-M542 HydrophobicContact CG1-CG 4.48Å; V538-M542 WeakPolarHBondContact O-CB 3.27Å; V538-M542 WeakPolarHBondContact O-CG 3.4Å; V538-M542 PolarHBondContact O-N 3.12Å; C539-M542 PolarHBondContact O-N 3.29Å; Q540-M542 VanDerWaalsContact C-N 3.34Å; M542-L546 WeakPolarHBondContact O-CB 3.32Å; M542-L546 PolarHBondContact O-N 2.85Å
543	E	94.1	Very high	92.5	Very high	88 Å²	88	55 Å²	55	41%	0.411	28%	0.28	S	S	.	.	H	α-helix	trans	-67.6	-45.7	179.8	-67.1	-174.1	155.5	0	0	111.6	L490 R494 C539 L546 S547	L490-E543 HydrophobicContact CD1-CG 3.82Å; L490-E543 HydrophobicContact CD2-CG 3.49Å; L490-E543 VanDerWaalsContact CD2-CG 3.49Å; L490-E543 HydrophobicContact CG-CG 4.32Å; R494-E543 IonicContact CZ-OE1 3.62Å; R494-E543 IonicContact NE-OE1 3.65Å; R494-E543 IonicContact NH2-OE1 2.73Å; R494-E543 PolarHBondContact NH2-OE1 3.46Å; C539-E543 WeakPolarHBondContact O-CG 3.35Å; C539-E543 PolarHBondContact O-N 3.4Å; E543-L546 PolarHBondContact O-N 3.26Å; E543-S547 PolarHBondContact O-N 2.97Å
544	S	93	Very high	92.8	Very high	68 Å²	68	54.7 Å²	54.7	48%	0.476	28%	0.279	S	S	.	.	H	α-helix	trans	-62.1	-45.2	176.2	56.3	0	0	0	0	112.4	Q540 Q541 L546 S547 I548	Q540-S544 WeakPolarHBondContact O-CB 3.38Å; Q540-S544 PolarHBondContact O-N 2.69Å; Q540-S544 PolarHBondContact O-OG 2.82Å; Q541-S544 PolarHBondContact O-OG 2.64Å; S544-L546 PolarHBondContact O-N 2.94Å; S544-S547 PolarHBondContact O-N 3.26Å; S544-I548 PolarHBondContact O-N 3.3Å
545	R	92.9	Very high	93.1	Very high	62 Å²	62	54.2 Å²	54.2	23%	0.234	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-35.8	177.5	-173.4	166.2	-177	166.2	2.8	112.6	F470 G471 H486 Q541 S547 I548 L549	F470-R545 VanDerWaalsContact O-CZ 3.23Å; F470-R545 PolarHBondContact O-NH1 3.36Å; F470-R545 PolarHBondContact O-NH2 3.47Å; G471-R545 PolarHBondContact O-NH2 3.11Å; H486-R545 VanDerWaalsContact NE2-CD 3.33Å; H486-R545 WeakPolarHBondContact NE2-CD 3.22Å; Q541-R545 WeakPolarHBondContact O-CB 3.15Å; Q541-R545 PolarHBondContact O-N 3.26Å; R545-S547 VanDerWaalsContact C-N 3.32Å; R545-S547 PolarHBondContact O-N 3.3Å; R545-I548 PolarHBondContact O-N 3.12Å; R545-L549 HydrophobicContact CG-CD1 4.02Å; R545-L549 HydrophobicContact CG-CG 4.3Å; R545-L549 VanDerWaalsContact O-CG 3.28Å; R545-L549 WeakPolarHBondContact O-CG 3.36Å; R545-L549 PolarHBondContact O-N 3.44Å; R545-L549 VanDerWaalsContact O-N 3.08Å
546	L	94.7	Very high	93.2	Very high	24 Å²	24	53.3 Å²	53.3	13%	0.126	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-36.4	176.6	176.7	60.6	0	0	0	112.3	I483 H486 K487 L490 M542 E543 S544 T550	I483-L546 HydrophobicContact CB-CD1 4.43Å; I483-L546 HydrophobicContact CG2-CD1 3.94Å; H486-L546 HydrophobicContact CB-CB 4.31Å; H486-L546 HydrophobicContact CB-CD1 4.03Å; K487-L546 HydrophobicContact CG-CD1 3.93Å; K487-L546 HydrophobicContact CG-CD2 3.59Å; K487-L546 HydrophobicContact CG-CG 4.44Å; L490-L546 HydrophobicContact CD1-CD2 3.66Å; M542-L546 WeakPolarHBondContact O-CB 3.32Å; M542-L546 PolarHBondContact O-N 2.85Å; E543-L546 PolarHBondContact O-N 3.26Å; S544-L546 PolarHBondContact O-N 2.94Å; L546-T550 WeakPolarHBondContact O-CB 3.29Å; L546-T550 PolarHBondContact O-N 3.35Å; L546-T550 PolarHBondContact O-OG1 3.25Å
547	S	93.7	Very high	93.3	Very high	60 Å²	60	53.1 Å²	53.1	42%	0.42	28%	0.276	S	S	.	.	H	α-helix	trans	-58.8	-59.6	173.6	-165.2	0	0	0	0	110.4	E543 S544 R545 L549 T550 D551	E543-S547 PolarHBondContact O-N 2.97Å; S544-S547 PolarHBondContact O-N 3.26Å; R545-S547 VanDerWaalsContact C-N 3.32Å; R545-S547 PolarHBondContact O-N 3.3Å; S547-L549 VanDerWaalsContact C-N 3.26Å; S547-L549 PolarHBondContact O-N 3.36Å; S547-T550 CarbonylContact O-C 3.52Å; S547-T550 WeakPolarHBondContact O-CA 3.47Å; S547-T550 WeakPolarHBondContact O-CB 3.37Å; S547-T550 PolarHBondContact O-N 3.49Å; S547-D551 VanDerWaalsContact C-OD2 3.28Å; S547-D551 VanDerWaalsContact O-CG 3.23Å; S547-D551 PolarHBondContact O-N 3Å; S547-D551 PolarHBondContact OG-OD2 2.65Å
548	I	92.4	Very high	93.4	Very high	83 Å²	83	53.4 Å²	53.4	43%	0.426	27%	0.268	S	S	.	.	H	α-helix	trans	-57.2	-40.2	-175.3	-52.1	168.6	0	0	0	111.2	S544 R545 A552 L622	S544-I548 PolarHBondContact O-N 3.3Å; R545-I548 PolarHBondContact O-N 3.12Å; I548-A552 VanDerWaalsContact O-CB 3.23Å; I548-A552 WeakPolarHBondContact O-CB 3.21Å; I548-A552 PolarHBondContact O-N 2.74Å; I548-L622 HydrophobicContact CG2-CD1 3.92Å
549	L	93.3	Very high	93.5	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-65.1	-37.3	175.2	-67.6	173.2	0	0	0	112.4	P473 L479 M482 I483 R545 S547 Y553 L622	P473-L549 HydrophobicContact CG-CD2 4Å; L479-L549 HydrophobicContact CD1-CB 3.86Å; L479-L549 HydrophobicContact CD1-CD2 3.53Å; L479-L549 HydrophobicContact CD1-CG 4.27Å; L479-L549 WeakPolarHBondContact CD1-O 3.44Å; M482-L549 HydrophobicContact CB-CD1 4.19Å; I483-L549 HydrophobicContact CD1-CB 4.47Å; I483-L549 WeakPolarHBondContact CD1-O 3.24Å; I483-L549 HydrophobicContact CG1-CB 3.78Å; R545-L549 HydrophobicContact CG-CD1 4.02Å; R545-L549 HydrophobicContact CG-CG 4.3Å; R545-L549 VanDerWaalsContact O-CG 3.28Å; R545-L549 WeakPolarHBondContact O-CG 3.36Å; R545-L549 PolarHBondContact O-N 3.44Å; R545-L549 VanDerWaalsContact O-N 3.08Å; S547-L549 VanDerWaalsContact C-N 3.26Å; S547-L549 PolarHBondContact O-N 3.36Å; L549-Y553 PolarHBondContact O-N 3.46Å; L549-L622 HydrophobicContact CD2-CD1 4.33Å; L549-L622 HydrophobicContact CD2-CD2 4.1Å
550	T	94.1	Very high	93.5	Very high	47 Å²	47	57.3 Å²	57.3	29%	0.288	28%	0.284	S	S	.	.	H	α-helix	trans	-71.2	-44.5	178.2	-53.8	0	0	0	0	111.2	L546 S547 A552 Y553 E554	L546-T550 WeakPolarHBondContact O-CB 3.29Å; L546-T550 PolarHBondContact O-N 3.35Å; L546-T550 PolarHBondContact O-OG1 3.25Å; S547-T550 CarbonylContact O-C 3.52Å; S547-T550 WeakPolarHBondContact O-CA 3.47Å; S547-T550 WeakPolarHBondContact O-CB 3.37Å; S547-T550 PolarHBondContact O-N 3.49Å; T550-A552 VanDerWaalsContact C-N 3.32Å; T550-A552 PolarHBondContact O-N 3.18Å; T550-Y553 WeakPolarHBondContact O-CB 3.28Å; T550-Y553 PolarHBondContact O-N 2.96Å; T550-E554 PolarHBondContact O-N 2.9Å
551	D	93.1	Very high	93.6	Very high	83 Å²	83	56.1 Å²	56.1	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-60.8	-42.6	177.6	-56.3	-39.8	0	0	0	111	S547 Y553 L555	S547-D551 VanDerWaalsContact C-OD2 3.28Å; S547-D551 VanDerWaalsContact O-CG 3.23Å; S547-D551 PolarHBondContact O-N 3Å; S547-D551 PolarHBondContact OG-OD2 2.65Å; D551-Y553 PolarHBondContact O-N 3.09Å; D551-L555 PolarHBondContact O-N 3.13Å
552	A	92.9	Very high	93.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.3	-21.8	175.2	0	0	0	0	0	114	L479 I548 T550 W556 L617 L622	L479-A552 HydrophobicContact CD2-CB 4.32Å; I548-A552 VanDerWaalsContact O-CB 3.23Å; I548-A552 WeakPolarHBondContact O-CB 3.21Å; I548-A552 PolarHBondContact O-N 2.74Å; T550-A552 VanDerWaalsContact C-N 3.32Å; T550-A552 PolarHBondContact O-N 3.18Å; A552-W556 VanDerWaalsContact O-CB 3.24Å; A552-W556 WeakPolarHBondContact O-CB 3.31Å; A552-W556 PolarHBondContact O-N 3.38Å; A552-L617 HydrophobicContact CB-CD2 3.69Å; A552-L617 WeakPolarHBondContact O-CD2 3.27Å; A552-L622 HydrophobicContact CB-CB 4.45Å; A552-L622 HydrophobicContact CB-CD1 3.5Å; A552-L622 VanDerWaalsContact CB-CD1 3.5Å
553	Y	93.2	Very high	93.5	Very high	75 Å²	75	54.9 Å²	54.9	29%	0.294	28%	0.275	S	S	.	.	H	α-helix	trans	-78.7	-43.9	178.8	178.4	-102.6	0	0	0	112.1	L479 C480 I483 L549 T550 D551 W556 K557	L479-Y553 HydrophobicContact CD2-CD2 4.17Å; L479-Y553 HydrophobicContact CG-CD2 4.35Å; C480-Y553 WeakPolarHBondContact SG-CE2 3.46Å; I483-Y553 HydrophobicContact CD1-CG 4.24Å; L549-Y553 PolarHBondContact O-N 3.46Å; T550-Y553 WeakPolarHBondContact O-CB 3.28Å; T550-Y553 PolarHBondContact O-N 2.96Å; D551-Y553 PolarHBondContact O-N 3.09Å; Y553-W556 PolarHBondContact O-N 3.01Å; Y553-K557 PolarHBondContact O-N 3.29Å
554	E	94.2	Very high	93.5	Very high	95 Å²	95	53.4 Å²	53.4	44%	0.444	28%	0.277	S	S	.	.	H	α-helix	trans	-68.2	-39.2	175.8	-64.2	-54.7	140.9	0	0	111.5	T550 W556 K557 E558	T550-E554 PolarHBondContact O-N 2.9Å; E554-W556 PolarHBondContact O-N 3.48Å; E554-K557 WeakPolarHBondContact O-CB 3.46Å; E554-K557 PolarHBondContact O-N 3.32Å; E554-K557 IonicContact OE2-NZ 3.82Å; E554-K557 PolarHBondContact OE2-NZ 3.21Å; E554-E558 PolarHBondContact O-N 2.88Å
555	L	94.4	Very high	93.4	Very high	40 Å²	40	54.7 Å²	54.7	21%	0.209	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-42.6	171	-76.8	174.9	0	0	0	112.2	D551 K557 E558 F559 I613 L617	D551-L555 PolarHBondContact O-N 3.13Å; L555-K557 VanDerWaalsContact C-N 3.31Å; L555-K557 PolarHBondContact O-N 3.03Å; L555-E558 PolarHBondContact O-N 3Å; L555-F559 WeakPolarHBondContact O-CB 3.47Å; L555-F559 PolarHBondContact O-N 3.31Å; L555-I613 HydrophobicContact CB-CG2 4.06Å; L555-I613 HydrophobicContact CD2-CG1 4.5Å; L555-I613 HydrophobicContact CD2-CG2 4.23Å; L555-I613 VanDerWaalsContact O-CG2 3.3Å; L555-I613 WeakPolarHBondContact O-CG2 3.43Å; L555-L617 HydrophobicContact CB-CD1 4.18Å; L555-L617 HydrophobicContact CB-CD2 3.8Å; L555-L617 HydrophobicContact CB-CG 4.07Å; L555-L617 HydrophobicContact CD1-CD2 4.14Å; L555-L617 HydrophobicContact CD1-CG 4.5Å
556	W	93.7	Very high	93.3	Very high	16 Å²	16	52 Å²	52	6%	0.061	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-39.7	175.6	169.8	-99.6	0	0	0	112.1	A552 Y553 E554 F559 Q560 L617 L623 A626 I627 E630	A552-W556 VanDerWaalsContact O-CB 3.24Å; A552-W556 WeakPolarHBondContact O-CB 3.31Å; A552-W556 PolarHBondContact O-N 3.38Å; Y553-W556 PolarHBondContact O-N 3.01Å; E554-W556 PolarHBondContact O-N 3.48Å; W556-F559 HydrophobicContact CE3-CD1 4.05Å; W556-F559 HydrophobicContact CH2-CD1 4.43Å; W556-F559 HydrophobicContact CH2-CE1 4.34Å; W556-F559 AromaticContact CZ3-CD1 3.81Å; W556-F559 HydrophobicContact CZ3-CD1 3.81Å; W556-F559 AromaticContact CZ3-CE1 3.86Å; W556-F559 HydrophobicContact CZ3-CE1 3.86Å; W556-F559 PolarHBondContact O-N 2.93Å; W556-Q560 HydrophobicContact CD2-CG 4.3Å; W556-Q560 HydrophobicContact CH2-CG 4.34Å; W556-Q560 HydrophobicContact CZ2-CG 3.72Å; W556-Q560 WeakPolarHBondContact O-CG 3.41Å; W556-Q560 PolarHBondContact O-N 3.16Å; W556-L617 HydrophobicContact CB-CD1 4.3Å; W556-L623 HydrophobicContact CB-CD1 3.48Å; W556-L623 VanDerWaalsContact CB-CD1 3.48Å; W556-L623 HydrophobicContact CD2-CD1 3.74Å; W556-L623 HydrophobicContact CE3-CD1 3.86Å; W556-L623 HydrophobicContact CG-CD1 3.56Å; W556-A626 HydrophobicContact CH2-CB 3.82Å; W556-A626 HydrophobicContact CZ2-CB 4.47Å; W556-A626 HydrophobicContact CZ3-CB 4.09Å; W556-I627 HydrophobicContact CE3-CG1 3.88Å; W556-I627 HydrophobicContact CZ3-CG1 3.72Å; W556-E630 HydrophobicContact CH2-CG 4.28Å
557	K	93	Very high	93.1	Very high	82 Å²	82	54.7 Å²	54.7	36%	0.357	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-47.4	175.3	172.4	170.4	145.2	-89.5	0	111.9	Y553 E554 L555 F559 Q560 E561	Y553-K557 PolarHBondContact O-N 3.29Å; E554-K557 WeakPolarHBondContact O-CB 3.46Å; E554-K557 PolarHBondContact O-N 3.32Å; E554-K557 IonicContact OE2-NZ 3.82Å; E554-K557 PolarHBondContact OE2-NZ 3.21Å; L555-K557 VanDerWaalsContact C-N 3.31Å; L555-K557 PolarHBondContact O-N 3.03Å; K557-F559 VanDerWaalsContact C-N 3.31Å; K557-F559 PolarHBondContact O-N 3.24Å; K557-Q560 PolarHBondContact O-N 3.31Å; K557-Q560 VanDerWaalsContact O-N 3.13Å; K557-E561 VanDerWaalsContact CE-OE1 3.31Å; K557-E561 WeakPolarHBondContact CE-OE1 3.4Å; K557-E561 VanDerWaalsContact CG-OE1 3.31Å; K557-E561 WeakPolarHBondContact CG-OE1 3.22Å; K557-E561 WeakPolarHBondContact O-CG 3.38Å; K557-E561 PolarHBondContact O-N 3.01Å
558	E	94.6	Very high	92.9	Very high	62 Å²	62	56.7 Å²	56.7	29%	0.29	29%	0.29	S	S	.	.	H	α-helix	trans	-55.8	-45.3	174.8	-169.5	-169.4	168.9	0	0	111.3	E554 L555 Q560 E561 L562 R609 I613	E554-E558 PolarHBondContact O-N 2.88Å; L555-E558 PolarHBondContact O-N 3Å; E558-Q560 PolarHBondContact O-N 3.07Å; E558-E561 PolarHBondContact O-N 3.47Å; E558-L562 HydrophobicContact CG-CD1 4.02Å; E558-L562 WeakPolarHBondContact O-CG 3.17Å; E558-L562 PolarHBondContact O-N 3.08Å; E558-R609 VanDerWaalsContact CD-NH2 3.31Å; E558-R609 IonicContact OE1-CZ 2.81Å; E558-R609 VanDerWaalsContact OE1-CZ 3.28Å; E558-R609 IonicContact OE1-NE 3.22Å; E558-R609 PolarHBondContact OE1-NE 3.37Å; E558-R609 IonicContact OE1-NH2 3.53Å; E558-R609 PolarHBondContact OE1-NH2 3.35Å; E558-R609 IonicContact OE2-CZ 3.73Å; E558-R609 IonicContact OE2-NE 2.63Å; E558-R609 IonicContact OE2-NH2 3.68Å; E558-R609 PolarHBondContact OE2-NH2 2.93Å; E558-I613 HydrophobicContact CB-CD1 4.12Å; E558-I613 VanDerWaalsContact CD-CD1 3.45Å; E558-I613 HydrophobicContact CG-CD1 3.72Å
559	F	94.3	Very high	92.7	Very high	1 Å²	1	55 Å²	55	0%	0.004	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-43.8	175.3	172	-91.4	0	0	0	112.7	L555 W556 K557 V563 I610 I613 A614 E630 L631	L555-F559 WeakPolarHBondContact O-CB 3.47Å; L555-F559 PolarHBondContact O-N 3.31Å; W556-F559 HydrophobicContact CE3-CD1 4.05Å; W556-F559 HydrophobicContact CH2-CD1 4.43Å; W556-F559 HydrophobicContact CH2-CE1 4.34Å; W556-F559 AromaticContact CZ3-CD1 3.81Å; W556-F559 HydrophobicContact CZ3-CD1 3.81Å; W556-F559 AromaticContact CZ3-CE1 3.86Å; W556-F559 HydrophobicContact CZ3-CE1 3.86Å; W556-F559 PolarHBondContact O-N 2.93Å; K557-F559 VanDerWaalsContact C-N 3.31Å; K557-F559 PolarHBondContact O-N 3.24Å; F559-V563 HydrophobicContact CD1-CG2 4.46Å; F559-V563 HydrophobicContact CD2-CG2 4.29Å; F559-V563 HydrophobicContact CE1-CG2 4.18Å; F559-V563 HydrophobicContact CE2-CG2 4.02Å; F559-V563 HydrophobicContact CZ-CG2 3.95Å; F559-V563 WeakPolarHBondContact O-CB 3.42Å; F559-V563 WeakPolarHBondContact O-CG2 3.4Å; F559-V563 PolarHBondContact O-N 2.95Å; F559-I610 HydrophobicContact CD2-CG2 4.04Å; F559-I610 HydrophobicContact CE2-CG2 3.69Å; F559-I613 HydrophobicContact CB-CB 4.41Å; F559-I613 HydrophobicContact CB-CG2 3.8Å; F559-A614 HydrophobicContact CD2-CB 4.46Å; F559-A614 HydrophobicContact CE2-CB 4.07Å; F559-E630 HydrophobicContact CE1-CB 3.83Å; F559-E630 HydrophobicContact CZ-CB 4.16Å; F559-L631 HydrophobicContact CE2-CD1 4.32Å; F559-L631 HydrophobicContact CZ-CB 4.35Å
560	Q	93.4	Very high	92.5	Very high	102 Å²	102	55.1 Å²	55.1	48%	0.477	29%	0.286	S	S	.	.	H	α-helix	trans	-65.8	-39	177.8	-68.3	-155.5	-95.2	0	0	112.6	W556 K557 E558 A564	W556-Q560 HydrophobicContact CD2-CG 4.3Å; W556-Q560 HydrophobicContact CH2-CG 4.34Å; W556-Q560 HydrophobicContact CZ2-CG 3.72Å; W556-Q560 WeakPolarHBondContact O-CG 3.41Å; W556-Q560 PolarHBondContact O-N 3.16Å; K557-Q560 PolarHBondContact O-N 3.31Å; K557-Q560 VanDerWaalsContact O-N 3.13Å; E558-Q560 PolarHBondContact O-N 3.07Å; Q560-A564 PolarHBondContact O-N 3.33Å; Q560-A564 VanDerWaalsContact O-N 3.16Å
561	E	93.1	Very high	92.3	Very high	111 Å²	111	56.2 Å²	56.2	52%	0.519	29%	0.29	S	S	.	.	H	α-helix	trans	-67.8	-45.1	179.3	-71.7	170.4	-170.9	0	0	111.2	K557 E558 A564 V565	K557-E561 VanDerWaalsContact CE-OE1 3.31Å; K557-E561 WeakPolarHBondContact CE-OE1 3.4Å; K557-E561 VanDerWaalsContact CG-OE1 3.31Å; K557-E561 WeakPolarHBondContact CG-OE1 3.22Å; K557-E561 WeakPolarHBondContact O-CG 3.38Å; K557-E561 PolarHBondContact O-N 3.01Å; E558-E561 PolarHBondContact O-N 3.47Å; E561-A564 WeakPolarHBondContact O-CB 3.34Å; E561-A564 PolarHBondContact O-N 3.2Å; E561-V565 PolarHBondContact O-N 3.02Å
562	L	93.7	Very high	92.1	Very high	45 Å²	45	58.6 Å²	58.6	24%	0.236	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-42.5	176.8	-69.3	169.2	0	0	0	113.1	E558 A564 V565 E566 R609 I610 I613	E558-L562 HydrophobicContact CG-CD1 4.02Å; E558-L562 WeakPolarHBondContact O-CG 3.17Å; E558-L562 PolarHBondContact O-N 3.08Å; L562-A564 PolarHBondContact O-N 3.39Å; L562-V565 PolarHBondContact O-N 2.88Å; L562-E566 PolarHBondContact O-N 2.79Å; L562-R609 HydrophobicContact CD1-CB 4.02Å; L562-R609 HydrophobicContact CD1-CG 3.44Å; L562-R609 VanDerWaalsContact CD1-CG 3.44Å; L562-I610 HydrophobicContact CB-CD1 4.14Å; L562-I610 HydrophobicContact CB-CG1 3.69Å; L562-I613 HydrophobicContact CD1-CD1 3.7Å
563	V	92.6	Very high	91.9	Very high	7 Å²	7	58.8 Å²	58.8	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-63.1	-29.4	176.1	168.7	0	0	0	0	111.6	F559 R567 I610	F559-V563 HydrophobicContact CD1-CG2 4.46Å; F559-V563 HydrophobicContact CD2-CG2 4.29Å; F559-V563 HydrophobicContact CE1-CG2 4.18Å; F559-V563 HydrophobicContact CE2-CG2 4.02Å; F559-V563 HydrophobicContact CZ-CG2 3.95Å; F559-V563 WeakPolarHBondContact O-CB 3.42Å; F559-V563 WeakPolarHBondContact O-CG2 3.4Å; F559-V563 PolarHBondContact O-N 2.95Å; V563-R567 VanDerWaalsContact O-CG 3.26Å; V563-R567 WeakPolarHBondContact O-CG 3.35Å; V563-R567 PolarHBondContact O-N 2.82Å; V563-I610 HydrophobicContact CG2-CD1 3.84Å; V563-I610 HydrophobicContact CG2-CG1 4.06Å; V563-I610 HydrophobicContact CG2-CG2 3.8Å
564	A	92.1	Very high	91.8	Very high	57 Å²	57	57.7 Å²	57.7	47%	0.471	29%	0.292	S	S	.	.	H	α-helix	trans	-70	-44.4	173.7	0	0	0	0	0	112.1	Q560 E561 L562 R567 V568	Q560-A564 PolarHBondContact O-N 3.33Å; Q560-A564 VanDerWaalsContact O-N 3.16Å; E561-A564 WeakPolarHBondContact O-CB 3.34Å; E561-A564 PolarHBondContact O-N 3.2Å; L562-A564 PolarHBondContact O-N 3.39Å; A564-R567 PolarHBondContact O-N 2.82Å; A564-V568 PolarHBondContact O-N 3.21Å
565	V	91.1	Very high	91.6	Very high	95 Å²	95	59.3 Å²	59.3	58%	0.576	30%	0.299	S	S	*	.	H	α-helix	trans	-62.4	-47.7	177.4	174.5	0	0	0	0	111.4	E561 L562 R567 V568 S569	E561-V565 PolarHBondContact O-N 3.02Å; L562-V565 PolarHBondContact O-N 2.88Å; V565-R567 VanDerWaalsContact C-N 3.31Å; V565-R567 PolarHBondContact O-N 2.97Å; V565-V568 PolarHBondContact O-N 2.96Å; V565-S569 PolarHBondContact O-N 3.21Å; V565-S569 PolarHBondContact O-OG 3.01Å
566	E	90.7	Very high	91.2	Very high	6 Å²	6	58.7 Å²	58.7	3%	0.028	30%	0.297	C	S	.	.	H	α-helix	trans	-65.7	-30.2	-179.3	-83.1	-92	141.7	0	0	113.4	L562 S569 L570 G606 H607 I610 Y634 R638	L562-E566 PolarHBondContact O-N 2.79Å; E566-S569 PolarHBondContact O-N 3.39Å; E566-L570 WeakPolarHBondContact O-CG 3.39Å; E566-L570 PolarHBondContact O-N 3.22Å; E566-L570 VanDerWaalsContact O-N 3.09Å; E566-G606 WeakPolarHBondContact OE1-CA 3.44Å; E566-G606 PolarHBondContact OE1-N 3.44Å; E566-H607 PolarHBondContact OE1-N 2.71Å; E566-I610 HydrophobicContact CB-CD1 4.04Å; E566-I610 HydrophobicContact CG-CD1 3.75Å; E566-Y634 HydrophobicContact CB-CE2 3.7Å; E566-Y634 HydrophobicContact CG-CE2 4.41Å; E566-Y634 PolarHBondContact OE2-OH 3.19Å; E566-R638 IonicContact OE2-CZ 2.63Å; E566-R638 IonicContact OE2-NH1 3Å; E566-R638 PolarHBondContact OE2-NH1 2.88Å
567	R	90.5	Very high	90.9	Very high	79 Å²	79	59.5 Å²	59.5	30%	0.298	30%	0.303	S	S	.	.	H	α-helix	trans	-64	-42.9	172.7	-77.1	175.3	-165.5	-170.2	9	111.9	V563 A564 V565 S569 L570 D571 E630	V563-R567 VanDerWaalsContact O-CG 3.26Å; V563-R567 WeakPolarHBondContact O-CG 3.35Å; V563-R567 PolarHBondContact O-N 2.82Å; A564-R567 PolarHBondContact O-N 2.82Å; V565-R567 VanDerWaalsContact C-N 3.31Å; V565-R567 PolarHBondContact O-N 2.97Å; R567-S569 VanDerWaalsContact C-N 3.28Å; R567-S569 PolarHBondContact O-N 3.38Å; R567-L570 PolarHBondContact O-N 3.33Å; R567-L570 VanDerWaalsContact O-N 3.14Å; R567-D571 VanDerWaalsContact O-CG 3.24Å; R567-D571 PolarHBondContact O-N 2.83Å; R567-E630 IonicContact CZ-OE2 2.73Å; R567-E630 IonicContact NH1-OE2 2.7Å; R567-E630 IonicContact NH2-OE2 3.18Å; R567-E630 PolarHBondContact NH2-OE2 3.28Å
568	V	90.4	Very high	90.6	Very high	103 Å²	103	61.7 Å²	61.7	62%	0.624	31%	0.312	S	S	*	.	H	α-helix	trans	-61.2	-37.8	176.6	177.5	0	0	0	0	111.5	A564 V565 R572	A564-V568 PolarHBondContact O-N 3.21Å; V565-V568 PolarHBondContact O-N 2.96Å; V568-R572 PolarHBondContact O-N 3.08Å; V568-R572 VanDerWaalsContact O-N 3.1Å
569	S	87.6	Confident	90.1	Very high	46 Å²	46	64.7 Å²	64.7	32%	0.322	33%	0.326	S	S	.	.	H	α-helix	trans	-63.9	-42	174.2	-59.1	0	0	0	0	112.8	V565 E566 R567 L573	V565-S569 PolarHBondContact O-N 3.21Å; V565-S569 PolarHBondContact O-OG 3.01Å; E566-S569 PolarHBondContact O-N 3.39Å; R567-S569 VanDerWaalsContact C-N 3.28Å; R567-S569 PolarHBondContact O-N 3.38Å; S569-L573 PolarHBondContact O-N 2.92Å
570	L	90.3	Very high	89.3	Confident	5 Å²	5	70.1 Å²	70.1	3%	0.026	36%	0.361	C	S	.	.	H	α-helix	trans	-68.9	-40.4	177.1	-69.2	169	0	0	0	112.1	E566 R567 R572 L573 E574 Y634 R637 R638 V641	E566-L570 WeakPolarHBondContact O-CG 3.39Å; E566-L570 PolarHBondContact O-N 3.22Å; E566-L570 VanDerWaalsContact O-N 3.09Å; R567-L570 PolarHBondContact O-N 3.33Å; R567-L570 VanDerWaalsContact O-N 3.14Å; L570-R572 VanDerWaalsContact C-N 3.31Å; L570-R572 PolarHBondContact O-N 2.89Å; L570-L573 PolarHBondContact O-N 3.05Å; L570-E574 PolarHBondContact O-N 2.88Å; L570-Y634 HydrophobicContact CD1-CD2 4.43Å; L570-Y634 HydrophobicContact CD1-CE2 4.12Å; L570-R637 HydrophobicContact CD1-CG 4.35Å; L570-R638 HydrophobicContact CD1-CB 3.9Å; L570-R638 HydrophobicContact CD1-CG 4.38Å; L570-R638 HydrophobicContact CD2-CB 4.39Å; L570-R638 HydrophobicContact CD2-CG 4.14Å; L570-V641 HydrophobicContact CD2-CB 4.35Å; L570-V641 HydrophobicContact CD2-CG1 4.44Å
571	D	89.9	Confident	88.5	Confident	70 Å²	70	68.5 Å²	68.5	37%	0.374	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-36.9	178.2	-65.6	-27.7	0	0	0	111	R567 E574 E575 R637	R567-D571 VanDerWaalsContact O-CG 3.24Å; R567-D571 PolarHBondContact O-N 2.83Å; D571-E574 PolarHBondContact O-N 3.24Å; D571-E575 PolarHBondContact O-N 2.98Å; D571-R637 IonicContact OD1-CZ 3.62Å; D571-R637 IonicContact OD1-NE 2.7Å; D571-R637 PolarHBondContact OD1-NE 2.91Å; D571-R637 IonicContact OD1-NH2 3.12Å; D571-R637 PolarHBondContact OD1-NH2 3.1Å
572	R	88.6	Confident	87.7	Confident	134 Å²	134	70.5 Å²	70.5	51%	0.506	36%	0.362	S	S	.	.	H	α-helix	trans	-62.7	-44.1	171.3	-168.5	-172.8	73.6	157.8	3	112.6	V568 L570 E574 E575 T576	V568-R572 PolarHBondContact O-N 3.08Å; V568-R572 VanDerWaalsContact O-N 3.1Å; L570-R572 VanDerWaalsContact C-N 3.31Å; L570-R572 PolarHBondContact O-N 2.89Å; R572-E574 VanDerWaalsContact C-N 3.29Å; R572-E574 PolarHBondContact O-N 3.49Å; R572-E575 WeakPolarHBondContact O-CB 3.29Å; R572-E575 PolarHBondContact O-N 3.39Å; R572-E575 VanDerWaalsContact O-N 3.15Å; R572-T576 PolarHBondContact O-N 2.65Å; R572-T576 VanDerWaalsContact O-N 3.16Å; R572-T576 PolarHBondContact O-OG1 3.47Å
573	L	88.9	Confident	86.6	Confident	4 Å²	4	72.6 Å²	72.6	2%	0.021	38%	0.38	C	S	.	.	H	α-helix	trans	-65	-35.7	177.2	-179.1	60.5	0	0	0	111.4	S569 L570 E575 T576 L577 F597 Q600 M601 V641 L642 A645	S569-L573 PolarHBondContact O-N 2.92Å; L570-L573 PolarHBondContact O-N 3.05Å; L573-E575 VanDerWaalsContact C-N 3.33Å; L573-T576 PolarHBondContact O-N 3.37Å; L573-L577 WeakPolarHBondContact O-CG 3.5Å; L573-L577 PolarHBondContact O-N 3.26Å; L573-F597 HydrophobicContact CD1-CE2 4.19Å; L573-F597 HydrophobicContact CD1-CZ 4.12Å; L573-Q600 HydrophobicContact CD1-CB 4.02Å; L573-M601 HydrophobicContact CD1-CG 4.22Å; L573-M601 HydrophobicContact CD2-CG 4.12Å; L573-V641 HydrophobicContact CB-CG1 4.02Å; L573-V641 HydrophobicContact CD2-CG1 3.93Å; L573-V641 HydrophobicContact CG-CG1 3.88Å; L573-L642 HydrophobicContact CD2-CD2 3.86Å; L573-A645 HydrophobicContact CD2-CB 4.36Å
574	E	90.4	Very high	85.9	Confident	52 Å²	52	72.9 Å²	72.9	24%	0.243	38%	0.383	C	S	.	.	H	α-helix	trans	-70.3	-25.2	173.2	-157.7	-156	-141.5	0	0	112.8	L570 D571 R572 K578 R637 V641	L570-E574 PolarHBondContact O-N 2.88Å; D571-E574 PolarHBondContact O-N 3.24Å; R572-E574 VanDerWaalsContact C-N 3.29Å; R572-E574 PolarHBondContact O-N 3.49Å; E574-K578 WeakPolarHBondContact O-CD 3.3Å; E574-K578 VanDerWaalsContact O-CE 3.27Å; E574-K578 WeakPolarHBondContact O-CE 3.33Å; E574-K578 VanDerWaalsContact O-CG 3.23Å; E574-K578 WeakPolarHBondContact O-CG 3.48Å; E574-K578 PolarHBondContact O-N 3.39Å; E574-K578 PolarHBondContact O-NZ 3.41Å; E574-K578 WeakPolarHBondContact OE2-CE 3.26Å; E574-K578 IonicContact OE2-NZ 3.74Å; E574-K578 PolarHBondContact OE2-NZ 3.48Å; E574-R637 VanDerWaalsContact CD-NH1 3.33Å; E574-R637 IonicContact OE1-CZ 3.78Å; E574-R637 IonicContact OE1-NH1 2.74Å; E574-R637 PolarHBondContact OE1-NH1 3.2Å; E574-R637 IonicContact OE1-NH2 3.64Å; E574-R637 PolarHBondContact OE1-NH2 3.14Å; E574-R637 IonicContact OE2-CZ 2.82Å; E574-R637 IonicContact OE2-NH1 2.63Å; E574-R637 IonicContact OE2-NH2 2.75Å; E574-R637 PolarHBondContact OE2-NH2 2.9Å; E574-V641 HydrophobicContact CB-CG1 4.15Å; E574-V641 HydrophobicContact CB-CG2 4.03Å; E574-V641 HydrophobicContact CG-CG2 4.15Å
575	E	89.5	Confident	85	Confident	128 Å²	128	71.3 Å²	71.3	60%	0.598	37%	0.37	S	S	*	.	H	α-helix	trans	-68.6	-50.6	169.4	-74.2	-178.5	151.9	0	0	110.8	D571 R572 L573 L577 K578 E579	D571-E575 PolarHBondContact O-N 2.98Å; R572-E575 WeakPolarHBondContact O-CB 3.29Å; R572-E575 PolarHBondContact O-N 3.39Å; R572-E575 VanDerWaalsContact O-N 3.15Å; L573-E575 VanDerWaalsContact C-N 3.33Å; E575-L577 PolarHBondContact O-N 3.49Å; E575-K578 WeakPolarHBondContact O-CB 3.33Å; E575-K578 PolarHBondContact O-N 3.3Å; E575-E579 PolarHBondContact O-N 3.28Å
576	T	86.6	Confident	84.5	Confident	27 Å²	27	67.8 Å²	67.8	17%	0.166	35%	0.348	C	S	.	.	H	α-helix	trans	-59.4	-32.9	176.2	-52.8	0	0	0	0	112.9	R572 L573 K578 E579 F597 Q600 R648	R572-T576 PolarHBondContact O-N 2.65Å; R572-T576 VanDerWaalsContact O-N 3.16Å; R572-T576 PolarHBondContact O-OG1 3.47Å; L573-T576 PolarHBondContact O-N 3.37Å; T576-K578 VanDerWaalsContact C-N 3.33Å; T576-K578 PolarHBondContact O-N 3.14Å; T576-E579 PolarHBondContact O-N 3.25Å; T576-F597 HydrophobicContact CG2-CD2 4.1Å; T576-F597 HydrophobicContact CG2-CE2 4.2Å; T576-Q600 PolarHBondContact OG1-OE1 3.37Å; T576-R648 PolarHBondContact O-NH1 3.42Å
577	L	87.6	Confident	84.3	Confident	34 Å²	34	68.3 Å²	68.3	18%	0.178	35%	0.353	C	S	.	.	H	α-helix	trans	-64.9	-32.8	173.3	-86.4	169	0	0	0	113.8	L573 E575 F597 V641 P644 A645 R648	L573-L577 WeakPolarHBondContact O-CG 3.5Å; L573-L577 PolarHBondContact O-N 3.26Å; E575-L577 PolarHBondContact O-N 3.49Å; L577-F597 HydrophobicContact CD2-CE2 4.32Å; L577-F597 HydrophobicContact CD2-CZ 3.93Å; L577-F597 HydrophobicContact CG-CE2 4.46Å; L577-F597 HydrophobicContact CG-CZ 4.28Å; L577-V641 HydrophobicContact CD1-CG1 4.13Å; L577-V641 WeakPolarHBondContact CD1-O 3.46Å; L577-P644 HydrophobicContact CD1-CB 4.11Å; L577-P644 HydrophobicContact CD2-CB 4.1Å; L577-A645 HydrophobicContact CD1-CB 4.25Å; L577-A645 HydrophobicContact CD2-CB 4.42Å; L577-R648 HydrophobicContact CD2-CB 4.37Å; L577-R648 PolarHBondContact O-NH1 3.09Å; L577-R648 VanDerWaalsContact O-NH1 3.07Å
578	K	87.5	Confident	84.1	Confident	128 Å²	128	71.7 Å²	71.7	56%	0.557	37%	0.372	S	S	*	.	H	α-helix	trans	-79.4	-22.6	178.6	-65.3	163.3	-162.4	120.6	0	112.4	E574 E575 T576	E574-K578 WeakPolarHBondContact O-CD 3.3Å; E574-K578 VanDerWaalsContact O-CE 3.27Å; E574-K578 WeakPolarHBondContact O-CE 3.33Å; E574-K578 VanDerWaalsContact O-CG 3.23Å; E574-K578 WeakPolarHBondContact O-CG 3.48Å; E574-K578 PolarHBondContact O-N 3.39Å; E574-K578 PolarHBondContact O-NZ 3.41Å; E574-K578 WeakPolarHBondContact OE2-CE 3.26Å; E574-K578 IonicContact OE2-NZ 3.74Å; E574-K578 PolarHBondContact OE2-NZ 3.48Å; E575-K578 WeakPolarHBondContact O-CB 3.33Å; E575-K578 PolarHBondContact O-N 3.3Å; T576-K578 VanDerWaalsContact C-N 3.33Å; T576-K578 PolarHBondContact O-N 3.14Å
579	E	83.4	Confident	83.9	Confident	125 Å²	125	70.9 Å²	70.9	58%	0.584	36%	0.362	S	S	*	.	S	Bend	trans	-68.2	130.7	173.8	-64	-165.5	154.1	0	0	110.2	E575 T576 R648	E575-E579 PolarHBondContact O-N 3.28Å; T576-E579 PolarHBondContact O-N 3.25Å; E579-R648 PolarHBondContact O-NH1 3.04Å; E579-R648 PolarHBondContact O-NH2 3.29Å
580	P	77.9	Confident	83.8	Confident	114 Å²	114	69.6 Å²	69.6	74%	0.74	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-60.6	147.4	176.9	27.4	-34.7	0	0	0	110.4
581	M	76.7	Confident	83.7	Confident	69 Å²	69	72.1 Å²	72.1	34%	0.34	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-61.7	139.4	176	-59.7	176.8	76.3	0	0	109.2	S583 R648 F651 L652	M581-S583 PolarHBondContact O-N 2.74Å; M581-R648 HydrophobicContact CE-CG 4.12Å; M581-R648 HydrophobicContact SD-CG 4.31Å; M581-F651 HydrophobicContact CE-CD1 3.61Å; M581-F651 HydrophobicContact CE-CE1 4.13Å; M581-F651 HydrophobicContact SD-CD1 4.06Å; M581-F651 HydrophobicContact SD-CE1 4.27Å; M581-L652 HydrophobicContact CE-CD1 4.26Å; M581-L652 HydrophobicContact CE-CD2 3.38Å; M581-L652 HydrophobicContact CE-CG 3.5Å
582	K	74.7	Confident	83.7	Confident	153 Å²	153	75.7 Å²	75.7	67%	0.665	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-70.8	134.1	179.1	-52.6	170.4	-174	165.9	0	106.9	A584 Q593	K582-A584 PolarHBondContact O-N 2.94Å; K582-Q593 HydrophobicContact CD-CG 4.38Å; K582-Q593 PolarHBondContact O-NE2 3.42Å; K582-Q593 PolarHBondContact O-OE1 2.8Å
583	S	72.4	Confident	83.6	Confident	89 Å²	89	70.5 Å²	70.5	62%	0.622	37%	0.365	S	S	*	.			trans	-67.1	99.1	-178.9	178.2	0	0	0	0	110.2	M581	M581-S583 PolarHBondContact O-N 2.74Å
584	A	76.4	Confident	83.7	Confident	12 Å²	12	71.7 Å²	71.7	10%	0.099	37%	0.371	C	S	.	.			trans	-81.3	148.2	169.3	0	0	0	0	0	111	K582 E589 F590	K582-A584 PolarHBondContact O-N 2.94Å; A584-E589 WeakPolarHBondContact CA-OE2 3.48Å; A584-E589 HydrophobicContact CB-CB 3.49Å; A584-E589 VanDerWaalsContact CB-CB 3.49Å; A584-F590 HydrophobicContact CB-CB 4.45Å; A584-F590 HydrophobicContact CB-CD1 3.65Å; A584-F590 HydrophobicContact CB-CD2 3.68Å; A584-F590 HydrophobicContact CB-CE1 3.69Å; A584-F590 HydrophobicContact CB-CE2 3.7Å; A584-F590 HydrophobicContact CB-CG 3.64Å; A584-F590 HydrophobicContact CB-CZ 3.7Å
585	A	74.7	Confident	83.6	Confident	25 Å²	25	74.1 Å²	74.1	21%	0.207	39%	0.385	C	S	.	.			trans	-121.4	-9.8	-179.8	0	0	0	0	0	113.8	E589	A585-E589 PolarHBondContact N-OE2 3.15Å
586	D	80.4	Confident	83.4	Confident	21 Å²	21	71.9 Å²	71.9	11%	0.112	38%	0.375	C	S	.	.	S	Bend	trans	-150.8	173.6	178.1	48.7	49.9	0	0	0	111	E588 E589 F590 E663 R732	D586-E588 VanDerWaalsContact C-N 3.27Å; D586-E588 PolarHBondContact O-N 3.38Å; D586-E589 PolarHBondContact O-N 3.34Å; D586-E589 PolarHBondContact OD1-N 3.09Å; D586-F590 WeakPolarHBondContact O-CD2 3.5Å; D586-E663 WeakPolarHBondContact CB-OE1 3.42Å; D586-R732 IonicContact OD2-CZ 2.69Å; D586-R732 IonicContact OD2-NH1 3.28Å; D586-R732 PolarHBondContact OD2-NH1 3.4Å; D586-R732 IonicContact OD2-NH2 3.77Å; D586-R732 PolarHBondContact OD2-NH2 3.27Å
587	A	85.7	Confident	83.4	Confident	16 Å²	16	71 Å²	71	13%	0.132	37%	0.369	C	S	.	.	H	α-helix	trans	-67.9	-22.8	-170.6	0	0	0	0	0	114.2	S591 A659 Q660	A587-S591 PolarHBondContact O-N 3.26Å; A587-S591 PolarHBondContact O-OG 3.49Å; A587-A659 HydrophobicContact CB-CB 4.03Å; A587-Q660 HydrophobicContact CB-CB 4.22Å
588	E	86.7	Confident	83.4	Confident	150 Å²	150	72.7 Å²	72.7	70%	0.701	38%	0.376	S	S	*	.	H	α-helix	trans	-71.6	-49	178.5	-169.1	166.8	-162.1	0	0	110.5	D586 F590 S591 E592	D586-E588 VanDerWaalsContact C-N 3.27Å; D586-E588 PolarHBondContact O-N 3.38Å; E588-F590 VanDerWaalsContact C-N 3.25Å; E588-F590 PolarHBondContact O-N 3.42Å; E588-S591 PolarHBondContact O-N 2.85Å; E588-E592 PolarHBondContact O-N 2.73Å
589	E	86	Confident	83.3	Confident	86 Å²	86	73.3 Å²	73.3	40%	0.402	38%	0.375	S	S	.	.	H	α-helix	trans	-64.4	-22.7	177.9	-70.1	-177.1	150.7	0	0	114.2	A584 A585 D586 Q593	A584-E589 WeakPolarHBondContact CA-OE2 3.48Å; A584-E589 HydrophobicContact CB-CB 3.49Å; A584-E589 VanDerWaalsContact CB-CB 3.49Å; A585-E589 PolarHBondContact N-OE2 3.15Å; D586-E589 PolarHBondContact O-N 3.34Å; D586-E589 PolarHBondContact OD1-N 3.09Å; E589-Q593 WeakPolarHBondContact O-CG 3.35Å; E589-Q593 PolarHBondContact O-NE2 3.46Å
590	F	85.8	Confident	83.3	Confident	19 Å²	19	68.7 Å²	68.7	8%	0.083	35%	0.353	C	S	.	.	H	α-helix	trans	-78.4	-37.2	169.6	-75.4	-70	0	0	0	112.4	A584 D586 E588 Q593 L594 D655 A656 A659	A584-F590 HydrophobicContact CB-CB 4.45Å; A584-F590 HydrophobicContact CB-CD1 3.65Å; A584-F590 HydrophobicContact CB-CD2 3.68Å; A584-F590 HydrophobicContact CB-CE1 3.69Å; A584-F590 HydrophobicContact CB-CE2 3.7Å; A584-F590 HydrophobicContact CB-CG 3.64Å; A584-F590 HydrophobicContact CB-CZ 3.7Å; D586-F590 WeakPolarHBondContact O-CD2 3.5Å; E588-F590 VanDerWaalsContact C-N 3.25Å; E588-F590 PolarHBondContact O-N 3.42Å; F590-Q593 PolarHBondContact O-N 3.21Å; F590-L594 PolarHBondContact O-N 3.01Å; F590-D655 HydrophobicContact CD1-CB 3.63Å; F590-D655 HydrophobicContact CD2-CB 4.39Å; F590-D655 HydrophobicContact CE1-CB 3.36Å; F590-D655 HydrophobicContact CE2-CB 4.18Å; F590-D655 HydrophobicContact CG-CB 4.15Å; F590-D655 HydrophobicContact CZ-CB 3.68Å; F590-A656 HydrophobicContact CB-CB 3.76Å; F590-A659 HydrophobicContact CD2-CB 4.19Å; F590-A659 HydrophobicContact CE2-CB 4.25Å
591	S	88.8	Confident	83.5	Confident	58 Å²	58	64.8 Å²	64.8	41%	0.406	33%	0.325	S	S	.	.	H	α-helix	trans	-69.6	-44.1	-175	-59.5	0	0	0	0	112	A587 E588 Q593 L594 D595	A587-S591 PolarHBondContact O-N 3.26Å; A587-S591 PolarHBondContact O-OG 3.49Å; E588-S591 PolarHBondContact O-N 2.85Å; S591-Q593 PolarHBondContact O-N 3.37Å; S591-Q593 VanDerWaalsContact O-N 3.16Å; S591-L594 WeakPolarHBondContact O-CB 3.41Å; S591-L594 PolarHBondContact O-N 3.14Å; S591-D595 PolarHBondContact O-N 2.83Å
592	E	88.5	Confident	83.5	Confident	146 Å²	146	69.3 Å²	69.3	68%	0.682	35%	0.345	S	S	*	.	H	α-helix	trans	-58	-30.5	175.4	-67.8	-162.6	147.1	0	0	113.2	E588 E596	E588-E592 PolarHBondContact O-N 2.73Å; E592-E596 PolarHBondContact O-N 2.86Å
593	Q	87.5	Confident	83.2	Confident	25 Å²	25	64.2 Å²	64.2	12%	0.117	34%	0.336	C	S	.	.	H	α-helix	trans	-75.5	-26.5	179.7	-71.1	-174.4	79.6	0	0	113	K582 E589 F590 S591 F597 L652	K582-Q593 HydrophobicContact CD-CG 4.38Å; K582-Q593 PolarHBondContact O-NE2 3.42Å; K582-Q593 PolarHBondContact O-OE1 2.8Å; E589-Q593 WeakPolarHBondContact O-CG 3.35Å; E589-Q593 PolarHBondContact O-NE2 3.46Å; F590-Q593 PolarHBondContact O-N 3.21Å; S591-Q593 PolarHBondContact O-N 3.37Å; S591-Q593 VanDerWaalsContact O-N 3.16Å; Q593-F597 WeakPolarHBondContact O-CB 3.31Å; Q593-F597 PolarHBondContact O-N 3.44Å; Q593-L652 HydrophobicContact CB-CD1 4.31Å; Q593-L652 HydrophobicContact CB-CD2 3.76Å
594	L	90	Very high	82.8	Confident	28 Å²	28	63.4 Å²	63.4	15%	0.147	34%	0.342	C	S	.	.	H	α-helix	trans	-71.7	-52.8	176.1	-176.6	61.5	0	0	0	110.4	F590 S591 E596 F597 E598 Q649 L652 E653	F590-L594 PolarHBondContact O-N 3.01Å; S591-L594 WeakPolarHBondContact O-CB 3.41Å; S591-L594 PolarHBondContact O-N 3.14Å; L594-E596 VanDerWaalsContact C-N 3.3Å; L594-E596 PolarHBondContact O-N 3.46Å; L594-F597 PolarHBondContact O-N 2.88Å; L594-E598 HydrophobicContact CD1-CG 4.15Å; L594-E598 HydrophobicContact CG-CG 4.42Å; L594-E598 PolarHBondContact O-N 2.72Å; L594-Q649 HydrophobicContact CD1-CG 3.75Å; L594-L652 HydrophobicContact CB-CB 4.32Å; L594-L652 HydrophobicContact CD1-CB 4.05Å; L594-E653 HydrophobicContact CD1-CG 4.21Å; L594-E653 HydrophobicContact CD2-CG 3.92Å
595	D	88	Confident	82.6	Confident	104 Å²	104	65.5 Å²	65.5	56%	0.556	37%	0.365	S	S	*	.	H	α-helix	trans	-56.8	-38.2	-178.8	-80	14.4	0	0	0	113.7	S591 R599	S591-D595 PolarHBondContact O-N 2.83Å; D595-R599 PolarHBondContact O-NH2 3.46Å
596	E	86.2	Confident	83.3	Confident	81 Å²	81	65 Å²	65	38%	0.379	36%	0.362	S	S	.	.	H	α-helix	trans	-69.5	-37.7	175	179.8	54.8	-138.6	0	0	111.7	E592 L594 R599 Q600	E592-E596 PolarHBondContact O-N 2.86Å; L594-E596 VanDerWaalsContact C-N 3.3Å; L594-E596 PolarHBondContact O-N 3.46Å; E596-R599 IonicContact OE1-NH1 3.63Å; E596-R599 IonicContact OE2-CZ 3.41Å; E596-R599 IonicContact OE2-NH1 2.69Å; E596-R599 PolarHBondContact OE2-NH1 3.17Å; E596-R599 IonicContact OE2-NH2 3.68Å; E596-Q600 WeakPolarHBondContact O-CG 3.47Å; E596-Q600 PolarHBondContact OE1-NE2 3.08Å
597	F	86.7	Confident	83.7	Confident	7 Å²	7	66.8 Å²	66.8	3%	0.031	37%	0.37	C	S	.	.	H	α-helix	trans	-74.7	-42.2	-176	-167.3	-97.4	0	0	0	112.5	L573 T576 L577 Q593 L594 R599 Q600 M601 A645 R648 L652	L573-F597 HydrophobicContact CD1-CE2 4.19Å; L573-F597 HydrophobicContact CD1-CZ 4.12Å; T576-F597 HydrophobicContact CG2-CD2 4.1Å; T576-F597 HydrophobicContact CG2-CE2 4.2Å; L577-F597 HydrophobicContact CD2-CE2 4.32Å; L577-F597 HydrophobicContact CD2-CZ 3.93Å; L577-F597 HydrophobicContact CG-CE2 4.46Å; L577-F597 HydrophobicContact CG-CZ 4.28Å; Q593-F597 WeakPolarHBondContact O-CB 3.31Å; Q593-F597 PolarHBondContact O-N 3.44Å; L594-F597 PolarHBondContact O-N 2.88Å; F597-R599 VanDerWaalsContact C-N 3.34Å; F597-R599 PolarHBondContact O-N 2.84Å; F597-Q600 PolarHBondContact O-N 3.18Å; F597-Q600 VanDerWaalsContact O-N 3.11Å; F597-M601 HydrophobicContact CD1-CG 4.5Å; F597-M601 HydrophobicContact CE1-CG 4.15Å; F597-M601 HydrophobicContact CE1-SD 4.2Å; F597-M601 PolarHBondContact O-N 2.64Å; F597-A645 HydrophobicContact CE1-CB 3.77Å; F597-A645 WeakPolarHBondContact CE1-O 3.49Å; F597-A645 HydrophobicContact CZ-CB 3.67Å; F597-R648 HydrophobicContact CE1-CB 4.27Å; F597-R648 HydrophobicContact CE2-CG 4.49Å; F597-R648 HydrophobicContact CZ-CB 4.19Å; F597-R648 HydrophobicContact CZ-CG 4.38Å; F597-L652 HydrophobicContact CB-CD1 4.43Å
598	E	87.9	Confident	84	Confident	71 Å²	71	69.5 Å²	69.5	33%	0.332	39%	0.388	S	S	.	.	H	α-helix	trans	-60.4	-43.3	178.1	-67.7	-168.6	164.6	0	0	112	L594 Q600 M601 E602 Q649	L594-E598 HydrophobicContact CD1-CG 4.15Å; L594-E598 HydrophobicContact CG-CG 4.42Å; L594-E598 PolarHBondContact O-N 2.72Å; E598-Q600 PolarHBondContact O-N 3.12Å; E598-Q600 VanDerWaalsContact O-N 3.07Å; E598-M601 WeakPolarHBondContact O-CB 3.33Å; E598-M601 PolarHBondContact O-N 3.43Å; E598-E602 PolarHBondContact O-N 3.05Å; E598-Q649 HydrophobicContact CG-CG 4.34Å; E598-Q649 PolarHBondContact OE1-NE2 2.68Å
599	R	85.1	Confident	84.3	Confident	141 Å²	141	66.7 Å²	66.7	53%	0.532	37%	0.371	S	S	.	.	H	α-helix	trans	-61.3	-19.1	177.4	-153.6	-174.4	-44.8	111.6	10.9	113.7	D595 E596 F597	D595-R599 PolarHBondContact O-NH2 3.46Å; E596-R599 IonicContact OE1-NH1 3.63Å; E596-R599 IonicContact OE2-CZ 3.41Å; E596-R599 IonicContact OE2-NH1 2.69Å; E596-R599 PolarHBondContact OE2-NH1 3.17Å; E596-R599 IonicContact OE2-NH2 3.68Å; F597-R599 VanDerWaalsContact C-N 3.34Å; F597-R599 PolarHBondContact O-N 2.84Å
600	Q	83.1	Confident	84.6	Confident	28 Å²	28	62.6 Å²	62.6	13%	0.131	35%	0.352	C	S	.	.	H	α-helix	trans	-89.1	-21.2	173.8	-61.6	-175.2	26.8	0	0	113	L573 T576 E596 F597 E598	L573-Q600 HydrophobicContact CD1-CB 4.02Å; T576-Q600 PolarHBondContact OG1-OE1 3.37Å; E596-Q600 WeakPolarHBondContact O-CG 3.47Å; E596-Q600 PolarHBondContact OE1-NE2 3.08Å; F597-Q600 PolarHBondContact O-N 3.18Å; F597-Q600 VanDerWaalsContact O-N 3.11Å; E598-Q600 PolarHBondContact O-N 3.12Å; E598-Q600 VanDerWaalsContact O-N 3.07Å
601	M	82.4	Confident	85	Confident	32 Å²	32	65.3 Å²	65.3	16%	0.158	37%	0.365	C	S	.	.	H	α-helix	trans	-79.8	-36.9	176.2	-71.1	-143.2	-68.2	0	0	114.1	L573 F597 E598 G603 L642 A645 Q649	L573-M601 HydrophobicContact CD1-CG 4.22Å; L573-M601 HydrophobicContact CD2-CG 4.12Å; F597-M601 HydrophobicContact CD1-CG 4.5Å; F597-M601 HydrophobicContact CE1-CG 4.15Å; F597-M601 HydrophobicContact CE1-SD 4.2Å; F597-M601 PolarHBondContact O-N 2.64Å; E598-M601 WeakPolarHBondContact O-CB 3.33Å; E598-M601 PolarHBondContact O-N 3.43Å; M601-G603 VanDerWaalsContact C-N 3.34Å; M601-G603 PolarHBondContact O-N 3.01Å; M601-L642 HydrophobicContact SD-CD2 4.25Å; M601-A645 HydrophobicContact CG-CB 4.16Å; M601-A645 HydrophobicContact SD-CB 3.37Å; M601-A645 WeakPolarHBondContact SD-CB 3.41Å; M601-Q649 HydrophobicContact CE-CB 4.35Å; M601-Q649 HydrophobicContact CE-CG 4.43Å
602	E	76.6	Confident	85.2	Confident	163 Å²	163	66.8 Å²	66.8	76%	0.762	37%	0.366	S	S	*	.	S	Bend	trans	-62.1	-40.4	-175.7	-64.2	-166.8	124.8	0	0	112.8	E598	E598-E602 PolarHBondContact O-N 3.05Å
603	G	67.8	Low	85.4	Confident	46 Å²	46	59.9 Å²	59.9	47%	0.474	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	-159.9	173.7	0	0	0	0	0	114.8	M601	M601-G603 VanDerWaalsContact C-N 3.34Å; M601-G603 PolarHBondContact O-N 3.01Å
604	G	63.9	Low	85.6	Confident	72 Å²	72	59 Å²	59	74%	0.742	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	12.8	-171.7	0	0	0	0	0	115.7	G606	G604-G606 PolarHBondContact O-N 2.78Å; G604-G606 VanDerWaalsContact O-N 3.15Å
605	G	73.9	Confident	85.7	Confident	56 Å²	56	64.7 Å²	64.7	58%	0.577	36%	0.356	S	S	*	.	S	Bend	trans	70.8	-0.7	-178.4	0	0	0	0	0	116.4	H607 S608	G605-H607 PolarHBondContact O-N 3.47Å; G605-H607 VanDerWaalsContact O-N 3.15Å; G605-S608 PolarHBondContact O-N 3.4Å
606	G	87.5	Confident	85.9	Confident	14 Å²	14	61.5 Å²	61.5	14%	0.144	35%	0.345	C	S	.	.	H	α-helix	trans	-61.1	-27.1	-174.5	0	0	0	0	0	114.2	E566 G604 S608 R609 I610	E566-G606 WeakPolarHBondContact OE1-CA 3.44Å; E566-G606 PolarHBondContact OE1-N 3.44Å; G604-G606 PolarHBondContact O-N 2.78Å; G604-G606 VanDerWaalsContact O-N 3.15Å; G606-S608 PolarHBondContact O-N 3.07Å; G606-R609 PolarHBondContact O-N 2.89Å; G606-I610 WeakPolarHBondContact O-CG1 3.06Å; G606-I610 PolarHBondContact O-N 3.5Å; G606-I610 VanDerWaalsContact O-N 3.16Å
607	H	90.4	Very high	86.1	Confident	60 Å²	60	57.7 Å²	57.7	28%	0.278	33%	0.327	S	S	.	.	H	α-helix	trans	-49.7	-47	177.8	-175.1	69.1	0	0	0	114.3	E566 G605 R609 I610 M611 Y634	E566-H607 PolarHBondContact OE1-N 2.71Å; G605-H607 PolarHBondContact O-N 3.47Å; G605-H607 VanDerWaalsContact O-N 3.15Å; H607-R609 PolarHBondContact O-N 3.48Å; H607-I610 PolarHBondContact O-N 2.82Å; H607-M611 WeakPolarHBondContact O-CG 3.22Å; H607-M611 PolarHBondContact O-N 2.98Å; H607-Y634 WeakPolarHBondContact CA-OH 3.15Å; H607-Y634 WeakPolarHBondContact CB-OH 3.11Å; H607-Y634 AromaticContact ND1-CE1 3.5Å; H607-Y634 WeakPolarHBondContact ND1-CE1 3.46Å; H607-Y634 AromaticContact ND1-CZ 3.57Å; H607-Y634 PolarHBondContact ND1-OH 2.92Å
608	S	90.9	Very high	86.1	Confident	73 Å²	73	60.6 Å²	60.6	51%	0.51	34%	0.342	S	S	.	.	H	α-helix	trans	-60.7	-46.2	-177.7	-172.4	0	0	0	0	111.3	G605 G606 I610 M611 E612	G605-S608 PolarHBondContact O-N 3.4Å; G606-S608 PolarHBondContact O-N 3.07Å; S608-I610 PolarHBondContact O-N 3.17Å; S608-M611 WeakPolarHBondContact O-CB 3.42Å; S608-M611 PolarHBondContact O-N 3.33Å; S608-M611 VanDerWaalsContact O-N 3.12Å; S608-E612 PolarHBondContact O-N 3.25Å; S608-E612 PolarHBondContact OG-OE1 3.45Å
609	R	93.2	Very high	86.1	Confident	91 Å²	91	61.4 Å²	61.4	34%	0.343	36%	0.356	S	S	.	.	H	α-helix	trans	-67.3	-35.6	-177	-173.7	59.8	-175.6	158.2	7.6	112.4	E558 L562 G606 H607 M611 E612 I613	E558-R609 VanDerWaalsContact CD-NH2 3.31Å; E558-R609 IonicContact OE1-CZ 2.81Å; E558-R609 VanDerWaalsContact OE1-CZ 3.28Å; E558-R609 IonicContact OE1-NE 3.22Å; E558-R609 PolarHBondContact OE1-NE 3.37Å; E558-R609 IonicContact OE1-NH2 3.53Å; E558-R609 PolarHBondContact OE1-NH2 3.35Å; E558-R609 IonicContact OE2-CZ 3.73Å; E558-R609 IonicContact OE2-NE 2.63Å; E558-R609 IonicContact OE2-NH2 3.68Å; E558-R609 PolarHBondContact OE2-NH2 2.93Å; L562-R609 HydrophobicContact CD1-CB 4.02Å; L562-R609 HydrophobicContact CD1-CG 3.44Å; L562-R609 VanDerWaalsContact CD1-CG 3.44Å; G606-R609 PolarHBondContact O-N 2.89Å; H607-R609 PolarHBondContact O-N 3.48Å; R609-M611 VanDerWaalsContact C-N 3.3Å; R609-M611 PolarHBondContact O-N 2.91Å; R609-E612 VanDerWaalsContact CD-OE2 3.24Å; R609-E612 WeakPolarHBondContact CD-OE2 3.39Å; R609-E612 IonicContact CZ-OE2 3.43Å; R609-E612 IonicContact NE-OE2 2.72Å; R609-E612 IonicContact NH1-OE2 3.32Å; R609-E612 PolarHBondContact NH1-OE2 2.82Å; R609-E612 PolarHBondContact O-N 3.45Å; R609-I613 HydrophobicContact CG-CD1 3.99Å; R609-I613 WeakPolarHBondContact O-CD1 3.35Å; R609-I613 VanDerWaalsContact O-CG1 3.28Å; R609-I613 WeakPolarHBondContact O-CG1 3.39Å; R609-I613 PolarHBondContact O-N 3.44Å; R609-I613 VanDerWaalsContact O-N 3.11Å
610	I	93.4	Very high	86	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-59.8	-42.1	172.5	-68.1	168.2	0	0	0	110.9	F559 L562 V563 E566 G606 H607 S608 A614 L631 Y634	F559-I610 HydrophobicContact CD2-CG2 4.04Å; F559-I610 HydrophobicContact CE2-CG2 3.69Å; L562-I610 HydrophobicContact CB-CD1 4.14Å; L562-I610 HydrophobicContact CB-CG1 3.69Å; V563-I610 HydrophobicContact CG2-CD1 3.84Å; V563-I610 HydrophobicContact CG2-CG1 4.06Å; V563-I610 HydrophobicContact CG2-CG2 3.8Å; E566-I610 HydrophobicContact CB-CD1 4.04Å; E566-I610 HydrophobicContact CG-CD1 3.75Å; G606-I610 WeakPolarHBondContact O-CG1 3.06Å; G606-I610 PolarHBondContact O-N 3.5Å; G606-I610 VanDerWaalsContact O-N 3.16Å; H607-I610 PolarHBondContact O-N 2.82Å; S608-I610 PolarHBondContact O-N 3.17Å; I610-A614 VanDerWaalsContact O-CB 3.3Å; I610-A614 WeakPolarHBondContact O-CB 3.35Å; I610-A614 PolarHBondContact O-N 3.35Å; I610-A614 VanDerWaalsContact O-N 3.08Å; I610-L631 HydrophobicContact CG2-CD1 4.06Å; I610-Y634 HydrophobicContact CB-CE1 4.32Å; I610-Y634 HydrophobicContact CD1-CD1 4.48Å; I610-Y634 HydrophobicContact CD1-CE1 3.91Å; I610-Y634 HydrophobicContact CD1-CE2 4.3Å; I610-Y634 HydrophobicContact CG2-CD1 3.88Å; I610-Y634 HydrophobicContact CG2-CE1 3.84Å
611	M	93.3	Very high	86	Confident	76 Å²	76	64.3 Å²	64.3	37%	0.374	37%	0.373	S	S	.	.	H	α-helix	trans	-68.1	-42.8	179	-64.6	-63.1	-71.4	0	0	112.2	H607 S608 R609 A614 Q615 L631 L635	H607-M611 WeakPolarHBondContact O-CG 3.22Å; H607-M611 PolarHBondContact O-N 2.98Å; S608-M611 WeakPolarHBondContact O-CB 3.42Å; S608-M611 PolarHBondContact O-N 3.33Å; S608-M611 VanDerWaalsContact O-N 3.12Å; R609-M611 VanDerWaalsContact C-N 3.3Å; R609-M611 PolarHBondContact O-N 2.91Å; M611-A614 PolarHBondContact O-N 3.32Å; M611-Q615 WeakPolarHBondContact O-CB 3.18Å; M611-Q615 PolarHBondContact O-N 3.22Å; M611-L631 HydrophobicContact SD-CD1 3.9Å; M611-L635 HydrophobicContact SD-CD2 4.19Å
612	E	93	Very high	86.1	Confident	88 Å²	88	63.4 Å²	63.4	41%	0.411	37%	0.369	S	S	.	.	H	α-helix	trans	-55.7	-51.6	174.5	-71.3	163.9	-143.5	0	0	112.2	S608 R609 A614 Q615 A616	S608-E612 PolarHBondContact O-N 3.25Å; S608-E612 PolarHBondContact OG-OE1 3.45Å; R609-E612 VanDerWaalsContact CD-OE2 3.24Å; R609-E612 WeakPolarHBondContact CD-OE2 3.39Å; R609-E612 IonicContact CZ-OE2 3.43Å; R609-E612 IonicContact NE-OE2 2.72Å; R609-E612 IonicContact NH1-OE2 3.32Å; R609-E612 PolarHBondContact NH1-OE2 2.82Å; R609-E612 PolarHBondContact O-N 3.45Å; E612-A614 PolarHBondContact O-N 3.47Å; E612-Q615 PolarHBondContact O-N 3.5Å; E612-A616 WeakPolarHBondContact O-CB 3.33Å; E612-A616 PolarHBondContact O-N 3.3Å
613	I	93	Very high	86.6	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-67.2	-40.3	-176.6	-59.1	159.4	0	0	0	110.7	L555 E558 F559 L562 R609 Q615 A616 L617	L555-I613 HydrophobicContact CB-CG2 4.06Å; L555-I613 HydrophobicContact CD2-CG1 4.5Å; L555-I613 HydrophobicContact CD2-CG2 4.23Å; L555-I613 VanDerWaalsContact O-CG2 3.3Å; L555-I613 WeakPolarHBondContact O-CG2 3.43Å; E558-I613 HydrophobicContact CB-CD1 4.12Å; E558-I613 VanDerWaalsContact CD-CD1 3.45Å; E558-I613 HydrophobicContact CG-CD1 3.72Å; F559-I613 HydrophobicContact CB-CB 4.41Å; F559-I613 HydrophobicContact CB-CG2 3.8Å; L562-I613 HydrophobicContact CD1-CD1 3.7Å; R609-I613 HydrophobicContact CG-CD1 3.99Å; R609-I613 WeakPolarHBondContact O-CD1 3.35Å; R609-I613 VanDerWaalsContact O-CG1 3.28Å; R609-I613 WeakPolarHBondContact O-CG1 3.39Å; R609-I613 PolarHBondContact O-N 3.44Å; R609-I613 VanDerWaalsContact O-N 3.11Å; I613-Q615 VanDerWaalsContact C-N 3.31Å; I613-Q615 PolarHBondContact O-N 3.05Å; I613-A616 PolarHBondContact O-N 3.3Å; I613-L617 HydrophobicContact CG2-CD1 3.87Å; I613-L617 HydrophobicContact CG2-CG 4.33Å; I613-L617 PolarHBondContact O-N 3.48Å
614	A	92.1	Very high	87.4	Confident	6 Å²	6	54.7 Å²	54.7	5%	0.05	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-39.9	175.2	0	0	0	0	0	111.9	F559 I610 M611 E612 N618 I627 L631	F559-A614 HydrophobicContact CD2-CB 4.46Å; F559-A614 HydrophobicContact CE2-CB 4.07Å; I610-A614 VanDerWaalsContact O-CB 3.3Å; I610-A614 WeakPolarHBondContact O-CB 3.35Å; I610-A614 PolarHBondContact O-N 3.35Å; I610-A614 VanDerWaalsContact O-N 3.08Å; M611-A614 PolarHBondContact O-N 3.32Å; E612-A614 PolarHBondContact O-N 3.47Å; A614-N618 WeakPolarHBondContact O-CB 3.35Å; A614-N618 PolarHBondContact O-N 2.83Å; A614-N618 VanDerWaalsContact O-N 3.14Å; A614-I627 HydrophobicContact CB-CG2 3.81Å; A614-L631 HydrophobicContact CB-CD1 4.19Å; A614-L631 HydrophobicContact CB-CD2 4.05Å
615	Q	91.7	Very high	88.4	Confident	149 Å²	149	54.1 Å²	54.1	70%	0.696	30%	0.303	S	S	*	.	H	α-helix	trans	-66.7	-46	174.5	-178.1	173.7	-10.8	0	0	111.8	M611 E612 I613 N618 S619	M611-Q615 WeakPolarHBondContact O-CB 3.18Å; M611-Q615 PolarHBondContact O-N 3.22Å; E612-Q615 PolarHBondContact O-N 3.5Å; I613-Q615 VanDerWaalsContact C-N 3.31Å; I613-Q615 PolarHBondContact O-N 3.05Å; Q615-N618 PolarHBondContact O-N 3.47Å; Q615-S619 WeakPolarHBondContact O-CB 3.47Å; Q615-S619 PolarHBondContact O-N 3.36Å
616	A	91.3	Very high	89.2	Confident	37 Å²	37	52.4 Å²	52.4	31%	0.306	28%	0.284	S	S	.	.	H	α-helix	trans	-58.5	-53.6	179.9	0	0	0	0	0	112	E612 I613 N618 S619 Q620	E612-A616 WeakPolarHBondContact O-CB 3.33Å; E612-A616 PolarHBondContact O-N 3.3Å; I613-A616 PolarHBondContact O-N 3.3Å; A616-N618 PolarHBondContact O-N 3.17Å; A616-S619 WeakPolarHBondContact O-CB 3.44Å; A616-S619 PolarHBondContact O-N 3.47Å; A616-S619 PolarHBondContact O-OG 3.28Å; A616-Q620 PolarHBondContact O-N 3.15Å
617	L	90.5	Very high	89.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.4	-39.2	180	-69.8	171.2	0	0	0	112.8	A552 L555 W556 I613 S619 Q620 K621 L622 I627	A552-L617 HydrophobicContact CB-CD2 3.69Å; A552-L617 WeakPolarHBondContact O-CD2 3.27Å; L555-L617 HydrophobicContact CB-CD1 4.18Å; L555-L617 HydrophobicContact CB-CD2 3.8Å; L555-L617 HydrophobicContact CB-CG 4.07Å; L555-L617 HydrophobicContact CD1-CD2 4.14Å; L555-L617 HydrophobicContact CD1-CG 4.5Å; W556-L617 HydrophobicContact CB-CD1 4.3Å; I613-L617 HydrophobicContact CG2-CD1 3.87Å; I613-L617 HydrophobicContact CG2-CG 4.33Å; I613-L617 PolarHBondContact O-N 3.48Å; L617-S619 VanDerWaalsContact C-N 3.29Å; L617-S619 PolarHBondContact O-N 3.29Å; L617-Q620 PolarHBondContact O-N 2.64Å; L617-K621 PolarHBondContact O-N 3.05Å; L617-L622 PolarHBondContact O-N 3.09Å; L617-I627 HydrophobicContact CB-CD1 3.32Å; L617-I627 HydrophobicContact CD1-CD1 3.81Å; L617-I627 HydrophobicContact CD1-CG1 4.31Å; L617-I627 HydrophobicContact CG-CD1 4.19Å
618	N	86.9	Confident	89.2	Confident	68 Å²	68	54.3 Å²	54.3	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-67.7	-28.9	176.3	-177.3	71.4	0	0	0	112	A614 Q615 A616 K621 K628	A614-N618 WeakPolarHBondContact O-CB 3.35Å; A614-N618 PolarHBondContact O-N 2.83Å; A614-N618 VanDerWaalsContact O-N 3.14Å; Q615-N618 PolarHBondContact O-N 3.47Å; A616-N618 PolarHBondContact O-N 3.17Å; N618-K621 PolarHBondContact O-N 3.07Å; N618-K628 WeakPolarHBondContact OD1-CE 3.49Å
619	S	87.7	Confident	89.3	Confident	88 Å²	88	53.5 Å²	53.5	62%	0.615	28%	0.282	S	S	*	.	H	α-helix	trans	-65.8	-37.1	172.7	82.4	0	0	0	0	112.6	Q615 A616 L617 K621	Q615-S619 WeakPolarHBondContact O-CB 3.47Å; Q615-S619 PolarHBondContact O-N 3.36Å; A616-S619 WeakPolarHBondContact O-CB 3.44Å; A616-S619 PolarHBondContact O-N 3.47Å; A616-S619 PolarHBondContact O-OG 3.28Å; L617-S619 VanDerWaalsContact C-N 3.29Å; L617-S619 PolarHBondContact O-N 3.29Å; S619-K621 PolarHBondContact O-N 3.19Å
620	Q	83.4	Confident	89.2	Confident	75 Å²	75	51.4 Å²	51.4	35%	0.35	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-7.5	175.3	-65.4	-179.2	-10.8	0	0	113.5	A616 L617 L622	A616-Q620 PolarHBondContact O-N 3.15Å; L617-Q620 PolarHBondContact O-N 2.64Å; Q620-L622 HydrophobicContact CB-CD1 4.26Å; Q620-L622 HydrophobicContact CB-CG 4.15Å; Q620-L622 PolarHBondContact O-N 3.46Å
621	K	83.9	Confident	89.2	Confident	156 Å²	156	52.7 Å²	52.7	68%	0.678	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	32.3	-174.7	-54	175.4	-175.6	171.2	0	113.4	S472 L617 N618 S619	S472-K621 WeakPolarHBondContact CB-O 3.47Å; S472-K621 PolarHBondContact OG-O 3.24Å; L617-K621 PolarHBondContact O-N 3.05Å; N618-K621 PolarHBondContact O-N 3.07Å; S619-K621 PolarHBondContact O-N 3.19Å
622	L	84	Confident	89.1	Confident	12 Å²	12	54 Å²	54	6%	0.063	29%	0.291	C	S	.	.	S	Bend	trans	-105.5	148.8	172.2	-59.8	179	0	0	0	109.2	P473 I548 L549 A552 L617 Q620 S624	P473-L622 HydrophobicContact CG-CD2 4.12Å; I548-L622 HydrophobicContact CG2-CD1 3.92Å; L549-L622 HydrophobicContact CD2-CD1 4.33Å; L549-L622 HydrophobicContact CD2-CD2 4.1Å; A552-L622 HydrophobicContact CB-CB 4.45Å; A552-L622 HydrophobicContact CB-CD1 3.5Å; A552-L622 VanDerWaalsContact CB-CD1 3.5Å; L617-L622 PolarHBondContact O-N 3.09Å; Q620-L622 HydrophobicContact CB-CD1 4.26Å; Q620-L622 HydrophobicContact CB-CG 4.15Å; Q620-L622 PolarHBondContact O-N 3.46Å; L622-S624 PolarHBondContact O-N 3.43Å; L622-S624 PolarHBondContact O-OG 2.74Å; L622-S624 VanDerWaalsContact O-OG 3.07Å
623	L	86.7	Confident	89.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	52.6	16.8	174.8	-62.8	173	0	0	0	115.5	P473 S475 L479 W556 S625 A626 I627	P473-L623 WeakPolarHBondContact O-CA 3.29Å; P473-L623 PolarHBondContact O-N 3.41Å; S475-L623 WeakPolarHBondContact O-CD2 3.32Å; L479-L623 HydrophobicContact CB-CD2 4.28Å; L479-L623 HydrophobicContact CD2-CD1 3.72Å; L479-L623 HydrophobicContact CD2-CD2 4.34Å; L479-L623 HydrophobicContact CD2-CG 4.16Å; W556-L623 HydrophobicContact CB-CD1 3.48Å; W556-L623 VanDerWaalsContact CB-CD1 3.48Å; W556-L623 HydrophobicContact CD2-CD1 3.74Å; W556-L623 HydrophobicContact CE3-CD1 3.86Å; W556-L623 HydrophobicContact CG-CD1 3.56Å; L623-S625 PolarHBondContact O-N 3.12Å; L623-A626 PolarHBondContact O-N 3.47Å; L623-I627 HydrophobicContact CB-CD1 3.63Å; L623-I627 HydrophobicContact CB-CG1 4.03Å; L623-I627 WeakPolarHBondContact O-CG1 3.48Å; L623-I627 PolarHBondContact O-N 3.04Å
624	S	83.9	Confident	89.2	Confident	27 Å²	27	54.5 Å²	54.5	19%	0.189	29%	0.292	C	S	.	.	H	α-helix	trans	-69.3	-17.3	-159.2	-43.1	0	0	0	0	113.6	L622 K628	L622-S624 PolarHBondContact O-N 3.43Å; L622-S624 PolarHBondContact O-OG 2.74Å; L622-S624 VanDerWaalsContact O-OG 3.07Å; S624-K628 WeakPolarHBondContact O-CB 3.39Å; S624-K628 WeakPolarHBondContact O-CD 3.42Å; S624-K628 WeakPolarHBondContact O-CG 3.47Å; S624-K628 PolarHBondContact O-N 3.49Å
625	S	86	Confident	89.2	Confident	59 Å²	59	57 Å²	57	41%	0.413	30%	0.304	S	S	.	.	H	α-helix	trans	-82.8	-45.4	170.6	44.8	0	0	0	0	112.3	N474 L623 K628 S629	N474-S625 WeakPolarHBondContact CB-OG 3.4Å; N474-S625 PolarHBondContact O-OG 3.44Å; N474-S625 PolarHBondContact OD1-OG 2.88Å; L623-S625 PolarHBondContact O-N 3.12Å; S625-K628 PolarHBondContact O-N 3.27Å; S625-S629 WeakPolarHBondContact O-CB 3.5Å; S625-S629 PolarHBondContact O-N 2.68Å
626	A	90	Very high	89.3	Confident	20 Å²	20	53 Å²	53	17%	0.165	30%	0.296	C	S	.	.	H	α-helix	trans	-61.7	-45.1	173.9	0	0	0	0	0	112.6	N474 W556 L623 S629 E630	N474-A626 WeakPolarHBondContact O-CB 3.3Å; N474-A626 PolarHBondContact O-N 3.38Å; W556-A626 HydrophobicContact CH2-CB 3.82Å; W556-A626 HydrophobicContact CZ2-CB 4.47Å; W556-A626 HydrophobicContact CZ3-CB 4.09Å; L623-A626 PolarHBondContact O-N 3.47Å; A626-S629 PolarHBondContact O-N 3.03Å; A626-E630 PolarHBondContact O-N 3.08Å
627	I	90	Very high	89.3	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.015	29%	0.291	C	S	.	.	H	α-helix	trans	-62.2	-49.3	177.3	-63.5	155.3	0	0	0	110.3	W556 A614 L617 L623 S629 E630 L631	W556-I627 HydrophobicContact CE3-CG1 3.88Å; W556-I627 HydrophobicContact CZ3-CG1 3.72Å; A614-I627 HydrophobicContact CB-CG2 3.81Å; L617-I627 HydrophobicContact CB-CD1 3.32Å; L617-I627 HydrophobicContact CD1-CD1 3.81Å; L617-I627 HydrophobicContact CD1-CG1 4.31Å; L617-I627 HydrophobicContact CG-CD1 4.19Å; L623-I627 HydrophobicContact CB-CD1 3.63Å; L623-I627 HydrophobicContact CB-CG1 4.03Å; L623-I627 WeakPolarHBondContact O-CG1 3.48Å; L623-I627 PolarHBondContact O-N 3.04Å; I627-S629 PolarHBondContact O-N 2.96Å; I627-E630 PolarHBondContact O-N 3.35Å; I627-L631 WeakPolarHBondContact O-CA 3.13Å; I627-L631 WeakPolarHBondContact O-CB 3.37Å; I627-L631 PolarHBondContact O-N 2.91Å
628	K	89.4	Confident	89.4	Confident	111 Å²	111	55.8 Å²	55.8	48%	0.483	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-35	176.1	-73.1	171.7	-165.4	174	0	112	N618 S624 S625 N632	N618-K628 WeakPolarHBondContact OD1-CE 3.49Å; S624-K628 WeakPolarHBondContact O-CB 3.39Å; S624-K628 WeakPolarHBondContact O-CD 3.42Å; S624-K628 WeakPolarHBondContact O-CG 3.47Å; S624-K628 PolarHBondContact O-N 3.49Å; S625-K628 PolarHBondContact O-N 3.27Å; K628-N632 WeakPolarHBondContact O-CB 3.49Å; K628-N632 PolarHBondContact O-N 3.34Å; K628-N632 PolarHBondContact O-ND2 3.18Å; K628-N632 PolarHBondContact O-OD1 3.35Å
629	S	91.2	Very high	89.6	Confident	56 Å²	56	56.8 Å²	56.8	39%	0.392	30%	0.301	S	S	.	.	H	α-helix	trans	-67.9	-50.5	176.9	-164.7	0	0	0	0	112.5	S625 A626 I627 K633	S625-S629 WeakPolarHBondContact O-CB 3.5Å; S625-S629 PolarHBondContact O-N 2.68Å; A626-S629 PolarHBondContact O-N 3.03Å; I627-S629 PolarHBondContact O-N 2.96Å; S629-K633 WeakPolarHBondContact O-CD 3.45Å; S629-K633 VanDerWaalsContact O-CG 3.23Å; S629-K633 WeakPolarHBondContact O-CG 3.36Å; S629-K633 PolarHBondContact O-N 3.16Å; S629-K633 VanDerWaalsContact O-N 3.14Å; S629-K633 WeakPolarHBondContact OG-CE 3.47Å; S629-K633 PolarHBondContact OG-NZ 3.19Å
630	E	91.7	Very high	89.8	Confident	48 Å²	48	58.1 Å²	58.1	22%	0.224	30%	0.298	C	S	.	.	H	α-helix	trans	-75.1	-34.1	-179	-69.5	-50.9	132.1	0	0	113.3	W556 F559 R567 A626 I627 K633 Y634	W556-E630 HydrophobicContact CH2-CG 4.28Å; F559-E630 HydrophobicContact CE1-CB 3.83Å; F559-E630 HydrophobicContact CZ-CB 4.16Å; R567-E630 IonicContact CZ-OE2 2.73Å; R567-E630 IonicContact NH1-OE2 2.7Å; R567-E630 IonicContact NH2-OE2 3.18Å; R567-E630 PolarHBondContact NH2-OE2 3.28Å; A626-E630 PolarHBondContact O-N 3.08Å; I627-E630 PolarHBondContact O-N 3.35Å; E630-K633 PolarHBondContact O-N 2.8Å; E630-K633 IonicContact OE1-NZ 3.72Å; E630-K633 PolarHBondContact OE1-NZ 3.28Å; E630-Y634 WeakPolarHBondContact O-CB 3.47Å; E630-Y634 PolarHBondContact O-N 2.68Å
631	L	93.1	Very high	90.1	Very high	26 Å²	26	54.6 Å²	54.6	14%	0.136	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-45.2	173.5	-172.8	72	0	0	0	110.7	F559 I610 M611 A614 I627 K633 Y634 L635	F559-L631 HydrophobicContact CE2-CD1 4.32Å; F559-L631 HydrophobicContact CZ-CB 4.35Å; I610-L631 HydrophobicContact CG2-CD1 4.06Å; M611-L631 HydrophobicContact SD-CD1 3.9Å; A614-L631 HydrophobicContact CB-CD1 4.19Å; A614-L631 HydrophobicContact CB-CD2 4.05Å; I627-L631 WeakPolarHBondContact O-CA 3.13Å; I627-L631 WeakPolarHBondContact O-CB 3.37Å; I627-L631 PolarHBondContact O-N 2.91Å; L631-K633 VanDerWaalsContact C-N 3.31Å; L631-K633 PolarHBondContact O-N 3.41Å; L631-Y634 HydrophobicContact CD1-CD1 4.35Å; L631-Y634 PolarHBondContact O-N 3.04Å; L631-L635 HydrophobicContact CD1-CD1 4.26Å; L631-L635 HydrophobicContact CD1-CG 4.27Å; L631-L635 HydrophobicContact CD2-CD1 4.28Å; L631-L635 HydrophobicContact CG-CD1 3.85Å; L631-L635 HydrophobicContact CG-CG 4.2Å; L631-L635 WeakPolarHBondContact O-CB 3.13Å; L631-L635 WeakPolarHBondContact O-CG 3.33Å; L631-L635 PolarHBondContact O-N 2.92Å
632	N	92.7	Very high	90.4	Very high	104 Å²	104	47.8 Å²	47.8	56%	0.556	25%	0.253	S	S	*	.	H	α-helix	trans	-63	-37.6	176.3	-72	5.2	0	0	0	111.8	K628 A636	K628-N632 WeakPolarHBondContact O-CB 3.49Å; K628-N632 PolarHBondContact O-N 3.34Å; K628-N632 PolarHBondContact O-ND2 3.18Å; K628-N632 PolarHBondContact O-OD1 3.35Å; N632-A636 WeakPolarHBondContact O-CB 3.35Å; N632-A636 PolarHBondContact O-N 3.35Å
633	K	93.1	Very high	90.6	Very high	100 Å²	100	51.4 Å²	51.4	44%	0.435	27%	0.269	S	S	.	.	H	α-helix	trans	-63.6	-45.2	173.4	-70.4	166	-158.3	172.5	0	111.8	S629 E630 L631 R637	S629-K633 WeakPolarHBondContact O-CD 3.45Å; S629-K633 VanDerWaalsContact O-CG 3.23Å; S629-K633 WeakPolarHBondContact O-CG 3.36Å; S629-K633 PolarHBondContact O-N 3.16Å; S629-K633 VanDerWaalsContact O-N 3.14Å; S629-K633 WeakPolarHBondContact OG-CE 3.47Å; S629-K633 PolarHBondContact OG-NZ 3.19Å; E630-K633 PolarHBondContact O-N 2.8Å; E630-K633 IonicContact OE1-NZ 3.72Å; E630-K633 PolarHBondContact OE1-NZ 3.28Å; L631-K633 VanDerWaalsContact C-N 3.31Å; L631-K633 PolarHBondContact O-N 3.41Å; K633-R637 VanDerWaalsContact O-CB 3.31Å; K633-R637 WeakPolarHBondContact O-CB 3.39Å; K633-R637 PolarHBondContact O-N 3.46Å
634	Y	93.3	Very high	90.8	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.9	-49.1	178.5	168.2	-117.6	0	0	0	111.9	E566 L570 H607 I610 E630 L631 R637 R638	E566-Y634 HydrophobicContact CB-CE2 3.7Å; E566-Y634 HydrophobicContact CG-CE2 4.41Å; E566-Y634 PolarHBondContact OE2-OH 3.19Å; L570-Y634 HydrophobicContact CD1-CD2 4.43Å; L570-Y634 HydrophobicContact CD1-CE2 4.12Å; H607-Y634 WeakPolarHBondContact CA-OH 3.15Å; H607-Y634 WeakPolarHBondContact CB-OH 3.11Å; H607-Y634 AromaticContact ND1-CE1 3.5Å; H607-Y634 WeakPolarHBondContact ND1-CE1 3.46Å; H607-Y634 AromaticContact ND1-CZ 3.57Å; H607-Y634 PolarHBondContact ND1-OH 2.92Å; I610-Y634 HydrophobicContact CB-CE1 4.32Å; I610-Y634 HydrophobicContact CD1-CD1 4.48Å; I610-Y634 HydrophobicContact CD1-CE1 3.91Å; I610-Y634 HydrophobicContact CD1-CE2 4.3Å; I610-Y634 HydrophobicContact CG2-CD1 3.88Å; I610-Y634 HydrophobicContact CG2-CE1 3.84Å; E630-Y634 WeakPolarHBondContact O-CB 3.47Å; E630-Y634 PolarHBondContact O-N 2.68Å; L631-Y634 HydrophobicContact CD1-CD1 4.35Å; L631-Y634 PolarHBondContact O-N 3.04Å; Y634-R637 PolarHBondContact O-N 2.75Å; Y634-R638 VanDerWaalsContact O-CB 3.3Å; Y634-R638 WeakPolarHBondContact O-CB 3.5Å; Y634-R638 PolarHBondContact O-N 3.32Å
635	L	93.3	Very high	91.1	Very high	59 Å²	59	52.7 Å²	52.7	31%	0.309	28%	0.277	S	S	.	.	H	α-helix	trans	-66.1	-40.6	179.5	-66.5	178	0	0	0	112.1	M611 L631 R638 E639	M611-L635 HydrophobicContact SD-CD2 4.19Å; L631-L635 HydrophobicContact CD1-CD1 4.26Å; L631-L635 HydrophobicContact CD1-CG 4.27Å; L631-L635 HydrophobicContact CD2-CD1 4.28Å; L631-L635 HydrophobicContact CG-CD1 3.85Å; L631-L635 HydrophobicContact CG-CG 4.2Å; L631-L635 WeakPolarHBondContact O-CB 3.13Å; L631-L635 WeakPolarHBondContact O-CG 3.33Å; L631-L635 PolarHBondContact O-N 2.92Å; L635-R638 PolarHBondContact O-N 2.73Å; L635-E639 PolarHBondContact O-N 2.82Å
636	A	92.6	Very high	91.3	Very high	64 Å²	64	53.3 Å²	53.3	53%	0.529	27%	0.27	S	S	.	.	H	α-helix	trans	-63	-45.8	175.4	0	0	0	0	0	111.8	N632 R638 E639 E640	N632-A636 WeakPolarHBondContact O-CB 3.35Å; N632-A636 PolarHBondContact O-N 3.35Å; A636-R638 VanDerWaalsContact C-N 3.33Å; A636-R638 PolarHBondContact O-N 2.96Å; A636-E639 PolarHBondContact O-N 2.74Å; A636-E640 VanDerWaalsContact O-CB 3.23Å; A636-E640 WeakPolarHBondContact O-CB 3.42Å; A636-E640 PolarHBondContact O-N 3.21Å
637	R	92.5	Very high	91.3	Very high	50 Å²	50	58.7 Å²	58.7	19%	0.189	29%	0.292	C	S	.	.	H	α-helix	trans	-64.7	-36	175.3	-179.2	56.1	171.7	168.4	3	112.3	L570 D571 E574 K633 Y634 E640 V641	L570-R637 HydrophobicContact CD1-CG 4.35Å; D571-R637 IonicContact OD1-CZ 3.62Å; D571-R637 IonicContact OD1-NE 2.7Å; D571-R637 PolarHBondContact OD1-NE 2.91Å; D571-R637 IonicContact OD1-NH2 3.12Å; D571-R637 PolarHBondContact OD1-NH2 3.1Å; E574-R637 VanDerWaalsContact CD-NH1 3.33Å; E574-R637 IonicContact OE1-CZ 3.78Å; E574-R637 IonicContact OE1-NH1 2.74Å; E574-R637 PolarHBondContact OE1-NH1 3.2Å; E574-R637 IonicContact OE1-NH2 3.64Å; E574-R637 PolarHBondContact OE1-NH2 3.14Å; E574-R637 IonicContact OE2-CZ 2.82Å; E574-R637 IonicContact OE2-NH1 2.63Å; E574-R637 IonicContact OE2-NH2 2.75Å; E574-R637 PolarHBondContact OE2-NH2 2.9Å; K633-R637 VanDerWaalsContact O-CB 3.31Å; K633-R637 WeakPolarHBondContact O-CB 3.39Å; K633-R637 PolarHBondContact O-N 3.46Å; Y634-R637 PolarHBondContact O-N 2.75Å; R637-E640 WeakPolarHBondContact CD-OE2 3.29Å; R637-E640 IonicContact CZ-OE2 2.77Å; R637-E640 IonicContact NE-OE2 2.73Å; R637-E640 IonicContact NH1-OE2 3.11Å; R637-E640 PolarHBondContact NH1-OE2 2.79Å; R637-V641 WeakPolarHBondContact O-CG2 3.5Å; R637-V641 PolarHBondContact O-N 3.33Å
638	R	92	Very high	91.3	Very high	45 Å²	45	60.4 Å²	60.4	17%	0.17	30%	0.298	C	S	.	.	H	α-helix	trans	-65.2	-44.2	176.5	-176.3	163.2	-177.7	97.7	12.6	111.3	E566 L570 Y634 L635 A636 L642	E566-R638 IonicContact OE2-CZ 2.63Å; E566-R638 IonicContact OE2-NH1 3Å; E566-R638 PolarHBondContact OE2-NH1 2.88Å; L570-R638 HydrophobicContact CD1-CB 3.9Å; L570-R638 HydrophobicContact CD1-CG 4.38Å; L570-R638 HydrophobicContact CD2-CB 4.39Å; L570-R638 HydrophobicContact CD2-CG 4.14Å; Y634-R638 VanDerWaalsContact O-CB 3.3Å; Y634-R638 WeakPolarHBondContact O-CB 3.5Å; Y634-R638 PolarHBondContact O-N 3.32Å; L635-R638 PolarHBondContact O-N 2.73Å; A636-R638 VanDerWaalsContact C-N 3.33Å; A636-R638 PolarHBondContact O-N 2.96Å; R638-L642 HydrophobicContact CG-CD1 3.64Å; R638-L642 HydrophobicContact CG-CG 4.29Å; R638-L642 VanDerWaalsContact O-CB 3.27Å; R638-L642 WeakPolarHBondContact O-CB 3.4Å; R638-L642 WeakPolarHBondContact O-CG 3.39Å; R638-L642 PolarHBondContact O-N 3.2Å
639	E	90.8	Very high	91.3	Very high	89 Å²	89	57.1 Å²	57.1	42%	0.416	28%	0.284	S	S	.	.	H	α-helix	trans	-74.9	-36.6	179.7	-157.4	67.2	176.7	0	0	112.5	L635 A636 V641 L642 E643 R646	L635-E639 PolarHBondContact O-N 2.82Å; A636-E639 PolarHBondContact O-N 2.74Å; E639-V641 VanDerWaalsContact C-N 3.25Å; E639-V641 PolarHBondContact O-N 2.76Å; E639-L642 PolarHBondContact O-N 2.91Å; E639-E643 HydrophobicContact CG-CG 4.23Å; E639-E643 PolarHBondContact O-N 2.86Å; E639-R646 IonicContact OE1-CZ 2.99Å; E639-R646 IonicContact OE1-NH1 3.54Å; E639-R646 PolarHBondContact OE1-NH1 3.19Å; E639-R646 IonicContact OE1-NH2 3.05Å; E639-R646 IonicContact OE2-CZ 2.65Å; E639-R646 IonicContact OE2-NH1 2.86Å; E639-R646 IonicContact OE2-NH2 4Å; E639-R646 PolarHBondContact OE2-NH2 3.34Å
640	E	91.6	Very high	91.2	Very high	116 Å²	116	60.2 Å²	60.2	54%	0.542	29%	0.291	S	S	.	.	H	α-helix	trans	-54.5	-38.7	172.5	177.3	-176.7	-118.2	0	0	112.7	A636 R637 P644	A636-E640 VanDerWaalsContact O-CB 3.23Å; A636-E640 WeakPolarHBondContact O-CB 3.42Å; A636-E640 PolarHBondContact O-N 3.21Å; R637-E640 WeakPolarHBondContact CD-OE2 3.29Å; R637-E640 IonicContact CZ-OE2 2.77Å; R637-E640 IonicContact NE-OE2 2.73Å; R637-E640 IonicContact NH1-OE2 3.11Å; R637-E640 PolarHBondContact NH1-OE2 2.79Å; E640-P644 WeakPolarHBondContact O-CD 3.47Å; E640-P644 WeakPolarHBondContact O-CG 3.29Å
641	V	91.4	Very high	91	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.006	30%	0.301	C	S	.	.	H	α-helix	trans	-87.7	-36.2	178.8	178	0	0	0	0	112.1	L570 L573 E574 L577 R637 E639 A645	L570-V641 HydrophobicContact CD2-CB 4.35Å; L570-V641 HydrophobicContact CD2-CG1 4.44Å; L573-V641 HydrophobicContact CB-CG1 4.02Å; L573-V641 HydrophobicContact CD2-CG1 3.93Å; L573-V641 HydrophobicContact CG-CG1 3.88Å; E574-V641 HydrophobicContact CB-CG1 4.15Å; E574-V641 HydrophobicContact CB-CG2 4.03Å; E574-V641 HydrophobicContact CG-CG2 4.15Å; L577-V641 HydrophobicContact CD1-CG1 4.13Å; L577-V641 WeakPolarHBondContact CD1-O 3.46Å; R637-V641 WeakPolarHBondContact O-CG2 3.5Å; R637-V641 PolarHBondContact O-N 3.33Å; E639-V641 VanDerWaalsContact C-N 3.25Å; E639-V641 PolarHBondContact O-N 2.76Å; V641-A645 WeakPolarHBondContact O-CB 3.38Å; V641-A645 PolarHBondContact O-N 3.5Å
642	L	90.1	Very high	90.8	Very high	14 Å²	14	61.6 Å²	61.6	7%	0.073	30%	0.295	C	S	.	.	H	α-helix	trans	-77.1	-29.6	-176.2	-72.5	179.4	0	0	0	114.4	L573 M601 R638 E639 A645 R646	L573-L642 HydrophobicContact CD2-CD2 3.86Å; M601-L642 HydrophobicContact SD-CD2 4.25Å; R638-L642 HydrophobicContact CG-CD1 3.64Å; R638-L642 HydrophobicContact CG-CG 4.29Å; R638-L642 VanDerWaalsContact O-CB 3.27Å; R638-L642 WeakPolarHBondContact O-CB 3.4Å; R638-L642 WeakPolarHBondContact O-CG 3.39Å; R638-L642 PolarHBondContact O-N 3.2Å; E639-L642 PolarHBondContact O-N 2.91Å; L642-A645 PolarHBondContact O-N 3.23Å; L642-R646 WeakPolarHBondContact O-CD 3.38Å; L642-R646 WeakPolarHBondContact O-CG 3.3Å; L642-R646 PolarHBondContact O-N 2.83Å
643	E	88.4	Confident	90.6	Very high	88 Å²	88	59.7 Å²	59.7	41%	0.411	28%	0.283	S	S	.	.	H	α-helix	trans	-64.7	-51.5	177.9	-80.7	-72.9	87.1	0	0	112.7	E639 A645 R646 E647	E639-E643 HydrophobicContact CG-CG 4.23Å; E639-E643 PolarHBondContact O-N 2.86Å; E643-A645 PolarHBondContact O-N 3.39Å; E643-R646 PolarHBondContact O-N 2.75Å; E643-R646 VanDerWaalsContact O-N 3.15Å; E643-R646 WeakPolarHBondContact OE1-CD 3.46Å; E643-R646 IonicContact OE1-CZ 2.75Å; E643-R646 IonicContact OE1-NE 3.81Å; E643-R646 IonicContact OE1-NH1 3.9Å; E643-R646 PolarHBondContact OE1-NH1 3.37Å; E643-E647 PolarHBondContact O-N 3.16Å
644	P	90.6	Very high	90.4	Very high	54 Å²	54	57.4 Å²	57.4	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-60	-28.9	173	-23.6	34.4	0	0	0	113.3	L577 E640 E647 R648	L577-P644 HydrophobicContact CD1-CB 4.11Å; L577-P644 HydrophobicContact CD2-CB 4.1Å; E640-P644 WeakPolarHBondContact O-CD 3.47Å; E640-P644 WeakPolarHBondContact O-CG 3.29Å; P644-E647 PolarHBondContact O-N 3.29Å; P644-R648 WeakPolarHBondContact O-CB 3.42Å; P644-R648 PolarHBondContact O-N 3.36Å
645	A	89.4	Confident	90	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-70.1	-45.3	175.2	0	0	0	0	0	112	L573 L577 F597 M601 V641 L642 E643 E647 R648 Q649	L573-A645 HydrophobicContact CD2-CB 4.36Å; L577-A645 HydrophobicContact CD1-CB 4.25Å; L577-A645 HydrophobicContact CD2-CB 4.42Å; F597-A645 HydrophobicContact CE1-CB 3.77Å; F597-A645 WeakPolarHBondContact CE1-O 3.49Å; F597-A645 HydrophobicContact CZ-CB 3.67Å; M601-A645 HydrophobicContact CG-CB 4.16Å; M601-A645 HydrophobicContact SD-CB 3.37Å; M601-A645 WeakPolarHBondContact SD-CB 3.41Å; V641-A645 WeakPolarHBondContact O-CB 3.38Å; V641-A645 PolarHBondContact O-N 3.5Å; L642-A645 PolarHBondContact O-N 3.23Å; E643-A645 PolarHBondContact O-N 3.39Å; A645-E647 PolarHBondContact O-N 3.43Å; A645-R648 PolarHBondContact O-N 3.37Å; A645-Q649 WeakPolarHBondContact O-CB 3.25Å; A645-Q649 PolarHBondContact O-N 2.84Å
646	R	90.4	Very high	89.7	Confident	72 Å²	72	56.3 Å²	56.3	27%	0.272	28%	0.276	S	S	.	.	H	α-helix	trans	-62.1	-28.7	172.4	-66	158.3	-170	163.3	9.9	112.1	E639 L642 E643 K650	E639-R646 IonicContact OE1-CZ 2.99Å; E639-R646 IonicContact OE1-NH1 3.54Å; E639-R646 PolarHBondContact OE1-NH1 3.19Å; E639-R646 IonicContact OE1-NH2 3.05Å; E639-R646 IonicContact OE2-CZ 2.65Å; E639-R646 IonicContact OE2-NH1 2.86Å; E639-R646 IonicContact OE2-NH2 4Å; E639-R646 PolarHBondContact OE2-NH2 3.34Å; L642-R646 WeakPolarHBondContact O-CD 3.38Å; L642-R646 WeakPolarHBondContact O-CG 3.3Å; L642-R646 PolarHBondContact O-N 2.83Å; E643-R646 PolarHBondContact O-N 2.75Å; E643-R646 VanDerWaalsContact O-N 3.15Å; E643-R646 WeakPolarHBondContact OE1-CD 3.46Å; E643-R646 IonicContact OE1-CZ 2.75Å; E643-R646 IonicContact OE1-NE 3.81Å; E643-R646 IonicContact OE1-NH1 3.9Å; E643-R646 PolarHBondContact OE1-NH1 3.37Å; R646-K650 WeakPolarHBondContact O-CD 3.09Å; R646-K650 VanDerWaalsContact O-CE 3.31Å; R646-K650 WeakPolarHBondContact O-CE 3.26Å; R646-K650 WeakPolarHBondContact O-CG 3.13Å; R646-K650 PolarHBondContact O-N 3.34Å
647	E	90	Very high	89.6	Confident	133 Å²	133	59.5 Å²	59.5	62%	0.621	27%	0.274	S	S	*	.	H	α-helix	trans	-72.6	-46.7	171.8	-69.7	-173.2	150.3	0	0	112	E643 P644 A645 Q649 K650 F651	E643-E647 PolarHBondContact O-N 3.16Å; P644-E647 PolarHBondContact O-N 3.29Å; A645-E647 PolarHBondContact O-N 3.43Å; E647-Q649 PolarHBondContact O-N 3.14Å; E647-K650 PolarHBondContact O-N 2.9Å; E647-F651 PolarHBondContact O-N 3.35Å
648	R	89.1	Confident	89.2	Confident	39 Å²	39	60.3 Å²	60.3	15%	0.147	28%	0.28	C	S	.	.	H	α-helix	trans	-63.9	-36.4	178.4	-172.2	169.4	177.5	147.2	-7.5	113	T576 L577 E579 M581 F597 P644 A645 F651 L652	T576-R648 PolarHBondContact O-NH1 3.42Å; L577-R648 HydrophobicContact CD2-CB 4.37Å; L577-R648 PolarHBondContact O-NH1 3.09Å; L577-R648 VanDerWaalsContact O-NH1 3.07Å; E579-R648 PolarHBondContact O-NH1 3.04Å; E579-R648 PolarHBondContact O-NH2 3.29Å; M581-R648 HydrophobicContact CE-CG 4.12Å; M581-R648 HydrophobicContact SD-CG 4.31Å; F597-R648 HydrophobicContact CE1-CB 4.27Å; F597-R648 HydrophobicContact CE2-CG 4.49Å; F597-R648 HydrophobicContact CZ-CB 4.19Å; F597-R648 HydrophobicContact CZ-CG 4.38Å; P644-R648 WeakPolarHBondContact O-CB 3.42Å; P644-R648 PolarHBondContact O-N 3.36Å; A645-R648 PolarHBondContact O-N 3.37Å; R648-F651 PolarHBondContact O-N 3.14Å; R648-L652 WeakPolarHBondContact O-CG 3.36Å; R648-L652 PolarHBondContact O-N 3.07Å
649	Q	89.7	Confident	89	Confident	41 Å²	41	58.4 Å²	58.4	19%	0.192	28%	0.275	C	S	.	.	H	α-helix	trans	-58.6	-56.8	172.3	-172.9	-171.2	13.8	0	0	110.9	L594 E598 M601 A645 E647 F651 L652 E653	L594-Q649 HydrophobicContact CD1-CG 3.75Å; E598-Q649 HydrophobicContact CG-CG 4.34Å; E598-Q649 PolarHBondContact OE1-NE2 2.68Å; M601-Q649 HydrophobicContact CE-CB 4.35Å; M601-Q649 HydrophobicContact CE-CG 4.43Å; A645-Q649 WeakPolarHBondContact O-CB 3.25Å; A645-Q649 PolarHBondContact O-N 2.84Å; E647-Q649 PolarHBondContact O-N 3.14Å; Q649-F651 PolarHBondContact O-N 3.16Å; Q649-L652 PolarHBondContact O-N 3.39Å; Q649-L652 VanDerWaalsContact O-N 3.1Å; Q649-E653 WeakPolarHBondContact O-CG 3.32Å; Q649-E653 PolarHBondContact O-N 2.98Å
650	K	90.5	Very high	88.8	Confident	122 Å²	122	60.1 Å²	60.1	53%	0.53	28%	0.283	S	S	.	.	H	α-helix	trans	-58	-33	178.9	-68.1	164.1	-165	159	0	113.2	R646 E647 S654	R646-K650 WeakPolarHBondContact O-CD 3.09Å; R646-K650 VanDerWaalsContact O-CE 3.31Å; R646-K650 WeakPolarHBondContact O-CE 3.26Å; R646-K650 WeakPolarHBondContact O-CG 3.13Å; R646-K650 PolarHBondContact O-N 3.34Å; E647-K650 PolarHBondContact O-N 2.9Å; K650-S654 WeakPolarHBondContact O-CB 3.39Å; K650-S654 PolarHBondContact O-N 2.9Å
651	F	87.2	Confident	88.7	Confident	100 Å²	100	58.4 Å²	58.4	44%	0.439	28%	0.277	S	S	.	.	H	α-helix	trans	-67.4	-51	175.3	-171.1	-80.1	0	0	0	111.2	M581 E647 R648 Q649 E653 S654 D655	M581-F651 HydrophobicContact CE-CD1 3.61Å; M581-F651 HydrophobicContact CE-CE1 4.13Å; M581-F651 HydrophobicContact SD-CD1 4.06Å; M581-F651 HydrophobicContact SD-CE1 4.27Å; E647-F651 PolarHBondContact O-N 3.35Å; R648-F651 PolarHBondContact O-N 3.14Å; Q649-F651 PolarHBondContact O-N 3.16Å; F651-E653 VanDerWaalsContact C-N 3.34Å; F651-E653 PolarHBondContact O-N 3.05Å; F651-S654 WeakPolarHBondContact O-CA 3.31Å; F651-S654 WeakPolarHBondContact O-CB 3.46Å; F651-S654 PolarHBondContact O-N 3.47Å; F651-D655 VanDerWaalsContact CE1-CG 3.5Å; F651-D655 WeakPolarHBondContact CE1-OD2 3.42Å; F651-D655 PolarHBondContact O-N 2.92Å
652	L	87.3	Confident	88.4	Confident	3 Å²	3	59 Å²	59	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-57.4	-44.6	176.6	-75.4	167.8	0	0	0	112.4	M581 Q593 L594 F597 R648 Q649 S654 A656	M581-L652 HydrophobicContact CE-CD1 4.26Å; M581-L652 HydrophobicContact CE-CD2 3.38Å; M581-L652 HydrophobicContact CE-CG 3.5Å; Q593-L652 HydrophobicContact CB-CD1 4.31Å; Q593-L652 HydrophobicContact CB-CD2 3.76Å; L594-L652 HydrophobicContact CB-CB 4.32Å; L594-L652 HydrophobicContact CD1-CB 4.05Å; F597-L652 HydrophobicContact CB-CD1 4.43Å; R648-L652 WeakPolarHBondContact O-CG 3.36Å; R648-L652 PolarHBondContact O-N 3.07Å; Q649-L652 PolarHBondContact O-N 3.39Å; Q649-L652 VanDerWaalsContact O-N 3.1Å; L652-S654 PolarHBondContact O-N 3.4Å; L652-A656 WeakPolarHBondContact O-CB 3.39Å; L652-A656 PolarHBondContact O-N 3.39Å; L652-A656 VanDerWaalsContact O-N 3.15Å
653	E	89.3	Confident	88.2	Confident	63 Å²	63	62.2 Å²	62.2	29%	0.294	30%	0.295	S	S	.	.	H	α-helix	trans	-59.4	-32.8	173.4	-62.5	171.5	-139.6	0	0	112.9	L594 Q649 F651 R657	L594-E653 HydrophobicContact CD1-CG 4.21Å; L594-E653 HydrophobicContact CD2-CG 3.92Å; Q649-E653 WeakPolarHBondContact O-CG 3.32Å; Q649-E653 PolarHBondContact O-N 2.98Å; F651-E653 VanDerWaalsContact C-N 3.34Å; F651-E653 PolarHBondContact O-N 3.05Å; E653-R657 VanDerWaalsContact O-CG 3.3Å; E653-R657 WeakPolarHBondContact O-CG 3.36Å; E653-R657 PolarHBondContact O-N 3.35Å; E653-R657 PolarHBondContact O-NE 2.97Å; E653-R657 PolarHBondContact O-NH1 2.73Å; E653-R657 PolarHBondContact O-NH2 3.16Å; E653-R657 IonicContact OE2-NH2 3.36Å; E653-R657 PolarHBondContact OE2-NH2 3.02Å
654	S	89.1	Confident	88.2	Confident	53 Å²	53	63.3 Å²	63.3	37%	0.371	30%	0.3	S	S	.	.	H	α-helix	trans	-76.3	-49.4	-176.7	-163.7	0	0	0	0	111.9	K650 F651 L652 A656 R657 E658	K650-S654 WeakPolarHBondContact O-CB 3.39Å; K650-S654 PolarHBondContact O-N 2.9Å; F651-S654 WeakPolarHBondContact O-CA 3.31Å; F651-S654 WeakPolarHBondContact O-CB 3.46Å; F651-S654 PolarHBondContact O-N 3.47Å; L652-S654 PolarHBondContact O-N 3.4Å; S654-A656 VanDerWaalsContact C-N 3.34Å; S654-A656 PolarHBondContact O-N 3.09Å; S654-R657 PolarHBondContact O-N 2.9Å; S654-E658 PolarHBondContact O-N 3.41Å
655	D	85.1	Confident	87.9	Confident	21 Å²	21	62.9 Å²	62.9	11%	0.112	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-39.1	-179.3	-76.5	30.1	0	0	0	111.3	F590 F651 R657 E658 A659	F590-D655 HydrophobicContact CD1-CB 3.63Å; F590-D655 HydrophobicContact CD2-CB 4.39Å; F590-D655 HydrophobicContact CE1-CB 3.36Å; F590-D655 HydrophobicContact CE2-CB 4.18Å; F590-D655 HydrophobicContact CG-CB 4.15Å; F590-D655 HydrophobicContact CZ-CB 3.68Å; F651-D655 VanDerWaalsContact CE1-CG 3.5Å; F651-D655 WeakPolarHBondContact CE1-OD2 3.42Å; F651-D655 PolarHBondContact O-N 2.92Å; D655-R657 VanDerWaalsContact C-N 3.32Å; D655-R657 PolarHBondContact O-N 2.9Å; D655-E658 PolarHBondContact O-N 2.99Å; D655-A659 PolarHBondContact O-N 3.3Å
656	A	87.6	Confident	87.8	Confident	14 Å²	14	63.4 Å²	63.4	12%	0.116	30%	0.296	C	S	.	.	H	α-helix	trans	-56.4	-44.8	172.6	0	0	0	0	0	112.2	F590 L652 S654 Q660	F590-A656 HydrophobicContact CB-CB 3.76Å; L652-A656 WeakPolarHBondContact O-CB 3.39Å; L652-A656 PolarHBondContact O-N 3.39Å; L652-A656 VanDerWaalsContact O-N 3.15Å; S654-A656 VanDerWaalsContact C-N 3.34Å; S654-A656 PolarHBondContact O-N 3.09Å; A656-Q660 PolarHBondContact O-N 3.48Å
657	R	88.5	Confident	87.7	Confident	131 Å²	131	66.2 Å²	66.2	49%	0.494	31%	0.312	S	S	.	.	H	α-helix	trans	-69.1	-32	177.8	-75.7	-175.2	-98.9	99.6	-8.4	112.9	E653 S654 D655	E653-R657 VanDerWaalsContact O-CG 3.3Å; E653-R657 WeakPolarHBondContact O-CG 3.36Å; E653-R657 PolarHBondContact O-N 3.35Å; E653-R657 PolarHBondContact O-NE 2.97Å; E653-R657 PolarHBondContact O-NH1 2.73Å; E653-R657 PolarHBondContact O-NH2 3.16Å; E653-R657 IonicContact OE2-NH2 3.36Å; E653-R657 PolarHBondContact OE2-NH2 3.02Å; S654-R657 PolarHBondContact O-N 2.9Å; D655-R657 VanDerWaalsContact C-N 3.32Å; D655-R657 PolarHBondContact O-N 2.9Å
658	E	85.7	Confident	87.5	Confident	67 Å²	67	64.3 Å²	64.3	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-73.6	-43.7	176.3	-175.8	161.5	-173.6	0	0	112.2	S654 D655 Q660 N661 I662 Q717	S654-E658 PolarHBondContact O-N 3.41Å; D655-E658 PolarHBondContact O-N 2.99Å; E658-Q660 PolarHBondContact O-N 2.94Å; E658-N661 PolarHBondContact O-N 3.04Å; E658-I662 HydrophobicContact CG-CD1 4.1Å; E658-I662 WeakPolarHBondContact O-CG1 3.45Å; E658-I662 PolarHBondContact O-N 3.43Å; E658-Q717 PolarHBondContact OE1-NE2 3.46Å
659	A	86.2	Confident	87.4	Confident	6 Å²	6	62.9 Å²	62.9	5%	0.05	30%	0.299	C	S	.	.	H	α-helix	trans	-57.2	-49	176.2	0	0	0	0	0	111.8	A587 F590 D655 N661 I662 E663	A587-A659 HydrophobicContact CB-CB 4.03Å; F590-A659 HydrophobicContact CD2-CB 4.19Å; F590-A659 HydrophobicContact CE2-CB 4.25Å; D655-A659 PolarHBondContact O-N 3.3Å; A659-N661 VanDerWaalsContact C-N 3.31Å; A659-N661 PolarHBondContact O-N 3.37Å; A659-I662 PolarHBondContact O-N 2.88Å; A659-E663 PolarHBondContact O-N 3.35Å; A659-E663 VanDerWaalsContact O-N 3.15Å
660	Q	88.5	Confident	87.3	Confident	125 Å²	125	64.3 Å²	64.3	58%	0.584	31%	0.307	S	S	*	.	H	α-helix	trans	-55.8	-41.7	179.3	-172.5	-177.3	28.3	0	0	113	A587 A656 E658 I662 E663 Q664	A587-Q660 HydrophobicContact CB-CB 4.22Å; A656-Q660 PolarHBondContact O-N 3.48Å; E658-Q660 PolarHBondContact O-N 2.94Å; Q660-I662 VanDerWaalsContact C-N 3.33Å; Q660-I662 PolarHBondContact O-N 3.22Å; Q660-E663 PolarHBondContact O-N 2.92Å; Q660-Q664 PolarHBondContact O-N 2.85Å; Q660-Q664 VanDerWaalsContact O-N 3.14Å
661	N	88	Confident	87.2	Confident	79 Å²	79	61.8 Å²	61.8	42%	0.422	31%	0.305	S	S	.	.	H	α-helix	trans	-67.2	-30.3	179	169.3	46.7	0	0	0	113.1	E658 A659 Q665	E658-N661 PolarHBondContact O-N 3.04Å; A659-N661 VanDerWaalsContact C-N 3.31Å; A659-N661 PolarHBondContact O-N 3.37Å; N661-Q665 PolarHBondContact ND2-NE2 3.4Å; N661-Q665 WeakPolarHBondContact O-CG 3.45Å; N661-Q665 PolarHBondContact O-N 2.83Å; N661-Q665 PolarHBondContact O-NE2 3.15Å; N661-Q665 PolarHBondContact OD1-NE2 3.3Å
662	I	84.8	Confident	87.2	Confident	13 Å²	13	57.9 Å²	57.9	7%	0.067	29%	0.287	C	S	.	.	H	α-helix	trans	-75.7	-41.8	177.9	-68.3	161.2	0	0	0	110.6	E658 A659 Q660 Q664 Q665 L666 L714 Q717 Y721 L733	E658-I662 HydrophobicContact CG-CD1 4.1Å; E658-I662 WeakPolarHBondContact O-CG1 3.45Å; E658-I662 PolarHBondContact O-N 3.43Å; A659-I662 PolarHBondContact O-N 2.88Å; Q660-I662 VanDerWaalsContact C-N 3.33Å; Q660-I662 PolarHBondContact O-N 3.22Å; I662-Q664 VanDerWaalsContact C-N 3.32Å; I662-Q664 PolarHBondContact O-N 3.34Å; I662-Q665 PolarHBondContact O-N 3.24Å; I662-L666 HydrophobicContact CG2-CD1 4.25Å; I662-L666 WeakPolarHBondContact O-CG 3.19Å; I662-L666 PolarHBondContact O-N 3.42Å; I662-L666 VanDerWaalsContact O-N 3.1Å; I662-L714 HydrophobicContact CG2-CD2 4.43Å; I662-Q717 HydrophobicContact CD1-CG 3.68Å; I662-Q717 HydrophobicContact CG1-CG 4.18Å; I662-Y721 HydrophobicContact CD1-CE2 3.9Å; I662-Y721 WeakPolarHBondContact CD1-OH 3.48Å; I662-L733 HydrophobicContact CG2-CD1 3.59Å; I662-L733 HydrophobicContact CG2-CD2 4.05Å; I662-L733 HydrophobicContact CG2-CG 4.44Å
663	E	86.3	Confident	87.2	Confident	82 Å²	82	57.9 Å²	57.9	38%	0.383	29%	0.287	S	S	.	.	H	α-helix	trans	-61.6	-39.8	176	-66.6	-178.2	144.4	0	0	111.9	D586 A659 Q660 L666 H667	D586-E663 WeakPolarHBondContact CB-OE1 3.42Å; A659-E663 PolarHBondContact O-N 3.35Å; A659-E663 VanDerWaalsContact O-N 3.15Å; Q660-E663 PolarHBondContact O-N 2.92Å; E663-L666 PolarHBondContact O-N 3.32Å; E663-H667 PolarHBondContact O-N 3.29Å
664	Q	88.1	Confident	87.2	Confident	112 Å²	112	57.9 Å²	57.9	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-59	-51.1	172.9	-176.2	-177.1	-26.1	0	0	112.1	Q660 I662 L666 H667 E668	Q660-Q664 PolarHBondContact O-N 2.85Å; Q660-Q664 VanDerWaalsContact O-N 3.14Å; I662-Q664 VanDerWaalsContact C-N 3.32Å; I662-Q664 PolarHBondContact O-N 3.34Å; Q664-L666 VanDerWaalsContact C-N 3.27Å; Q664-L666 PolarHBondContact O-N 2.96Å; Q664-H667 WeakPolarHBondContact O-CB 2.92Å; Q664-H667 PolarHBondContact O-N 3.05Å; Q664-H667 VanDerWaalsContact O-N 3.11Å; Q664-E668 WeakPolarHBondContact CG-OE1 3.09Å; Q664-E668 PolarHBondContact NE2-OE1 2.89Å; Q664-E668 WeakPolarHBondContact O-CG 3.14Å; Q664-E668 PolarHBondContact O-N 2.82Å
665	Q	86.1	Confident	87	Confident	45 Å²	45	60.1 Å²	60.1	21%	0.21	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-32.4	-178.1	-73	173.9	57.8	0	0	113	N661 I662 C669 L714	N661-Q665 PolarHBondContact ND2-NE2 3.4Å; N661-Q665 WeakPolarHBondContact O-CG 3.45Å; N661-Q665 PolarHBondContact O-N 2.83Å; N661-Q665 PolarHBondContact O-NE2 3.15Å; N661-Q665 PolarHBondContact OD1-NE2 3.3Å; I662-Q665 PolarHBondContact O-N 3.24Å; Q665-C669 PolarHBondContact O-N 2.75Å; Q665-C669 PolarHBondContact O-SG 3.4Å; Q665-L714 HydrophobicContact CB-CD2 3.97Å
666	L	86.8	Confident	87	Confident	10 Å²	10	59.2 Å²	59.2	5%	0.052	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-45.5	172.2	-74.7	166.4	0	0	0	111.9	I662 E663 Q664 C669 L670 L714 L733 Q736 V737 L740	I662-L666 HydrophobicContact CG2-CD1 4.25Å; I662-L666 WeakPolarHBondContact O-CG 3.19Å; I662-L666 PolarHBondContact O-N 3.42Å; I662-L666 VanDerWaalsContact O-N 3.1Å; E663-L666 PolarHBondContact O-N 3.32Å; Q664-L666 VanDerWaalsContact C-N 3.27Å; Q664-L666 PolarHBondContact O-N 2.96Å; L666-C669 PolarHBondContact O-N 3.37Å; L666-L670 WeakPolarHBondContact O-CG 3.22Å; L666-L670 PolarHBondContact O-N 2.96Å; L666-L714 HydrophobicContact CD2-CD1 3.8Å; L666-L714 HydrophobicContact CG-CD1 4.27Å; L666-L733 HydrophobicContact CD1-CD1 3.79Å; L666-L733 HydrophobicContact CD2-CD1 4.13Å; L666-L733 HydrophobicContact CG-CD1 4.21Å; L666-Q736 HydrophobicContact CD1-CB 4.38Å; L666-Q736 HydrophobicContact CD2-CB 3.84Å; L666-V737 HydrophobicContact CD2-CG2 4.38Å; L666-L740 HydrophobicContact CD2-CD1 3.9Å
667	H	87.9	Confident	86.9	Confident	132 Å²	132	59 Å²	59	61%	0.611	29%	0.291	S	S	*	.	H	α-helix	trans	-61.5	-45.8	178.7	-175	87.8	0	0	0	111.9	E663 Q664 C669 L670 S671	E663-H667 PolarHBondContact O-N 3.29Å; Q664-H667 WeakPolarHBondContact O-CB 2.92Å; Q664-H667 PolarHBondContact O-N 3.05Å; Q664-H667 VanDerWaalsContact O-N 3.11Å; H667-C669 VanDerWaalsContact C-N 3.31Å; H667-C669 PolarHBondContact O-N 3.03Å; H667-L670 PolarHBondContact O-N 2.63Å; H667-S671 WeakPolarHBondContact O-CB 3.22Å; H667-S671 PolarHBondContact O-N 3.25Å
668	E	86.6	Confident	86.8	Confident	93 Å²	93	54.7 Å²	54.7	44%	0.435	28%	0.276	S	S	.	.	H	α-helix	trans	-55.7	-43.7	176.4	-72.1	173.6	-171.5	0	0	112.1	Q664 W672	Q664-E668 WeakPolarHBondContact CG-OE1 3.09Å; Q664-E668 PolarHBondContact NE2-OE1 2.89Å; Q664-E668 WeakPolarHBondContact O-CG 3.14Å; Q664-E668 PolarHBondContact O-N 2.82Å; E668-W672 PolarHBondContact O-N 3.16Å
669	C	85.9	Confident	86.7	Confident	8 Å²	8	53.8 Å²	53.8	5%	0.054	27%	0.272	C	S	.	.	H	α-helix	trans	-71.5	-37.8	179.4	-64.9	0	0	0	0	113.3	Q665 L666 H667 L673 L740	Q665-C669 PolarHBondContact O-N 2.75Å; Q665-C669 PolarHBondContact O-SG 3.4Å; L666-C669 PolarHBondContact O-N 3.37Å; H667-C669 VanDerWaalsContact C-N 3.31Å; H667-C669 PolarHBondContact O-N 3.03Å; C669-L673 WeakPolarHBondContact O-CD1 3.46Å; C669-L673 WeakPolarHBondContact O-CG 3.46Å; C669-L673 PolarHBondContact O-N 3.16Å; C669-L740 HydrophobicContact CB-CD1 3.82Å; C669-L740 HydrophobicContact CB-CD2 3.63Å; C669-L740 HydrophobicContact CB-CG 4.39Å
670	L	87.5	Confident	86.4	Confident	72 Å²	72	54.7 Å²	54.7	38%	0.377	28%	0.276	S	S	.	.	H	α-helix	trans	-67.7	-38.3	176.8	-75	170.1	0	0	0	112.1	L666 H667 S674 L740	L666-L670 WeakPolarHBondContact O-CG 3.22Å; L666-L670 PolarHBondContact O-N 2.96Å; H667-L670 PolarHBondContact O-N 2.63Å; L670-S674 PolarHBondContact O-N 3.44Å; L670-S674 PolarHBondContact O-OG 3.15Å; L670-L740 HydrophobicContact CD2-CD2 3.65Å; L670-L740 HydrophobicContact CD2-CG 4.32Å; L670-L740 HydrophobicContact CG-CD2 3.81Å
671	S	88.1	Confident	86.1	Confident	68 Å²	68	51.8 Å²	51.8	48%	0.476	26%	0.262	S	S	.	.	H	α-helix	trans	-63.2	-53.2	178.9	-173.8	0	0	0	0	111.4	H667 L673 S674 Q675	H667-S671 WeakPolarHBondContact O-CB 3.22Å; H667-S671 PolarHBondContact O-N 3.25Å; S671-L673 PolarHBondContact O-N 3.4Å; S671-S674 WeakPolarHBondContact O-CB 3.26Å; S671-S674 PolarHBondContact O-N 2.93Å; S671-S674 VanDerWaalsContact O-N 3.11Å; S671-Q675 PolarHBondContact O-N 3.4Å; S671-Q675 VanDerWaalsContact O-N 3.08Å
672	W	88.5	Confident	85.5	Confident	19 Å²	19	50.3 Å²	50.3	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-61.5	-44.2	-178.9	176.6	83.8	0	0	0	113.4	E668 S674 Q675 V676 D703 F704 H707	E668-W672 PolarHBondContact O-N 3.16Å; W672-S674 PolarHBondContact O-N 3.06Å; W672-Q675 WeakPolarHBondContact O-CB 3.46Å; W672-Q675 PolarHBondContact O-N 2.93Å; W672-V676 HydrophobicContact CD2-CG2 4.12Å; W672-V676 HydrophobicContact CH2-CG2 4Å; W672-V676 HydrophobicContact CZ2-CG2 3.51Å; W672-V676 PolarHBondContact O-N 3.27Å; W672-D703 HydrophobicContact CZ2-CB 3.59Å; W672-F704 HydrophobicContact CH2-CB 4.21Å; W672-F704 AromaticContact CH2-CD1 3.68Å; W672-F704 HydrophobicContact CH2-CD1 3.68Å; W672-F704 HydrophobicContact CH2-CD2 4.02Å; W672-F704 AromaticContact CH2-CE1 3.96Å; W672-F704 HydrophobicContact CH2-CE1 3.96Å; W672-F704 HydrophobicContact CH2-CE2 4.27Å; W672-F704 AromaticContact CH2-CG 3.69Å; W672-F704 HydrophobicContact CH2-CG 3.69Å; W672-F704 HydrophobicContact CH2-CZ 4.24Å; W672-F704 HydrophobicContact CZ2-CD2 4.44Å; W672-F704 HydrophobicContact CZ2-CG 4.38Å; W672-F704 HydrophobicContact CZ3-CD1 4.31Å; W672-F704 HydrophobicContact CZ3-CE1 4.42Å; W672-H707 VanDerWaalsContact CB-CE1 3.49Å; W672-H707 WeakPolarHBondContact CB-CE1 3.33Å; W672-H707 AromaticContact CD1-CD2 3.8Å; W672-H707 AromaticContact CD1-NE2 3.55Å; W672-H707 HydrophobicContact CD2-CB 4.26Å; W672-H707 AromaticContact CD2-CD2 3.24Å; W672-H707 AromaticContact CD2-CG 3.63Å; W672-H707 AromaticContact CD2-NE2 3.69Å; W672-H707 AromaticContact CE2-CD2 3.62Å; W672-H707 HydrophobicContact CE3-CB 3.66Å; W672-H707 AromaticContact CE3-CD2 3.59Å; W672-H707 AromaticContact CE3-CG 3.47Å; W672-H707 VanDerWaalsContact CE3-CG 3.47Å; W672-H707 AromaticContact CG-CD2 3.42Å; W672-H707 VanDerWaalsContact CG-CD2 3.42Å; W672-H707 AromaticContact CG-CE1 3.73Å; W672-H707 AromaticContact CG-CG 3.96Å; W672-H707 AromaticContact CG-NE2 3.28Å; W672-H707 VanDerWaalsContact CG-NE2 3.28Å; W672-H707 HydrophobicContact CZ3-CB 3.83Å; W672-H707 AromaticContact NE1-CD2 3.89Å
673	L	87.2	Confident	85.1	Confident	3 Å²	3	53 Å²	53	2%	0.016	27%	0.265	C	S	.	.	H	α-helix	trans	-58.7	-36.3	176.2	-73.9	168.2	0	0	0	111.9	C669 S671 D677 L740 Y743 M744 L747	C669-L673 WeakPolarHBondContact O-CD1 3.46Å; C669-L673 WeakPolarHBondContact O-CG 3.46Å; C669-L673 PolarHBondContact O-N 3.16Å; S671-L673 PolarHBondContact O-N 3.4Å; L673-D677 PolarHBondContact O-N 3.03Å; L673-D677 VanDerWaalsContact O-N 3.12Å; L673-L740 HydrophobicContact CD1-CD2 3.6Å; L673-Y743 HydrophobicContact CB-CD1 3.58Å; L673-Y743 HydrophobicContact CB-CE1 3.62Å; L673-Y743 HydrophobicContact CB-CG 4.32Å; L673-Y743 HydrophobicContact CD1-CD1 3.94Å; L673-Y743 HydrophobicContact CD1-CG 4.37Å; L673-Y743 HydrophobicContact CG-CD1 4.3Å; L673-M744 HydrophobicContact CD2-CB 3.85Å; L673-M744 HydrophobicContact CD2-CG 4.19Å; L673-L747 HydrophobicContact CB-CD1 4.43Å; L673-L747 HydrophobicContact CD2-CD1 4.1Å; L673-L747 WeakPolarHBondContact O-CD1 3.13Å
674	S	88	Confident	84.3	Confident	62 Å²	62	53 Å²	53	43%	0.434	27%	0.274	S	S	.	.	H	α-helix	trans	-69.8	-34.4	176.9	-56.8	0	0	0	0	112.6	L670 S671 W672 F678	L670-S674 PolarHBondContact O-N 3.44Å; L670-S674 PolarHBondContact O-OG 3.15Å; S671-S674 WeakPolarHBondContact O-CB 3.26Å; S671-S674 PolarHBondContact O-N 2.93Å; S671-S674 VanDerWaalsContact O-N 3.11Å; W672-S674 PolarHBondContact O-N 3.06Å; S674-F678 PolarHBondContact O-N 2.84Å
675	Q	86.5	Confident	83.7	Confident	101 Å²	101	54.5 Å²	54.5	47%	0.472	28%	0.281	S	S	.	.	H	α-helix	trans	-68.5	-41	174.9	-165.7	173.3	27.3	0	0	112.1	S671 W672 F678 I679	S671-Q675 PolarHBondContact O-N 3.4Å; S671-Q675 VanDerWaalsContact O-N 3.08Å; W672-Q675 WeakPolarHBondContact O-CB 3.46Å; W672-Q675 PolarHBondContact O-N 2.93Å; Q675-F678 WeakPolarHBondContact O-CB 3.34Å; Q675-F678 PolarHBondContact O-N 3.4Å; Q675-F678 VanDerWaalsContact O-N 3.17Å; Q675-I679 HydrophobicContact CG-CD1 4.15Å; Q675-I679 WeakPolarHBondContact O-CG1 3.39Å; Q675-I679 PolarHBondContact O-N 3.12Å
676	V	85.2	Confident	82.9	Confident	2 Å²	2	56 Å²	56	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-67	-38.4	176.5	175.2	0	0	0	0	112	W672 F678 I679 L680 L700 F704 L747	W672-V676 HydrophobicContact CD2-CG2 4.12Å; W672-V676 HydrophobicContact CH2-CG2 4Å; W672-V676 HydrophobicContact CZ2-CG2 3.51Å; W672-V676 PolarHBondContact O-N 3.27Å; V676-F678 PolarHBondContact O-N 3.46Å; V676-I679 PolarHBondContact O-N 2.83Å; V676-L680 HydrophobicContact CG1-CD1 3.72Å; V676-L680 HydrophobicContact CG1-CG 4.31Å; V676-L680 WeakPolarHBondContact O-CB 3.39Å; V676-L680 WeakPolarHBondContact O-CG 3.38Å; V676-L680 PolarHBondContact O-N 2.94Å; V676-L680 VanDerWaalsContact O-N 3.13Å; V676-L700 HydrophobicContact CG1-CD2 4.42Å; V676-L700 HydrophobicContact CG2-CD2 4.05Å; V676-F704 HydrophobicContact CG1-CE2 3.98Å; V676-F704 HydrophobicContact CG1-CZ 4.08Å; V676-L747 HydrophobicContact CB-CD1 4.21Å; V676-L747 HydrophobicContact CG1-CB 4.4Å; V676-L747 HydrophobicContact CG1-CD1 4.2Å
677	D	85.3	Confident	81.8	Confident	9 Å²	9	62.6 Å²	62.6	5%	0.048	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-24.6	173.3	-168.3	41.5	0	0	0	112.9	L673 K681 Y743 L747 K750	L673-D677 PolarHBondContact O-N 3.03Å; L673-D677 VanDerWaalsContact O-N 3.12Å; D677-K681 WeakPolarHBondContact O-CG 3.27Å; D677-K681 PolarHBondContact O-NZ 3.42Å; D677-K681 IonicContact OD1-NZ 2.67Å; D677-K681 PolarHBondContact OD1-NZ 2.92Å; D677-K681 IonicContact OD2-NZ 2.91Å; D677-K681 PolarHBondContact OD2-NZ 3.04Å; D677-Y743 HydrophobicContact CB-CE2 4.14Å; D677-Y743 VanDerWaalsContact CB-OH 3.3Å; D677-Y743 WeakPolarHBondContact CB-OH 3.37Å; D677-L747 HydrophobicContact CB-CD1 4.08Å; D677-L747 HydrophobicContact CB-CD2 3.61Å; D677-L747 VanDerWaalsContact OD1-CD2 3.27Å; D677-L747 WeakPolarHBondContact OD1-CD2 3.39Å; D677-K750 IonicContact OD1-NZ 3.89Å; D677-K750 PolarHBondContact OD1-NZ 3.36Å
678	F	85.5	Confident	80.7	Confident	40 Å²	40	58.5 Å²	58.5	18%	0.175	31%	0.313	C	S	.	.	H	α-helix	trans	-77.3	-55.7	172.8	176.1	-123.8	0	0	0	111.3	S674 Q675 V676 L680 K681 T682 V1193	S674-F678 PolarHBondContact O-N 2.84Å; Q675-F678 WeakPolarHBondContact O-CB 3.34Å; Q675-F678 PolarHBondContact O-N 3.4Å; Q675-F678 VanDerWaalsContact O-N 3.17Å; V676-F678 PolarHBondContact O-N 3.46Å; F678-L680 VanDerWaalsContact C-N 3.27Å; F678-L680 PolarHBondContact O-N 3.33Å; F678-K681 WeakPolarHBondContact O-CB 3.28Å; F678-K681 PolarHBondContact O-N 3.31Å; F678-T682 WeakPolarHBondContact CE2-OG1 3.45Å; F678-T682 PolarHBondContact O-N 3Å; F678-T682 PolarHBondContact O-OG1 2.79Å; F678-V1193 HydrophobicContact CD2-CG2 4.46Å; F678-V1193 HydrophobicContact CE2-CG1 3.71Å; F678-V1193 HydrophobicContact CE2-CG2 4.36Å; F678-V1193 HydrophobicContact CZ-CG1 4.36Å
679	I	83.8	Confident	79.7	Confident	48 Å²	48	56.1 Å²	56.1	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-52.8	-45.1	-178.2	-66.1	164	0	0	0	111.5	Q675 V676 K681 T682 R683 L700	Q675-I679 HydrophobicContact CG-CD1 4.15Å; Q675-I679 WeakPolarHBondContact O-CG1 3.39Å; Q675-I679 PolarHBondContact O-N 3.12Å; V676-I679 PolarHBondContact O-N 2.83Å; I679-K681 VanDerWaalsContact C-N 3.27Å; I679-K681 PolarHBondContact O-N 3.2Å; I679-T682 PolarHBondContact O-N 3.25Å; I679-R683 HydrophobicContact CG2-CG 4.28Å; I679-R683 WeakPolarHBondContact O-CG 3.41Å; I679-R683 PolarHBondContact O-N 2.77Å; I679-R683 VanDerWaalsContact O-N 3.09Å; I679-L700 HydrophobicContact CD1-CD2 4.17Å; I679-L700 HydrophobicContact CG2-CD1 4.15Å; I679-L700 HydrophobicContact CG2-CD2 4.49Å
680	L	79.4	Confident	78.7	Confident	25 Å²	25	56.8 Å²	56.8	13%	0.131	31%	0.309	C	S	.	.	H	α-helix	trans	-70.7	-16.6	-178.8	-67.1	174	0	0	0	114.3	V676 F678 S684 L700 K750 L751	V676-L680 HydrophobicContact CG1-CD1 3.72Å; V676-L680 HydrophobicContact CG1-CG 4.31Å; V676-L680 WeakPolarHBondContact O-CB 3.39Å; V676-L680 WeakPolarHBondContact O-CG 3.38Å; V676-L680 PolarHBondContact O-N 2.94Å; V676-L680 VanDerWaalsContact O-N 3.13Å; F678-L680 VanDerWaalsContact C-N 3.27Å; F678-L680 PolarHBondContact O-N 3.33Å; L680-S684 PolarHBondContact O-OG 3.5Å; L680-L700 HydrophobicContact CD2-CD1 4.48Å; L680-K750 HydrophobicContact CD1-CB 4.03Å; L680-L751 HydrophobicContact CD2-CD1 3.96Å
681	K	81.9	Confident	77.5	Confident	64 Å²	64	56.6 Å²	56.6	28%	0.278	31%	0.314	S	S	.	.	H	α-helix	trans	-83.3	-55.2	168.4	-69.9	-175.6	-160.3	86.5	0	110.7	D677 F678 I679 R683 S684 E685	D677-K681 WeakPolarHBondContact O-CG 3.27Å; D677-K681 PolarHBondContact O-NZ 3.42Å; D677-K681 IonicContact OD1-NZ 2.67Å; D677-K681 PolarHBondContact OD1-NZ 2.92Å; D677-K681 IonicContact OD2-NZ 2.91Å; D677-K681 PolarHBondContact OD2-NZ 3.04Å; F678-K681 WeakPolarHBondContact O-CB 3.28Å; F678-K681 PolarHBondContact O-N 3.31Å; I679-K681 VanDerWaalsContact C-N 3.27Å; I679-K681 PolarHBondContact O-N 3.2Å; K681-R683 VanDerWaalsContact C-N 3.29Å; K681-R683 PolarHBondContact O-N 2.89Å; K681-S684 CarbonylContact O-C 3.55Å; K681-S684 WeakPolarHBondContact O-CA 3.27Å; K681-S684 WeakPolarHBondContact O-CB 3.5Å; K681-S684 PolarHBondContact O-N 3.09Å; K681-S684 PolarHBondContact O-OG 2.63Å; K681-E685 PolarHBondContact O-N 3.29Å; K681-E685 VanDerWaalsContact O-N 3.09Å
682	T	77.2	Confident	76.5	Confident	49 Å²	49	57.8 Å²	57.8	30%	0.301	32%	0.315	S	S	.	.	H	α-helix	trans	-57.4	-41.9	-173.6	-44.2	0	0	0	0	111.7	F678 I679 S684 E685 C686	F678-T682 WeakPolarHBondContact CE2-OG1 3.45Å; F678-T682 PolarHBondContact O-N 3Å; F678-T682 PolarHBondContact O-OG1 2.79Å; I679-T682 PolarHBondContact O-N 3.25Å; T682-S684 VanDerWaalsContact C-N 3.27Å; T682-S684 PolarHBondContact O-N 2.88Å; T682-E685 PolarHBondContact O-N 3.13Å; T682-C686 PolarHBondContact O-N 3.49Å; T682-C686 PolarHBondContact O-SG 3.38Å
683	R	76.5	Confident	75.8	Confident	68 Å²	68	58.6 Å²	58.6	26%	0.257	32%	0.322	S	S	.	.	H	α-helix	trans	-62.1	-32.4	174.8	-66.7	-64.4	-172.5	-161.5	0.2	113.1	I679 K681 I688 D696 Y754	I679-R683 HydrophobicContact CG2-CG 4.28Å; I679-R683 WeakPolarHBondContact O-CG 3.41Å; I679-R683 PolarHBondContact O-N 2.77Å; I679-R683 VanDerWaalsContact O-N 3.09Å; K681-R683 VanDerWaalsContact C-N 3.29Å; K681-R683 PolarHBondContact O-N 2.89Å; R683-I688 VanDerWaalsContact NH1-CD1 3.34Å; R683-D696 IonicContact CZ-OD2 3.99Å; R683-D696 IonicContact NE-OD2 2.68Å; R683-D696 IonicContact NH2-OD2 2.79Å; R683-D696 PolarHBondContact NH2-OD2 3.25Å; R683-Y754 HydrophobicContact CB-CE2 3.69Å
684	S	69.1	Low	74.9	Confident	82 Å²	82	62.3 Å²	62.3	57%	0.573	35%	0.347	S	S	*	.	H	α-helix	trans	-82.5	-11.7	177	71.8	0	0	0	0	115	L680 K681 T682	L680-S684 PolarHBondContact O-OG 3.5Å; K681-S684 CarbonylContact O-C 3.55Å; K681-S684 WeakPolarHBondContact O-CA 3.27Å; K681-S684 WeakPolarHBondContact O-CB 3.5Å; K681-S684 PolarHBondContact O-N 3.09Å; K681-S684 PolarHBondContact O-OG 2.63Å; T682-S684 VanDerWaalsContact C-N 3.27Å; T682-S684 PolarHBondContact O-N 2.88Å
685	E	74	Confident	74.3	Confident	145 Å²	145	67.4 Å²	67.4	68%	0.678	36%	0.363	S	S	*	.	H	α-helix	trans	-96.6	-10.2	178.4	-70.9	171.9	-172.3	0	0	112.7	K681 T682	K681-E685 PolarHBondContact O-N 3.29Å; K681-E685 VanDerWaalsContact O-N 3.09Å; T682-E685 PolarHBondContact O-N 3.13Å
686	C	69.6	Low	73.9	Confident	77 Å²	77	65.4 Å²	65.4	52%	0.52	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	13.3	-175.7	-59.8	0	0	0	0	114.2	T682 I688	T682-C686 PolarHBondContact O-N 3.49Å; T682-C686 PolarHBondContact O-SG 3.38Å; C686-I688 HydrophobicContact CB-CD1 3.91Å; C686-I688 HydrophobicContact CB-CG1 3.86Å; C686-I688 PolarHBondContact O-N 3.02Å
687	D	63.2	Low	73.5	Confident	148 Å²	148	68.4 Å²	68.4	79%	0.791	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	23.6	-175.5	-68.4	-37.1	0	0	0	115.3
688	I	66	Low	73.3	Confident	46 Å²	46	74.4 Å²	74.4	24%	0.236	39%	0.393	C	S	.	.			trans	-78.7	130.8	176.6	-54.1	177.7	0	0	0	108.4	R683 C686 D692 V693 Y754	R683-I688 VanDerWaalsContact NH1-CD1 3.34Å; C686-I688 HydrophobicContact CB-CD1 3.91Å; C686-I688 HydrophobicContact CB-CG1 3.86Å; C686-I688 PolarHBondContact O-N 3.02Å; I688-D692 HydrophobicContact CG2-CB 3.96Å; I688-V693 HydrophobicContact CG2-CG2 4.17Å; I688-Y754 WeakPolarHBondContact O-CE2 3.24Å; I688-Y754 PolarHBondContact O-OH 3.48Å
689	L	64.5	Low	73.2	Confident	43 Å²	43	78.6 Å²	78.6	23%	0.225	41%	0.411	C	S	.	.			trans	-102.6	164.9	-177.2	-64.4	171	0	0	0	112.4	S691 D692 Y754 Q756 P757	L689-S691 VanDerWaalsContact CB-OG 3.27Å; L689-S691 WeakPolarHBondContact CB-OG 3.43Å; L689-S691 PolarHBondContact O-N 3.05Å; L689-S691 VanDerWaalsContact O-N 3.17Å; L689-D692 PolarHBondContact N-OD2 3.14Å; L689-D692 WeakPolarHBondContact O-CB 3.39Å; L689-D692 PolarHBondContact O-N 3.22Å; L689-Y754 PolarHBondContact O-OH 3.31Å; L689-Q756 WeakPolarHBondContact CD1-O 3.44Å; L689-Q756 VanDerWaalsContact CD2-O 3.26Å; L689-Q756 WeakPolarHBondContact CD2-O 3.24Å; L689-P757 HydrophobicContact CD1-CB 3.63Å; L689-P757 HydrophobicContact CD1-CG 3.98Å
690	A	66	Low	73.1	Confident	22 Å²	22	77.1 Å²	77.1	18%	0.182	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.3	171	0	0	0	0	0	114.1	D692 Y754 K755	A690-D692 VanDerWaalsContact C-N 3.27Å; A690-Y754 HydrophobicContact CB-CD1 3.6Å; A690-Y754 HydrophobicContact CB-CE1 3.89Å; A690-Y754 HydrophobicContact CB-CG 4.38Å; A690-Y754 WeakPolarHBondContact CB-O 3Å; A690-Y754 PolarHBondContact N-O 3.35Å; A690-K755 HydrophobicContact CB-CG 4.35Å
691	S	63.1	Low	73.1	Confident	68 Å²	68	81.4 Å²	81.4	48%	0.476	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-28.2	171.2	39.2	0	0	0	0	113	L689	L689-S691 VanDerWaalsContact CB-OG 3.27Å; L689-S691 WeakPolarHBondContact CB-OG 3.43Å; L689-S691 PolarHBondContact O-N 3.05Å; L689-S691 VanDerWaalsContact O-N 3.17Å
692	D	65.8	Low	73.2	Confident	92 Å²	92	82.6 Å²	82.6	49%	0.492	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-26.4	-161.8	-46.4	-12.4	0	0	0	110.8	I688 L689 A690	I688-D692 HydrophobicContact CG2-CB 3.96Å; L689-D692 PolarHBondContact N-OD2 3.14Å; L689-D692 WeakPolarHBondContact O-CB 3.39Å; L689-D692 PolarHBondContact O-N 3.22Å; A690-D692 VanDerWaalsContact C-N 3.27Å
693	V	73.6	Confident	73.6	Confident	36 Å²	36	82.5 Å²	82.5	22%	0.218	43%	0.426	C	S	.	.			trans	-136.3	75.1	170.9	-159.4	0	0	0	0	111.4	I688 E695 D696	I688-V693 HydrophobicContact CG2-CG2 4.17Å; V693-E695 VanDerWaalsContact C-N 3.27Å; V693-E695 PolarHBondContact O-N 3.25Å; V693-D696 HydrophobicContact CB-CB 4.31Å; V693-D696 HydrophobicContact CG1-CB 3.71Å
694	P	69.7	Low	74	Confident	82 Å²	82	80 Å²	80	53%	0.532	42%	0.417	S	S	.	.	H	α-helix	trans	-65.3	-27.1	-178.8	-22.9	35.3	0	0	0	114.2	K698	P694-K698 PolarHBondContact O-N 3.48Å
695	E	75.3	Confident	74.7	Confident	168 Å²	168	79.3 Å²	79.3	79%	0.785	41%	0.407	S	S	*	.	H	α-helix	trans	-71.2	-44.3	-176.9	-58.7	-171.2	159.9	0	0	111.9	V693 Y697 K698 K699	V693-E695 VanDerWaalsContact C-N 3.27Å; V693-E695 PolarHBondContact O-N 3.25Å; E695-Y697 VanDerWaalsContact C-N 3.34Å; E695-Y697 PolarHBondContact O-N 3.11Å; E695-K698 PolarHBondContact O-N 3.42Å; E695-K699 PolarHBondContact O-N 3.15Å
696	D	77.3	Confident	75.2	Confident	60 Å²	60	75.8 Å²	75.8	32%	0.321	40%	0.399	S	S	.	.	H	α-helix	trans	-57.5	-45.6	173.7	-85.3	8.3	0	0	0	111.6	R683 V693 K698 K699 L700	R683-D696 IonicContact CZ-OD2 3.99Å; R683-D696 IonicContact NE-OD2 2.68Å; R683-D696 IonicContact NH2-OD2 2.79Å; R683-D696 PolarHBondContact NH2-OD2 3.25Å; V693-D696 HydrophobicContact CB-CB 4.31Å; V693-D696 HydrophobicContact CG1-CB 3.71Å; D696-K698 VanDerWaalsContact C-N 3.27Å; D696-K698 PolarHBondContact O-N 3.17Å; D696-K699 PolarHBondContact O-N 3.29Å; D696-L700 WeakPolarHBondContact O-CB 3.5Å; D696-L700 WeakPolarHBondContact O-CG 3.38Å; D696-L700 PolarHBondContact O-N 3.36Å
697	Y	77.2	Confident	76	Confident	64 Å²	64	74.1 Å²	74.1	25%	0.251	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-39.4	-179.5	179.3	-93.4	0	0	0	111.7	E695 L751 Y754 K755	E695-Y697 VanDerWaalsContact C-N 3.34Å; E695-Y697 PolarHBondContact O-N 3.11Å; Y697-L751 HydrophobicContact CD2-CD1 3.79Å; Y697-L751 HydrophobicContact CD2-CG 4.49Å; Y697-L751 HydrophobicContact CE2-CD1 3.68Å; Y697-L751 HydrophobicContact CE2-CG 3.9Å; Y697-Y754 HydrophobicContact CD2-CD1 4.34Å; Y697-K755 WeakPolarHBondContact OH-CE 3.45Å; Y697-K755 PolarHBondContact OH-NZ 3.49Å
698	K	80.9	Confident	77	Confident	135 Å²	135	72.1 Å²	72.1	59%	0.587	37%	0.367	S	S	*	.	H	α-helix	trans	-68	-49.3	174.9	-168	-161.6	171.2	-152.2	0	111.3	P694 E695 D696 L700 Y701 D702	P694-K698 PolarHBondContact O-N 3.48Å; E695-K698 PolarHBondContact O-N 3.42Å; D696-K698 VanDerWaalsContact C-N 3.27Å; D696-K698 PolarHBondContact O-N 3.17Å; K698-L700 VanDerWaalsContact C-N 3.34Å; K698-L700 PolarHBondContact O-N 3.31Å; K698-Y701 WeakPolarHBondContact O-CB 3.46Å; K698-Y701 PolarHBondContact O-N 3.25Å; K698-D702 WeakPolarHBondContact CE-OD2 3.12Å; K698-D702 IonicContact NZ-OD2 3.98Å; K698-D702 PolarHBondContact O-N 2.58Å
699	K	82.4	Confident	77.9	Confident	129 Å²	129	74.3 Å²	74.3	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-57.1	-46.4	-178.4	-174.4	-168.4	169.9	-166.8	0	111.8	E695 D696 Y701 D702 D703	E695-K699 PolarHBondContact O-N 3.15Å; D696-K699 PolarHBondContact O-N 3.29Å; K699-Y701 PolarHBondContact O-N 3.29Å; K699-D702 PolarHBondContact O-N 3.34Å; K699-D703 PolarHBondContact O-N 3.31Å
700	L	82.1	Confident	78.9	Confident	17 Å²	17	72.9 Å²	72.9	9%	0.089	38%	0.375	C	S	.	.	H	α-helix	trans	-54.1	-39.1	176.3	-74.4	169.1	0	0	0	112	V676 I679 L680 D696 K698 F704 L751	V676-L700 HydrophobicContact CG1-CD2 4.42Å; V676-L700 HydrophobicContact CG2-CD2 4.05Å; I679-L700 HydrophobicContact CD1-CD2 4.17Å; I679-L700 HydrophobicContact CG2-CD1 4.15Å; I679-L700 HydrophobicContact CG2-CD2 4.49Å; L680-L700 HydrophobicContact CD2-CD1 4.48Å; D696-L700 WeakPolarHBondContact O-CB 3.5Å; D696-L700 WeakPolarHBondContact O-CG 3.38Å; D696-L700 PolarHBondContact O-N 3.36Å; K698-L700 VanDerWaalsContact C-N 3.34Å; K698-L700 PolarHBondContact O-N 3.31Å; L700-F704 VanDerWaalsContact O-CD2 3.26Å; L700-F704 WeakPolarHBondContact O-CD2 3.23Å; L700-F704 PolarHBondContact O-N 3.14Å; L700-L751 HydrophobicContact CD1-CD1 4.24Å
701	Y	80.1	Confident	79.9	Confident	114 Å²	114	72.1 Å²	72.1	45%	0.447	37%	0.368	S	S	.	.	H	α-helix	trans	-71.7	-44.2	179.2	-160.8	-75.4	0	0	0	112.4	K698 K699 D703 F704 L751	K698-Y701 WeakPolarHBondContact O-CB 3.46Å; K698-Y701 PolarHBondContact O-N 3.25Å; K699-Y701 PolarHBondContact O-N 3.29Å; Y701-D703 VanDerWaalsContact C-N 3.31Å; Y701-D703 PolarHBondContact O-N 2.93Å; Y701-F704 PolarHBondContact O-N 3.1Å; Y701-L751 HydrophobicContact CD2-CD2 4.29Å
702	D	83.6	Confident	81	Confident	89 Å²	89	75.4 Å²	75.4	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-62	-39.2	177.2	-69.9	-27.3	0	0	0	111	K698 K699	K698-D702 WeakPolarHBondContact CE-OD2 3.12Å; K698-D702 IonicContact NZ-OD2 3.98Å; K698-D702 PolarHBondContact O-N 2.58Å; K699-D702 PolarHBondContact O-N 3.34Å
703	D	85.2	Confident	82	Confident	47 Å²	47	78.7 Å²	78.7	25%	0.251	38%	0.379	S	S	.	.	H	α-helix	trans	-66.9	-34.1	177.7	-70.3	-18	0	0	0	113	W672 K699 Y701 D705 S706 H707	W672-D703 HydrophobicContact CZ2-CB 3.59Å; K699-D703 PolarHBondContact O-N 3.31Å; Y701-D703 VanDerWaalsContact C-N 3.31Å; Y701-D703 PolarHBondContact O-N 2.93Å; D703-D705 PolarHBondContact O-N 3.22Å; D703-S706 VanDerWaalsContact O-CB 3.31Å; D703-S706 WeakPolarHBondContact O-CB 3.45Å; D703-S706 PolarHBondContact O-N 3.34Å; D703-S706 VanDerWaalsContact O-N 3.1Å; D703-H707 PolarHBondContact O-N 3.28Å; D703-H707 VanDerWaalsContact O-N 3.14Å
704	F	85.4	Confident	82.7	Confident	15 Å²	15	77 Å²	77	7%	0.066	37%	0.369	C	S	.	.	H	α-helix	trans	-59.4	-42.9	178.9	-104.1	-72.4	0	0	0	112.9	W672 V676 L700 Y701 S706 K708 M744 L747 Q748 L751	W672-F704 HydrophobicContact CH2-CB 4.21Å; W672-F704 AromaticContact CH2-CD1 3.68Å; W672-F704 HydrophobicContact CH2-CD1 3.68Å; W672-F704 HydrophobicContact CH2-CD2 4.02Å; W672-F704 AromaticContact CH2-CE1 3.96Å; W672-F704 HydrophobicContact CH2-CE1 3.96Å; W672-F704 HydrophobicContact CH2-CE2 4.27Å; W672-F704 AromaticContact CH2-CG 3.69Å; W672-F704 HydrophobicContact CH2-CG 3.69Å; W672-F704 HydrophobicContact CH2-CZ 4.24Å; W672-F704 HydrophobicContact CZ2-CD2 4.44Å; W672-F704 HydrophobicContact CZ2-CG 4.38Å; W672-F704 HydrophobicContact CZ3-CD1 4.31Å; W672-F704 HydrophobicContact CZ3-CE1 4.42Å; V676-F704 HydrophobicContact CG1-CE2 3.98Å; V676-F704 HydrophobicContact CG1-CZ 4.08Å; L700-F704 VanDerWaalsContact O-CD2 3.26Å; L700-F704 WeakPolarHBondContact O-CD2 3.23Å; L700-F704 PolarHBondContact O-N 3.14Å; Y701-F704 PolarHBondContact O-N 3.1Å; F704-S706 VanDerWaalsContact C-N 3.32Å; F704-K708 VanDerWaalsContact O-CB 3.24Å; F704-K708 WeakPolarHBondContact O-CB 3.32Å; F704-K708 PolarHBondContact O-N 2.85Å; F704-M744 HydrophobicContact CD1-CG 4.01Å; F704-M744 HydrophobicContact CE1-CG 3.9Å; F704-L747 HydrophobicContact CE1-CB 4.42Å; F704-L747 HydrophobicContact CZ-CB 3.83Å; F704-Q748 HydrophobicContact CE1-CB 4.12Å; F704-Q748 HydrophobicContact CZ-CB 4.27Å; F704-L751 HydrophobicContact CD2-CD2 4.46Å; F704-L751 HydrophobicContact CE2-CD2 4.37Å
705	D	83	Confident	83.6	Confident	69 Å²	69	76.6 Å²	76.6	37%	0.369	36%	0.36	S	S	.	.	H	α-helix	trans	-73.5	-25.2	176.8	-90.4	-34.7	0	0	0	112	D703 K708 N709	D703-D705 PolarHBondContact O-N 3.22Å; D705-K708 WeakPolarHBondContact OD1-CD 3.48Å; D705-K708 WeakPolarHBondContact OD1-CE 3.48Å; D705-K708 IonicContact OD1-NZ 3.63Å; D705-K708 PolarHBondContact OD1-NZ 2.85Å; D705-N709 PolarHBondContact O-N 3.37Å; D705-N709 PolarHBondContact O-ND2 3.31Å
706	S	85.1	Confident	84.3	Confident	71 Å²	71	76.3 Å²	76.3	50%	0.497	36%	0.356	S	S	.	.	H	α-helix	trans	-64.4	-55.5	173.1	-170.3	0	0	0	0	112	D703 F704 K708 N709 G710	D703-S706 VanDerWaalsContact O-CB 3.31Å; D703-S706 WeakPolarHBondContact O-CB 3.45Å; D703-S706 PolarHBondContact O-N 3.34Å; D703-S706 VanDerWaalsContact O-N 3.1Å; F704-S706 VanDerWaalsContact C-N 3.32Å; S706-K708 VanDerWaalsContact C-N 3.31Å; S706-K708 PolarHBondContact O-N 3.49Å; S706-N709 WeakPolarHBondContact O-CB 3.26Å; S706-N709 PolarHBondContact O-N 2.86Å; S706-G710 PolarHBondContact O-N 3.44Å
707	H	86	Confident	84.7	Confident	42 Å²	42	75.3 Å²	75.3	19%	0.194	35%	0.35	C	S	.	.	H	α-helix	trans	-68.7	-29.7	-177.3	-77.9	-83.7	0	0	0	113.4	W672 D703 N709 G710 I711	W672-H707 VanDerWaalsContact CB-CE1 3.49Å; W672-H707 WeakPolarHBondContact CB-CE1 3.33Å; W672-H707 AromaticContact CD1-CD2 3.8Å; W672-H707 AromaticContact CD1-NE2 3.55Å; W672-H707 HydrophobicContact CD2-CB 4.26Å; W672-H707 AromaticContact CD2-CD2 3.24Å; W672-H707 AromaticContact CD2-CG 3.63Å; W672-H707 AromaticContact CD2-NE2 3.69Å; W672-H707 AromaticContact CE2-CD2 3.62Å; W672-H707 HydrophobicContact CE3-CB 3.66Å; W672-H707 AromaticContact CE3-CD2 3.59Å; W672-H707 AromaticContact CE3-CG 3.47Å; W672-H707 VanDerWaalsContact CE3-CG 3.47Å; W672-H707 AromaticContact CG-CD2 3.42Å; W672-H707 VanDerWaalsContact CG-CD2 3.42Å; W672-H707 AromaticContact CG-CE1 3.73Å; W672-H707 AromaticContact CG-CG 3.96Å; W672-H707 AromaticContact CG-NE2 3.28Å; W672-H707 VanDerWaalsContact CG-NE2 3.28Å; W672-H707 HydrophobicContact CZ3-CB 3.83Å; W672-H707 AromaticContact NE1-CD2 3.89Å; D703-H707 PolarHBondContact O-N 3.28Å; D703-H707 VanDerWaalsContact O-N 3.14Å; H707-N709 VanDerWaalsContact C-N 3.3Å; H707-N709 PolarHBondContact O-N 3.11Å; H707-G710 WeakPolarHBondContact O-CA 3.4Å; H707-G710 PolarHBondContact O-N 2.99Å; H707-I711 PolarHBondContact O-N 2.69Å
708	K	85	Confident	85.2	Confident	105 Å²	105	73.1 Å²	73.1	46%	0.457	34%	0.342	S	S	.	.	H	α-helix	trans	-60.3	-35.6	169.6	177.4	171.6	152.8	-156.2	0	112.9	F704 D705 S706 F712 M744	F704-K708 VanDerWaalsContact O-CB 3.24Å; F704-K708 WeakPolarHBondContact O-CB 3.32Å; F704-K708 PolarHBondContact O-N 2.85Å; D705-K708 WeakPolarHBondContact OD1-CD 3.48Å; D705-K708 WeakPolarHBondContact OD1-CE 3.48Å; D705-K708 IonicContact OD1-NZ 3.63Å; D705-K708 PolarHBondContact OD1-NZ 2.85Å; S706-K708 VanDerWaalsContact C-N 3.31Å; S706-K708 PolarHBondContact O-N 3.49Å; K708-F712 PolarHBondContact O-N 2.85Å; K708-M744 HydrophobicContact CB-CE 4.19Å; K708-M744 HydrophobicContact CB-SD 3.91Å; K708-M744 HydrophobicContact CD-CE 4.48Å; K708-M744 HydrophobicContact CG-CE 4.18Å
709	N	85.3	Confident	85.5	Confident	93 Å²	93	68.5 Å²	68.5	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-72.3	-30.1	170.7	-76.7	-67	0	0	0	112.7	D705 S706 H707 R713	D705-N709 PolarHBondContact O-N 3.37Å; D705-N709 PolarHBondContact O-ND2 3.31Å; S706-N709 WeakPolarHBondContact O-CB 3.26Å; S706-N709 PolarHBondContact O-N 2.86Å; H707-N709 VanDerWaalsContact C-N 3.3Å; H707-N709 PolarHBondContact O-N 3.11Å; N709-R713 PolarHBondContact O-N 2.98Å
710	G	84.4	Confident	85.7	Confident	13 Å²	13	66 Å²	66	13%	0.134	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-51.6	171.9	0	0	0	0	0	112.4	S706 H707 F712 R713 L714	S706-G710 PolarHBondContact O-N 3.44Å; H707-G710 WeakPolarHBondContact O-CA 3.4Å; H707-G710 PolarHBondContact O-N 2.99Å; G710-F712 PolarHBondContact O-N 3.38Å; G710-R713 WeakPolarHBondContact O-CB 3.47Å; G710-R713 PolarHBondContact O-N 3.33Å; G710-L714 PolarHBondContact O-N 2.81Å
711	I	86.7	Confident	85.8	Confident	5 Å²	5	66.2 Å²	66.2	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-53.4	-41.2	176	-69.8	172.1	0	0	0	111.6	H707 R713 L714 E715 V737 L740 K741 M744	H707-I711 PolarHBondContact O-N 2.69Å; I711-R713 VanDerWaalsContact C-N 3.3Å; I711-R713 PolarHBondContact O-N 2.76Å; I711-L714 PolarHBondContact O-N 3.33Å; I711-E715 PolarHBondContact O-N 3.46Å; I711-E715 VanDerWaalsContact O-N 3.11Å; I711-V737 HydrophobicContact CG2-CG1 4.26Å; I711-L740 HydrophobicContact CD1-CB 4.04Å; I711-L740 HydrophobicContact CG1-CB 4.25Å; I711-L740 HydrophobicContact CG1-CD1 4.5Å; I711-K741 HydrophobicContact CG2-CD 4.28Å; I711-K741 HydrophobicContact CG2-CG 3.66Å; I711-M744 HydrophobicContact CD1-CE 4.18Å; I711-M744 HydrophobicContact CD1-SD 3.96Å
712	F	87.8	Confident	86.1	Confident	137 Å²	137	66.2 Å²	66.2	60%	0.601	32%	0.323	S	S	*	.	H	α-helix	trans	-64.6	-28.1	178.2	-178.2	-105.1	0	0	0	113.9	K708 G710 K716	K708-F712 PolarHBondContact O-N 2.85Å; G710-F712 PolarHBondContact O-N 3.38Å; F712-K716 PolarHBondContact O-N 2.9Å
713	R	86.3	Confident	86.1	Confident	161 Å²	161	69.4 Å²	69.4	61%	0.608	34%	0.335	S	S	*	.	H	α-helix	trans	-69.7	-42.9	173.5	-61.9	173.6	-164.5	162.2	5.1	111.2	N709 G710 I711 E715 K716 Q717	N709-R713 PolarHBondContact O-N 2.98Å; G710-R713 WeakPolarHBondContact O-CB 3.47Å; G710-R713 PolarHBondContact O-N 3.33Å; I711-R713 VanDerWaalsContact C-N 3.3Å; I711-R713 PolarHBondContact O-N 2.76Å; R713-E715 VanDerWaalsContact C-N 3.31Å; R713-E715 PolarHBondContact O-N 3.16Å; R713-K716 WeakPolarHBondContact O-CB 3.34Å; R713-K716 PolarHBondContact O-N 3.15Å; R713-K716 VanDerWaalsContact O-N 3.08Å; R713-Q717 PolarHBondContact O-N 3.46Å
714	L	88.5	Confident	85.9	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-64.7	-35.6	178.4	-61	170.5	0	0	0	111.6	I662 Q665 L666 G710 I711 K716 Q717 I718 L733 V737 L740	I662-L714 HydrophobicContact CG2-CD2 4.43Å; Q665-L714 HydrophobicContact CB-CD2 3.97Å; L666-L714 HydrophobicContact CD2-CD1 3.8Å; L666-L714 HydrophobicContact CG-CD1 4.27Å; G710-L714 PolarHBondContact O-N 2.81Å; I711-L714 PolarHBondContact O-N 3.33Å; L714-K716 VanDerWaalsContact C-N 3.32Å; L714-K716 PolarHBondContact O-N 3.01Å; L714-Q717 WeakPolarHBondContact O-CB 3.33Å; L714-Q717 PolarHBondContact O-N 2.9Å; L714-Q717 VanDerWaalsContact O-N 3.14Å; L714-I718 WeakPolarHBondContact O-CG1 3.45Å; L714-I718 PolarHBondContact O-N 3.07Å; L714-L733 HydrophobicContact CD2-CD1 4.46Å; L714-V737 HydrophobicContact CB-CG2 3.51Å; L714-V737 HydrophobicContact CD1-CG2 4.15Å; L714-V737 HydrophobicContact CG-CG2 4.45Å; L714-L740 HydrophobicContact CD1-CD1 4.25Å
715	E	88.1	Confident	85.5	Confident	73 Å²	73	75.8 Å²	75.8	34%	0.341	37%	0.373	S	S	.	.	H	α-helix	trans	-60.3	-39.5	169.8	-70.5	-167.7	104.8	0	0	113.5	I711 R713 Q717 I718 A719 V737 K741	I711-E715 PolarHBondContact O-N 3.46Å; I711-E715 VanDerWaalsContact O-N 3.11Å; R713-E715 VanDerWaalsContact C-N 3.31Å; R713-E715 PolarHBondContact O-N 3.16Å; E715-Q717 VanDerWaalsContact C-N 3.28Å; E715-Q717 PolarHBondContact O-N 3.35Å; E715-I718 PolarHBondContact O-N 2.91Å; E715-A719 PolarHBondContact O-N 3.37Å; E715-V737 HydrophobicContact CG-CG1 3.79Å; E715-K741 VanDerWaalsContact CD-CE 3.4Å; E715-K741 WeakPolarHBondContact OE1-CE 3.07Å; E715-K741 IonicContact OE1-NZ 2.64Å; E715-K741 PolarHBondContact OE1-NZ 3.06Å; E715-K741 WeakPolarHBondContact OE2-CE 3.38Å; E715-K741 IonicContact OE2-NZ 2.67Å; E715-K741 PolarHBondContact OE2-NZ 3.28Å
716	K	89.1	Confident	85.3	Confident	163 Å²	163	75.1 Å²	75.1	71%	0.709	37%	0.367	S	S	*	.	H	α-helix	trans	-65.6	-33.7	174.9	-166.9	-169.5	173.4	-161.1	0	111.6	F712 R713 L714 A719 H720	F712-K716 PolarHBondContact O-N 2.9Å; R713-K716 WeakPolarHBondContact O-CB 3.34Å; R713-K716 PolarHBondContact O-N 3.15Å; R713-K716 VanDerWaalsContact O-N 3.08Å; L714-K716 VanDerWaalsContact C-N 3.32Å; L714-K716 PolarHBondContact O-N 3.01Å; K716-A719 PolarHBondContact O-N 3.28Å; K716-H720 PolarHBondContact O-N 2.84Å; K716-H720 VanDerWaalsContact O-N 3.13Å
717	Q	86	Confident	85.2	Confident	39 Å²	39	75.7 Å²	75.7	18%	0.182	36%	0.362	C	S	.	.	H	α-helix	trans	-71	-39.8	176.5	-168.1	64.6	19	0	0	112.5	E658 I662 R713 L714 E715 A719 H720 Y721 L733	E658-Q717 PolarHBondContact OE1-NE2 3.46Å; I662-Q717 HydrophobicContact CD1-CG 3.68Å; I662-Q717 HydrophobicContact CG1-CG 4.18Å; R713-Q717 PolarHBondContact O-N 3.46Å; L714-Q717 WeakPolarHBondContact O-CB 3.33Å; L714-Q717 PolarHBondContact O-N 2.9Å; L714-Q717 VanDerWaalsContact O-N 3.14Å; E715-Q717 VanDerWaalsContact C-N 3.28Å; E715-Q717 PolarHBondContact O-N 3.35Å; Q717-A719 VanDerWaalsContact C-N 3.26Å; Q717-A719 PolarHBondContact O-N 3.47Å; Q717-H720 WeakPolarHBondContact O-CA 3.39Å; Q717-H720 WeakPolarHBondContact O-CB 3.4Å; Q717-H720 PolarHBondContact O-N 3.06Å; Q717-Y721 HydrophobicContact CG-CE2 4.32Å; Q717-Y721 PolarHBondContact O-N 2.99Å; Q717-L733 HydrophobicContact CB-CD2 4Å; Q717-L733 HydrophobicContact CG-CD2 3.91Å
718	I	87.4	Confident	84.9	Confident	17 Å²	17	78.2 Å²	78.2	9%	0.087	38%	0.377	C	S	.	.	H	α-helix	trans	-56	-45.3	171.1	-65.4	160.3	0	0	0	110.2	L714 E715 H720 Y721 Q722 L733 A734 V737	L714-I718 WeakPolarHBondContact O-CG1 3.45Å; L714-I718 PolarHBondContact O-N 3.07Å; E715-I718 PolarHBondContact O-N 2.91Å; I718-H720 PolarHBondContact O-N 2.8Å; I718-Y721 PolarHBondContact O-N 2.88Å; I718-Q722 VanDerWaalsContact O-CG 3.29Å; I718-Q722 WeakPolarHBondContact O-CG 3.48Å; I718-Q722 PolarHBondContact O-N 2.91Å; I718-L733 HydrophobicContact CD1-CG 4.14Å; I718-L733 HydrophobicContact CG1-CB 3.99Å; I718-L733 HydrophobicContact CG1-CD2 3.69Å; I718-L733 HydrophobicContact CG1-CG 3.55Å; I718-A734 HydrophobicContact CD1-CB 4.02Å; I718-A734 HydrophobicContact CG1-CB 4.42Å; I718-A734 HydrophobicContact CG2-CB 4.14Å; I718-V737 HydrophobicContact CD1-CB 3.88Å; I718-V737 HydrophobicContact CD1-CG1 4.2Å; I718-V737 HydrophobicContact CD1-CG2 3.84Å
719	A	87.5	Confident	84.8	Confident	39 Å²	39	73.8 Å²	73.8	32%	0.322	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-21.1	176.3	0	0	0	0	0	113.5	E715 K716 Q717 Q723	E715-A719 PolarHBondContact O-N 3.37Å; K716-A719 PolarHBondContact O-N 3.28Å; Q717-A719 VanDerWaalsContact C-N 3.26Å; Q717-A719 PolarHBondContact O-N 3.47Å; A719-Q723 VanDerWaalsContact O-CD 3.28Å; A719-Q723 VanDerWaalsContact O-CG 3.26Å; A719-Q723 WeakPolarHBondContact O-CG 3.38Å; A719-Q723 PolarHBondContact O-NE2 3.37Å
720	H	86.4	Confident	84.8	Confident	77 Å²	77	69.4 Å²	69.4	36%	0.356	34%	0.337	S	S	.	.	H	α-helix	trans	-79.3	-49.5	172.6	-171.3	39.8	0	0	0	111.7	K716 Q717 I718 Q722 Q723 V724	K716-H720 PolarHBondContact O-N 2.84Å; K716-H720 VanDerWaalsContact O-N 3.13Å; Q717-H720 WeakPolarHBondContact O-CA 3.39Å; Q717-H720 WeakPolarHBondContact O-CB 3.4Å; Q717-H720 PolarHBondContact O-N 3.06Å; I718-H720 PolarHBondContact O-N 2.8Å; H720-Q722 PolarHBondContact O-N 3.02Å; H720-Q723 WeakPolarHBondContact O-CA 3.21Å; H720-Q723 WeakPolarHBondContact O-CB 3.19Å; H720-Q723 PolarHBondContact O-N 3.47Å; H720-V724 PolarHBondContact O-N 2.65Å; H720-V724 VanDerWaalsContact O-N 3.1Å
721	Y	85.6	Confident	84.9	Confident	21 Å²	21	74 Å²	74	8%	0.082	35%	0.354	C	S	.	.	H	α-helix	trans	-59.1	-32.7	175.7	-70.3	-31.3	0	0	0	112.9	I662 Q717 I718 Q723 V724 D725 Q726 A729 L733	I662-Y721 HydrophobicContact CD1-CE2 3.9Å; I662-Y721 WeakPolarHBondContact CD1-OH 3.48Å; Q717-Y721 HydrophobicContact CG-CE2 4.32Å; Q717-Y721 PolarHBondContact O-N 2.99Å; I718-Y721 PolarHBondContact O-N 2.88Å; Y721-Q723 VanDerWaalsContact C-N 3.28Å; Y721-Q723 PolarHBondContact O-N 3.13Å; Y721-V724 PolarHBondContact O-N 3.46Å; Y721-D725 PolarHBondContact O-N 3.07Å; Y721-Q726 HydrophobicContact CD1-CB 4.4Å; Y721-Q726 PolarHBondContact O-N 3.41Å; Y721-A729 HydrophobicContact CD2-CB 3.78Å; Y721-A729 HydrophobicContact CE2-CB 3.8Å; Y721-A729 HydrophobicContact CG-CB 4.2Å; Y721-L733 HydrophobicContact CD2-CD2 4.16Å; Y721-L733 HydrophobicContact CE2-CD2 4.13Å
722	Q	85.6	Confident	84.8	Confident	113 Å²	113	78.7 Å²	78.7	53%	0.528	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-21.2	171.1	-71.2	174.9	-1.2	0	0	114.3	I718 H720 A730	I718-Q722 VanDerWaalsContact O-CG 3.29Å; I718-Q722 WeakPolarHBondContact O-CG 3.48Å; I718-Q722 PolarHBondContact O-N 2.91Å; H720-Q722 PolarHBondContact O-N 3.02Å; Q722-A730 HydrophobicContact CG-CB 3.84Å
723	Q	84.3	Confident	84.7	Confident	156 Å²	156	72.4 Å²	72.4	73%	0.729	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-25.4	174.6	-69.9	165.7	28.1	0	0	112.7	A719 H720 Y721 D725	A719-Q723 VanDerWaalsContact O-CD 3.28Å; A719-Q723 VanDerWaalsContact O-CG 3.26Å; A719-Q723 WeakPolarHBondContact O-CG 3.38Å; A719-Q723 PolarHBondContact O-NE2 3.37Å; H720-Q723 WeakPolarHBondContact O-CA 3.21Å; H720-Q723 WeakPolarHBondContact O-CB 3.19Å; H720-Q723 PolarHBondContact O-N 3.47Å; Y721-Q723 VanDerWaalsContact C-N 3.28Å; Y721-Q723 PolarHBondContact O-N 3.13Å; Q723-D725 VanDerWaalsContact C-N 3.32Å
724	V	80.2	Confident	84.9	Confident	77 Å²	77	65.8 Å²	65.8	47%	0.467	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	4.1	177.5	-171.3	0	0	0	0	111.6	H720 Y721 Q726	H720-V724 PolarHBondContact O-N 2.65Å; H720-V724 VanDerWaalsContact O-N 3.1Å; Y721-V724 PolarHBondContact O-N 3.46Å; V724-Q726 HydrophobicContact CG1-CG 4.21Å; V724-Q726 PolarHBondContact O-N 3.4Å
725	D	78.2	Confident	84.9	Confident	120 Å²	120	72.7 Å²	72.7	64%	0.642	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	20.4	-177.5	-146.2	13.7	0	0	0	114.7	Y721 Q723 Q727	Y721-D725 PolarHBondContact O-N 3.07Å; Q723-D725 VanDerWaalsContact C-N 3.32Å; D725-Q727 PolarHBondContact O-N 2.91Å; D725-Q727 PolarHBondContact OD1-NE2 3.11Å
726	Q	78	Confident	84.9	Confident	54 Å²	54	72.9 Å²	72.9	25%	0.252	36%	0.357	S	S	.	.			trans	-77.3	64.6	172.9	-71.8	-177.2	-15.3	0	0	110.3	Y721 V724 L728 A729 A730	Y721-Q726 HydrophobicContact CD1-CB 4.4Å; Y721-Q726 PolarHBondContact O-N 3.41Å; V724-Q726 HydrophobicContact CG1-CG 4.21Å; V724-Q726 PolarHBondContact O-N 3.4Å; Q726-L728 VanDerWaalsContact C-N 3.29Å; Q726-L728 PolarHBondContact O-N 3.18Å; Q726-A729 HydrophobicContact CB-CB 4.32Å; Q726-A729 PolarHBondContact O-N 3.04Å; Q726-A730 WeakPolarHBondContact O-CB 3.33Å; Q726-A730 PolarHBondContact O-N 3.17Å
727	Q	81.8	Confident	85	Confident	84 Å²	84	65.3 Å²	65.3	39%	0.393	32%	0.324	S	S	.	.	H	α-helix	trans	-56	-37.3	-171.1	-65.4	-63.7	-26.4	0	0	113.7	D725 Q731	D725-Q727 PolarHBondContact O-N 2.91Å; D725-Q727 PolarHBondContact OD1-NE2 3.11Å; Q727-Q731 WeakPolarHBondContact O-CB 3.23Å; Q727-Q731 WeakPolarHBondContact O-CG 3.3Å; Q727-Q731 PolarHBondContact O-N 3.06Å; Q727-Q731 PolarHBondContact O-NE2 3.17Å
728	L	81	Confident	85.1	Confident	95 Å²	95	68.6 Å²	68.6	50%	0.497	34%	0.343	S	S	.	.	H	α-helix	trans	-70.2	-47.5	-179.4	-65.6	177.6	0	0	0	112	Q726 A730 Q731 R732	Q726-L728 VanDerWaalsContact C-N 3.29Å; Q726-L728 PolarHBondContact O-N 3.18Å; L728-A730 VanDerWaalsContact C-N 3.34Å; L728-A730 PolarHBondContact O-N 2.91Å; L728-Q731 PolarHBondContact O-N 3.28Å; L728-R732 WeakPolarHBondContact O-CB 3.2Å; L728-R732 PolarHBondContact O-N 3.01Å
729	A	81.6	Confident	85.2	Confident	12 Å²	12	73.4 Å²	73.4	10%	0.099	37%	0.365	C	S	.	.	H	α-helix	trans	-62.1	-42.4	175.1	0	0	0	0	0	111.4	Y721 Q726 Q731 L733	Y721-A729 HydrophobicContact CD2-CB 3.78Å; Y721-A729 HydrophobicContact CE2-CB 3.8Å; Y721-A729 HydrophobicContact CG-CB 4.2Å; Q726-A729 HydrophobicContact CB-CB 4.32Å; Q726-A729 PolarHBondContact O-N 3.04Å; A729-Q731 PolarHBondContact O-N 3.44Å; A729-L733 VanDerWaalsContact O-CB 3.27Å; A729-L733 WeakPolarHBondContact O-CB 3.36Å; A729-L733 PolarHBondContact O-N 3.44Å
730	A	86	Confident	85.2	Confident	1 Å²	1	71.6 Å²	71.6	1%	0.008	35%	0.35	C	S	.	.	H	α-helix	trans	-59.3	-42.4	174.7	0	0	0	0	0	113.1	Q722 Q726 L728 A734	Q722-A730 HydrophobicContact CG-CB 3.84Å; Q726-A730 WeakPolarHBondContact O-CB 3.33Å; Q726-A730 PolarHBondContact O-N 3.17Å; L728-A730 VanDerWaalsContact C-N 3.34Å; L728-A730 PolarHBondContact O-N 2.91Å; A730-A734 WeakPolarHBondContact O-CB 3.47Å; A730-A734 PolarHBondContact O-N 3.16Å; A730-A734 VanDerWaalsContact O-N 3.09Å
731	Q	86.5	Confident	85.2	Confident	108 Å²	108	71.3 Å²	71.3	51%	0.505	35%	0.348	S	S	.	.	H	α-helix	trans	-69.8	-50	179.1	-74.9	167.4	33.6	0	0	111.6	Q727 L728 A729 L733 A734 E735	Q727-Q731 WeakPolarHBondContact O-CB 3.23Å; Q727-Q731 WeakPolarHBondContact O-CG 3.3Å; Q727-Q731 PolarHBondContact O-N 3.06Å; Q727-Q731 PolarHBondContact O-NE2 3.17Å; L728-Q731 PolarHBondContact O-N 3.28Å; A729-Q731 PolarHBondContact O-N 3.44Å; Q731-L733 PolarHBondContact O-N 3.12Å; Q731-A734 PolarHBondContact O-N 3.15Å; Q731-A734 VanDerWaalsContact O-N 3.11Å; Q731-E735 PolarHBondContact O-N 3.01Å
732	R	84.4	Confident	85.4	Confident	105 Å²	105	77.3 Å²	77.3	40%	0.396	38%	0.375	S	S	.	.	H	α-helix	trans	-58.7	-45.8	-179.6	-172.4	166.4	170.7	176.5	-13.6	111.5	D586 L728 E735 Q736	D586-R732 IonicContact OD2-CZ 2.69Å; D586-R732 IonicContact OD2-NH1 3.28Å; D586-R732 PolarHBondContact OD2-NH1 3.4Å; D586-R732 IonicContact OD2-NH2 3.77Å; D586-R732 PolarHBondContact OD2-NH2 3.27Å; L728-R732 WeakPolarHBondContact O-CB 3.2Å; L728-R732 PolarHBondContact O-N 3.01Å; R732-E735 PolarHBondContact O-N 3.16Å; R732-Q736 WeakPolarHBondContact O-CG 3.28Å; R732-Q736 PolarHBondContact O-N 2.78Å; R732-Q736 PolarHBondContact O-OE1 3.19Å
733	L	87	Confident	85.5	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-65.7	-38.2	175.7	-174.6	58.5	0	0	0	112.4	I662 L666 L714 Q717 I718 Y721 A729 Q731 Q736 V737	I662-L733 HydrophobicContact CG2-CD1 3.59Å; I662-L733 HydrophobicContact CG2-CD2 4.05Å; I662-L733 HydrophobicContact CG2-CG 4.44Å; L666-L733 HydrophobicContact CD1-CD1 3.79Å; L666-L733 HydrophobicContact CD2-CD1 4.13Å; L666-L733 HydrophobicContact CG-CD1 4.21Å; L714-L733 HydrophobicContact CD2-CD1 4.46Å; Q717-L733 HydrophobicContact CB-CD2 4Å; Q717-L733 HydrophobicContact CG-CD2 3.91Å; I718-L733 HydrophobicContact CD1-CG 4.14Å; I718-L733 HydrophobicContact CG1-CB 3.99Å; I718-L733 HydrophobicContact CG1-CD2 3.69Å; I718-L733 HydrophobicContact CG1-CG 3.55Å; Y721-L733 HydrophobicContact CD2-CD2 4.16Å; Y721-L733 HydrophobicContact CE2-CD2 4.13Å; A729-L733 VanDerWaalsContact O-CB 3.27Å; A729-L733 WeakPolarHBondContact O-CB 3.36Å; A729-L733 PolarHBondContact O-N 3.44Å; Q731-L733 PolarHBondContact O-N 3.12Å; L733-Q736 PolarHBondContact O-N 3.37Å; L733-V737 HydrophobicContact CD1-CG2 4.14Å; L733-V737 HydrophobicContact CG-CG2 4.38Å; L733-V737 WeakPolarHBondContact O-CB 3.4Å; L733-V737 VanDerWaalsContact O-CG2 3.31Å; L733-V737 WeakPolarHBondContact O-CG2 3.3Å; L733-V737 PolarHBondContact O-N 3.38Å
734	A	88.7	Confident	85.6	Confident	22 Å²	22	67.5 Å²	67.5	18%	0.182	33%	0.327	C	S	.	.	H	α-helix	trans	-64.8	-38.5	177.3	0	0	0	0	0	113.3	I718 A730 Q731 N738	I718-A734 HydrophobicContact CD1-CB 4.02Å; I718-A734 HydrophobicContact CG1-CB 4.42Å; I718-A734 HydrophobicContact CG2-CB 4.14Å; A730-A734 WeakPolarHBondContact O-CB 3.47Å; A730-A734 PolarHBondContact O-N 3.16Å; A730-A734 VanDerWaalsContact O-N 3.09Å; Q731-A734 PolarHBondContact O-N 3.15Å; Q731-A734 VanDerWaalsContact O-N 3.11Å; A734-N738 WeakPolarHBondContact O-CB 3.36Å; A734-N738 PolarHBondContact O-N 2.92Å; A734-N738 VanDerWaalsContact O-N 3.08Å; A734-N738 PolarHBondContact O-ND2 3.29Å
735	E	89	Confident	85.9	Confident	147 Å²	147	67.2 Å²	67.2	69%	0.687	33%	0.328	S	S	*	.	H	α-helix	trans	-63.7	-44.8	175.5	-69	-174.3	165.9	0	0	111.5	Q731 R732 N738 H739	Q731-E735 PolarHBondContact O-N 3.01Å; R732-E735 PolarHBondContact O-N 3.16Å; E735-N738 PolarHBondContact O-N 3.45Å; E735-H739 PolarHBondContact O-N 3.42Å; E735-H739 VanDerWaalsContact O-N 3.15Å
736	Q	89.5	Confident	86.3	Confident	77 Å²	77	65.7 Å²	65.7	36%	0.36	32%	0.32	S	S	.	.	H	α-helix	trans	-64.6	-44.3	179.2	-65.3	165.9	-41.8	0	0	112.3	L666 R732 L733 H739 L740	L666-Q736 HydrophobicContact CD1-CB 4.38Å; L666-Q736 HydrophobicContact CD2-CB 3.84Å; R732-Q736 WeakPolarHBondContact O-CG 3.28Å; R732-Q736 PolarHBondContact O-N 2.78Å; R732-Q736 PolarHBondContact O-OE1 3.19Å; L733-Q736 PolarHBondContact O-N 3.37Å; Q736-H739 WeakPolarHBondContact O-CB 3.18Å; Q736-H739 PolarHBondContact O-N 2.94Å; Q736-L740 PolarHBondContact O-N 3.14Å; Q736-L740 VanDerWaalsContact O-N 3.15Å
737	V	89.3	Confident	86.6	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.018	31%	0.308	C	S	.	.	H	α-helix	trans	-66.8	-36.6	178.2	171.3	0	0	0	0	112.4	L666 I711 L714 E715 I718 L733 H739 L740 K741	L666-V737 HydrophobicContact CD2-CG2 4.38Å; I711-V737 HydrophobicContact CG2-CG1 4.26Å; L714-V737 HydrophobicContact CB-CG2 3.51Å; L714-V737 HydrophobicContact CD1-CG2 4.15Å; L714-V737 HydrophobicContact CG-CG2 4.45Å; E715-V737 HydrophobicContact CG-CG1 3.79Å; I718-V737 HydrophobicContact CD1-CB 3.88Å; I718-V737 HydrophobicContact CD1-CG1 4.2Å; I718-V737 HydrophobicContact CD1-CG2 3.84Å; L733-V737 HydrophobicContact CD1-CG2 4.14Å; L733-V737 HydrophobicContact CG-CG2 4.38Å; L733-V737 WeakPolarHBondContact O-CB 3.4Å; L733-V737 VanDerWaalsContact O-CG2 3.31Å; L733-V737 WeakPolarHBondContact O-CG2 3.3Å; L733-V737 PolarHBondContact O-N 3.38Å; V737-H739 VanDerWaalsContact C-N 3.32Å; V737-H739 PolarHBondContact O-N 3.11Å; V737-L740 PolarHBondContact O-N 2.99Å; V737-K741 PolarHBondContact O-N 3.41Å; V737-K741 VanDerWaalsContact O-N 3.12Å
738	N	88.8	Confident	86.7	Confident	108 Å²	108	64 Å²	64	58%	0.578	31%	0.312	S	S	*	.	H	α-helix	trans	-65.7	-34.4	174.3	-81.3	-61.1	0	0	0	112.3	A734 E735 K742	A734-N738 WeakPolarHBondContact O-CB 3.36Å; A734-N738 PolarHBondContact O-N 2.92Å; A734-N738 VanDerWaalsContact O-N 3.08Å; A734-N738 PolarHBondContact O-ND2 3.29Å; E735-N738 PolarHBondContact O-N 3.45Å; N738-K742 PolarHBondContact O-N 3.45Å
739	H	89.6	Confident	86.8	Confident	119 Å²	119	63.2 Å²	63.2	55%	0.551	31%	0.314	S	S	*	.	H	α-helix	trans	-64	-49.1	173.8	-170.3	92	0	0	0	111.8	E735 Q736 V737 K741 K742 Y743	E735-H739 PolarHBondContact O-N 3.42Å; E735-H739 VanDerWaalsContact O-N 3.15Å; Q736-H739 WeakPolarHBondContact O-CB 3.18Å; Q736-H739 PolarHBondContact O-N 2.94Å; V737-H739 VanDerWaalsContact C-N 3.32Å; V737-H739 PolarHBondContact O-N 3.11Å; H739-K741 VanDerWaalsContact C-N 3.35Å; H739-K741 PolarHBondContact O-N 2.93Å; H739-K742 PolarHBondContact O-N 2.81Å; H739-Y743 PolarHBondContact O-N 3.4Å
740	L	87.7	Confident	86.8	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-53.8	-48	176.5	-78	171.8	0	0	0	112.4	L666 C669 L670 L673 I711 L714 Q736 V737 K742 Y743 M744	L666-L740 HydrophobicContact CD2-CD1 3.9Å; C669-L740 HydrophobicContact CB-CD1 3.82Å; C669-L740 HydrophobicContact CB-CD2 3.63Å; C669-L740 HydrophobicContact CB-CG 4.39Å; L670-L740 HydrophobicContact CD2-CD2 3.65Å; L670-L740 HydrophobicContact CD2-CG 4.32Å; L670-L740 HydrophobicContact CG-CD2 3.81Å; L673-L740 HydrophobicContact CD1-CD2 3.6Å; I711-L740 HydrophobicContact CD1-CB 4.04Å; I711-L740 HydrophobicContact CG1-CB 4.25Å; I711-L740 HydrophobicContact CG1-CD1 4.5Å; L714-L740 HydrophobicContact CD1-CD1 4.25Å; Q736-L740 PolarHBondContact O-N 3.14Å; Q736-L740 VanDerWaalsContact O-N 3.15Å; V737-L740 PolarHBondContact O-N 2.99Å; L740-K742 VanDerWaalsContact C-N 3.34Å; L740-K742 PolarHBondContact O-N 3.16Å; L740-Y743 PolarHBondContact O-N 3.46Å; L740-M744 PolarHBondContact O-N 3.02Å
741	K	87.2	Confident	86.4	Confident	70 Å²	70	66.8 Å²	66.8	30%	0.304	33%	0.328	S	S	.	.	H	α-helix	trans	-57.8	-43.3	179.6	-80.7	-171.2	165.6	-166.2	0	113.5	I711 E715 V737 H739 C745	I711-K741 HydrophobicContact CG2-CD 4.28Å; I711-K741 HydrophobicContact CG2-CG 3.66Å; E715-K741 VanDerWaalsContact CD-CE 3.4Å; E715-K741 WeakPolarHBondContact OE1-CE 3.07Å; E715-K741 IonicContact OE1-NZ 2.64Å; E715-K741 PolarHBondContact OE1-NZ 3.06Å; E715-K741 WeakPolarHBondContact OE2-CE 3.38Å; E715-K741 IonicContact OE2-NZ 2.67Å; E715-K741 PolarHBondContact OE2-NZ 3.28Å; V737-K741 PolarHBondContact O-N 3.41Å; V737-K741 VanDerWaalsContact O-N 3.12Å; H739-K741 VanDerWaalsContact C-N 3.35Å; H739-K741 PolarHBondContact O-N 2.93Å; K741-C745 PolarHBondContact O-SG 2.96Å; K741-C745 VanDerWaalsContact O-SG 3.33Å
742	K	88.8	Confident	85.7	Confident	148 Å²	148	67.5 Å²	67.5	64%	0.643	33%	0.331	S	S	*	.	H	α-helix	trans	-63.9	-49.5	-179.3	-175.3	-177.6	175.6	-173.7	0	111	N738 H739 L740 M744 C745 D746	N738-K742 PolarHBondContact O-N 3.45Å; H739-K742 PolarHBondContact O-N 2.81Å; L740-K742 VanDerWaalsContact C-N 3.34Å; L740-K742 PolarHBondContact O-N 3.16Å; K742-M744 VanDerWaalsContact C-N 3.32Å; K742-M744 PolarHBondContact O-N 2.92Å; K742-C745 PolarHBondContact O-N 2.88Å; K742-D746 PolarHBondContact O-N 2.86Å
743	Y	89.1	Confident	85.1	Confident	41 Å²	41	72.8 Å²	72.8	16%	0.161	35%	0.351	C	S	.	.	H	α-helix	trans	-62.4	-38.6	-176.2	-170.5	-164.4	0	0	0	112	L673 D677 H739 L740 C745 D746 L747	L673-Y743 HydrophobicContact CB-CD1 3.58Å; L673-Y743 HydrophobicContact CB-CE1 3.62Å; L673-Y743 HydrophobicContact CB-CG 4.32Å; L673-Y743 HydrophobicContact CD1-CD1 3.94Å; L673-Y743 HydrophobicContact CD1-CG 4.37Å; L673-Y743 HydrophobicContact CG-CD1 4.3Å; D677-Y743 HydrophobicContact CB-CE2 4.14Å; D677-Y743 VanDerWaalsContact CB-OH 3.3Å; D677-Y743 WeakPolarHBondContact CB-OH 3.37Å; H739-Y743 PolarHBondContact O-N 3.4Å; L740-Y743 PolarHBondContact O-N 3.46Å; Y743-C745 VanDerWaalsContact C-N 3.35Å; Y743-C745 PolarHBondContact O-N 3.34Å; Y743-D746 PolarHBondContact O-N 2.76Å; Y743-L747 HydrophobicContact CD2-CD1 4.09Å; Y743-L747 HydrophobicContact CD2-CG 4.12Å; Y743-L747 HydrophobicContact CE2-CD1 3.87Å; Y743-L747 HydrophobicContact CE2-CD2 4.1Å; Y743-L747 HydrophobicContact CE2-CG 4.07Å; Y743-L747 WeakPolarHBondContact O-CG 3.41Å; Y743-L747 PolarHBondContact O-N 2.89Å
744	M	86.1	Confident	84.3	Confident	22 Å²	22	74.6 Å²	74.6	11%	0.108	36%	0.358	C	S	.	.	H	α-helix	trans	-58.7	-41.1	175.9	-170.2	176.2	65.2	0	0	113.4	L673 F704 K708 I711 L740 K742 L747 Q748	L673-M744 HydrophobicContact CD2-CB 3.85Å; L673-M744 HydrophobicContact CD2-CG 4.19Å; F704-M744 HydrophobicContact CD1-CG 4.01Å; F704-M744 HydrophobicContact CE1-CG 3.9Å; K708-M744 HydrophobicContact CB-CE 4.19Å; K708-M744 HydrophobicContact CB-SD 3.91Å; K708-M744 HydrophobicContact CD-CE 4.48Å; K708-M744 HydrophobicContact CG-CE 4.18Å; I711-M744 HydrophobicContact CD1-CE 4.18Å; I711-M744 HydrophobicContact CD1-SD 3.96Å; L740-M744 PolarHBondContact O-N 3.02Å; K742-M744 VanDerWaalsContact C-N 3.32Å; K742-M744 PolarHBondContact O-N 2.92Å; M744-L747 PolarHBondContact O-N 3.39Å; M744-Q748 PolarHBondContact O-N 3.23Å
745	C	85.7	Confident	83	Confident	70 Å²	70	77.7 Å²	77.7	47%	0.473	37%	0.367	S	S	.	.	H	α-helix	trans	-68.9	-36.8	-179.2	-62.5	0	0	0	0	112.7	K741 K742 Y743 L747 S749	K741-C745 PolarHBondContact O-SG 2.96Å; K741-C745 VanDerWaalsContact O-SG 3.33Å; K742-C745 PolarHBondContact O-N 2.88Å; Y743-C745 VanDerWaalsContact C-N 3.35Å; Y743-C745 PolarHBondContact O-N 3.34Å; C745-L747 VanDerWaalsContact C-N 3.29Å; C745-L747 PolarHBondContact O-N 2.89Å; C745-S749 PolarHBondContact O-N 3.48Å; C745-S749 PolarHBondContact O-OG 3.06Å; C745-S749 VanDerWaalsContact O-OG 3.04Å
746	D	86.2	Confident	81	Confident	88 Å²	88	78.8 Å²	78.8	47%	0.471	37%	0.372	S	S	.	.	H	α-helix	trans	-66	-32.5	178.8	-71	-25.4	0	0	0	111.7	K742 Y743	K742-D746 PolarHBondContact O-N 2.86Å; Y743-D746 PolarHBondContact O-N 2.76Å
747	L	85.7	Confident	78.9	Confident	1 Å²	1	79.8 Å²	79.8	1%	0.005	39%	0.385	C	S	.	.	H	α-helix	trans	-81.2	-39.9	-179.8	-61.8	-178.7	0	0	0	113.4	L673 V676 D677 F704 Y743 M744 C745 S749 K750	L673-L747 HydrophobicContact CB-CD1 4.43Å; L673-L747 HydrophobicContact CD2-CD1 4.1Å; L673-L747 WeakPolarHBondContact O-CD1 3.13Å; V676-L747 HydrophobicContact CB-CD1 4.21Å; V676-L747 HydrophobicContact CG1-CB 4.4Å; V676-L747 HydrophobicContact CG1-CD1 4.2Å; D677-L747 HydrophobicContact CB-CD1 4.08Å; D677-L747 HydrophobicContact CB-CD2 3.61Å; D677-L747 VanDerWaalsContact OD1-CD2 3.27Å; D677-L747 WeakPolarHBondContact OD1-CD2 3.39Å; F704-L747 HydrophobicContact CE1-CB 4.42Å; F704-L747 HydrophobicContact CZ-CB 3.83Å; Y743-L747 HydrophobicContact CD2-CD1 4.09Å; Y743-L747 HydrophobicContact CD2-CG 4.12Å; Y743-L747 HydrophobicContact CE2-CD1 3.87Å; Y743-L747 HydrophobicContact CE2-CD2 4.1Å; Y743-L747 HydrophobicContact CE2-CG 4.07Å; Y743-L747 WeakPolarHBondContact O-CG 3.41Å; Y743-L747 PolarHBondContact O-N 2.89Å; M744-L747 PolarHBondContact O-N 3.39Å; C745-L747 VanDerWaalsContact C-N 3.29Å; C745-L747 PolarHBondContact O-N 2.89Å; L747-S749 PolarHBondContact O-N 3.13Å; L747-S749 VanDerWaalsContact O-N 3.16Å; L747-K750 HydrophobicContact CD2-CD 4.12Å; L747-K750 WeakPolarHBondContact O-CB 3.48Å; L747-K750 PolarHBondContact O-N 3.29Å
748	Q	83.6	Confident	77	Confident	103 Å²	103	85 Å²	85	48%	0.481	42%	0.422	S	S	.	.	H	α-helix	trans	-56.1	-33.9	174.9	-168.8	179	6.4	0	0	111.4	F704 M744 K750	F704-Q748 HydrophobicContact CE1-CB 4.12Å; F704-Q748 HydrophobicContact CZ-CB 4.27Å; M744-Q748 PolarHBondContact O-N 3.23Å; Q748-K750 VanDerWaalsContact C-N 3.28Å; Q748-K750 PolarHBondContact O-N 3.49Å
749	S	81.5	Confident	75.4	Confident	78 Å²	78	88 Å²	88	55%	0.545	43%	0.433	S	S	.	.	H	α-helix	trans	-69.4	-16.3	177.4	-58.2	0	0	0	0	114.9	C745 L747	C745-S749 PolarHBondContact O-N 3.48Å; C745-S749 PolarHBondContact O-OG 3.06Å; C745-S749 VanDerWaalsContact O-OG 3.04Å; L747-S749 PolarHBondContact O-N 3.13Å; L747-S749 VanDerWaalsContact O-N 3.16Å
750	K	81.5	Confident	74	Confident	82 Å²	82	86.5 Å²	86.5	36%	0.357	43%	0.428	S	S	.	.	H	α-helix	trans	-87.2	-41.4	177.7	-63.7	179.7	-173.6	-173.5	0	112.1	D677 L680 L747 Q748 E752 R753	D677-K750 IonicContact OD1-NZ 3.89Å; D677-K750 PolarHBondContact OD1-NZ 3.36Å; L680-K750 HydrophobicContact CD1-CB 4.03Å; L747-K750 HydrophobicContact CD2-CD 4.12Å; L747-K750 WeakPolarHBondContact O-CB 3.48Å; L747-K750 PolarHBondContact O-N 3.29Å; Q748-K750 VanDerWaalsContact C-N 3.28Å; Q748-K750 PolarHBondContact O-N 3.49Å; K750-E752 PolarHBondContact O-N 3.41Å; K750-R753 PolarHBondContact O-N 3.2Å
751	L	79.4	Confident	73	Confident	6 Å²	6	93 Å²	93	3%	0.031	46%	0.463	C	S	.	.	H	α-helix	trans	-55.6	-25.2	-177.5	-175	64.4	0	0	0	113.2	L680 Y697 L700 Y701 F704 R753 K755	L680-L751 HydrophobicContact CD2-CD1 3.96Å; Y697-L751 HydrophobicContact CD2-CD1 3.79Å; Y697-L751 HydrophobicContact CD2-CG 4.49Å; Y697-L751 HydrophobicContact CE2-CD1 3.68Å; Y697-L751 HydrophobicContact CE2-CG 3.9Å; L700-L751 HydrophobicContact CD1-CD1 4.24Å; Y701-L751 HydrophobicContact CD2-CD2 4.29Å; F704-L751 HydrophobicContact CD2-CD2 4.46Å; F704-L751 HydrophobicContact CE2-CD2 4.37Å; L751-R753 PolarHBondContact O-N 3.28Å; L751-K755 PolarHBondContact O-NZ 3.16Å
752	E	72	Confident	72	Confident	122 Å²	122	94.9 Å²	94.9	57%	0.57	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.4	-178.9	-76.7	-64.4	-176.5	0	0	116.1	K750 K755	K750-E752 PolarHBondContact O-N 3.41Å; E752-K755 VanDerWaalsContact O-CD 3.29Å; E752-K755 WeakPolarHBondContact O-CD 3.28Å; E752-K755 PolarHBondContact O-NZ 2.97Å; E752-K755 IonicContact OE2-NZ 2.73Å; E752-K755 PolarHBondContact OE2-NZ 3.22Å
753	R	70.7	Confident	71.1	Confident	217 Å²	217	92.2 Å²	92.2	82%	0.819	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-5.8	-170	-60.5	-175.7	-178.4	-176.4	-0.6	116.1	K750 L751 K755	K750-R753 PolarHBondContact O-N 3.2Å; L751-R753 PolarHBondContact O-N 3.28Å; R753-K755 PolarHBondContact O-N 2.98Å; R753-K755 VanDerWaalsContact O-N 3.12Å
754	Y	70.3	Confident	70.2	Confident	42 Å²	42	91.4 Å²	91.4	17%	0.165	46%	0.461	C	S	.	.			trans	-86.7	39.6	-152.7	-173.9	-126.8	0	0	0	116.9	R683 I688 L689 A690 Y697	R683-Y754 HydrophobicContact CB-CE2 3.69Å; I688-Y754 WeakPolarHBondContact O-CE2 3.24Å; I688-Y754 PolarHBondContact O-OH 3.48Å; L689-Y754 PolarHBondContact O-OH 3.31Å; A690-Y754 HydrophobicContact CB-CD1 3.6Å; A690-Y754 HydrophobicContact CB-CE1 3.89Å; A690-Y754 HydrophobicContact CB-CG 4.38Å; A690-Y754 WeakPolarHBondContact CB-O 3Å; A690-Y754 PolarHBondContact N-O 3.35Å; Y697-Y754 HydrophobicContact CD2-CD1 4.34Å
755	K	61	Low	69.6	Low	87 Å²	87	97.7 Å²	97.7	38%	0.378	49%	0.49	S	S	.	.			trans	-138.2	31	-142.8	-81.3	139.1	173.4	165.5	0	121.6	A690 Y697 L751 E752 R753	A690-K755 HydrophobicContact CB-CG 4.35Å; Y697-K755 WeakPolarHBondContact OH-CE 3.45Å; Y697-K755 PolarHBondContact OH-NZ 3.49Å; L751-K755 PolarHBondContact O-NZ 3.16Å; E752-K755 VanDerWaalsContact O-CD 3.29Å; E752-K755 WeakPolarHBondContact O-CD 3.28Å; E752-K755 PolarHBondContact O-NZ 2.97Å; E752-K755 IonicContact OE2-NZ 2.73Å; E752-K755 PolarHBondContact OE2-NZ 3.22Å; R753-K755 PolarHBondContact O-N 2.98Å; R753-K755 VanDerWaalsContact O-N 3.12Å
756	Q	48.1	Very low	69.2	Low	169 Å²	169	100.8 Å²	100.8	79%	0.79	49%	0.491	S	S	*	.			trans	-148	132.7	176.6	-79.7	-167.9	-121.7	0	0	117.8	L689	L689-Q756 WeakPolarHBondContact CD1-O 3.44Å; L689-Q756 VanDerWaalsContact CD2-O 3.26Å; L689-Q756 WeakPolarHBondContact CD2-O 3.24Å
757	P	45.1	Very low	69	Low	98 Å²	98	96.7 Å²	96.7	64%	0.636	47%	0.469	S	S	*	.			trans	-107.2	169.9	172.3	5.7	16.9	0	0	0	116.9	L689	L689-P757 HydrophobicContact CD1-CB 3.63Å; L689-P757 HydrophobicContact CD1-CG 3.98Å
758	S	49	Very low	68.8	Low	113 Å²	113	100.5 Å²	100.5	79%	0.79	48%	0.484	S	S	*	.			trans	-138	-159	-174.6	55.4	0	0	0	0	116.5
759	E	56.3	Low	68.7	Low	172 Å²	172	103.9 Å²	103.9	80%	0.804	49%	0.492	S	S	*	.			trans	-97.8	-159.9	-149.8	-57.6	-167.7	139	0	0	118
760	L	60.1	Low	68.7	Low	86 Å²	86	102.7 Å²	102.7	45%	0.45	48%	0.479	S	S	.	.	S	Bend	trans	-102	-38.5	-150.6	-133.6	169.5	0	0	0	116.1	D762 R763 T818	L760-D762 VanDerWaalsContact C-N 3.27Å; L760-D762 PolarHBondContact O-N 2.84Å; L760-R763 WeakPolarHBondContact O-CB 3.31Å; L760-R763 PolarHBondContact O-N 3.15Å; L760-T818 HydrophobicContact CD1-CG2 4.07Å; L760-T818 HydrophobicContact CD2-CG2 4.12Å; L760-T818 HydrophobicContact CG-CG2 4.5Å
761	D	65.6	Low	68.9	Low	137 Å²	137	99.1 Å²	99.1	73%	0.733	46%	0.464	S	S	*	.	H	α-helix	trans	-65.3	-30.7	-174.8	-81.9	-20.3	0	0	0	112.7	R763 L764 Q765	D761-R763 PolarHBondContact O-N 3.01Å; D761-R763 VanDerWaalsContact O-N 3.12Å; D761-L764 PolarHBondContact O-N 3.41Å; D761-Q765 PolarHBondContact O-N 3.49Å
762	D	66.1	Low	69	Low	111 Å²	111	103.4 Å²	103.4	59%	0.594	49%	0.487	S	S	*	.	H	α-helix	trans	-55.2	-30.7	176.5	-58.5	-39.8	0	0	0	112.1	L760 R766	L760-D762 VanDerWaalsContact C-N 3.27Å; L760-D762 PolarHBondContact O-N 2.84Å; D762-R766 PolarHBondContact O-N 3.44Å
763	R	70.5	Confident	69.5	Low	92 Å²	92	101.6 Å²	101.6	35%	0.347	48%	0.481	S	S	.	.	H	α-helix	trans	-72.2	-32.9	176	-64.4	-173.6	64.4	-168.8	-1.8	113.1	L760 D761 D814 L815	L760-R763 WeakPolarHBondContact O-CB 3.31Å; L760-R763 PolarHBondContact O-N 3.15Å; D761-R763 PolarHBondContact O-N 3.01Å; D761-R763 VanDerWaalsContact O-N 3.12Å; R763-D814 IonicContact NH2-OD2 2.63Å; R763-L815 HydrophobicContact CB-CD2 3.96Å
764	L	69	Low	70.2	Confident	24 Å²	24	92.3 Å²	92.3	13%	0.126	45%	0.447	C	S	.	.	H	α-helix	trans	-78	-39.5	-176	-166.6	151.7	0	0	0	111.5	D761 R766 R768 L815 I834	D761-L764 PolarHBondContact O-N 3.41Å; L764-R766 VanDerWaalsContact C-N 3.31Å; L764-R766 PolarHBondContact O-N 3.39Å; L764-R768 PolarHBondContact O-N 3.08Å; L764-L815 HydrophobicContact CB-CD1 4.47Å; L764-L815 HydrophobicContact CG-CD1 4.46Å; L764-I834 HydrophobicContact CD1-CD1 4.42Å; L764-I834 HydrophobicContact CD1-CG1 4.13Å
765	Q	75.1	Confident	70.9	Confident	154 Å²	154	93.1 Å²	93.1	72%	0.72	45%	0.453	S	S	*	.	H	α-helix	trans	-63.1	-36	172.5	-90.9	-171.4	0.2	0	0	112.7	D761 R769	D761-Q765 PolarHBondContact O-N 3.49Å; Q765-R769 PolarHBondContact O-N 3.1Å
766	R	77.6	Confident	72	Confident	135 Å²	135	95.3 Å²	95.3	51%	0.509	46%	0.464	S	S	.	.	H	α-helix	trans	-56.7	-50.8	177.3	178.7	170.4	171.9	-94	1.8	112	D762 L764 R769 I770 E811	D762-R766 PolarHBondContact O-N 3.44Å; L764-R766 VanDerWaalsContact C-N 3.31Å; L764-R766 PolarHBondContact O-N 3.39Å; R766-R769 PolarHBondContact O-N 3.34Å; R766-I770 HydrophobicContact CG-CD1 3.97Å; R766-I770 WeakPolarHBondContact O-CD1 3.42Å; R766-I770 WeakPolarHBondContact O-CG1 3.46Å; R766-I770 PolarHBondContact O-N 2.94Å; R766-E811 IonicContact CZ-OE1 3.92Å; R766-E811 IonicContact CZ-OE2 2.69Å; R766-E811 IonicContact NH1-OE1 3.22Å; R766-E811 PolarHBondContact NH1-OE1 3.2Å; R766-E811 IonicContact NH1-OE2 2.8Å; R766-E811 PolarHBondContact NH1-OE2 3.04Å; R766-E811 IonicContact NH2-OE1 3.94Å
767	V	80	Confident	73.5	Confident	1 Å²	1	89.9 Å²	89.9	1%	0.006	45%	0.445	C	S	.	.	H	α-helix	trans	-64.5	-43	-176.9	-177.7	0	0	0	0	112.1	R769 I770 L771 L808 E811 V812 L815 L837	V767-R769 PolarHBondContact O-N 2.93Å; V767-I770 PolarHBondContact O-N 3.37Å; V767-L771 PolarHBondContact O-N 2.84Å; V767-L808 HydrophobicContact CB-CD2 4.49Å; V767-L808 HydrophobicContact CG1-CD2 3.76Å; V767-E811 HydrophobicContact CG2-CB 3.92Å; V767-E811 WeakPolarHBondContact CG2-OE2 3.45Å; V767-V812 HydrophobicContact CG1-CG2 3.64Å; V767-L815 HydrophobicContact CB-CD1 4.34Å; V767-L815 HydrophobicContact CG2-CD1 3.76Å; V767-L837 HydrophobicContact CB-CD2 4.26Å; V767-L837 HydrophobicContact CG1-CD2 3.77Å; V767-L837 HydrophobicContact CG1-CG 4.45Å
768	R	81.6	Confident	75.5	Confident	82 Å²	82	85.9 Å²	85.9	31%	0.309	42%	0.418	S	S	.	.	H	α-helix	trans	-59.5	-44.3	177.5	-81.2	-171.5	170.5	-126.3	-1.9	112.3	L764 I770 L771 D772 E833 E836 L837	L764-R768 PolarHBondContact O-N 3.08Å; R768-I770 PolarHBondContact O-N 3.42Å; R768-L771 PolarHBondContact O-N 3.37Å; R768-D772 PolarHBondContact O-N 2.91Å; R768-E833 VanDerWaalsContact NH2-CA 3.32Å; R768-E833 PolarHBondContact NH2-O 3.3Å; R768-E836 IonicContact CZ-OE2 2.63Å; R768-E836 IonicContact NH1-OE2 3.58Å; R768-E836 IonicContact NH2-OE2 2.68Å; R768-E836 PolarHBondContact NH2-OE2 2.98Å; R768-L837 HydrophobicContact CG-CD1 3.96Å; R768-L837 HydrophobicContact CG-CD2 3.91Å
769	R	82.1	Confident	76.9	Confident	174 Å²	174	87.5 Å²	87.5	66%	0.657	41%	0.413	S	S	*	.	H	α-helix	trans	-63	-40.7	-178.8	-155	-168.3	85.4	-160.4	2.8	112.6	Q765 R766 V767 L771 D772 D773	Q765-R769 PolarHBondContact O-N 3.1Å; R766-R769 PolarHBondContact O-N 3.34Å; V767-R769 PolarHBondContact O-N 2.93Å; R769-L771 VanDerWaalsContact C-N 3.3Å; R769-L771 PolarHBondContact O-N 3.27Å; R769-D772 PolarHBondContact O-N 3.06Å; R769-D773 IonicContact NE-OD2 2.61Å; R769-D773 PolarHBondContact NE-OD2 3.4Å; R769-D773 IonicContact NH2-OD2 3.28Å; R769-D773 WeakPolarHBondContact O-CB 3.28Å; R769-D773 PolarHBondContact O-N 2.97Å
770	I	82.7	Confident	77.9	Confident	53 Å²	53	86.3 Å²	86.3	27%	0.272	41%	0.411	S	S	.	.	H	α-helix	trans	-65.6	-35	-178.9	-58.3	161.5	0	0	0	110.8	R766 V767 R768 L774 L808	R766-I770 HydrophobicContact CG-CD1 3.97Å; R766-I770 WeakPolarHBondContact O-CD1 3.42Å; R766-I770 WeakPolarHBondContact O-CG1 3.46Å; R766-I770 PolarHBondContact O-N 2.94Å; V767-I770 PolarHBondContact O-N 3.37Å; R768-I770 PolarHBondContact O-N 3.42Å; I770-L774 HydrophobicContact CG2-CD1 4.19Å; I770-L774 VanDerWaalsContact O-CG 3.26Å; I770-L774 WeakPolarHBondContact O-CG 3.32Å; I770-L774 PolarHBondContact O-N 2.86Å; I770-L808 HydrophobicContact CB-CD1 4.43Å; I770-L808 HydrophobicContact CB-CD2 3.96Å; I770-L808 HydrophobicContact CD1-CD2 4.27Å; I770-L808 HydrophobicContact CG2-CD1 4.03Å; I770-L808 HydrophobicContact CG2-CD2 3.99Å; I770-L808 HydrophobicContact CG2-CG 4.4Å
771	L	84	Confident	78.8	Confident	6 Å²	6	83.8 Å²	83.8	3%	0.031	40%	0.398	C	S	.	.	H	α-helix	trans	-67	-47	175.8	-177	60.1	0	0	0	112.5	V767 R768 R769 D773 L774 E775 L808 L837 A840 L841 F844	V767-L771 PolarHBondContact O-N 2.84Å; R768-L771 PolarHBondContact O-N 3.37Å; R769-L771 VanDerWaalsContact C-N 3.3Å; R769-L771 PolarHBondContact O-N 3.27Å; L771-D773 VanDerWaalsContact C-N 3.27Å; L771-D773 PolarHBondContact O-N 3.37Å; L771-L774 PolarHBondContact O-N 2.95Å; L771-L774 VanDerWaalsContact O-N 3.13Å; L771-E775 HydrophobicContact CD1-CG 4.41Å; L771-E775 PolarHBondContact O-N 3.48Å; L771-L808 HydrophobicContact CB-CD1 4.39Å; L771-L837 HydrophobicContact CD2-CD1 3.67Å; L771-A840 HydrophobicContact CD2-CB 3.65Å; L771-L841 HydrophobicContact CD1-CD2 3.79Å; L771-L841 HydrophobicContact CD1-CG 4.26Å; L771-L841 HydrophobicContact CD2-CD2 4.49Å; L771-L841 HydrophobicContact CD2-CG 4.11Å; L771-F844 HydrophobicContact CD1-CD1 4.28Å
772	D	83.3	Confident	79.1	Confident	97 Å²	97	80.1 Å²	80.1	52%	0.519	39%	0.387	S	S	.	.	H	α-helix	trans	-60.9	-38.2	177.3	-69.2	-18.1	0	0	0	111.4	R768 R769 Q776	R768-D772 PolarHBondContact O-N 2.91Å; R769-D772 PolarHBondContact O-N 3.06Å; D772-Q776 WeakPolarHBondContact O-CG 3.32Å; D772-Q776 PolarHBondContact O-NE2 3.24Å
773	D	81.9	Confident	79.3	Confident	83 Å²	83	76.7 Å²	76.7	44%	0.444	37%	0.37	S	S	.	.	H	α-helix	trans	-65.5	-36.8	175.5	-71.3	-28.5	0	0	0	111.4	R769 L771	R769-D773 IonicContact NE-OD2 2.61Å; R769-D773 PolarHBondContact NE-OD2 3.4Å; R769-D773 IonicContact NH2-OD2 3.28Å; R769-D773 WeakPolarHBondContact O-CB 3.28Å; R769-D773 PolarHBondContact O-N 2.97Å; L771-D773 VanDerWaalsContact C-N 3.27Å; L771-D773 PolarHBondContact O-N 3.37Å
774	L	84.9	Confident	79.1	Confident	22 Å²	22	77.4 Å²	77.4	12%	0.115	39%	0.385	C	S	.	.	H	α-helix	trans	-72.2	-48.9	178.4	-75.9	167.5	0	0	0	113.3	I770 L771 Q776 S777 F778 T801 A804 L808 F844	I770-L774 HydrophobicContact CG2-CD1 4.19Å; I770-L774 VanDerWaalsContact O-CG 3.26Å; I770-L774 WeakPolarHBondContact O-CG 3.32Å; I770-L774 PolarHBondContact O-N 2.86Å; L771-L774 PolarHBondContact O-N 2.95Å; L771-L774 VanDerWaalsContact O-N 3.13Å; L774-Q776 VanDerWaalsContact C-N 3.31Å; L774-Q776 PolarHBondContact O-N 2.88Å; L774-S777 WeakPolarHBondContact O-CB 3.45Å; L774-S777 PolarHBondContact O-N 3.36Å; L774-S777 PolarHBondContact O-OG 2.97Å; L774-F778 PolarHBondContact O-N 3.39Å; L774-T801 HydrophobicContact CD2-CG2 4.21Å; L774-A804 HydrophobicContact CD1-CB 3.82Å; L774-A804 HydrophobicContact CD2-CB 3.93Å; L774-L808 HydrophobicContact CD1-CD1 3.56Å; L774-F844 HydrophobicContact CB-CE1 3.99Å; L774-F844 HydrophobicContact CB-CZ 4.41Å
775	E	84.2	Confident	79	Confident	60 Å²	60	77.8 Å²	77.8	28%	0.28	39%	0.389	S	S	.	.	H	α-helix	trans	-58.8	-43.3	-177.1	-69.7	-150.3	133.4	0	0	111.6	L771 S777 F778 E779 F844	L771-E775 HydrophobicContact CD1-CG 4.41Å; L771-E775 PolarHBondContact O-N 3.48Å; E775-S777 VanDerWaalsContact C-N 3.26Å; E775-S777 PolarHBondContact O-N 2.99Å; E775-F778 PolarHBondContact O-N 2.91Å; E775-E779 PolarHBondContact O-N 3.19Å; E775-F844 HydrophobicContact CB-CE2 4.5Å; E775-F844 HydrophobicContact CG-CB 4.44Å; E775-F844 HydrophobicContact CG-CD1 4.36Å; E775-F844 HydrophobicContact CG-CD2 3.86Å; E775-F844 HydrophobicContact CG-CE2 4.21Å; E775-F844 HydrophobicContact CG-CG 3.97Å
776	Q	84.6	Confident	78.6	Confident	132 Å²	132	72.1 Å²	72.1	62%	0.617	36%	0.364	S	S	*	.	H	α-helix	trans	-62.9	-30.2	177.5	-73.1	173.9	84.3	0	0	113.3	D772 L774	D772-Q776 WeakPolarHBondContact O-CG 3.32Å; D772-Q776 PolarHBondContact O-NE2 3.24Å; L774-Q776 VanDerWaalsContact C-N 3.31Å; L774-Q776 PolarHBondContact O-N 2.88Å
777	S	80.4	Confident	78.4	Confident	56 Å²	56	67.7 Å²	67.7	39%	0.392	35%	0.35	S	S	.	.	H	α-helix	trans	-72.7	-30	177.5	78	0	0	0	0	112.8	L774 E775	L774-S777 WeakPolarHBondContact O-CB 3.45Å; L774-S777 PolarHBondContact O-N 3.36Å; L774-S777 PolarHBondContact O-OG 2.97Å; E775-S777 VanDerWaalsContact C-N 3.26Å; E775-S777 PolarHBondContact O-N 2.99Å
778	F	86	Confident	78.4	Confident	14 Å²	14	69.4 Å²	69.4	6%	0.061	36%	0.359	C	S	.	.	H	α-helix	trans	-82.3	-33.8	-172.2	-166.6	-85	0	0	0	113.4	L774 E775 L780 L781 V798 T801 F844 K847 V848 S851	L774-F778 PolarHBondContact O-N 3.39Å; E775-F778 PolarHBondContact O-N 2.91Å; F778-L780 PolarHBondContact O-N 3.31Å; F778-L781 HydrophobicContact CD2-CD1 3.65Å; F778-L781 HydrophobicContact CE2-CD1 3.78Å; F778-L781 HydrophobicContact CG-CD1 4.07Å; F778-L781 HydrophobicContact CZ-CD1 4.29Å; F778-L781 WeakPolarHBondContact O-CB 3.3Å; F778-L781 WeakPolarHBondContact O-CG 3.22Å; F778-L781 PolarHBondContact O-N 3.24Å; F778-L781 VanDerWaalsContact O-N 3.16Å; F778-V798 HydrophobicContact CE2-CG2 4.01Å; F778-V798 HydrophobicContact CZ-CG2 4.38Å; F778-T801 HydrophobicContact CD2-CG2 4.21Å; F778-F844 HydrophobicContact CB-CE2 3.61Å; F778-F844 HydrophobicContact CB-CZ 3.75Å; F778-F844 HydrophobicContact CD1-CE2 4.22Å; F778-F844 HydrophobicContact CD2-CE2 4.24Å; F778-F844 HydrophobicContact CD2-CZ 4.14Å; F778-F844 AromaticContact CG-CE2 3.76Å; F778-F844 HydrophobicContact CG-CE2 3.76Å; F778-F844 HydrophobicContact CG-CZ 4.02Å; F778-K847 HydrophobicContact CE1-CB 4.15Å; F778-V848 HydrophobicContact CD2-CG2 4.17Å; F778-V848 HydrophobicContact CE2-CB 4.15Å; F778-V848 HydrophobicContact CE2-CG1 4.23Å; F778-V848 HydrophobicContact CE2-CG2 3.82Å; F778-V848 HydrophobicContact CZ-CB 4.39Å; F778-V848 HydrophobicContact CZ-CG2 4.27Å; F778-S851 WeakPolarHBondContact CZ-OG 3.34Å
779	E	78.8	Confident	78.2	Confident	146 Å²	146	71.2 Å²	71.2	68%	0.682	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-4.4	179	-58.8	-157.7	150.3	0	0	113.7	E775 K847	E775-E779 PolarHBondContact O-N 3.19Å; E779-K847 IonicContact OE1-NZ 2.68Å; E779-K847 PolarHBondContact OE1-NZ 3.2Å; E779-K847 VanDerWaalsContact OE1-NZ 3.12Å
780	L	78	Confident	78.1	Confident	147 Å²	147	65.3 Å²	65.3	77%	0.77	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	0.6	176.4	-59	175.4	0	0	0	113.9	F778	F778-L780 PolarHBondContact O-N 3.31Å
781	L	78.7	Confident	78.1	Confident	34 Å²	34	62.8 Å²	62.8	18%	0.178	34%	0.338	C	S	.	.			trans	-89.4	115.9	-175	-57.8	176.3	0	0	0	112.5	F778 L794 K797 V798 Y855	F778-L781 HydrophobicContact CD2-CD1 3.65Å; F778-L781 HydrophobicContact CE2-CD1 3.78Å; F778-L781 HydrophobicContact CG-CD1 4.07Å; F778-L781 HydrophobicContact CZ-CD1 4.29Å; F778-L781 WeakPolarHBondContact O-CB 3.3Å; F778-L781 WeakPolarHBondContact O-CG 3.22Å; F778-L781 PolarHBondContact O-N 3.24Å; F778-L781 VanDerWaalsContact O-N 3.16Å; L781-L794 HydrophobicContact CB-CD2 4.13Å; L781-L794 HydrophobicContact CD2-CD2 3.89Å; L781-K797 HydrophobicContact CD1-CB 4.43Å; L781-K797 HydrophobicContact CD2-CB 4.11Å; L781-K797 HydrophobicContact CD2-CD 3.73Å; L781-V798 HydrophobicContact CD1-CG2 4.2Å; L781-Y855 WeakPolarHBondContact CB-OH 3.45Å; L781-Y855 PolarHBondContact O-OH 2.83Å
782	A	71.2	Confident	78.1	Confident	60 Å²	60	65.8 Å²	65.8	50%	0.496	35%	0.354	S	S	.	.			trans	-145.9	149.5	177.1	0	0	0	0	0	111.5	L794	A782-L794 WeakPolarHBondContact O-CD1 3.33Å
783	V	70.2	Confident	78.1	Confident	38 Å²	38	65.2 Å²	65.2	23%	0.23	35%	0.348	C	S	.	.			trans	-83.7	121.7	173.2	-169	0	0	0	0	108.9	I791 L794 Y855 I858	V783-I791 HydrophobicContact CG1-CG1 4.48Å; V783-L794 HydrophobicContact CG2-CD1 4.2Å; V783-Y855 HydrophobicContact CG2-CD1 3.59Å; V783-Y855 HydrophobicContact CG2-CE1 3.49Å; V783-Y855 VanDerWaalsContact CG2-CE1 3.49Å; V783-I858 HydrophobicContact CG1-CD1 4.41Å; V783-I858 HydrophobicContact CG2-CD1 4.1Å
784	T	66.8	Low	78.2	Confident	108 Å²	108	61.7 Å²	61.7	66%	0.663	33%	0.329	S	S	*	.			trans	-121.3	-20.6	179.4	40.9	0	0	0	0	114.3	E790	T784-E790 WeakPolarHBondContact CA-OE1 3.31Å; T784-E790 PolarHBondContact N-OE1 3.28Å; T784-E790 PolarHBondContact OG1-OE1 3.46Å; T784-E790 PolarHBondContact OG1-OE2 3.49Å
785	S	67.6	Low	78.3	Confident	31 Å²	31	61 Å²	61	22%	0.217	33%	0.326	C	S	.	.			trans	-122.4	168.4	-175.5	-169.7	0	0	0	0	114.2	D787 E790	S785-D787 VanDerWaalsContact C-N 3.31Å; S785-D787 PolarHBondContact OG-N 3.01Å; S785-E790 VanDerWaalsContact CB-CD 3.49Å; S785-E790 WeakPolarHBondContact CB-OE2 3.48Å; S785-E790 PolarHBondContact N-OE1 2.86Å
786	D	66.9	Low	78.3	Confident	35 Å²	35	64.2 Å²	64.2	19%	0.187	34%	0.341	C	S	.	.	S	Bend	trans	-85.4	3	159.6	64.1	-42	0	0	0	113	L788 L862 F925 A933	D786-L788 PolarHBondContact O-N 3.11Å; D786-L862 HydrophobicContact CB-CD2 4.09Å; D786-L862 WeakPolarHBondContact O-CD1 3.46Å; D786-F925 HydrophobicContact CB-CE1 4.45Å; D786-F925 HydrophobicContact CB-CZ 3.85Å; D786-A933 HydrophobicContact CB-CB 4.31Å
787	D	73.5	Confident	78.3	Confident	42 Å²	42	62.1 Å²	62.1	23%	0.225	33%	0.33	C	S	.	.			trans	-72.9	121.3	178.6	-154.8	-22.8	0	0	0	112.2	S785 E789 E790 I791	S785-D787 VanDerWaalsContact C-N 3.31Å; S785-D787 PolarHBondContact OG-N 3.01Å; D787-E789 PolarHBondContact O-N 2.83Å; D787-E789 WeakPolarHBondContact OD1-CB 3.5Å; D787-E789 PolarHBondContact OD1-N 3.02Å; D787-E790 HydrophobicContact CB-CB 4.19Å; D787-E790 PolarHBondContact O-N 3.04Å; D787-I791 PolarHBondContact O-N 2.7Å
788	L	78.8	Confident	78.6	Confident	38 Å²	38	59.6 Å²	59.6	20%	0.199	31%	0.312	C	S	.	.	H	α-helix	trans	-57.1	-32.5	170.5	-77.8	165.3	0	0	0	111.9	D786 I791 D792 K859 L862 T863	D786-L788 PolarHBondContact O-N 3.11Å; L788-I791 PolarHBondContact O-N 2.77Å; L788-D792 WeakPolarHBondContact O-CB 3.49Å; L788-D792 PolarHBondContact O-N 3.42Å; L788-K859 HydrophobicContact CD2-CG 4.22Å; L788-L862 HydrophobicContact CD1-CB 4.41Å; L788-L862 HydrophobicContact CD2-CB 3.59Å; L788-L862 HydrophobicContact CG-CB 3.88Å; L788-T863 HydrophobicContact CD1-CG2 4.21Å; L788-T863 HydrophobicContact CD2-CG2 3.77Å
789	E	78.5	Confident	78.7	Confident	119 Å²	119	63 Å²	63	56%	0.556	33%	0.328	S	S	*	.	H	α-helix	trans	-74.9	-27.6	-179.1	-158.1	167.4	172.1	0	0	112	D787 Q793	D787-E789 PolarHBondContact O-N 2.83Å; D787-E789 WeakPolarHBondContact OD1-CB 3.5Å; D787-E789 PolarHBondContact OD1-N 3.02Å; E789-Q793 WeakPolarHBondContact O-CB 3.35Å; E789-Q793 WeakPolarHBondContact O-CG 3.28Å; E789-Q793 PolarHBondContact O-N 2.65Å; E789-Q793 PolarHBondContact O-NE2 3.32Å
790	E	80.1	Confident	79	Confident	51 Å²	51	59.9 Å²	59.9	24%	0.238	32%	0.319	C	S	.	.	H	α-helix	trans	-70.2	-43.3	168.6	-177.9	177.4	119.2	0	0	110.5	T784 S785 D787 Q793 L794	T784-E790 WeakPolarHBondContact CA-OE1 3.31Å; T784-E790 PolarHBondContact N-OE1 3.28Å; T784-E790 PolarHBondContact OG1-OE1 3.46Å; T784-E790 PolarHBondContact OG1-OE2 3.49Å; S785-E790 VanDerWaalsContact CB-CD 3.49Å; S785-E790 WeakPolarHBondContact CB-OE2 3.48Å; S785-E790 PolarHBondContact N-OE1 2.86Å; D787-E790 HydrophobicContact CB-CB 4.19Å; D787-E790 PolarHBondContact O-N 3.04Å; E790-Q793 PolarHBondContact O-N 3.25Å; E790-L794 HydrophobicContact CG-CD1 4.39Å; E790-L794 VanDerWaalsContact O-CG 3.32Å; E790-L794 WeakPolarHBondContact O-CG 3.48Å; E790-L794 PolarHBondContact O-N 3.19Å
791	I	81.8	Confident	79.4	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-71.2	-37	-178.2	-65.8	161.5	0	0	0	111.9	V783 D787 L788 L794 L795 I858 K859 L862	V783-I791 HydrophobicContact CG1-CG1 4.48Å; D787-I791 PolarHBondContact O-N 2.7Å; L788-I791 PolarHBondContact O-N 2.77Å; I791-L794 PolarHBondContact O-N 2.81Å; I791-L795 HydrophobicContact CG2-CD1 4.38Å; I791-L795 PolarHBondContact O-N 3.32Å; I791-I858 HydrophobicContact CD1-CB 4.38Å; I791-I858 HydrophobicContact CD1-CG2 3.65Å; I791-K859 HydrophobicContact CG2-CB 3.98Å; I791-L862 HydrophobicContact CD1-CD1 3.31Å
792	D	84.2	Confident	79.7	Confident	68 Å²	68	53 Å²	53	36%	0.364	28%	0.283	S	S	.	.	H	α-helix	trans	-65.9	-39.7	172.6	-82.2	-20.5	0	0	0	111.7	L788 L794 L795 E796 K859	L788-D792 WeakPolarHBondContact O-CB 3.49Å; L788-D792 PolarHBondContact O-N 3.42Å; D792-L794 VanDerWaalsContact C-N 3.31Å; D792-L794 PolarHBondContact O-N 3.13Å; D792-L795 PolarHBondContact O-N 2.63Å; D792-E796 WeakPolarHBondContact O-CB 3.3Å; D792-E796 PolarHBondContact O-N 3.42Å; D792-K859 VanDerWaalsContact OD1-CD 3.31Å; D792-K859 WeakPolarHBondContact OD1-CD 3.01Å; D792-K859 WeakPolarHBondContact OD1-CE 3.33Å; D792-K859 IonicContact OD1-NZ 3.6Å; D792-K859 PolarHBondContact OD1-NZ 3.08Å
793	Q	83.5	Confident	80.4	Confident	86 Å²	86	56.7 Å²	56.7	40%	0.402	29%	0.29	S	S	.	.	H	α-helix	trans	-66.1	-30.4	171.7	-74.8	171.7	52.4	0	0	113.3	E789 E790 K797	E789-Q793 WeakPolarHBondContact O-CB 3.35Å; E789-Q793 WeakPolarHBondContact O-CG 3.28Å; E789-Q793 PolarHBondContact O-N 2.65Å; E789-Q793 PolarHBondContact O-NE2 3.32Å; E790-Q793 PolarHBondContact O-N 3.25Å; Q793-K797 WeakPolarHBondContact O-CB 3.35Å; Q793-K797 WeakPolarHBondContact O-CD 3.16Å; Q793-K797 WeakPolarHBondContact O-CE 3.45Å; Q793-K797 WeakPolarHBondContact O-CG 3.3Å; Q793-K797 PolarHBondContact O-N 2.68Å
794	L	84.2	Confident	81.1	Confident	9 Å²	9	55.9 Å²	55.9	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-71.2	-39.7	173.3	-73.7	170.8	0	0	0	111.1	L781 A782 V783 E790 I791 D792 V798 Y855	L781-L794 HydrophobicContact CB-CD2 4.13Å; L781-L794 HydrophobicContact CD2-CD2 3.89Å; A782-L794 WeakPolarHBondContact O-CD1 3.33Å; V783-L794 HydrophobicContact CG2-CD1 4.2Å; E790-L794 HydrophobicContact CG-CD1 4.39Å; E790-L794 VanDerWaalsContact O-CG 3.32Å; E790-L794 WeakPolarHBondContact O-CG 3.48Å; E790-L794 PolarHBondContact O-N 3.19Å; I791-L794 PolarHBondContact O-N 2.81Å; D792-L794 VanDerWaalsContact C-N 3.31Å; D792-L794 PolarHBondContact O-N 3.13Å; L794-V798 VanDerWaalsContact O-CG2 3.27Å; L794-V798 WeakPolarHBondContact O-CG2 3.32Å; L794-V798 PolarHBondContact O-N 3.38Å; L794-V798 VanDerWaalsContact O-N 3.12Å; L794-Y855 HydrophobicContact CB-CD2 3.77Å; L794-Y855 HydrophobicContact CB-CE2 3.74Å; L794-Y855 HydrophobicContact CB-CG 4.34Å; L794-Y855 HydrophobicContact CD1-CE1 4.39Å; L794-Y855 HydrophobicContact CD2-CE2 4.45Å; L794-Y855 HydrophobicContact CG-CE2 4.49Å
795	L	85.6	Confident	81.9	Confident	8 Å²	8	50.7 Å²	50.7	4%	0.042	26%	0.256	C	S	.	.	H	α-helix	trans	-66.7	-45.8	173.9	-76.4	166.4	0	0	0	112.2	I791 D792 K797 V798 E799 R852 K859	I791-L795 HydrophobicContact CG2-CD1 4.38Å; I791-L795 PolarHBondContact O-N 3.32Å; D792-L795 PolarHBondContact O-N 2.63Å; L795-K797 VanDerWaalsContact C-N 3.32Å; L795-K797 PolarHBondContact O-N 2.82Å; L795-V798 WeakPolarHBondContact O-CB 3.37Å; L795-V798 PolarHBondContact O-N 3.41Å; L795-V798 VanDerWaalsContact O-N 3.13Å; L795-E799 WeakPolarHBondContact O-CG 3.44Å; L795-E799 PolarHBondContact O-N 3.41Å; L795-R852 HydrophobicContact CD2-CG 4.35Å; L795-K859 HydrophobicContact CD1-CD 3.62Å
796	E	85.9	Confident	82.8	Confident	126 Å²	126	52.3 Å²	52.3	59%	0.589	27%	0.266	S	S	*	.	H	α-helix	trans	-58.1	-43	176.7	-177.1	-179.7	-149.3	0	0	111.5	D792 E799 V800	D792-E796 WeakPolarHBondContact O-CB 3.3Å; D792-E796 PolarHBondContact O-N 3.42Å; E796-E799 PolarHBondContact O-N 2.98Å; E796-V800 WeakPolarHBondContact O-CB 3.27Å; E796-V800 WeakPolarHBondContact O-CG2 3.46Å; E796-V800 PolarHBondContact O-N 2.89Å
797	K	84.3	Confident	83.6	Confident	89 Å²	89	57.8 Å²	57.8	39%	0.387	29%	0.291	S	S	.	.	H	α-helix	trans	-62.9	-42.5	175.3	-71.7	161.7	-160	159.1	0	112	L781 Q793 L795 T801	L781-K797 HydrophobicContact CD1-CB 4.43Å; L781-K797 HydrophobicContact CD2-CB 4.11Å; L781-K797 HydrophobicContact CD2-CD 3.73Å; Q793-K797 WeakPolarHBondContact O-CB 3.35Å; Q793-K797 WeakPolarHBondContact O-CD 3.16Å; Q793-K797 WeakPolarHBondContact O-CE 3.45Å; Q793-K797 WeakPolarHBondContact O-CG 3.3Å; Q793-K797 PolarHBondContact O-N 2.68Å; L795-K797 VanDerWaalsContact C-N 3.32Å; L795-K797 PolarHBondContact O-N 2.82Å; K797-T801 WeakPolarHBondContact O-CG2 3.39Å; K797-T801 PolarHBondContact O-N 3.42Å; K797-T801 PolarHBondContact O-OG1 3.39Å; K797-T801 VanDerWaalsContact O-OG1 3.13Å
798	V	87.2	Confident	84	Confident	2 Å²	2	56.1 Å²	56.1	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-61.7	-45.9	175.9	166.8	0	0	0	0	110.8	F778 L781 L794 L795 T801 D802 V848 R852 Y855	F778-V798 HydrophobicContact CE2-CG2 4.01Å; F778-V798 HydrophobicContact CZ-CG2 4.38Å; L781-V798 HydrophobicContact CD1-CG2 4.2Å; L794-V798 VanDerWaalsContact O-CG2 3.27Å; L794-V798 WeakPolarHBondContact O-CG2 3.32Å; L794-V798 PolarHBondContact O-N 3.38Å; L794-V798 VanDerWaalsContact O-N 3.12Å; L795-V798 WeakPolarHBondContact O-CB 3.37Å; L795-V798 PolarHBondContact O-N 3.41Å; L795-V798 VanDerWaalsContact O-N 3.13Å; V798-T801 WeakPolarHBondContact CA-OG1 3.48Å; V798-T801 PolarHBondContact O-N 3.03Å; V798-T801 PolarHBondContact O-OG1 3.05Å; V798-D802 PolarHBondContact O-N 3.28Å; V798-V848 HydrophobicContact CG1-CG1 3.8Å; V798-V848 WeakPolarHBondContact O-CG1 3.31Å; V798-R852 HydrophobicContact CG1-CB 3.86Å; V798-R852 HydrophobicContact CG1-CG 4.21Å; V798-Y855 HydrophobicContact CG2-CD2 4.07Å; V798-Y855 HydrophobicContact CG2-CE2 3.75Å
799	E	86.8	Confident	84.3	Confident	87 Å²	87	57.7 Å²	57.7	41%	0.407	29%	0.288	S	S	.	.	H	α-helix	trans	-66.5	-42.7	179.5	-68.6	-174.1	152.7	0	0	112.3	L795 E796 T801 D802 E803 R852	L795-E799 WeakPolarHBondContact O-CG 3.44Å; L795-E799 PolarHBondContact O-N 3.41Å; E796-E799 PolarHBondContact O-N 2.98Å; E799-T801 VanDerWaalsContact C-N 3.32Å; E799-T801 PolarHBondContact O-N 3.45Å; E799-D802 WeakPolarHBondContact O-CB 3.49Å; E799-D802 PolarHBondContact O-N 2.79Å; E799-D802 VanDerWaalsContact O-N 3.09Å; E799-E803 PolarHBondContact O-N 2.98Å; E799-R852 IonicContact OE1-CZ 2.7Å; E799-R852 IonicContact OE1-NE 3.18Å; E799-R852 IonicContact OE1-NH2 3.36Å; E799-R852 PolarHBondContact OE1-NH2 3.34Å
800	V	86.2	Confident	84.5	Confident	80 Å²	80	53.9 Å²	53.9	49%	0.485	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-36.8	173.7	170.6	0	0	0	0	112	E796 D802 A804	E796-V800 WeakPolarHBondContact O-CB 3.27Å; E796-V800 WeakPolarHBondContact O-CG2 3.46Å; E796-V800 PolarHBondContact O-N 2.89Å; V800-D802 VanDerWaalsContact C-N 3.33Å; V800-A804 WeakPolarHBondContact O-CB 3.39Å; V800-A804 PolarHBondContact O-N 3.37Å
801	T	85.2	Confident	84.4	Confident	7 Å²	7	53.9 Å²	53.9	4%	0.043	28%	0.281	C	S	.	.	H	α-helix	trans	-69.1	-29.4	173.4	53.6	0	0	0	0	113.1	L774 F778 K797 V798 E799 V805	L774-T801 HydrophobicContact CD2-CG2 4.21Å; F778-T801 HydrophobicContact CD2-CG2 4.21Å; K797-T801 WeakPolarHBondContact O-CG2 3.39Å; K797-T801 PolarHBondContact O-N 3.42Å; K797-T801 PolarHBondContact O-OG1 3.39Å; K797-T801 VanDerWaalsContact O-OG1 3.13Å; V798-T801 WeakPolarHBondContact CA-OG1 3.48Å; V798-T801 PolarHBondContact O-N 3.03Å; V798-T801 PolarHBondContact O-OG1 3.05Å; E799-T801 VanDerWaalsContact C-N 3.32Å; E799-T801 PolarHBondContact O-N 3.45Å; T801-V805 WeakPolarHBondContact O-CB 3.33Å; T801-V805 WeakPolarHBondContact O-CG2 3.39Å; T801-V805 PolarHBondContact O-N 3.04Å; T801-V805 VanDerWaalsContact O-N 3.11Å
802	D	85.9	Confident	84.4	Confident	28 Å²	28	54 Å²	54	15%	0.15	28%	0.282	C	S	.	.	H	α-helix	trans	-72.2	-43.6	175.4	-158.9	34.2	0	0	0	111.4	V798 E799 V800 V805 C806 H845 V848 R852	V798-D802 PolarHBondContact O-N 3.28Å; E799-D802 WeakPolarHBondContact O-CB 3.49Å; E799-D802 PolarHBondContact O-N 2.79Å; E799-D802 VanDerWaalsContact O-N 3.09Å; V800-D802 VanDerWaalsContact C-N 3.33Å; D802-V805 PolarHBondContact O-N 3.18Å; D802-C806 PolarHBondContact O-N 2.92Å; D802-C806 PolarHBondContact O-SG 3.23Å; D802-H845 IonicContact OD1-CE1 3.84Å; D802-H845 PolarHBondContact OD1-CE1 3.49Å; D802-H845 IonicContact OD1-ND1 3.66Å; D802-H845 PolarHBondContact OD1-ND1 3.34Å; D802-V848 HydrophobicContact CB-CG1 3.99Å; D802-R852 IonicContact OD2-NH1 2.71Å
803	E	86.2	Confident	84.2	Confident	138 Å²	138	54 Å²	54	65%	0.645	29%	0.287	S	S	*	.	H	α-helix	trans	-59.7	-49.4	173.9	-71	-170.6	156.6	0	0	111.7	E799 V805 C806 E807	E799-E803 PolarHBondContact O-N 2.98Å; E803-V805 VanDerWaalsContact C-N 3.31Å; E803-V805 PolarHBondContact O-N 3.17Å; E803-C806 WeakPolarHBondContact O-CA 3.4Å; E803-C806 WeakPolarHBondContact O-CB 3.43Å; E803-C806 PolarHBondContact O-N 3.36Å; E803-E807 PolarHBondContact O-N 3.49Å
804	A	83.6	Confident	84	Confident	21 Å²	21	54.1 Å²	54.1	17%	0.174	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-35.9	179.4	0	0	0	0	0	112.5	L774 V800 E807 L808	L774-A804 HydrophobicContact CD1-CB 3.82Å; L774-A804 HydrophobicContact CD2-CB 3.93Å; V800-A804 WeakPolarHBondContact O-CB 3.39Å; V800-A804 PolarHBondContact O-N 3.37Å; A804-E807 PolarHBondContact O-N 3.42Å; A804-L808 VanDerWaalsContact O-CG 3.28Å; A804-L808 WeakPolarHBondContact O-CG 3.45Å; A804-L808 PolarHBondContact O-N 3.21Å
805	V	84.8	Confident	83.6	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-37.5	172.9	164.6	0	0	0	0	111.7	T801 D802 E803 Q809 L841 F844 H845	T801-V805 WeakPolarHBondContact O-CB 3.33Å; T801-V805 WeakPolarHBondContact O-CG2 3.39Å; T801-V805 PolarHBondContact O-N 3.04Å; T801-V805 VanDerWaalsContact O-N 3.11Å; D802-V805 PolarHBondContact O-N 3.18Å; E803-V805 VanDerWaalsContact C-N 3.31Å; E803-V805 PolarHBondContact O-N 3.17Å; V805-Q809 VanDerWaalsContact O-CG 3.28Å; V805-Q809 WeakPolarHBondContact O-CG 3.48Å; V805-Q809 PolarHBondContact O-N 3.49Å; V805-L841 HydrophobicContact CG1-CD2 4.21Å; V805-L841 HydrophobicContact CG2-CD2 4.46Å; V805-F844 HydrophobicContact CG2-CD1 3.41Å; V805-F844 VanDerWaalsContact CG2-CD1 3.41Å; V805-F844 HydrophobicContact CG2-CE1 3.6Å; V805-H845 HydrophobicContact CG1-CB 4.05Å
806	C	85.5	Confident	83	Confident	65 Å²	65	57.8 Å²	57.8	44%	0.439	31%	0.305	S	S	.	.	H	α-helix	trans	-66.5	-41.5	174.1	-68	0	0	0	0	112.4	D802 E803 Q809 G810	D802-C806 PolarHBondContact O-N 2.92Å; D802-C806 PolarHBondContact O-SG 3.23Å; E803-C806 WeakPolarHBondContact O-CA 3.4Å; E803-C806 WeakPolarHBondContact O-CB 3.43Å; E803-C806 PolarHBondContact O-N 3.36Å; C806-Q809 PolarHBondContact O-N 2.95Å; C806-G810 PolarHBondContact O-N 3.24Å; C806-G810 VanDerWaalsContact O-N 3.09Å
807	E	83.1	Confident	82.6	Confident	150 Å²	150	53.5 Å²	53.5	70%	0.701	29%	0.291	S	S	*	.	H	α-helix	trans	-62.4	-43.6	174.6	-69.9	-162.3	149.5	0	0	112	E803 A804 Q809 G810 E811	E803-E807 PolarHBondContact O-N 3.49Å; A804-E807 PolarHBondContact O-N 3.42Å; E807-Q809 PolarHBondContact O-N 2.96Å; E807-G810 CarbonylContact O-C 3.59Å; E807-G810 VanDerWaalsContact O-CA 3.31Å; E807-G810 WeakPolarHBondContact O-CA 3.3Å; E807-G810 PolarHBondContact O-N 2.99Å; E807-E811 PolarHBondContact O-N 3.12Å
808	L	83.5	Confident	81.9	Confident	7 Å²	7	51 Å²	51	4%	0.037	28%	0.284	C	S	.	.	H	α-helix	trans	-64.9	-38.5	176.7	-68.8	171.4	0	0	0	112.2	V767 I770 L771 L774 A804 G810 E811 V812 L841	V767-L808 HydrophobicContact CB-CD2 4.49Å; V767-L808 HydrophobicContact CG1-CD2 3.76Å; I770-L808 HydrophobicContact CB-CD1 4.43Å; I770-L808 HydrophobicContact CB-CD2 3.96Å; I770-L808 HydrophobicContact CD1-CD2 4.27Å; I770-L808 HydrophobicContact CG2-CD1 4.03Å; I770-L808 HydrophobicContact CG2-CD2 3.99Å; I770-L808 HydrophobicContact CG2-CG 4.4Å; L771-L808 HydrophobicContact CB-CD1 4.39Å; L774-L808 HydrophobicContact CD1-CD1 3.56Å; A804-L808 VanDerWaalsContact O-CG 3.28Å; A804-L808 WeakPolarHBondContact O-CG 3.45Å; A804-L808 PolarHBondContact O-N 3.21Å; L808-G810 PolarHBondContact O-N 2.88Å; L808-E811 PolarHBondContact O-N 2.67Å; L808-V812 WeakPolarHBondContact O-CB 3.08Å; L808-V812 VanDerWaalsContact O-CG2 3.23Å; L808-V812 WeakPolarHBondContact O-CG2 3.42Å; L808-V812 PolarHBondContact O-N 3.36Å; L808-L841 HydrophobicContact CB-CD1 4.08Å; L808-L841 HydrophobicContact CB-CD2 3.65Å; L808-L841 HydrophobicContact CD1-CD2 4Å
809	Q	84.4	Confident	81	Confident	71 Å²	71	54.1 Å²	54.1	33%	0.332	30%	0.295	S	S	.	.	H	α-helix	trans	-59.9	-33.8	170.9	-72.5	173.4	31.2	0	0	111.9	V805 C806 E807 S813 L841	V805-Q809 VanDerWaalsContact O-CG 3.28Å; V805-Q809 WeakPolarHBondContact O-CG 3.48Å; V805-Q809 PolarHBondContact O-N 3.49Å; C806-Q809 PolarHBondContact O-N 2.95Å; E807-Q809 PolarHBondContact O-N 2.96Å; Q809-S813 WeakPolarHBondContact O-CB 3.41Å; Q809-S813 PolarHBondContact O-N 3.31Å; Q809-S813 VanDerWaalsContact O-N 3.09Å; Q809-S813 PolarHBondContact O-OG 2.63Å; Q809-L841 HydrophobicContact CG-CB 4.42Å; Q809-L841 HydrophobicContact CG-CD1 4.29Å
810	G	81.6	Confident	79.9	Confident	39 Å²	39	54.3 Å²	54.3	40%	0.402	31%	0.312	S	S	.	.	H	α-helix	trans	-63.4	-56.9	169.8	0	0	0	0	0	112.9	C806 E807 L808 V812 S813 D814	C806-G810 PolarHBondContact O-N 3.24Å; C806-G810 VanDerWaalsContact O-N 3.09Å; E807-G810 CarbonylContact O-C 3.59Å; E807-G810 VanDerWaalsContact O-CA 3.31Å; E807-G810 WeakPolarHBondContact O-CA 3.3Å; E807-G810 PolarHBondContact O-N 2.99Å; L808-G810 PolarHBondContact O-N 2.88Å; G810-V812 VanDerWaalsContact C-N 3.31Å; G810-V812 PolarHBondContact O-N 3.03Å; G810-S813 WeakPolarHBondContact O-CB 3.29Å; G810-S813 PolarHBondContact O-N 3.13Å; G810-S813 VanDerWaalsContact O-N 3.13Å; G810-D814 PolarHBondContact O-N 2.88Å
811	E	79.4	Confident	78.9	Confident	51 Å²	51	58.6 Å²	58.6	24%	0.238	32%	0.324	C	S	.	.	H	α-helix	trans	-62	-36	-179.7	-72.3	-155.1	-172.4	0	0	112.9	R766 V767 E807 L808 D814 L815	R766-E811 IonicContact CZ-OE1 3.92Å; R766-E811 IonicContact CZ-OE2 2.69Å; R766-E811 IonicContact NH1-OE1 3.22Å; R766-E811 PolarHBondContact NH1-OE1 3.2Å; R766-E811 IonicContact NH1-OE2 2.8Å; R766-E811 PolarHBondContact NH1-OE2 3.04Å; R766-E811 IonicContact NH2-OE1 3.94Å; V767-E811 HydrophobicContact CG2-CB 3.92Å; V767-E811 WeakPolarHBondContact CG2-OE2 3.45Å; E807-E811 PolarHBondContact O-N 3.12Å; L808-E811 PolarHBondContact O-N 2.67Å; E811-D814 PolarHBondContact O-N 3.2Å; E811-L815 WeakPolarHBondContact O-CB 3.42Å; E811-L815 WeakPolarHBondContact O-CG 3.41Å; E811-L815 PolarHBondContact O-N 3.24Å
812	V	81.2	Confident	77.6	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.018	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-42	174	174.2	0	0	0	0	111.3	V767 L808 G810 D814 L815 K816 I834 L837 E838 L841	V767-V812 HydrophobicContact CG1-CG2 3.64Å; L808-V812 WeakPolarHBondContact O-CB 3.08Å; L808-V812 VanDerWaalsContact O-CG2 3.23Å; L808-V812 WeakPolarHBondContact O-CG2 3.42Å; L808-V812 PolarHBondContact O-N 3.36Å; G810-V812 VanDerWaalsContact C-N 3.31Å; G810-V812 PolarHBondContact O-N 3.03Å; V812-D814 PolarHBondContact O-N 3.18Å; V812-L815 PolarHBondContact O-N 2.89Å; V812-K816 VanDerWaalsContact O-CB 3.31Å; V812-K816 WeakPolarHBondContact O-CB 3.49Å; V812-K816 PolarHBondContact O-N 3.46Å; V812-I834 HydrophobicContact CG1-CG2 4.07Å; V812-L837 HydrophobicContact CG2-CD2 3.81Å; V812-L837 HydrophobicContact CG2-CG 3.87Å; V812-E838 HydrophobicContact CG1-CG 3.43Å; V812-E838 VanDerWaalsContact CG1-CG 3.43Å; V812-L841 HydrophobicContact CB-CD1 4.47Å; V812-L841 HydrophobicContact CG2-CD1 3.76Å
813	S	81	Confident	75.9	Confident	67 Å²	67	66.2 Å²	66.2	47%	0.469	37%	0.367	S	S	.	.	H	α-helix	trans	-60.3	-37.7	173.7	-62.7	0	0	0	0	111.7	Q809 G810 K816 A817	Q809-S813 WeakPolarHBondContact O-CB 3.41Å; Q809-S813 PolarHBondContact O-N 3.31Å; Q809-S813 VanDerWaalsContact O-N 3.09Å; Q809-S813 PolarHBondContact O-OG 2.63Å; G810-S813 WeakPolarHBondContact O-CB 3.29Å; G810-S813 PolarHBondContact O-N 3.13Å; G810-S813 VanDerWaalsContact O-N 3.13Å; S813-K816 PolarHBondContact O-N 3.38Å; S813-A817 VanDerWaalsContact O-CB 3.32Å; S813-A817 WeakPolarHBondContact O-CB 3.44Å; S813-A817 PolarHBondContact O-N 3.26Å
814	D	77.8	Confident	74.2	Confident	88 Å²	88	66.7 Å²	66.7	47%	0.471	38%	0.382	S	S	.	.	H	α-helix	trans	-75.7	-37.4	-179.8	-133.2	36.1	0	0	0	112.6	R763 G810 E811 V812 A817 T818	R763-D814 IonicContact NH2-OD2 2.63Å; G810-D814 PolarHBondContact O-N 2.88Å; E811-D814 PolarHBondContact O-N 3.2Å; V812-D814 PolarHBondContact O-N 3.18Å; D814-A817 PolarHBondContact O-N 2.84Å; D814-T818 VanDerWaalsContact O-CB 3.3Å; D814-T818 WeakPolarHBondContact O-CB 3.06Å; D814-T818 PolarHBondContact O-N 3.08Å; D814-T818 PolarHBondContact O-OG1 3.35Å
815	L	76.2	Confident	72.6	Confident	7 Å²	7	70.6 Å²	70.6	4%	0.037	41%	0.408	C	S	.	.	H	α-helix	trans	-61.7	-44.3	168.4	-76.3	173	0	0	0	110.9	R763 L764 V767 E811 V812 T818 R819 I834	R763-L815 HydrophobicContact CB-CD2 3.96Å; L764-L815 HydrophobicContact CB-CD1 4.47Å; L764-L815 HydrophobicContact CG-CD1 4.46Å; V767-L815 HydrophobicContact CB-CD1 4.34Å; V767-L815 HydrophobicContact CG2-CD1 3.76Å; E811-L815 WeakPolarHBondContact O-CB 3.42Å; E811-L815 WeakPolarHBondContact O-CG 3.41Å; E811-L815 PolarHBondContact O-N 3.24Å; V812-L815 PolarHBondContact O-N 2.89Å; L815-T818 PolarHBondContact O-N 3.18Å; L815-R819 WeakPolarHBondContact O-CB 3.35Å; L815-R819 PolarHBondContact O-N 3.22Å; L815-I834 HydrophobicContact CB-CD1 4.23Å
816	K	74.2	Confident	70.9	Confident	87 Å²	87	73.7 Å²	73.7	38%	0.378	43%	0.43	S	S	.	.	H	α-helix	trans	-61.8	-44.6	175.1	-163.3	-179.8	-147.9	166.4	0	111.5	V812 S813 T818 R819 A820 I834 E838	V812-K816 VanDerWaalsContact O-CB 3.31Å; V812-K816 WeakPolarHBondContact O-CB 3.49Å; V812-K816 PolarHBondContact O-N 3.46Å; S813-K816 PolarHBondContact O-N 3.38Å; K816-T818 VanDerWaalsContact C-N 3.32Å; K816-T818 PolarHBondContact O-N 2.87Å; K816-R819 PolarHBondContact O-N 3.42Å; K816-A820 VanDerWaalsContact O-CB 3.25Å; K816-A820 WeakPolarHBondContact O-CB 3.05Å; K816-A820 PolarHBondContact O-N 2.67Å; K816-I834 HydrophobicContact CB-CG2 4.16Å; K816-I834 HydrophobicContact CG-CG2 4.32Å; K816-E838 VanDerWaalsContact CD-OE1 3.3Å; K816-E838 WeakPolarHBondContact CD-OE1 3.4Å; K816-E838 WeakPolarHBondContact CE-OE1 3.49Å; K816-E838 IonicContact NZ-OE1 2.67Å; K816-E838 PolarHBondContact NZ-OE1 3Å; K816-E838 IonicContact NZ-OE2 2.73Å; K816-E838 PolarHBondContact NZ-OE2 2.89Å
817	A	75.8	Confident	69.2	Low	36 Å²	36	74.1 Å²	74.1	30%	0.298	43%	0.434	S	S	.	.	H	α-helix	trans	-67.4	-30	176.5	0	0	0	0	0	113.2	S813 D814 K821	S813-A817 VanDerWaalsContact O-CB 3.32Å; S813-A817 WeakPolarHBondContact O-CB 3.44Å; S813-A817 PolarHBondContact O-N 3.26Å; D814-A817 PolarHBondContact O-N 2.84Å; A817-K821 VanDerWaalsContact O-CD 3.23Å; A817-K821 WeakPolarHBondContact O-CD 3.41Å; A817-K821 VanDerWaalsContact O-CE 3.24Å; A817-K821 WeakPolarHBondContact O-CE 3.35Å; A817-K821 VanDerWaalsContact O-CG 3.29Å; A817-K821 WeakPolarHBondContact O-CG 3.43Å
818	T	70.3	Confident	67.8	Low	37 Å²	37	72.4 Å²	72.4	23%	0.227	43%	0.433	C	S	.	.	H	α-helix	trans	-78.1	-44	176.2	-56.4	0	0	0	0	110.9	L760 D814 L815 K816 A820 K821 A822	L760-T818 HydrophobicContact CD1-CG2 4.07Å; L760-T818 HydrophobicContact CD2-CG2 4.12Å; L760-T818 HydrophobicContact CG-CG2 4.5Å; D814-T818 VanDerWaalsContact O-CB 3.3Å; D814-T818 WeakPolarHBondContact O-CB 3.06Å; D814-T818 PolarHBondContact O-N 3.08Å; D814-T818 PolarHBondContact O-OG1 3.35Å; L815-T818 PolarHBondContact O-N 3.18Å; K816-T818 VanDerWaalsContact C-N 3.32Å; K816-T818 PolarHBondContact O-N 2.87Å; T818-A820 PolarHBondContact O-N 3.4Å; T818-K821 WeakPolarHBondContact O-CB 3.42Å; T818-K821 PolarHBondContact O-N 3.12Å; T818-K821 VanDerWaalsContact O-N 3.12Å; T818-A822 PolarHBondContact O-N 2.79Å
819	R	67.3	Low	66.6	Low	68 Å²	68	76.2 Å²	76.2	26%	0.257	46%	0.457	S	S	.	.	H	α-helix	trans	-60	-42.3	172.5	-170.1	178.8	-170.6	81.4	11.2	111.8	L815 K816 K821 A822 S827 G830 T831 I834	L815-R819 WeakPolarHBondContact O-CB 3.35Å; L815-R819 PolarHBondContact O-N 3.22Å; K816-R819 PolarHBondContact O-N 3.42Å; R819-K821 PolarHBondContact O-N 3.33Å; R819-K821 VanDerWaalsContact O-N 3.16Å; R819-A822 PolarHBondContact O-N 3.08Å; R819-S827 PolarHBondContact NH2-O 2.98Å; R819-S827 PolarHBondContact NH2-OG 3.25Å; R819-G830 VanDerWaalsContact CZ-CA 3.5Å; R819-G830 VanDerWaalsContact NE-C 3.3Å; R819-G830 PolarHBondContact NE-O 3.42Å; R819-G830 PolarHBondContact NH1-O 3.44Å; R819-T831 PolarHBondContact NE-OG1 2.87Å; R819-I834 HydrophobicContact CB-CD1 4.22Å
820	A	64.1	Low	65.4	Low	90 Å²	90	73 Å²	73	74%	0.744	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-20.7	176.9	0	0	0	0	0	114	K816 T818	K816-A820 VanDerWaalsContact O-CB 3.25Å; K816-A820 WeakPolarHBondContact O-CB 3.05Å; K816-A820 PolarHBondContact O-N 2.67Å; T818-A820 PolarHBondContact O-N 3.4Å
821	K	65.7	Low	64.6	Low	170 Å²	170	73.9 Å²	73.9	74%	0.739	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-13.6	173.3	-64.9	160.5	-167.6	162.6	0	112.6	A817 T818 R819	A817-K821 VanDerWaalsContact O-CD 3.23Å; A817-K821 WeakPolarHBondContact O-CD 3.41Å; A817-K821 VanDerWaalsContact O-CE 3.24Å; A817-K821 WeakPolarHBondContact O-CE 3.35Å; A817-K821 VanDerWaalsContact O-CG 3.29Å; A817-K821 WeakPolarHBondContact O-CG 3.43Å; T818-K821 WeakPolarHBondContact O-CB 3.42Å; T818-K821 PolarHBondContact O-N 3.12Å; T818-K821 VanDerWaalsContact O-N 3.12Å; R819-K821 PolarHBondContact O-N 3.33Å; R819-K821 VanDerWaalsContact O-N 3.16Å
822	A	57.3	Low	64.2	Low	53 Å²	53	75.7 Å²	75.7	44%	0.438	45%	0.451	S	S	.	.	S	Bend	trans	-106.4	88.9	-173.6	0	0	0	0	0	112.4	T818 R819	T818-A822 PolarHBondContact O-N 2.79Å; R819-A822 PolarHBondContact O-N 3.08Å
823	Q	50.2	Low	63.8	Low	142 Å²	142	79 Å²	79	66%	0.664	47%	0.466	S	S	*	.			trans	45.3	109.6	169.5	-67.5	-168.2	-6.6	0	0	117.9	S825 S826	Q823-S825 PolarHBondContact O-N 3.19Å; Q823-S826 PolarHBondContact O-OG 2.64Å
824	P	51.9	Low	63.7	Low	149 Å²	149	76 Å²	76	97%	0.968	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	34.5	179.8	35.1	-38.5	0	0	0	114.3
825	S	48.7	Very low	63.8	Low	103 Å²	103	76.5 Å²	76.5	72%	0.72	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.4	5.9	-173.6	54.3	0	0	0	0	114.8	Q823	Q823-S825 PolarHBondContact O-N 3.19Å
826	S	49.1	Very low	64.2	Low	64 Å²	64	81.4 Å²	81.4	45%	0.448	47%	0.468	S	S	.	.	S	Bend	trans	-121.3	124	-178.8	45.1	0	0	0	0	112.3	Q823	Q823-S826 PolarHBondContact O-OG 2.64Å
827	S	49.5	Very low	64.6	Low	75 Å²	75	77.6 Å²	77.6	52%	0.524	45%	0.451	S	S	.	.			trans	41.4	108.5	175.2	66.3	0	0	0	0	117.9	R819 V829	R819-S827 PolarHBondContact NH2-O 2.98Å; R819-S827 PolarHBondContact NH2-OG 3.25Å; S827-V829 PolarHBondContact O-N 2.92Å
828	T	53.9	Low	65.1	Low	113 Å²	113	78 Å²	78	69%	0.693	45%	0.447	S	S	*	.	S	Bend	trans	-58.3	-29.8	164.1	-16.7	0	0	0	0	112.3	T831 L832	T828-T831 PolarHBondContact O-N 2.65Å; T828-T831 VanDerWaalsContact O-N 3.15Å; T828-L832 PolarHBondContact O-N 3.35Å
829	V	58	Low	65.8	Low	88 Å²	88	81.3 Å²	81.3	53%	0.533	46%	0.46	S	S	.	.	H	α-helix	trans	-49.8	-63.1	-175.8	-176.1	0	0	0	0	111.6	S827 T831 L832 E833	S827-V829 PolarHBondContact O-N 2.92Å; V829-T831 PolarHBondContact O-N 3.24Å; V829-L832 WeakPolarHBondContact O-CB 3.43Å; V829-L832 PolarHBondContact O-N 3.35Å; V829-E833 HydrophobicContact CG1-CG 4.5Å; V829-E833 WeakPolarHBondContact CG1-OE1 3.34Å; V829-E833 PolarHBondContact O-N 3.28Å
830	G	60	Low	66.8	Low	4 Å²	4	79.7 Å²	79.7	4%	0.041	46%	0.461	C	S	.	.	H	α-helix	trans	-71.6	-2	-176.2	0	0	0	0	0	115.7	R819 E833	R819-G830 VanDerWaalsContact CZ-CA 3.5Å; R819-G830 VanDerWaalsContact NE-C 3.3Å; R819-G830 PolarHBondContact NE-O 3.42Å; R819-G830 PolarHBondContact NH1-O 3.44Å; G830-E833 VanDerWaalsContact CA-OE2 3.26Å; G830-E833 WeakPolarHBondContact CA-OE2 3.43Å
831	T	64.7	Low	67.9	Low	56 Å²	56	75.5 Å²	75.5	34%	0.344	43%	0.426	S	S	.	.	H	α-helix	trans	-85.9	-42.8	169.2	-50.9	0	0	0	0	109.4	R819 T828 V829 E833 I834 E835	R819-T831 PolarHBondContact NE-OG1 2.87Å; T828-T831 PolarHBondContact O-N 2.65Å; T828-T831 VanDerWaalsContact O-N 3.15Å; V829-T831 PolarHBondContact O-N 3.24Å; T831-E833 VanDerWaalsContact C-N 3.28Å; T831-E833 PolarHBondContact O-N 2.87Å; T831-I834 PolarHBondContact O-N 2.69Å; T831-I834 VanDerWaalsContact O-N 3.16Å; T831-E835 WeakPolarHBondContact O-CG 3.38Å; T831-E835 PolarHBondContact O-N 2.8Å
832	L	70.5	Confident	68.9	Low	90 Å²	90	73.1 Å²	73.1	47%	0.471	41%	0.413	S	S	.	.	H	α-helix	trans	-59.6	-40.2	169.3	-60.7	165.6	0	0	0	110.7	T828 V829 I834 E835 E836	T828-L832 PolarHBondContact O-N 3.35Å; V829-L832 WeakPolarHBondContact O-CB 3.43Å; V829-L832 PolarHBondContact O-N 3.35Å; L832-I834 PolarHBondContact O-N 2.96Å; L832-I834 VanDerWaalsContact O-N 3.15Å; L832-E835 PolarHBondContact O-N 2.94Å; L832-E835 VanDerWaalsContact O-N 3.11Å; L832-E836 WeakPolarHBondContact O-CB 3.46Å; L832-E836 VanDerWaalsContact O-CG 3.31Å; L832-E836 WeakPolarHBondContact O-CG 3.46Å; L832-E836 PolarHBondContact O-N 2.88Å
833	E	74.6	Confident	70.4	Confident	71 Å²	71	74.1 Å²	74.1	33%	0.332	42%	0.416	S	S	.	.	H	α-helix	trans	-62.4	-21.8	177.8	-66.9	169.8	168.7	0	0	114	R768 V829 G830 T831	R768-E833 VanDerWaalsContact NH2-CA 3.32Å; R768-E833 PolarHBondContact NH2-O 3.3Å; V829-E833 HydrophobicContact CG1-CG 4.5Å; V829-E833 WeakPolarHBondContact CG1-OE1 3.34Å; V829-E833 PolarHBondContact O-N 3.28Å; G830-E833 VanDerWaalsContact CA-OE2 3.26Å; G830-E833 WeakPolarHBondContact CA-OE2 3.43Å; T831-E833 VanDerWaalsContact C-N 3.28Å; T831-E833 PolarHBondContact O-N 2.87Å
834	I	77.4	Confident	72.3	Confident	5 Å²	5	67.4 Å²	67.4	3%	0.026	39%	0.385	C	S	.	.	H	α-helix	trans	-87.5	-41.8	172.1	-67.5	-179.8	0	0	0	110.5	L764 V812 L815 K816 R819 T831 L832 L837 E838	L764-I834 HydrophobicContact CD1-CD1 4.42Å; L764-I834 HydrophobicContact CD1-CG1 4.13Å; V812-I834 HydrophobicContact CG1-CG2 4.07Å; L815-I834 HydrophobicContact CB-CD1 4.23Å; K816-I834 HydrophobicContact CB-CG2 4.16Å; K816-I834 HydrophobicContact CG-CG2 4.32Å; R819-I834 HydrophobicContact CB-CD1 4.22Å; T831-I834 PolarHBondContact O-N 2.69Å; T831-I834 VanDerWaalsContact O-N 3.16Å; L832-I834 PolarHBondContact O-N 2.96Å; L832-I834 VanDerWaalsContact O-N 3.15Å; I834-L837 WeakPolarHBondContact O-CB 3.31Å; I834-L837 PolarHBondContact O-N 3.49Å; I834-E838 PolarHBondContact O-N 3.45Å
835	E	80.8	Confident	74.1	Confident	98 Å²	98	63.3 Å²	63.3	46%	0.458	35%	0.353	S	S	.	.	H	α-helix	trans	-65.8	-37.3	179.4	-69.8	173.4	174.2	0	0	112.7	T831 L832 L837 E838 E839	T831-E835 WeakPolarHBondContact O-CG 3.38Å; T831-E835 PolarHBondContact O-N 2.8Å; L832-E835 PolarHBondContact O-N 2.94Å; L832-E835 VanDerWaalsContact O-N 3.11Å; E835-L837 VanDerWaalsContact C-N 3.31Å; E835-L837 PolarHBondContact O-N 2.7Å; E835-E838 PolarHBondContact O-N 3.42Å; E835-E839 PolarHBondContact O-N 3.17Å
836	E	83.5	Confident	76.1	Confident	111 Å²	111	62.4 Å²	62.4	52%	0.519	34%	0.343	S	S	.	.	H	α-helix	trans	-58.1	-42.6	170	-74.6	172.2	179.6	0	0	112.1	R768 L832 E839 A840	R768-E836 IonicContact CZ-OE2 2.63Å; R768-E836 IonicContact NH1-OE2 3.58Å; R768-E836 IonicContact NH2-OE2 2.68Å; R768-E836 PolarHBondContact NH2-OE2 2.98Å; L832-E836 WeakPolarHBondContact O-CB 3.46Å; L832-E836 VanDerWaalsContact O-CG 3.31Å; L832-E836 WeakPolarHBondContact O-CG 3.46Å; L832-E836 PolarHBondContact O-N 2.88Å; E836-E839 PolarHBondContact O-N 3.28Å; E836-A840 PolarHBondContact O-N 3.02Å; E836-A840 VanDerWaalsContact O-N 3.13Å
837	L	83.7	Confident	77.9	Confident	7 Å²	7	62.9 Å²	62.9	4%	0.037	34%	0.337	C	S	.	.	H	α-helix	trans	-72	-34.7	-175.9	-172.1	54.8	0	0	0	111.6	V767 R768 L771 V812 I834 E835 E839 L841	V767-L837 HydrophobicContact CB-CD2 4.26Å; V767-L837 HydrophobicContact CG1-CD2 3.77Å; V767-L837 HydrophobicContact CG1-CG 4.45Å; R768-L837 HydrophobicContact CG-CD1 3.96Å; R768-L837 HydrophobicContact CG-CD2 3.91Å; L771-L837 HydrophobicContact CD2-CD1 3.67Å; V812-L837 HydrophobicContact CG2-CD2 3.81Å; V812-L837 HydrophobicContact CG2-CG 3.87Å; I834-L837 WeakPolarHBondContact O-CB 3.31Å; I834-L837 PolarHBondContact O-N 3.49Å; E835-L837 VanDerWaalsContact C-N 3.31Å; E835-L837 PolarHBondContact O-N 2.7Å; L837-E839 VanDerWaalsContact C-N 3.33Å; L837-L841 WeakPolarHBondContact O-CG 3.07Å; L837-L841 PolarHBondContact O-N 3.2Å
838	E	85.2	Confident	79.8	Confident	43 Å²	43	59.3 Å²	59.3	20%	0.201	31%	0.312	C	S	.	.	H	α-helix	trans	-66.4	-29.2	170.6	-72.3	-175.6	162	0	0	113.7	V812 K816 I834 E835 R842	V812-E838 HydrophobicContact CG1-CG 3.43Å; V812-E838 VanDerWaalsContact CG1-CG 3.43Å; K816-E838 VanDerWaalsContact CD-OE1 3.3Å; K816-E838 WeakPolarHBondContact CD-OE1 3.4Å; K816-E838 WeakPolarHBondContact CE-OE1 3.49Å; K816-E838 IonicContact NZ-OE1 2.67Å; K816-E838 PolarHBondContact NZ-OE1 3Å; K816-E838 IonicContact NZ-OE2 2.73Å; K816-E838 PolarHBondContact NZ-OE2 2.89Å; I834-E838 PolarHBondContact O-N 3.45Å; E835-E838 PolarHBondContact O-N 3.42Å; E838-R842 WeakPolarHBondContact O-CG 3.46Å; E838-R842 VanDerWaalsContact O-CZ 3.31Å; E838-R842 PolarHBondContact O-NE 2.86Å; E838-R842 PolarHBondContact O-NH2 3.25Å
839	E	86.4	Confident	81.3	Confident	107 Å²	107	57.3 Å²	57.3	50%	0.5	30%	0.295	S	S	.	.	H	α-helix	trans	-77.7	-45.2	177.8	-165	64.9	-123.6	0	0	111.5	E835 E836 L837 L841 R842 S843	E835-E839 PolarHBondContact O-N 3.17Å; E836-E839 PolarHBondContact O-N 3.28Å; L837-E839 VanDerWaalsContact C-N 3.33Å; E839-L841 PolarHBondContact O-N 3.21Å; E839-R842 VanDerWaalsContact CD-NH2 3.34Å; E839-R842 PolarHBondContact O-N 3.02Å; E839-R842 IonicContact OE1-CZ 3.6Å; E839-R842 IonicContact OE1-NH1 3.62Å; E839-R842 PolarHBondContact OE1-NH1 2.75Å; E839-R842 IonicContact OE1-NH2 2.61Å; E839-R842 IonicContact OE2-CZ 3.72Å; E839-R842 VanDerWaalsContact OE2-CZ 3.28Å; E839-R842 IonicContact OE2-NH1 2.72Å; E839-R842 PolarHBondContact OE2-NH1 3.05Å; E839-R842 IonicContact OE2-NH2 2.7Å; E839-R842 PolarHBondContact OE2-NH2 2.87Å; E839-S843 PolarHBondContact O-N 3.42Å
840	A	87	Confident	82.7	Confident	35 Å²	35	60 Å²	60	29%	0.289	30%	0.303	S	S	.	.	H	α-helix	trans	-58.8	-49.2	177.1	0	0	0	0	0	111.8	L771 E836 R842 S843 F844	L771-A840 HydrophobicContact CD2-CB 3.65Å; E836-A840 PolarHBondContact O-N 3.02Å; E836-A840 VanDerWaalsContact O-N 3.13Å; A840-R842 VanDerWaalsContact C-N 3.27Å; A840-R842 PolarHBondContact O-N 3.38Å; A840-S843 PolarHBondContact O-N 2.89Å; A840-S843 VanDerWaalsContact O-N 3.12Å; A840-F844 PolarHBondContact O-N 2.84Å
841	L	86.8	Confident	83.9	Confident	2 Å²	2	61.1 Å²	61.1	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-54	-40	175.6	-83.3	165.2	0	0	0	113.3	L771 V805 L808 Q809 V812 L837 E839 H845	L771-L841 HydrophobicContact CD1-CD2 3.79Å; L771-L841 HydrophobicContact CD1-CG 4.26Å; L771-L841 HydrophobicContact CD2-CD2 4.49Å; L771-L841 HydrophobicContact CD2-CG 4.11Å; V805-L841 HydrophobicContact CG1-CD2 4.21Å; V805-L841 HydrophobicContact CG2-CD2 4.46Å; L808-L841 HydrophobicContact CB-CD1 4.08Å; L808-L841 HydrophobicContact CB-CD2 3.65Å; L808-L841 HydrophobicContact CD1-CD2 4Å; Q809-L841 HydrophobicContact CG-CB 4.42Å; Q809-L841 HydrophobicContact CG-CD1 4.29Å; V812-L841 HydrophobicContact CB-CD1 4.47Å; V812-L841 HydrophobicContact CG2-CD1 3.76Å; L837-L841 WeakPolarHBondContact O-CG 3.07Å; L837-L841 PolarHBondContact O-N 3.2Å; E839-L841 PolarHBondContact O-N 3.21Å; L841-H845 PolarHBondContact O-N 3.21Å
842	R	87.7	Confident	85	Confident	119 Å²	119	62.1 Å²	62.1	45%	0.449	31%	0.307	S	S	.	.	H	α-helix	trans	-73.3	-37.2	178.6	-79	-179.5	-72.9	107.1	-5.1	112.8	E838 E839 A840 F844	E838-R842 WeakPolarHBondContact O-CG 3.46Å; E838-R842 VanDerWaalsContact O-CZ 3.31Å; E838-R842 PolarHBondContact O-NE 2.86Å; E838-R842 PolarHBondContact O-NH2 3.25Å; E839-R842 VanDerWaalsContact CD-NH2 3.34Å; E839-R842 PolarHBondContact O-N 3.02Å; E839-R842 IonicContact OE1-CZ 3.6Å; E839-R842 IonicContact OE1-NH1 3.62Å; E839-R842 PolarHBondContact OE1-NH1 2.75Å; E839-R842 IonicContact OE1-NH2 2.61Å; E839-R842 IonicContact OE2-CZ 3.72Å; E839-R842 VanDerWaalsContact OE2-CZ 3.28Å; E839-R842 IonicContact OE2-NH1 2.72Å; E839-R842 PolarHBondContact OE2-NH1 3.05Å; E839-R842 IonicContact OE2-NH2 2.7Å; E839-R842 PolarHBondContact OE2-NH2 2.87Å; A840-R842 VanDerWaalsContact C-N 3.27Å; A840-R842 PolarHBondContact O-N 3.38Å; R842-F844 VanDerWaalsContact C-N 3.32Å
843	S	88.4	Confident	85.7	Confident	74 Å²	74	63.6 Å²	63.6	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-68.8	-32	176.4	-169.5	0	0	0	0	112.4	E839 A840	E839-S843 PolarHBondContact O-N 3.42Å; A840-S843 PolarHBondContact O-N 2.89Å; A840-S843 VanDerWaalsContact O-N 3.12Å
844	F	90.4	Very high	86.1	Confident	1 Å²	1	65.5 Å²	65.5	0%	0.004	32%	0.323	C	S	.	.	H	α-helix	trans	-72.5	-48.3	179.2	-177.4	-132.5	0	0	0	112.1	L771 L774 E775 F778 V805 A840 R842 V846 K847 V848	L771-F844 HydrophobicContact CD1-CD1 4.28Å; L774-F844 HydrophobicContact CB-CE1 3.99Å; L774-F844 HydrophobicContact CB-CZ 4.41Å; E775-F844 HydrophobicContact CB-CE2 4.5Å; E775-F844 HydrophobicContact CG-CB 4.44Å; E775-F844 HydrophobicContact CG-CD1 4.36Å; E775-F844 HydrophobicContact CG-CD2 3.86Å; E775-F844 HydrophobicContact CG-CE2 4.21Å; E775-F844 HydrophobicContact CG-CG 3.97Å; F778-F844 HydrophobicContact CB-CE2 3.61Å; F778-F844 HydrophobicContact CB-CZ 3.75Å; F778-F844 HydrophobicContact CD1-CE2 4.22Å; F778-F844 HydrophobicContact CD2-CE2 4.24Å; F778-F844 HydrophobicContact CD2-CZ 4.14Å; F778-F844 AromaticContact CG-CE2 3.76Å; F778-F844 HydrophobicContact CG-CE2 3.76Å; F778-F844 HydrophobicContact CG-CZ 4.02Å; V805-F844 HydrophobicContact CG2-CD1 3.41Å; V805-F844 VanDerWaalsContact CG2-CD1 3.41Å; V805-F844 HydrophobicContact CG2-CE1 3.6Å; A840-F844 PolarHBondContact O-N 2.84Å; R842-F844 VanDerWaalsContact C-N 3.32Å; F844-V846 PolarHBondContact O-N 3.48Å; F844-V846 VanDerWaalsContact O-N 3.07Å; F844-K847 WeakPolarHBondContact O-CB 3.46Å; F844-K847 PolarHBondContact O-N 3.35Å; F844-V848 HydrophobicContact CE1-CG2 4.3Å; F844-V848 HydrophobicContact CE2-CG2 4.27Å; F844-V848 HydrophobicContact CZ-CG2 4.13Å; F844-V848 PolarHBondContact O-N 3.01Å
845	H	89.8	Confident	86.6	Confident	64 Å²	64	65.7 Å²	65.7	30%	0.296	32%	0.323	S	S	.	.	H	α-helix	trans	-51	-35	179.9	-179.9	63	0	0	0	114.1	D802 V805 L841 V848 M849	D802-H845 IonicContact OD1-CE1 3.84Å; D802-H845 PolarHBondContact OD1-CE1 3.49Å; D802-H845 IonicContact OD1-ND1 3.66Å; D802-H845 PolarHBondContact OD1-ND1 3.34Å; V805-H845 HydrophobicContact CG1-CB 4.05Å; L841-H845 PolarHBondContact O-N 3.21Å; H845-V848 WeakPolarHBondContact O-CB 3.3Å; H845-V848 PolarHBondContact O-N 3.41Å; H845-M849 PolarHBondContact O-N 3.45Å
846	V	89.7	Confident	86.9	Confident	84 Å²	84	64.5 Å²	64.5	51%	0.509	32%	0.318	S	S	.	.	H	α-helix	trans	-65.2	-40.1	177.5	-179.9	0	0	0	0	112.2	F844 V848 M849 E850	F844-V846 PolarHBondContact O-N 3.48Å; F844-V846 VanDerWaalsContact O-N 3.07Å; V846-V848 VanDerWaalsContact C-N 3.29Å; V846-V848 PolarHBondContact O-N 2.9Å; V846-M849 PolarHBondContact O-N 2.86Å; V846-E850 PolarHBondContact O-N 3.4Å
847	K	88.2	Confident	86.9	Confident	73 Å²	73	61 Å²	61	32%	0.317	31%	0.306	S	S	.	.	H	α-helix	trans	-63	-37.1	176	-62.5	-179	179.4	176.5	0	111.8	F778 E779 F844 S851	F778-K847 HydrophobicContact CE1-CB 4.15Å; E779-K847 IonicContact OE1-NZ 2.68Å; E779-K847 PolarHBondContact OE1-NZ 3.2Å; E779-K847 VanDerWaalsContact OE1-NZ 3.12Å; F844-K847 WeakPolarHBondContact O-CB 3.46Å; F844-K847 PolarHBondContact O-N 3.35Å; K847-S851 PolarHBondContact O-N 2.85Å; K847-S851 PolarHBondContact O-OG 3.09Å
848	V	88.3	Confident	86.9	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-60.7	-49.1	178.6	-177.9	0	0	0	0	110	F778 V798 D802 F844 H845 V846 S851 R852	F778-V848 HydrophobicContact CD2-CG2 4.17Å; F778-V848 HydrophobicContact CE2-CB 4.15Å; F778-V848 HydrophobicContact CE2-CG1 4.23Å; F778-V848 HydrophobicContact CE2-CG2 3.82Å; F778-V848 HydrophobicContact CZ-CB 4.39Å; F778-V848 HydrophobicContact CZ-CG2 4.27Å; V798-V848 HydrophobicContact CG1-CG1 3.8Å; V798-V848 WeakPolarHBondContact O-CG1 3.31Å; D802-V848 HydrophobicContact CB-CG1 3.99Å; F844-V848 HydrophobicContact CE1-CG2 4.3Å; F844-V848 HydrophobicContact CE2-CG2 4.27Å; F844-V848 HydrophobicContact CZ-CG2 4.13Å; F844-V848 PolarHBondContact O-N 3.01Å; H845-V848 WeakPolarHBondContact O-CB 3.3Å; H845-V848 PolarHBondContact O-N 3.41Å; V846-V848 VanDerWaalsContact C-N 3.29Å; V846-V848 PolarHBondContact O-N 2.9Å; V848-S851 PolarHBondContact O-N 2.99Å; V848-R852 PolarHBondContact O-N 3.48Å
849	M	87	Confident	86.8	Confident	70 Å²	70	61.3 Å²	61.3	35%	0.345	31%	0.306	S	S	.	.	H	α-helix	trans	-67.1	-42.7	-178.1	-67.8	-59.1	-64.2	0	0	114	H845 V846 S851 R852	H845-M849 PolarHBondContact O-N 3.45Å; V846-M849 PolarHBondContact O-N 2.86Å; M849-S851 PolarHBondContact O-N 2.9Å; M849-R852 WeakPolarHBondContact O-CB 3.35Å; M849-R852 PolarHBondContact O-N 2.92Å
850	E	86.7	Confident	86.6	Confident	146 Å²	146	60.2 Å²	60.2	68%	0.682	30%	0.303	S	S	*	.	H	α-helix	trans	-62.5	-30.6	178.2	-69.9	-171.9	154.4	0	0	112.9	V846	V846-E850 PolarHBondContact O-N 3.4Å
851	S	84.7	Confident	86.4	Confident	27 Å²	27	59.5 Å²	59.5	19%	0.189	29%	0.294	C	S	.	.	H	α-helix	trans	-75	-36.7	179.1	-55.2	0	0	0	0	112.1	F778 K847 V848 M849 K854 Y855	F778-S851 WeakPolarHBondContact CZ-OG 3.34Å; K847-S851 PolarHBondContact O-N 2.85Å; K847-S851 PolarHBondContact O-OG 3.09Å; V848-S851 PolarHBondContact O-N 2.99Å; M849-S851 PolarHBondContact O-N 2.9Å; S851-K854 PolarHBondContact O-N 3.15Å; S851-Y855 WeakPolarHBondContact O-CD2 3.32Å; S851-Y855 PolarHBondContact O-N 3.41Å
852	R	87.6	Confident	86.1	Confident	76 Å²	76	59.8 Å²	59.8	29%	0.287	30%	0.296	S	S	.	.	H	α-helix	trans	-55.5	-53.8	178.3	-166.1	-176.4	-168.5	158.5	6	112.3	L795 V798 E799 D802 V848 M849 K854 Y855 Q856	L795-R852 HydrophobicContact CD2-CG 4.35Å; V798-R852 HydrophobicContact CG1-CB 3.86Å; V798-R852 HydrophobicContact CG1-CG 4.21Å; E799-R852 IonicContact OE1-CZ 2.7Å; E799-R852 IonicContact OE1-NE 3.18Å; E799-R852 IonicContact OE1-NH2 3.36Å; E799-R852 PolarHBondContact OE1-NH2 3.34Å; D802-R852 IonicContact OD2-NH1 2.71Å; V848-R852 PolarHBondContact O-N 3.48Å; M849-R852 WeakPolarHBondContact O-CB 3.35Å; M849-R852 PolarHBondContact O-N 2.92Å; R852-K854 VanDerWaalsContact C-N 3.27Å; R852-K854 PolarHBondContact O-N 3.46Å; R852-Y855 PolarHBondContact O-N 2.83Å; R852-Q856 PolarHBondContact O-N 3.37Å
853	D	85.7	Confident	85.9	Confident	122 Å²	122	56.7 Å²	56.7	65%	0.652	29%	0.29	S	S	*	.	H	α-helix	trans	-60.4	-38.2	-176.8	-76.1	-4.1	0	0	0	111.8	S857	D853-S857 PolarHBondContact O-N 3.24Å
854	K	84	Confident	85.6	Confident	110 Å²	110	57 Å²	57	48%	0.478	29%	0.289	S	S	.	.	H	α-helix	trans	-64.9	-49	177.2	-176.4	-178.1	176.8	-176.8	0	111.7	S851 R852 S857 I858	S851-K854 PolarHBondContact O-N 3.15Å; R852-K854 VanDerWaalsContact C-N 3.27Å; R852-K854 PolarHBondContact O-N 3.46Å; K854-S857 PolarHBondContact O-N 3.37Å; K854-I858 HydrophobicContact CG-CD1 4.42Å; K854-I858 WeakPolarHBondContact O-CG1 3.35Å
855	Y	86.4	Confident	85.2	Confident	9 Å²	9	57.4 Å²	57.4	4%	0.035	29%	0.292	C	S	.	.	H	α-helix	trans	-66.5	-40.2	-177.3	-59.4	-22.5	0	0	0	111.4	L781 V783 L794 V798 S851 R852 S857 I858 K859	L781-Y855 WeakPolarHBondContact CB-OH 3.45Å; L781-Y855 PolarHBondContact O-OH 2.83Å; V783-Y855 HydrophobicContact CG2-CD1 3.59Å; V783-Y855 HydrophobicContact CG2-CE1 3.49Å; V783-Y855 VanDerWaalsContact CG2-CE1 3.49Å; L794-Y855 HydrophobicContact CB-CD2 3.77Å; L794-Y855 HydrophobicContact CB-CE2 3.74Å; L794-Y855 HydrophobicContact CB-CG 4.34Å; L794-Y855 HydrophobicContact CD1-CE1 4.39Å; L794-Y855 HydrophobicContact CD2-CE2 4.45Å; L794-Y855 HydrophobicContact CG-CE2 4.49Å; V798-Y855 HydrophobicContact CG2-CD2 4.07Å; V798-Y855 HydrophobicContact CG2-CE2 3.75Å; S851-Y855 WeakPolarHBondContact O-CD2 3.32Å; S851-Y855 PolarHBondContact O-N 3.41Å; R852-Y855 PolarHBondContact O-N 2.83Å; Y855-S857 PolarHBondContact O-N 2.73Å; Y855-I858 PolarHBondContact O-N 3.07Å; Y855-I858 VanDerWaalsContact O-N 3.15Å; Y855-K859 PolarHBondContact O-N 3.36Å; Y855-K859 VanDerWaalsContact O-N 3.1Å
856	Q	86.8	Confident	84.8	Confident	74 Å²	74	55.4 Å²	55.4	35%	0.346	29%	0.285	S	S	.	.	H	α-helix	trans	-58.8	-46.4	176.3	-173.8	61.8	49.5	0	0	112.2	R852 I858 K859 D860	R852-Q856 PolarHBondContact O-N 3.37Å; Q856-I858 PolarHBondContact O-N 3.26Å; Q856-I858 VanDerWaalsContact O-N 3.12Å; Q856-K859 WeakPolarHBondContact O-CB 3.31Å; Q856-K859 PolarHBondContact O-N 3.27Å; Q856-D860 PolarHBondContact NE2-OD1 3.43Å; Q856-D860 VanDerWaalsContact O-CG 3.3Å; Q856-D860 PolarHBondContact O-N 2.72Å
857	S	83.8	Confident	84.5	Confident	38 Å²	38	55.3 Å²	55.3	27%	0.266	29%	0.285	S	S	.	.	H	α-helix	trans	-64.8	-17.8	179.5	-177	0	0	0	0	114.1	D853 K854 Y855 M861	D853-S857 PolarHBondContact O-N 3.24Å; K854-S857 PolarHBondContact O-N 3.37Å; Y855-S857 PolarHBondContact O-N 2.73Å; S857-M861 WeakPolarHBondContact O-CE 3.38Å
858	I	83.2	Confident	84.3	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-86.9	-43	175.8	-58.3	168.8	0	0	0	109.7	V783 I791 K854 Y855 Q856 D860 M861 L862 F925 L928 T929	V783-I858 HydrophobicContact CG1-CD1 4.41Å; V783-I858 HydrophobicContact CG2-CD1 4.1Å; I791-I858 HydrophobicContact CD1-CB 4.38Å; I791-I858 HydrophobicContact CD1-CG2 3.65Å; K854-I858 HydrophobicContact CG-CD1 4.42Å; K854-I858 WeakPolarHBondContact O-CG1 3.35Å; Y855-I858 PolarHBondContact O-N 3.07Å; Y855-I858 VanDerWaalsContact O-N 3.15Å; Q856-I858 PolarHBondContact O-N 3.26Å; Q856-I858 VanDerWaalsContact O-N 3.12Å; I858-D860 VanDerWaalsContact C-N 3.3Å; I858-D860 PolarHBondContact O-N 2.99Å; I858-M861 PolarHBondContact O-N 3.37Å; I858-M861 VanDerWaalsContact O-N 3.11Å; I858-L862 HydrophobicContact CG2-CD1 3.88Å; I858-L862 PolarHBondContact O-N 3.24Å; I858-L862 VanDerWaalsContact O-N 3.1Å; I858-F925 HydrophobicContact CG2-CD2 4.32Å; I858-F925 HydrophobicContact CG2-CE2 3.91Å; I858-L928 HydrophobicContact CG1-CB 4.48Å; I858-T929 HydrophobicContact CD1-CG2 4.38Å; I858-T929 HydrophobicContact CG2-CG2 4.22Å
859	K	84.1	Confident	84.1	Confident	55 Å²	55	53.1 Å²	53.1	24%	0.239	28%	0.276	C	S	.	.	H	α-helix	trans	-52.5	-45.1	172	178.6	173.7	176.5	169.1	0	112.4	L788 I791 D792 L795 Y855 Q856 M861 L862 T863	L788-K859 HydrophobicContact CD2-CG 4.22Å; I791-K859 HydrophobicContact CG2-CB 3.98Å; D792-K859 VanDerWaalsContact OD1-CD 3.31Å; D792-K859 WeakPolarHBondContact OD1-CD 3.01Å; D792-K859 WeakPolarHBondContact OD1-CE 3.33Å; D792-K859 IonicContact OD1-NZ 3.6Å; D792-K859 PolarHBondContact OD1-NZ 3.08Å; L795-K859 HydrophobicContact CD1-CD 3.62Å; Y855-K859 PolarHBondContact O-N 3.36Å; Y855-K859 VanDerWaalsContact O-N 3.1Å; Q856-K859 WeakPolarHBondContact O-CB 3.31Å; Q856-K859 PolarHBondContact O-N 3.27Å; K859-M861 VanDerWaalsContact C-N 3.26Å; K859-M861 PolarHBondContact O-N 3.44Å; K859-L862 PolarHBondContact O-N 3.09Å; K859-T863 HydrophobicContact CG-CG2 4.31Å; K859-T863 WeakPolarHBondContact O-CB 3.42Å; K859-T863 WeakPolarHBondContact O-CG2 3.49Å; K859-T863 PolarHBondContact O-N 3.21Å; K859-T863 PolarHBondContact O-OG1 3.33Å
860	D	82.8	Confident	83.9	Confident	85 Å²	85	53.2 Å²	53.2	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-62.5	-28.7	179.8	-65.8	-13.2	0	0	0	113.4	Q856 I858 T863 V864	Q856-D860 PolarHBondContact NE2-OD1 3.43Å; Q856-D860 VanDerWaalsContact O-CG 3.3Å; Q856-D860 PolarHBondContact O-N 2.72Å; I858-D860 VanDerWaalsContact C-N 3.3Å; I858-D860 PolarHBondContact O-N 2.99Å; D860-T863 PolarHBondContact O-OG1 3.38Å; D860-V864 WeakPolarHBondContact O-CG2 3.23Å
861	M	81.4	Confident	83.8	Confident	19 Å²	19	48.6 Å²	48.6	9%	0.094	26%	0.258	C	S	.	.	H	α-helix	trans	-84.3	-39.4	177.9	-63.4	-173	-64.2	0	0	112.4	S857 I858 K859 S865 K924 F925 L928	S857-M861 WeakPolarHBondContact O-CE 3.38Å; I858-M861 PolarHBondContact O-N 3.37Å; I858-M861 VanDerWaalsContact O-N 3.11Å; K859-M861 VanDerWaalsContact C-N 3.26Å; K859-M861 PolarHBondContact O-N 3.44Å; M861-S865 WeakPolarHBondContact O-CB 3.4Å; M861-S865 PolarHBondContact O-N 3.14Å; M861-S865 VanDerWaalsContact O-N 3.12Å; M861-S865 PolarHBondContact O-OG 3.18Å; M861-K924 HydrophobicContact SD-CB 3.88Å; M861-K924 HydrophobicContact SD-CD 3.66Å; M861-K924 HydrophobicContact SD-CG 3.69Å; M861-F925 HydrophobicContact CE-CB 4.38Å; M861-F925 HydrophobicContact CE-CD2 4.22Å; M861-L928 HydrophobicContact CE-CB 4.47Å; M861-L928 HydrophobicContact CE-CD1 3.56Å; M861-L928 HydrophobicContact SD-CD1 4.37Å
862	L	81.9	Confident	83.9	Confident	8 Å²	8	47.3 Å²	47.3	4%	0.042	25%	0.249	C	C	.	.	H	α-helix	trans	-73.5	-35.4	-178.9	-73.8	168.1	0	0	0	112.3	D786 L788 I791 I858 K859 S865 S866 F925 L937	D786-L862 HydrophobicContact CB-CD2 4.09Å; D786-L862 WeakPolarHBondContact O-CD1 3.46Å; L788-L862 HydrophobicContact CD1-CB 4.41Å; L788-L862 HydrophobicContact CD2-CB 3.59Å; L788-L862 HydrophobicContact CG-CB 3.88Å; I791-L862 HydrophobicContact CD1-CD1 3.31Å; I858-L862 HydrophobicContact CG2-CD1 3.88Å; I858-L862 PolarHBondContact O-N 3.24Å; I858-L862 VanDerWaalsContact O-N 3.1Å; K859-L862 PolarHBondContact O-N 3.09Å; L862-S865 PolarHBondContact O-N 2.85Å; L862-S866 VanDerWaalsContact O-CB 3.31Å; L862-S866 WeakPolarHBondContact O-CB 3.39Å; L862-S866 PolarHBondContact O-N 3Å; L862-F925 HydrophobicContact CD1-CE2 3.92Å; L862-F925 HydrophobicContact CD2-CD2 4.18Å; L862-F925 HydrophobicContact CD2-CE2 3.67Å; L862-F925 HydrophobicContact CD2-CZ 4.05Å; L862-F925 HydrophobicContact CG-CD2 4.28Å; L862-F925 HydrophobicContact CG-CE2 3.82Å; L862-L937 HydrophobicContact CD2-CD1 4.38Å
863	T	82.7	Confident	83.7	Confident	54 Å²	54	44.7 Å²	44.7	33%	0.331	24%	0.242	S	C	.	.	H	α-helix	trans	-60.2	-48	174.3	44.9	0	0	0	0	112.1	L788 K859 D860 S865 S866 T867	L788-T863 HydrophobicContact CD1-CG2 4.21Å; L788-T863 HydrophobicContact CD2-CG2 3.77Å; K859-T863 HydrophobicContact CG-CG2 4.31Å; K859-T863 WeakPolarHBondContact O-CB 3.42Å; K859-T863 WeakPolarHBondContact O-CG2 3.49Å; K859-T863 PolarHBondContact O-N 3.21Å; K859-T863 PolarHBondContact O-OG1 3.33Å; D860-T863 PolarHBondContact O-OG1 3.38Å; T863-S865 VanDerWaalsContact C-N 3.32Å; T863-S865 PolarHBondContact O-N 3.25Å; T863-S866 PolarHBondContact O-N 3.14Å; T863-T867 WeakPolarHBondContact O-CG2 3.3Å; T863-T867 PolarHBondContact O-N 2.93Å; T863-T867 PolarHBondContact O-OG1 2.91Å
864	V	82.9	Confident	83.7	Confident	82 Å²	82	43.8 Å²	43.8	50%	0.497	23%	0.234	S	C	.	.	H	α-helix	trans	-63.8	-36.8	175.4	175.9	0	0	0	0	111.8	D860 T867 N868	D860-V864 WeakPolarHBondContact O-CG2 3.23Å; V864-T867 PolarHBondContact O-OG1 2.84Å; V864-N868 WeakPolarHBondContact O-CB 3.41Å; V864-N868 PolarHBondContact O-N 3.45Å; V864-N868 PolarHBondContact O-ND2 2.92Å
865	S	81.8	Confident	83.8	Confident	9 Å²	9	40.2 Å²	40.2	6%	0.063	22%	0.22	C	C	.	.	H	α-helix	trans	-71	-41.8	178.3	-57.5	0	0	0	0	112.1	M861 L862 T863 L869	M861-S865 WeakPolarHBondContact O-CB 3.4Å; M861-S865 PolarHBondContact O-N 3.14Å; M861-S865 VanDerWaalsContact O-N 3.12Å; M861-S865 PolarHBondContact O-OG 3.18Å; L862-S865 PolarHBondContact O-N 2.85Å; T863-S865 VanDerWaalsContact C-N 3.32Å; T863-S865 PolarHBondContact O-N 3.25Å; S865-L869 WeakPolarHBondContact O-CB 3.35Å; S865-L869 WeakPolarHBondContact O-CD1 3.43Å; S865-L869 VanDerWaalsContact O-CG 3.25Å; S865-L869 WeakPolarHBondContact O-CG 3.47Å; S865-L869 PolarHBondContact O-N 2.95Å; S865-L869 VanDerWaalsContact O-N 3.15Å
866	S	81.4	Confident	83.8	Confident	22 Å²	22	39.9 Å²	39.9	15%	0.154	22%	0.219	C	C	.	.	H	α-helix	trans	-68.3	-41.9	179.8	-172.7	0	0	0	0	112.1	L862 T863 L869 Q870	L862-S866 VanDerWaalsContact O-CB 3.31Å; L862-S866 WeakPolarHBondContact O-CB 3.39Å; L862-S866 PolarHBondContact O-N 3Å; T863-S866 PolarHBondContact O-N 3.14Å; S866-L869 PolarHBondContact O-N 3.11Å; S866-Q870 VanDerWaalsContact O-CB 3.28Å; S866-Q870 WeakPolarHBondContact O-CB 3.29Å; S866-Q870 PolarHBondContact O-N 3.14Å
867	T	82.4	Confident	83.7	Confident	81 Å²	81	39.3 Å²	39.3	50%	0.497	22%	0.218	S	C	.	.	H	α-helix	trans	-64.2	-51.3	178.6	47.8	0	0	0	0	111.4	T863 V864 L869 Q870 T871	T863-T867 WeakPolarHBondContact O-CG2 3.3Å; T863-T867 PolarHBondContact O-N 2.93Å; T863-T867 PolarHBondContact O-OG1 2.91Å; V864-T867 PolarHBondContact O-OG1 2.84Å; T867-L869 VanDerWaalsContact C-N 3.32Å; T867-L869 PolarHBondContact O-N 3.34Å; T867-Q870 PolarHBondContact O-N 3Å; T867-T871 PolarHBondContact O-N 3.3Å; T867-T871 PolarHBondContact O-OG1 3.09Å; T867-T871 VanDerWaalsContact O-OG1 3.13Å
868	N	85.5	Confident	83.8	Confident	21 Å²	21	42 Å²	42	11%	0.112	23%	0.226	C	C	.	.	H	α-helix	trans	-53.3	-46	175.6	-80.4	-22.4	0	0	0	112.9	V864 C872 Y914 T918	V864-N868 WeakPolarHBondContact O-CB 3.41Å; V864-N868 PolarHBondContact O-N 3.45Å; V864-N868 PolarHBondContact O-ND2 2.92Å; N868-C872 WeakPolarHBondContact O-CB 3.49Å; N868-C872 PolarHBondContact O-N 3.29Å; N868-Y914 VanDerWaalsContact OD1-CD1 3.31Å; N868-Y914 WeakPolarHBondContact OD1-CD1 3.23Å; N868-T918 WeakPolarHBondContact CB-OG1 3.37Å; N868-T918 PolarHBondContact ND2-OG1 3.41Å
869	L	84.2	Confident	83.9	Confident	8 Å²	8	42 Å²	42	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-72.4	-33.6	-178.4	-70.8	172.2	0	0	0	112.9	F2 S865 S866 T867 S873 L915 T918 I940 L941 L944	F2-L869 HydrophobicContact CE2-CB 4.13Å; F2-L869 HydrophobicContact CE2-CD1 3.61Å; F2-L869 HydrophobicContact CZ-CD1 3.59Å; S865-L869 WeakPolarHBondContact O-CB 3.35Å; S865-L869 WeakPolarHBondContact O-CD1 3.43Å; S865-L869 VanDerWaalsContact O-CG 3.25Å; S865-L869 WeakPolarHBondContact O-CG 3.47Å; S865-L869 PolarHBondContact O-N 2.95Å; S865-L869 VanDerWaalsContact O-N 3.15Å; S866-L869 PolarHBondContact O-N 3.11Å; T867-L869 VanDerWaalsContact C-N 3.32Å; T867-L869 PolarHBondContact O-N 3.34Å; L869-S873 PolarHBondContact O-N 3.5Å; L869-L915 HydrophobicContact CD2-CD2 3.91Å; L869-T918 HydrophobicContact CD1-CG2 4.08Å; L869-T918 HydrophobicContact CD2-CG2 4.45Å; L869-T918 HydrophobicContact CG-CG2 4.1Å; L869-I940 HydrophobicContact CD1-CG2 4.35Å; L869-I940 HydrophobicContact CD2-CG2 4.26Å; L869-L941 HydrophobicContact CD2-CD2 3.87Å; L869-L944 HydrophobicContact CD2-CD1 3.62Å
870	Q	82.8	Confident	83.8	Confident	72 Å²	72	41.6 Å²	41.6	34%	0.336	23%	0.226	S	C	.	.	H	α-helix	trans	-67.1	-51	173.8	-179.9	169.2	-14.3	0	0	111.2	M1 S866 T867 C872 S873 E874	M1-Q870 VanDerWaalsContact CE-OE1 3.25Å; S866-Q870 VanDerWaalsContact O-CB 3.28Å; S866-Q870 WeakPolarHBondContact O-CB 3.29Å; S866-Q870 PolarHBondContact O-N 3.14Å; T867-Q870 PolarHBondContact O-N 3Å; Q870-C872 VanDerWaalsContact C-N 3.28Å; Q870-C872 PolarHBondContact O-N 2.89Å; Q870-S873 WeakPolarHBondContact O-CA 3.2Å; Q870-S873 WeakPolarHBondContact O-CB 3.41Å; Q870-S873 PolarHBondContact O-N 3.3Å; Q870-E874 HydrophobicContact CG-CG 4.37Å; Q870-E874 WeakPolarHBondContact CG-OE1 3.43Å; Q870-E874 PolarHBondContact NE2-OE1 3.37Å; Q870-E874 WeakPolarHBondContact O-CG 3.2Å; Q870-E874 PolarHBondContact O-N 3Å
871	T	83.5	Confident	83.8	Confident	49 Å²	49	39.8 Å²	39.8	30%	0.301	22%	0.219	S	C	.	.	H	α-helix	trans	-58	-40.1	177.1	-56.5	0	0	0	0	111.7	T867 L875 Y914	T867-T871 PolarHBondContact O-N 3.3Å; T867-T871 PolarHBondContact O-OG1 3.09Å; T867-T871 VanDerWaalsContact O-OG1 3.13Å; T871-L875 HydrophobicContact CG2-CD1 3.86Å; T871-L875 HydrophobicContact CG2-CG 4.4Å; T871-L875 WeakPolarHBondContact O-CB 3.33Å; T871-L875 WeakPolarHBondContact O-CG 3.44Å; T871-L875 PolarHBondContact O-N 3.46Å; T871-Y914 HydrophobicContact CG2-CD2 4.42Å; T871-Y914 HydrophobicContact CG2-CE2 3.87Å
872	C	86.5	Confident	83.6	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.1	-43.2	170.9	-83.8	0	0	0	0	113.5	N868 Q870 L876 C911 L944	N868-C872 WeakPolarHBondContact O-CB 3.49Å; N868-C872 PolarHBondContact O-N 3.29Å; Q870-C872 VanDerWaalsContact C-N 3.28Å; Q870-C872 PolarHBondContact O-N 2.89Å; C872-L876 VanDerWaalsContact O-CB 3.3Å; C872-L876 WeakPolarHBondContact O-CB 3.45Å; C872-L876 WeakPolarHBondContact O-CD1 3.29Å; C872-L876 WeakPolarHBondContact O-CG 3.34Å; C872-L876 PolarHBondContact O-N 2.9Å; C872-C911 PolarHBondContact SG-O 3Å; C872-L944 HydrophobicContact CB-CD1 4.11Å
873	S	84.2	Confident	83.4	Confident	21 Å²	21	41 Å²	41	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-64.1	-47.2	179.3	-163.6	0	0	0	0	111	L869 Q870 L876 N877	L869-S873 PolarHBondContact O-N 3.5Å; Q870-S873 WeakPolarHBondContact O-CA 3.2Å; Q870-S873 WeakPolarHBondContact O-CB 3.41Å; Q870-S873 PolarHBondContact O-N 3.3Å; S873-L876 PolarHBondContact O-N 3.08Å; S873-N877 VanDerWaalsContact O-CB 3.29Å; S873-N877 WeakPolarHBondContact O-CB 3.39Å; S873-N877 PolarHBondContact O-N 2.67Å; S873-N877 PolarHBondContact O-ND2 3.29Å; S873-N877 PolarHBondContact OG-ND2 3.18Å
874	E	84.8	Confident	83.1	Confident	102 Å²	102	44.5 Å²	44.5	48%	0.477	23%	0.232	S	C	.	.	H	α-helix	trans	-62.5	-54.5	-177.6	-71.9	166.4	175.7	0	0	111.6	Q870 L876 N877 E878	Q870-E874 HydrophobicContact CG-CG 4.37Å; Q870-E874 WeakPolarHBondContact CG-OE1 3.43Å; Q870-E874 PolarHBondContact NE2-OE1 3.37Å; Q870-E874 WeakPolarHBondContact O-CG 3.2Å; Q870-E874 PolarHBondContact O-N 3Å; E874-L876 PolarHBondContact O-N 3.39Å; E874-N877 PolarHBondContact O-N 3.49Å; E874-N877 VanDerWaalsContact O-N 3.15Å; E874-E878 WeakPolarHBondContact O-CB 3.45Å; E874-E878 PolarHBondContact O-N 3.23Å
875	L	86.5	Confident	82.5	Confident	36 Å²	36	46.7 Å²	46.7	19%	0.188	24%	0.235	C	C	.	.	H	α-helix	trans	-59.1	-42	178.3	-70.3	172.2	0	0	0	112.6	T871 E878 V879 Q907	T871-L875 HydrophobicContact CG2-CD1 3.86Å; T871-L875 HydrophobicContact CG2-CG 4.4Å; T871-L875 WeakPolarHBondContact O-CB 3.33Å; T871-L875 WeakPolarHBondContact O-CG 3.44Å; T871-L875 PolarHBondContact O-N 3.46Å; L875-E878 PolarHBondContact O-N 3.12Å; L875-V879 VanDerWaalsContact O-CG2 3.26Å; L875-V879 WeakPolarHBondContact O-CG2 3.36Å; L875-V879 PolarHBondContact O-N 3.45Å; L875-Q907 HydrophobicContact CD2-CB 4.38Å; L875-Q907 HydrophobicContact CD2-CG 4.24Å
876	L	87.8	Confident	81.7	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-73.5	-27.2	179.3	-63.1	170.9	0	0	0	112.6	C872 S873 E874 E880 V908 C911 L944 K947 I948 I951	C872-L876 VanDerWaalsContact O-CB 3.3Å; C872-L876 WeakPolarHBondContact O-CB 3.45Å; C872-L876 WeakPolarHBondContact O-CD1 3.29Å; C872-L876 WeakPolarHBondContact O-CG 3.34Å; C872-L876 PolarHBondContact O-N 2.9Å; S873-L876 PolarHBondContact O-N 3.08Å; E874-L876 PolarHBondContact O-N 3.39Å; L876-E880 WeakPolarHBondContact O-CB 3.47Å; L876-E880 PolarHBondContact O-N 3.3Å; L876-V908 HydrophobicContact CD2-CG2 4.2Å; L876-C911 HydrophobicContact CD1-CB 4.4Å; L876-C911 HydrophobicContact CD2-CB 4.21Å; L876-C911 HydrophobicContact CG-CB 4.31Å; L876-L944 HydrophobicContact CD1-CD2 4.3Å; L876-K947 HydrophobicContact CB-CD 3.93Å; L876-K947 HydrophobicContact CB-CG 4.21Å; L876-K947 HydrophobicContact CD1-CG 4.46Å; L876-K947 WeakPolarHBondContact O-CE 3.32Å; L876-I948 HydrophobicContact CD1-CD1 4.26Å; L876-I948 HydrophobicContact CD1-CG1 3.75Å; L876-I948 HydrophobicContact CD2-CG1 3.68Å; L876-I948 HydrophobicContact CG-CG1 4.39Å; L876-I951 HydrophobicContact CB-CD1 4.06Å; L876-I951 HydrophobicContact CD2-CD1 3.88Å; L876-I951 WeakPolarHBondContact O-CD1 3.2Å
877	N	84.6	Confident	80.9	Confident	63 Å²	63	51.2 Å²	51.2	34%	0.337	25%	0.253	S	S	.	.	H	α-helix	trans	-74.3	-40.1	172.3	-69.5	-27.9	0	0	0	111.5	S873 E874 E880 S881 K947	S873-N877 VanDerWaalsContact O-CB 3.29Å; S873-N877 WeakPolarHBondContact O-CB 3.39Å; S873-N877 PolarHBondContact O-N 2.67Å; S873-N877 PolarHBondContact O-ND2 3.29Å; S873-N877 PolarHBondContact OG-ND2 3.18Å; E874-N877 PolarHBondContact O-N 3.49Å; E874-N877 VanDerWaalsContact O-N 3.15Å; N877-E880 PolarHBondContact O-N 3.19Å; N877-S881 WeakPolarHBondContact O-CB 3.43Å; N877-S881 PolarHBondContact O-N 2.93Å; N877-K947 PolarHBondContact OD1-NZ 3.09Å
878	E	84	Confident	79.8	Confident	94 Å²	94	49 Å²	49	44%	0.439	25%	0.247	S	C	.	.	H	α-helix	trans	-59.3	-57.8	175.8	-177.8	177.3	-118.2	0	0	110.8	E874 L875 E880 S881 E882 Q907	E874-E878 WeakPolarHBondContact O-CB 3.45Å; E874-E878 PolarHBondContact O-N 3.23Å; L875-E878 PolarHBondContact O-N 3.12Å; E878-E880 VanDerWaalsContact C-N 3.28Å; E878-E880 PolarHBondContact O-N 3.02Å; E878-S881 WeakPolarHBondContact O-CA 3.27Å; E878-S881 WeakPolarHBondContact O-CB 3.4Å; E878-S881 PolarHBondContact O-N 3.39Å; E878-S881 PolarHBondContact O-OG 2.93Å; E878-E882 HydrophobicContact CG-CG 4.36Å; E878-E882 WeakPolarHBondContact O-CG 3.31Å; E878-E882 PolarHBondContact O-N 3.39Å; E878-Q907 PolarHBondContact OE2-NE2 2.85Å
879	V	85.6	Confident	78.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-55.5	-41.2	178.5	175.3	0	0	0	0	111.9	L875 E882 L883 H904 Q907 V908 I951	L875-V879 VanDerWaalsContact O-CG2 3.26Å; L875-V879 WeakPolarHBondContact O-CG2 3.36Å; L875-V879 PolarHBondContact O-N 3.45Å; V879-E882 PolarHBondContact O-N 3.23Å; V879-L883 HydrophobicContact CG1-CD1 3.94Å; V879-L883 WeakPolarHBondContact O-CB 3.4Å; V879-L883 WeakPolarHBondContact O-CD1 3.48Å; V879-L883 VanDerWaalsContact O-CG 3.29Å; V879-L883 WeakPolarHBondContact O-CG 3.49Å; V879-L883 PolarHBondContact O-N 2.04Å; V879-L883 VanDerWaalsContact O-N 3.09Å; V879-H904 HydrophobicContact CG1-CB 3.79Å; V879-H904 HydrophobicContact CG2-CB 4.15Å; V879-Q907 HydrophobicContact CG2-CB 4.1Å; V879-Q907 VanDerWaalsContact CG2-OE1 3.3Å; V879-V908 HydrophobicContact CG1-CG2 4.5Å; V879-I951 HydrophobicContact CB-CG2 4.44Å; V879-I951 HydrophobicContact CG1-CG2 3.42Å; V879-I951 VanDerWaalsContact CG1-CG2 3.42Å
880	E	83.6	Confident	76.6	Confident	47 Å²	47	63.1 Å²	63.1	22%	0.22	32%	0.322	C	S	.	.	H	α-helix	trans	-66.6	-37.3	176.5	-162.7	-162.1	150.6	0	0	112.1	L876 N877 E878 R884 K947 I951	L876-E880 WeakPolarHBondContact O-CB 3.47Å; L876-E880 PolarHBondContact O-N 3.3Å; N877-E880 PolarHBondContact O-N 3.19Å; E878-E880 VanDerWaalsContact C-N 3.28Å; E878-E880 PolarHBondContact O-N 3.02Å; E880-R884 WeakPolarHBondContact O-CB 3.2Å; E880-R884 WeakPolarHBondContact O-CG 3.27Å; E880-R884 PolarHBondContact O-N 3.41Å; E880-R884 IonicContact OE1-CZ 3.61Å; E880-R884 IonicContact OE1-NE 3.81Å; E880-R884 PolarHBondContact OE1-NE 3.49Å; E880-R884 IonicContact OE1-NH2 2.69Å; E880-R884 PolarHBondContact OE1-NH2 3.42Å; E880-K947 WeakPolarHBondContact OE2-CE 3.36Å; E880-K947 IonicContact OE2-NZ 2.91Å; E880-K947 PolarHBondContact OE2-NZ 3.26Å; E880-I951 HydrophobicContact CB-CD1 4.37Å
881	S	81.6	Confident	75.3	Confident	46 Å²	46	63 Å²	63	32%	0.322	33%	0.327	S	S	.	.	H	α-helix	trans	-66.2	-40.4	177	84	0	0	0	0	112	N877 E878 R884 K885	N877-S881 WeakPolarHBondContact O-CB 3.43Å; N877-S881 PolarHBondContact O-N 2.93Å; E878-S881 WeakPolarHBondContact O-CA 3.27Å; E878-S881 WeakPolarHBondContact O-CB 3.4Å; E878-S881 PolarHBondContact O-N 3.39Å; E878-S881 PolarHBondContact O-OG 2.93Å; S881-R884 PolarHBondContact O-N 2.98Å; S881-K885 VanDerWaalsContact O-CG 3.26Å; S881-K885 WeakPolarHBondContact O-CG 3.48Å; S881-K885 PolarHBondContact O-N 2.92Å
882	E	78.5	Confident	74.1	Confident	52 Å²	52	62.7 Å²	62.7	24%	0.243	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-43.1	180	-63.5	-88.9	89.2	0	0	110.9	E878 V879 K885 S886 H904	E878-E882 HydrophobicContact CG-CG 4.36Å; E878-E882 WeakPolarHBondContact O-CG 3.31Å; E878-E882 PolarHBondContact O-N 3.39Å; V879-E882 PolarHBondContact O-N 3.23Å; E882-K885 PolarHBondContact O-N 2.91Å; E882-K885 IonicContact OE1-NZ 2.66Å; E882-K885 PolarHBondContact OE1-NZ 3.1Å; E882-S886 WeakPolarHBondContact O-CB 3.18Å; E882-S886 PolarHBondContact O-N 3.43Å; E882-S886 PolarHBondContact O-OG 2.97Å; E882-H904 WeakPolarHBondContact CB-NE2 3.24Å; E882-H904 IonicContact OE2-CE1 3.68Å
883	L	77.3	Confident	72.9	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-63.4	-40.4	171.7	-70.2	167.4	0	0	0	112.1	V879 S886 E887 I951 K954 L955 W958	V879-L883 HydrophobicContact CG1-CD1 3.94Å; V879-L883 WeakPolarHBondContact O-CB 3.4Å; V879-L883 WeakPolarHBondContact O-CD1 3.48Å; V879-L883 VanDerWaalsContact O-CG 3.29Å; V879-L883 WeakPolarHBondContact O-CG 3.49Å; V879-L883 PolarHBondContact O-N 2.04Å; V879-L883 VanDerWaalsContact O-N 3.09Å; L883-S886 PolarHBondContact O-OG 3Å; L883-E887 WeakPolarHBondContact O-CG 3.33Å; L883-I951 HydrophobicContact CD1-CG2 4.24Å; L883-K954 HydrophobicContact CB-CD 4.38Å; L883-K954 HydrophobicContact CD1-CB 3.99Å; L883-K954 HydrophobicContact CD1-CD 4.39Å; L883-L955 HydrophobicContact CD1-CD2 4.49Å; L883-L955 HydrophobicContact CD1-CG 4.33Å; L883-L955 HydrophobicContact CD2-CD2 4.04Å; L883-W958 HydrophobicContact CD2-CD2 4.31Å; L883-W958 HydrophobicContact CD2-CG 4.43Å
884	R	75.7	Confident	71.9	Confident	127 Å²	127	64.6 Å²	64.6	48%	0.479	34%	0.34	S	S	.	.	H	α-helix	trans	-69.1	-40	176.2	-75.3	-179.5	-174.2	-121	12.7	113	D16 E880 S881 S886	D16-R884 IonicContact OD2-NH2 2.68Å; E880-R884 WeakPolarHBondContact O-CB 3.2Å; E880-R884 WeakPolarHBondContact O-CG 3.27Å; E880-R884 PolarHBondContact O-N 3.41Å; E880-R884 IonicContact OE1-CZ 3.61Å; E880-R884 IonicContact OE1-NE 3.81Å; E880-R884 PolarHBondContact OE1-NE 3.49Å; E880-R884 IonicContact OE1-NH2 2.69Å; E880-R884 PolarHBondContact OE1-NH2 3.42Å; S881-R884 PolarHBondContact O-N 2.98Å; R884-S886 VanDerWaalsContact C-N 3.25Å; R884-S886 PolarHBondContact O-N 3.44Å
885	K	71.4	Confident	70.9	Confident	128 Å²	128	66.3 Å²	66.3	56%	0.557	35%	0.348	S	S	*	.	H	α-helix	trans	-57.3	-42.2	176.4	-72.9	167	-155.3	171.2	0	111.2	S881 E882 E887 G888	S881-K885 VanDerWaalsContact O-CG 3.26Å; S881-K885 WeakPolarHBondContact O-CG 3.48Å; S881-K885 PolarHBondContact O-N 2.92Å; E882-K885 PolarHBondContact O-N 2.91Å; E882-K885 IonicContact OE1-NZ 2.66Å; E882-K885 PolarHBondContact OE1-NZ 3.1Å; K885-E887 VanDerWaalsContact C-N 3.34Å; K885-E887 PolarHBondContact O-N 3.31Å; K885-G888 PolarHBondContact O-N 3.32Å
886	S	64.4	Low	70	Confident	9 Å²	9	68 Å²	68	6%	0.063	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	9.3	-167.7	62.4	0	0	0	0	114.5	E882 L883 R884 W958	E882-S886 WeakPolarHBondContact O-CB 3.18Å; E882-S886 PolarHBondContact O-N 3.43Å; E882-S886 PolarHBondContact O-OG 2.97Å; L883-S886 PolarHBondContact O-OG 3Å; R884-S886 VanDerWaalsContact C-N 3.25Å; R884-S886 PolarHBondContact O-N 3.44Å; S886-W958 VanDerWaalsContact CB-CZ2 3.44Å; S886-W958 WeakPolarHBondContact OG-CZ2 3.47Å
887	E	63.6	Low	69.2	Low	116 Å²	116	69.1 Å²	69.1	54%	0.542	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-8.6	161.9	-75.2	165.9	-175.2	0	0	112.9	L883 K885 K954	L883-E887 WeakPolarHBondContact O-CG 3.33Å; K885-E887 VanDerWaalsContact C-N 3.34Å; K885-E887 PolarHBondContact O-N 3.31Å; E887-K954 IonicContact OE1-NZ 3.71Å; E887-K954 PolarHBondContact OE1-NZ 3.3Å; E887-K954 IonicContact OE2-NZ 3.49Å; E887-K954 PolarHBondContact OE2-NZ 2.71Å
888	G	59.5	Low	68.6	Low	35 Å²	35	74.9 Å²	74.9	36%	0.361	38%	0.379	S	S	.	.	S	Bend	trans	-87.6	178	179.5	0	0	0	0	0	115.3	K885 D890 T891	K885-G888 PolarHBondContact O-N 3.32Å; G888-D890 PolarHBondContact O-N 3.47Å; G888-T891 WeakPolarHBondContact O-CG2 3.42Å; G888-T891 PolarHBondContact O-N 2.88Å
889	D	49.7	Very low	68.3	Low	171 Å²	171	78.2 Å²	78.2	91%	0.914	39%	0.387	S	S	*	.	S	Bend	trans	-59.8	-30.2	-178.1	-85.7	-36.2	0	0	0	113.5	T891	D889-T891 PolarHBondContact O-N 3.07Å
890	D	52.1	Low	67.8	Low	155 Å²	155	80.1 Å²	80.1	83%	0.829	40%	0.397	S	S	*	.	S	Bend	trans	-73.8	49.6	173.7	-63.1	-51.5	0	0	0	112.1	G888 P892	G888-D890 PolarHBondContact O-N 3.47Å; D890-P892 WeakPolarHBondContact O-CD 3.4Å
891	T	56.2	Low	67.6	Low	69 Å²	69	78.6 Å²	78.6	42%	0.423	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-65.9	125.5	-177.5	70.9	0	0	0	0	110.3	G888 D889 R897	G888-T891 WeakPolarHBondContact O-CG2 3.42Å; G888-T891 PolarHBondContact O-N 2.88Å; D889-T891 PolarHBondContact O-N 3.07Å; T891-R897 PolarHBondContact OG1-NH2 3.5Å
892	P	57.8	Low	67.7	Low	42 Å²	42	82 Å²	82	27%	0.273	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-61.6	165.4	-176.1	-23.2	32.3	0	0	0	113.3	D890 D896 R897	D890-P892 WeakPolarHBondContact O-CD 3.4Å; P892-D896 HydrophobicContact CB-CB 4.37Å; P892-R897 HydrophobicContact CB-CG 3.84Å; P892-R897 HydrophobicContact CG-CG 4.2Å; P892-R897 VanDerWaalsContact O-CZ 3.24Å; P892-R897 PolarHBondContact O-NE 2.92Å; P892-R897 PolarHBondContact O-NH2 3.38Å
893	A	61.3	Low	67.9	Low	35 Å²	35	81.9 Å²	81.9	29%	0.289	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-58.7	149	174.8	0	0	0	0	0	111.1	E895 D896 R897	A893-E895 PolarHBondContact O-N 2.9Å; A893-E895 VanDerWaalsContact O-N 3.09Å; A893-D896 PolarHBondContact O-N 2.9Å; A893-R897 PolarHBondContact O-N 3.32Å; A893-R897 VanDerWaalsContact O-N 3.07Å
894	P	64.1	Low	68.3	Low	27 Å²	27	81.9 Å²	81.9	18%	0.175	42%	0.415	C	S	.	.	H	α-helix	trans	-57.9	-27.9	-175.3	-27.2	35.9	0	0	0	114.5	R898 I965	P894-R898 PolarHBondContact O-N 3.44Å; P894-I965 HydrophobicContact CG-CG2 4.11Å
895	E	64	Low	68.9	Low	137 Å²	137	81.4 Å²	81.4	64%	0.64	41%	0.413	S	S	*	.	H	α-helix	trans	-74.6	-40.6	175.8	-57	-159.8	155.8	0	0	112.3	A893 R898 R899	A893-E895 PolarHBondContact O-N 2.9Å; A893-E895 VanDerWaalsContact O-N 3.09Å; E895-R898 WeakPolarHBondContact O-CB 3.1Å; E895-R898 PolarHBondContact O-N 3.12Å; E895-R898 VanDerWaalsContact O-N 3.12Å; E895-R899 PolarHBondContact O-N 3.44Å
896	D	67.9	Low	69.6	Low	72 Å²	72	80 Å²	80	39%	0.385	41%	0.406	S	S	.	.	H	α-helix	trans	-70.1	-38.6	179.5	-60.3	-42.1	0	0	0	111.6	P892 A893 R898 R899 L900	P892-D896 HydrophobicContact CB-CB 4.37Å; A893-D896 PolarHBondContact O-N 2.9Å; D896-R898 PolarHBondContact O-N 3.45Å; D896-R899 PolarHBondContact O-N 2.81Å; D896-R899 IonicContact OD1-NH1 2.83Å; D896-R899 PolarHBondContact OD1-NH1 2.92Å; D896-L900 VanDerWaalsContact O-CB 3.24Å; D896-L900 WeakPolarHBondContact O-CB 3.24Å; D896-L900 PolarHBondContact O-N 3.03Å
897	R	70.3	Confident	70.7	Confident	24 Å²	24	81.4 Å²	81.4	9%	0.091	41%	0.412	C	S	.	.	H	α-helix	trans	-58.5	-33.9	170.4	-61	-168	-129.1	-175.8	-3.9	112.1	T891 P892 A893 A901 W958 N962	T891-R897 PolarHBondContact OG1-NH2 3.5Å; P892-R897 HydrophobicContact CB-CG 3.84Å; P892-R897 HydrophobicContact CG-CG 4.2Å; P892-R897 VanDerWaalsContact O-CZ 3.24Å; P892-R897 PolarHBondContact O-NE 2.92Å; P892-R897 PolarHBondContact O-NH2 3.38Å; A893-R897 PolarHBondContact O-N 3.32Å; A893-R897 VanDerWaalsContact O-N 3.07Å; R897-A901 WeakPolarHBondContact O-CB 3.32Å; R897-A901 PolarHBondContact O-N 3.25Å; R897-A901 VanDerWaalsContact O-N 3.09Å; R897-W958 HydrophobicContact CB-CE3 4.28Å; R897-W958 HydrophobicContact CB-CH2 3.62Å; R897-W958 HydrophobicContact CB-CZ2 4.32Å; R897-W958 HydrophobicContact CB-CZ3 3.61Å; R897-W958 HydrophobicContact CG-CH2 3.46Å; R897-W958 VanDerWaalsContact CG-CH2 3.46Å; R897-W958 HydrophobicContact CG-CZ2 3.92Å; R897-W958 HydrophobicContact CG-CZ3 4.02Å; R897-W958 WeakPolarHBondContact O-CZ3 3.27Å; R897-N962 WeakPolarHBondContact CB-ND2 3.24Å; R897-N962 WeakPolarHBondContact CD-OD1 3Å
898	R	73	Confident	71.9	Confident	184 Å²	184	76 Å²	76	69%	0.694	39%	0.387	S	S	*	.	H	α-helix	trans	-73.8	-39.4	177.4	-172.9	178.2	-179.7	177.7	-0.3	112.4	P894 E895 D896 L902	P894-R898 PolarHBondContact O-N 3.44Å; E895-R898 WeakPolarHBondContact O-CB 3.1Å; E895-R898 PolarHBondContact O-N 3.12Å; E895-R898 VanDerWaalsContact O-N 3.12Å; D896-R898 PolarHBondContact O-N 3.45Å; R898-L902 PolarHBondContact O-N 2.93Å
899	R	75.9	Confident	73.3	Confident	164 Å²	164	77.1 Å²	77.1	62%	0.619	39%	0.393	S	S	*	.	H	α-helix	trans	-62.5	-48.7	172	-71.5	172.8	171.7	148.1	-4.3	111	E895 D896 A901 L902 A903	E895-R899 PolarHBondContact O-N 3.44Å; D896-R899 PolarHBondContact O-N 2.81Å; D896-R899 IonicContact OD1-NH1 2.83Å; D896-R899 PolarHBondContact OD1-NH1 2.92Å; R899-A901 PolarHBondContact O-N 3.43Å; R899-L902 WeakPolarHBondContact O-CB 3.4Å; R899-L902 PolarHBondContact O-N 2.72Å; R899-L902 VanDerWaalsContact O-N 3.14Å; R899-A903 PolarHBondContact O-N 3.46Å; R899-A903 VanDerWaalsContact O-N 3.12Å
900	L	76.8	Confident	75.1	Confident	41 Å²	41	72 Å²	72	22%	0.215	37%	0.366	C	S	.	.	H	α-helix	trans	-61.3	-44.2	-178	-169.8	65.5	0	0	0	112.2	D896 L902 A903 H904 W958	D896-L900 VanDerWaalsContact O-CB 3.24Å; D896-L900 WeakPolarHBondContact O-CB 3.24Å; D896-L900 PolarHBondContact O-N 3.03Å; L900-L902 VanDerWaalsContact C-N 3.25Å; L900-L902 PolarHBondContact O-N 3.29Å; L900-A903 PolarHBondContact O-N 2.92Å; L900-H904 WeakPolarHBondContact CG-NE2 3.48Å; L900-H904 PolarHBondContact O-N 3.42Å; L900-W958 HydrophobicContact CB-CZ3 4.32Å; L900-W958 HydrophobicContact CD2-CH2 3.98Å; L900-W958 HydrophobicContact CD2-CZ3 4.03Å; L900-W958 HydrophobicContact CG-CZ3 4.48Å
901	A	79.3	Confident	76.8	Confident	15 Å²	15	64.7 Å²	64.7	12%	0.124	33%	0.326	C	S	.	.	H	α-helix	trans	-62	-28.4	176	0	0	0	0	0	114.1	R897 R899 R905 L955 W958	R897-A901 WeakPolarHBondContact O-CB 3.32Å; R897-A901 PolarHBondContact O-N 3.25Å; R897-A901 VanDerWaalsContact O-N 3.09Å; R899-A901 PolarHBondContact O-N 3.43Å; A901-R905 WeakPolarHBondContact O-CG 3.36Å; A901-R905 PolarHBondContact O-N 2.65Å; A901-L955 HydrophobicContact CB-CD2 4.48Å; A901-W958 HydrophobicContact CB-CE3 4.28Å
902	L	82.1	Confident	78.3	Confident	116 Å²	116	63.5 Å²	63.5	61%	0.607	32%	0.321	S	S	*	.	H	α-helix	trans	-75.5	-44.4	174	-78.8	161.4	0	0	0	111.4	R898 R899 L900 R905 K906	R898-L902 PolarHBondContact O-N 2.93Å; R899-L902 WeakPolarHBondContact O-CB 3.4Å; R899-L902 PolarHBondContact O-N 2.72Å; R899-L902 VanDerWaalsContact O-N 3.14Å; L900-L902 VanDerWaalsContact C-N 3.25Å; L900-L902 PolarHBondContact O-N 3.29Å; L902-R905 PolarHBondContact O-N 3.24Å; L902-K906 PolarHBondContact O-N 2.9Å
903	A	83.4	Confident	79.8	Confident	50 Å²	50	66.4 Å²	66.4	41%	0.413	33%	0.329	S	S	.	.	H	α-helix	trans	-59.3	-49.8	177.3	0	0	0	0	0	111.8	R899 L900 R905 K906 Q907	R899-A903 PolarHBondContact O-N 3.46Å; R899-A903 VanDerWaalsContact O-N 3.12Å; L900-A903 PolarHBondContact O-N 2.92Å; A903-R905 VanDerWaalsContact C-N 3.32Å; A903-R905 PolarHBondContact O-N 2.86Å; A903-K906 WeakPolarHBondContact O-CB 3.18Å; A903-K906 PolarHBondContact O-N 3.01Å; A903-Q907 PolarHBondContact O-N 2.83Å; A903-Q907 VanDerWaalsContact O-N 3.16Å
904	H	86.2	Confident	81.1	Confident	3 Å²	3	67.8 Å²	67.8	1%	0.014	33%	0.327	C	S	.	.	H	α-helix	trans	-59.9	-37.3	179.2	-67.4	-20.3	0	0	0	113.6	V879 E882 L900 K906 Q907 V908 L955	V879-H904 HydrophobicContact CG1-CB 3.79Å; V879-H904 HydrophobicContact CG2-CB 4.15Å; E882-H904 WeakPolarHBondContact CB-NE2 3.24Å; E882-H904 IonicContact OE2-CE1 3.68Å; L900-H904 WeakPolarHBondContact CG-NE2 3.48Å; L900-H904 PolarHBondContact O-N 3.42Å; H904-K906 VanDerWaalsContact C-N 3.25Å; H904-K906 PolarHBondContact O-N 3.48Å; H904-Q907 PolarHBondContact ND1-OE1 2.89Å; H904-Q907 PolarHBondContact O-N 3.16Å; H904-V908 VanDerWaalsContact O-CG2 3.27Å; H904-V908 WeakPolarHBondContact O-CG2 3.49Å; H904-V908 PolarHBondContact O-N 3.37Å; H904-L955 HydrophobicContact CB-CD1 4.12Å; H904-L955 HydrophobicContact CB-CD2 3.78Å
905	R	87.1	Confident	82.2	Confident	117 Å²	117	66.8 Å²	66.8	44%	0.442	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-29.5	175.5	-81.2	-178.8	168.6	174.6	-2.6	112.8	A901 L902 A903 A909 L955 D956	A901-R905 WeakPolarHBondContact O-CG 3.36Å; A901-R905 PolarHBondContact O-N 2.65Å; L902-R905 PolarHBondContact O-N 3.24Å; A903-R905 VanDerWaalsContact C-N 3.32Å; A903-R905 PolarHBondContact O-N 2.86Å; R905-A909 PolarHBondContact O-N 3.38Å; R905-L955 HydrophobicContact CG-CD1 4.08Å; R905-D956 IonicContact CZ-OD1 3.61Å; R905-D956 IonicContact NH2-OD1 3.9Å; R905-D956 PolarHBondContact NH2-OD1 2.69Å
906	K	87.7	Confident	83.3	Confident	97 Å²	97	67.8 Å²	67.8	42%	0.422	32%	0.319	S	S	.	.	H	α-helix	trans	-71.1	-51.8	173.6	-163.6	164.7	-174.6	163	0	110.9	L902 A903 H904 V908 A909 D910 D1275	L902-K906 PolarHBondContact O-N 2.9Å; A903-K906 WeakPolarHBondContact O-CB 3.18Å; A903-K906 PolarHBondContact O-N 3.01Å; H904-K906 VanDerWaalsContact C-N 3.25Å; H904-K906 PolarHBondContact O-N 3.48Å; K906-V908 VanDerWaalsContact C-N 3.28Å; K906-V908 PolarHBondContact O-N 2.91Å; K906-A909 WeakPolarHBondContact O-CA 3.39Å; K906-A909 WeakPolarHBondContact O-CB 3.49Å; K906-A909 PolarHBondContact O-N 2.91Å; K906-D910 PolarHBondContact O-N 3.19Å; K906-D910 VanDerWaalsContact O-N 3.08Å; K906-D1275 PolarHBondContact NZ-O 2.77Å; K906-D1275 IonicContact NZ-OD1 3.86Å; K906-D1275 PolarHBondContact NZ-OD1 3.36Å
907	Q	86.5	Confident	84.1	Confident	39 Å²	39	68.2 Å²	68.2	18%	0.182	32%	0.321	C	S	.	.	H	α-helix	trans	-53.4	-41.5	177.7	-62.7	176.3	-69.9	0	0	112.9	L875 E878 V879 A903 H904 D910 C911	L875-Q907 HydrophobicContact CD2-CB 4.38Å; L875-Q907 HydrophobicContact CD2-CG 4.24Å; E878-Q907 PolarHBondContact OE2-NE2 2.85Å; V879-Q907 HydrophobicContact CG2-CB 4.1Å; V879-Q907 VanDerWaalsContact CG2-OE1 3.3Å; A903-Q907 PolarHBondContact O-N 2.83Å; A903-Q907 VanDerWaalsContact O-N 3.16Å; H904-Q907 PolarHBondContact ND1-OE1 2.89Å; H904-Q907 PolarHBondContact O-N 3.16Å; Q907-D910 PolarHBondContact O-N 3.14Å; Q907-C911 PolarHBondContact O-N 2.87Å; Q907-C911 VanDerWaalsContact O-N 3.1Å; Q907-C911 PolarHBondContact O-SG 3.27Å
908	V	88.7	Confident	84.8	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.018	32%	0.318	C	S	.	.	H	α-helix	trans	-71.1	-30.6	178.3	174.5	0	0	0	0	112.7	L876 V879 H904 K906 S912 I948 I951 N952	L876-V908 HydrophobicContact CD2-CG2 4.2Å; V879-V908 HydrophobicContact CG1-CG2 4.5Å; H904-V908 VanDerWaalsContact O-CG2 3.27Å; H904-V908 WeakPolarHBondContact O-CG2 3.49Å; H904-V908 PolarHBondContact O-N 3.37Å; K906-V908 VanDerWaalsContact C-N 3.28Å; K906-V908 PolarHBondContact O-N 2.91Å; V908-S912 PolarHBondContact O-N 3.25Å; V908-S912 PolarHBondContact O-OG 2.71Å; V908-I948 HydrophobicContact CG1-CG2 3.9Å; V908-I951 HydrophobicContact CG2-CG2 3.69Å; V908-N952 WeakPolarHBondContact CG1-ND2 3.28Å
909	A	88.4	Confident	85.4	Confident	58 Å²	58	60.9 Å²	60.9	48%	0.479	30%	0.296	S	S	.	.	H	α-helix	trans	-70	-41.2	174.1	0	0	0	0	0	111.8	R905 K906 S912 K913	R905-A909 PolarHBondContact O-N 3.38Å; K906-A909 WeakPolarHBondContact O-CA 3.39Å; K906-A909 WeakPolarHBondContact O-CB 3.49Å; K906-A909 PolarHBondContact O-N 2.91Å; A909-S912 CarbonylContact O-C 3.48Å; A909-S912 WeakPolarHBondContact O-CA 3.24Å; A909-S912 VanDerWaalsContact O-CB 3.29Å; A909-S912 WeakPolarHBondContact O-CB 3.34Å; A909-S912 PolarHBondContact O-N 3.2Å; A909-S912 VanDerWaalsContact O-N 3.07Å; A909-K913 PolarHBondContact O-N 2.97Å
910	D	88	Confident	85.9	Confident	65 Å²	65	57.7 Å²	57.7	35%	0.348	30%	0.295	S	S	.	.	H	α-helix	trans	-65.6	-39.4	175.4	-69.6	-48.9	0	0	0	112.1	K906 Q907 S912 K913 Y914	K906-D910 PolarHBondContact O-N 3.19Å; K906-D910 VanDerWaalsContact O-N 3.08Å; Q907-D910 PolarHBondContact O-N 3.14Å; D910-S912 PolarHBondContact O-N 2.72Å; D910-K913 WeakPolarHBondContact O-CA 3.28Å; D910-K913 VanDerWaalsContact O-CB 3.27Å; D910-K913 WeakPolarHBondContact O-CB 3.41Å; D910-K913 PolarHBondContact O-N 3.47Å; D910-Y914 HydrophobicContact CB-CE2 4.13Å; D910-Y914 WeakPolarHBondContact O-CD2 3.18Å; D910-Y914 PolarHBondContact O-N 3.12Å
911	C	88.1	Confident	86	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57	-36.5	169.8	-66.8	0	0	0	0	112.5	C872 L876 Q907 K913 L915 I948	C872-C911 PolarHBondContact SG-O 3Å; L876-C911 HydrophobicContact CD1-CB 4.4Å; L876-C911 HydrophobicContact CD2-CB 4.21Å; L876-C911 HydrophobicContact CG-CB 4.31Å; Q907-C911 PolarHBondContact O-N 2.87Å; Q907-C911 VanDerWaalsContact O-N 3.1Å; Q907-C911 PolarHBondContact O-SG 3.27Å; C911-K913 PolarHBondContact O-N 3.34Å; C911-L915 WeakPolarHBondContact O-CG 3.48Å; C911-L915 PolarHBondContact O-N 2.84Å; C911-I948 HydrophobicContact CB-CD1 4.01Å; C911-I948 HydrophobicContact CB-CG1 4.48Å
912	S	88.1	Confident	86.1	Confident	45 Å²	45	56.8 Å²	56.8	32%	0.315	29%	0.293	S	S	.	.	H	α-helix	trans	-73.1	-4.6	175.6	-54.1	0	0	0	0	113.8	V908 A909 D910 R916	V908-S912 PolarHBondContact O-N 3.25Å; V908-S912 PolarHBondContact O-OG 2.71Å; A909-S912 CarbonylContact O-C 3.48Å; A909-S912 WeakPolarHBondContact O-CA 3.24Å; A909-S912 VanDerWaalsContact O-CB 3.29Å; A909-S912 WeakPolarHBondContact O-CB 3.34Å; A909-S912 PolarHBondContact O-N 3.2Å; A909-S912 VanDerWaalsContact O-N 3.07Å; D910-S912 PolarHBondContact O-N 2.72Å; S912-R916 PolarHBondContact O-NE 3.32Å; S912-R916 PolarHBondContact O-NH2 3.21Å; S912-R916 VanDerWaalsContact O-NH2 3.16Å
913	K	89.2	Confident	86	Confident	102 Å²	102	57.5 Å²	57.5	44%	0.443	29%	0.293	S	S	.	.	H	α-helix	trans	-93.4	-54.7	169.9	-179.6	-169.8	167.7	-165.4	0	111	A909 D910 C911 L915 R916 D917	A909-K913 PolarHBondContact O-N 2.97Å; D910-K913 WeakPolarHBondContact O-CA 3.28Å; D910-K913 VanDerWaalsContact O-CB 3.27Å; D910-K913 WeakPolarHBondContact O-CB 3.41Å; D910-K913 PolarHBondContact O-N 3.47Å; C911-K913 PolarHBondContact O-N 3.34Å; K913-L915 PolarHBondContact O-N 2.97Å; K913-L915 VanDerWaalsContact O-N 3.16Å; K913-R916 WeakPolarHBondContact O-CB 3.28Å; K913-R916 PolarHBondContact O-N 2.93Å; K913-D917 PolarHBondContact O-N 3.27Å
914	Y	88.4	Confident	85.7	Confident	64 Å²	64	60.2 Å²	60.2	25%	0.251	30%	0.296	S	S	.	.	H	α-helix	trans	-56.9	-34.9	-178.3	-55.4	-58.1	0	0	0	113.3	N868 T871 D910 R916 D917 T918	N868-Y914 VanDerWaalsContact OD1-CD1 3.31Å; N868-Y914 WeakPolarHBondContact OD1-CD1 3.23Å; T871-Y914 HydrophobicContact CG2-CD2 4.42Å; T871-Y914 HydrophobicContact CG2-CE2 3.87Å; D910-Y914 HydrophobicContact CB-CE2 4.13Å; D910-Y914 WeakPolarHBondContact O-CD2 3.18Å; D910-Y914 PolarHBondContact O-N 3.12Å; Y914-R916 PolarHBondContact O-N 3.41Å; Y914-D917 PolarHBondContact O-N 3.35Å; Y914-T918 WeakPolarHBondContact O-CB 3.39Å; Y914-T918 PolarHBondContact O-N 3.46Å; Y914-T918 PolarHBondContact O-OG1 2.86Å
915	L	87.4	Confident	85.4	Confident	6 Å²	6	60.2 Å²	60.2	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-70.4	-11.7	175.2	-65.7	174.2	0	0	0	114.9	L869 C911 K913 L941 L944 R945 I948	L869-L915 HydrophobicContact CD2-CD2 3.91Å; C911-L915 WeakPolarHBondContact O-CG 3.48Å; C911-L915 PolarHBondContact O-N 2.84Å; K913-L915 PolarHBondContact O-N 2.97Å; K913-L915 VanDerWaalsContact O-N 3.16Å; L915-L941 HydrophobicContact CD2-CD2 3.76Å; L915-L944 HydrophobicContact CD1-CB 3.95Å; L915-L944 HydrophobicContact CD2-CB 3.87Å; L915-L944 HydrophobicContact CD2-CD1 3.8Å; L915-R945 HydrophobicContact CD1-CG 4.24Å; L915-R945 PolarHBondContact O-NH2 3.11Å; L915-I948 HydrophobicContact CD1-CD1 3.45Å; L915-I948 VanDerWaalsContact CD1-CD1 3.45Å
916	R	86.4	Confident	84.9	Confident	159 Å²	159	57.7 Å²	57.7	60%	0.6	30%	0.296	S	S	*	.	H	α-helix	trans	-91.9	-43	170.4	-74.2	179.5	-77.9	140.1	-3.9	111.1	S912 K913 Y914 T918 Q919 V920	S912-R916 PolarHBondContact O-NE 3.32Å; S912-R916 PolarHBondContact O-NH2 3.21Å; S912-R916 VanDerWaalsContact O-NH2 3.16Å; K913-R916 WeakPolarHBondContact O-CB 3.28Å; K913-R916 PolarHBondContact O-N 2.93Å; Y914-R916 PolarHBondContact O-N 3.41Å; R916-T918 VanDerWaalsContact C-N 3.33Å; R916-T918 PolarHBondContact O-N 3.11Å; R916-Q919 WeakPolarHBondContact O-CB 3.39Å; R916-Q919 PolarHBondContact O-N 2.95Å; R916-Q919 VanDerWaalsContact O-N 3.15Å; R916-V920 PolarHBondContact O-N 3.37Å
917	D	85.1	Confident	84.5	Confident	80 Å²	80	60.7 Å²	60.7	43%	0.428	31%	0.312	S	S	.	.	H	α-helix	trans	-64.4	-41.4	-179.4	-58.4	-26	0	0	0	110.7	K913 Y914 Q919 V920 G921	K913-D917 PolarHBondContact O-N 3.27Å; Y914-D917 PolarHBondContact O-N 3.35Å; D917-Q919 VanDerWaalsContact C-N 3.31Å; D917-Q919 PolarHBondContact O-N 3.28Å; D917-V920 PolarHBondContact O-N 2.83Å; D917-G921 PolarHBondContact O-N 3.37Å
918	T	85.2	Confident	83.8	Confident	6 Å²	6	62 Å²	62	4%	0.037	32%	0.319	C	S	.	.	H	α-helix	trans	-62.4	-34.3	174.1	-51.3	0	0	0	0	113.2	N868 L869 Y914 R916 V920 G921 L922 L941	N868-T918 WeakPolarHBondContact CB-OG1 3.37Å; N868-T918 PolarHBondContact ND2-OG1 3.41Å; L869-T918 HydrophobicContact CD1-CG2 4.08Å; L869-T918 HydrophobicContact CD2-CG2 4.45Å; L869-T918 HydrophobicContact CG-CG2 4.1Å; Y914-T918 WeakPolarHBondContact O-CB 3.39Å; Y914-T918 PolarHBondContact O-N 3.46Å; Y914-T918 PolarHBondContact O-OG1 2.86Å; R916-T918 VanDerWaalsContact C-N 3.33Å; R916-T918 PolarHBondContact O-N 3.11Å; T918-V920 PolarHBondContact O-N 3.17Å; T918-G921 PolarHBondContact O-N 2.7Å; T918-L922 PolarHBondContact O-N 3.46Å; T918-L922 VanDerWaalsContact O-N 3.12Å; T918-L941 HydrophobicContact CG2-CD2 4.02Å
919	Q	86.4	Confident	82.9	Confident	49 Å²	49	63.4 Å²	63.4	23%	0.229	33%	0.328	C	S	.	.	H	α-helix	trans	-65.6	-25.1	178.9	-173.4	69.3	83.6	0	0	112.2	R916 D917 L941	R916-Q919 WeakPolarHBondContact O-CB 3.39Å; R916-Q919 PolarHBondContact O-N 2.95Å; R916-Q919 VanDerWaalsContact O-N 3.15Å; D917-Q919 VanDerWaalsContact C-N 3.31Å; D917-Q919 PolarHBondContact O-N 3.28Å; Q919-L941 HydrophobicContact CB-CD1 4.45Å
920	V	85.3	Confident	82	Confident	97 Å²	97	63 Å²	63	59%	0.588	32%	0.322	S	S	*	.	H	α-helix	trans	-78.6	-43.9	174.6	-178.5	0	0	0	0	111	R916 D917 T918 L922 Q923	R916-V920 PolarHBondContact O-N 3.37Å; D917-V920 PolarHBondContact O-N 2.83Å; T918-V920 PolarHBondContact O-N 3.17Å; V920-L922 VanDerWaalsContact C-N 3.28Å; V920-L922 PolarHBondContact O-N 3.14Å; V920-Q923 PolarHBondContact O-N 2.92Å
921	G	79.8	Confident	81.3	Confident	23 Å²	23	65.1 Å²	65.1	24%	0.237	34%	0.339	C	S	.	.	H	α-helix	trans	-57.6	-40.7	176.1	0	0	0	0	0	112.8	D917 T918 Q923 K924 F925	D917-G921 PolarHBondContact O-N 3.37Å; T918-G921 PolarHBondContact O-N 2.7Å; G921-Q923 VanDerWaalsContact C-N 3.27Å; G921-Q923 PolarHBondContact O-N 3.36Å; G921-K924 PolarHBondContact O-N 3.15Å; G921-F925 PolarHBondContact O-N 3.25Å
922	L	80.6	Confident	80.6	Confident	13 Å²	13	72.5 Å²	72.5	7%	0.068	37%	0.374	C	S	.	.	H	α-helix	trans	-60	-32.2	178.7	-175.6	55.4	0	0	0	113.8	T918 V920 F925 S926 A934 L937 Q938 L941	T918-L922 PolarHBondContact O-N 3.46Å; T918-L922 VanDerWaalsContact O-N 3.12Å; V920-L922 VanDerWaalsContact C-N 3.28Å; V920-L922 PolarHBondContact O-N 3.14Å; L922-F925 HydrophobicContact CD1-CD1 4.26Å; L922-S926 PolarHBondContact O-N 2.96Å; L922-A934 HydrophobicContact CD1-CB 4.18Å; L922-L937 HydrophobicContact CD1-CB 3.64Å; L922-L937 HydrophobicContact CD1-CD1 3.68Å; L922-L937 HydrophobicContact CD1-CG 4.3Å; L922-L937 HydrophobicContact CD2-CB 4.15Å; L922-Q938 HydrophobicContact CD2-CB 4.04Å; L922-L941 HydrophobicContact CD2-CD1 4.01Å
923	Q	79.3	Confident	79.6	Confident	131 Å²	131	70.8 Å²	70.8	61%	0.612	36%	0.362	S	S	*	.	H	α-helix	trans	-65.2	-47	176.6	-67.9	-177.8	-21.7	0	0	111	V920 G921 S926	V920-Q923 PolarHBondContact O-N 2.92Å; G921-Q923 VanDerWaalsContact C-N 3.27Å; G921-Q923 PolarHBondContact O-N 3.36Å; Q923-S926 PolarHBondContact O-N 3.14Å; Q923-S926 PolarHBondContact O-OG 3.07Å
924	K	78.4	Confident	79	Confident	107 Å²	107	66.7 Å²	66.7	47%	0.465	35%	0.347	S	S	.	.	H	α-helix	trans	-68.9	-34.5	178.4	-168.3	-174.6	171.7	-156.7	0	112.4	M861 G921 S926 E927	M861-K924 HydrophobicContact SD-CB 3.88Å; M861-K924 HydrophobicContact SD-CD 3.66Å; M861-K924 HydrophobicContact SD-CG 3.69Å; G921-K924 PolarHBondContact O-N 3.15Å; K924-S926 VanDerWaalsContact C-N 3.29Å; K924-S926 PolarHBondContact O-N 2.71Å; K924-E927 PolarHBondContact O-N 3.31Å
925	F	78.6	Confident	78.6	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.018	36%	0.359	C	S	.	.	H	α-helix	trans	-56.7	-43.9	172.8	-176.7	-105.3	0	0	0	111.6	D786 I858 M861 L862 G921 L922 E927 L928 T929 A933 A934 L937	D786-F925 HydrophobicContact CB-CE1 4.45Å; D786-F925 HydrophobicContact CB-CZ 3.85Å; I858-F925 HydrophobicContact CG2-CD2 4.32Å; I858-F925 HydrophobicContact CG2-CE2 3.91Å; M861-F925 HydrophobicContact CE-CB 4.38Å; M861-F925 HydrophobicContact CE-CD2 4.22Å; L862-F925 HydrophobicContact CD1-CE2 3.92Å; L862-F925 HydrophobicContact CD2-CD2 4.18Å; L862-F925 HydrophobicContact CD2-CE2 3.67Å; L862-F925 HydrophobicContact CD2-CZ 4.05Å; L862-F925 HydrophobicContact CG-CD2 4.28Å; L862-F925 HydrophobicContact CG-CE2 3.82Å; G921-F925 PolarHBondContact O-N 3.25Å; L922-F925 HydrophobicContact CD1-CD1 4.26Å; F925-E927 PolarHBondContact O-N 3.46Å; F925-E927 VanDerWaalsContact O-N 3.08Å; F925-L928 PolarHBondContact O-N 2.97Å; F925-T929 HydrophobicContact CD2-CG2 3.9Å; F925-T929 HydrophobicContact CE1-CG2 4.25Å; F925-T929 WeakPolarHBondContact CE1-OG1 3Å; F925-T929 HydrophobicContact CE2-CG2 3.47Å; F925-T929 VanDerWaalsContact CE2-CG2 3.47Å; F925-T929 HydrophobicContact CG-CG2 4.45Å; F925-T929 HydrophobicContact CZ-CG2 3.67Å; F925-T929 PolarHBondContact O-N 2.98Å; F925-T929 PolarHBondContact O-OG1 3.24Å; F925-A933 HydrophobicContact CE1-CB 3.78Å; F925-A933 HydrophobicContact CZ-CB 4.08Å; F925-A934 HydrophobicContact CD1-CB 4.36Å; F925-L937 HydrophobicContact CD1-CD1 3.95Å; F925-L937 HydrophobicContact CE1-CD1 3.84Å; F925-L937 HydrophobicContact CZ-CD1 4.44Å
926	S	77.9	Confident	78	Confident	64 Å²	64	70.8 Å²	70.8	45%	0.448	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.3	179.2	77.1	0	0	0	0	115.6	L922 Q923 K924	L922-S926 PolarHBondContact O-N 2.96Å; Q923-S926 PolarHBondContact O-N 3.14Å; Q923-S926 PolarHBondContact O-OG 3.07Å; K924-S926 VanDerWaalsContact C-N 3.29Å; K924-S926 PolarHBondContact O-N 2.71Å
927	E	77.9	Confident	77.5	Confident	160 Å²	160	63.7 Å²	63.7	75%	0.748	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-15.7	173.7	-58.2	-176.5	146.5	0	0	113	K924 F925	K924-E927 PolarHBondContact O-N 3.31Å; F925-E927 PolarHBondContact O-N 3.46Å; F925-E927 VanDerWaalsContact O-N 3.08Å
928	L	72.7	Confident	77.5	Confident	66 Å²	66	62.6 Å²	62.6	35%	0.346	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-11.7	-168.1	-72.1	166.3	0	0	0	114.4	I858 M861 F925	I858-L928 HydrophobicContact CG1-CB 4.48Å; M861-L928 HydrophobicContact CE-CB 4.47Å; M861-L928 HydrophobicContact CE-CD1 3.56Å; M861-L928 HydrophobicContact SD-CD1 4.37Å; F925-L928 PolarHBondContact O-N 2.97Å
929	T	69.9	Low	77.5	Confident	33 Å²	33	65.8 Å²	65.8	20%	0.202	37%	0.368	C	S	.	.	S	Bend	trans	-129.4	-171.5	-175.3	65.7	0	0	0	0	113.1	I858 F925	I858-T929 HydrophobicContact CD1-CG2 4.38Å; I858-T929 HydrophobicContact CG2-CG2 4.22Å; F925-T929 HydrophobicContact CD2-CG2 3.9Å; F925-T929 HydrophobicContact CE1-CG2 4.25Å; F925-T929 WeakPolarHBondContact CE1-OG1 3Å; F925-T929 HydrophobicContact CE2-CG2 3.47Å; F925-T929 VanDerWaalsContact CE2-CG2 3.47Å; F925-T929 HydrophobicContact CG-CG2 4.45Å; F925-T929 HydrophobicContact CZ-CG2 3.67Å; F925-T929 PolarHBondContact O-N 2.98Å; F925-T929 PolarHBondContact O-OG1 3.24Å
930	S	70	Confident	77.3	Confident	49 Å²	49	64.1 Å²	64.1	34%	0.343	36%	0.36	S	S	.	.			trans	-69.9	152.8	169.8	77.2	0	0	0	0	111.4	E932	S930-E932 PolarHBondContact O-N 3.43Å
931	P	73.3	Confident	77.3	Confident	109 Å²	109	59.5 Å²	59.5	71%	0.708	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-14.4	176.6	29.7	-35.9	0	0	0	113.6
932	E	73.3	Confident	77.6	Confident	156 Å²	156	61.9 Å²	61.9	73%	0.729	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-44.7	179.9	-63.3	-178.4	150	0	0	111.1	S930 A934 A935	S930-E932 PolarHBondContact O-N 3.43Å; E932-A934 VanDerWaalsContact C-N 3.28Å; E932-A934 PolarHBondContact O-N 2.94Å; E932-A935 WeakPolarHBondContact O-CB 3.47Å; E932-A935 PolarHBondContact O-N 3.33Å
933	A	67.3	Low	77.9	Confident	9 Å²	9	65.2 Å²	65.2	7%	0.074	36%	0.357	C	S	.	.	H	α-helix	trans	-59.6	-36.8	176.7	0	0	0	0	0	112.7	D786 F925 A935	D786-A933 HydrophobicContact CB-CB 4.31Å; F925-A933 HydrophobicContact CE1-CB 3.78Å; F925-A933 HydrophobicContact CZ-CB 4.08Å; A933-A935 PolarHBondContact O-N 2.88Å
934	A	75.5	Confident	78.3	Confident	15 Å²	15	59.2 Å²	59.2	12%	0.124	33%	0.329	C	S	.	.	H	α-helix	trans	-66.9	-22.7	176.2	0	0	0	0	0	113.6	L922 F925 E932 Q938	L922-A934 HydrophobicContact CD1-CB 4.18Å; F925-A934 HydrophobicContact CD1-CB 4.36Å; E932-A934 VanDerWaalsContact C-N 3.28Å; E932-A934 PolarHBondContact O-N 2.94Å; A934-Q938 PolarHBondContact O-N 2.94Å
935	A	80.1	Confident	78.8	Confident	61 Å²	61	58.1 Å²	58.1	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-79.4	-36.4	-179.8	0	0	0	0	0	113	E932 A933 Q938 S939	E932-A935 WeakPolarHBondContact O-CB 3.47Å; E932-A935 PolarHBondContact O-N 3.33Å; A933-A935 PolarHBondContact O-N 2.88Å; A935-Q938 PolarHBondContact O-N 3.34Å; A935-S939 PolarHBondContact O-N 3.03Å
936	E	75	Confident	79.3	Confident	96 Å²	96	63 Å²	63	45%	0.449	35%	0.348	S	S	.	.	H	α-helix	trans	-62.8	-46.3	177.4	-67.5	-114.5	-175.3	0	0	111	R10 Q938 S939 I940	R10-E936 IonicContact NH2-OE2 2.69Å; R10-E936 PolarHBondContact NH2-OE2 2.73Å; E936-Q938 VanDerWaalsContact C-N 3.32Å; E936-Q938 PolarHBondContact O-N 3Å; E936-S939 WeakPolarHBondContact O-CB 3.4Å; E936-S939 PolarHBondContact O-N 3.46Å; E936-S939 VanDerWaalsContact O-N 3.16Å; E936-I940 PolarHBondContact O-N 3.22Å
937	L	76.6	Confident	79.8	Confident	9 Å²	9	61.5 Å²	61.5	5%	0.047	33%	0.333	C	S	.	.	H	α-helix	trans	-59.2	-39.7	176.7	-69	170.5	0	0	0	112.6	F2 L862 L922 F925 S939 I940 L941	F2-L937 HydrophobicContact CE1-CD2 3.5Å; F2-L937 VanDerWaalsContact CE1-CD2 3.5Å; F2-L937 HydrophobicContact CZ-CD2 3.48Å; F2-L937 VanDerWaalsContact CZ-CD2 3.48Å; L862-L937 HydrophobicContact CD2-CD1 4.38Å; L922-L937 HydrophobicContact CD1-CB 3.64Å; L922-L937 HydrophobicContact CD1-CD1 3.68Å; L922-L937 HydrophobicContact CD1-CG 4.3Å; L922-L937 HydrophobicContact CD2-CB 4.15Å; F925-L937 HydrophobicContact CD1-CD1 3.95Å; F925-L937 HydrophobicContact CE1-CD1 3.84Å; F925-L937 HydrophobicContact CZ-CD1 4.44Å; L937-S939 VanDerWaalsContact C-N 3.35Å; L937-S939 PolarHBondContact O-N 2.91Å; L937-I940 PolarHBondContact O-N 2.9Å; L937-L941 PolarHBondContact O-N 3.44Å
938	Q	84.3	Confident	80.3	Confident	58 Å²	58	54.7 Å²	54.7	27%	0.271	30%	0.302	S	S	.	.	H	α-helix	trans	-63.5	-39.7	176.9	-171.8	57.9	68.5	0	0	112	L922 A934 A935 E936 I940 L941 D942	L922-Q938 HydrophobicContact CD2-CB 4.04Å; A934-Q938 PolarHBondContact O-N 2.94Å; A935-Q938 PolarHBondContact O-N 3.34Å; E936-Q938 VanDerWaalsContact C-N 3.32Å; E936-Q938 PolarHBondContact O-N 3Å; Q938-I940 VanDerWaalsContact C-N 3.26Å; Q938-I940 PolarHBondContact O-N 3.28Å; Q938-L941 PolarHBondContact O-N 3.36Å; Q938-D942 PolarHBondContact NE2-OD2 2.75Å; Q938-D942 PolarHBondContact O-N 2.82Å
939	S	84.6	Confident	81	Confident	73 Å²	73	55.7 Å²	55.7	51%	0.51	31%	0.314	S	S	.	.	H	α-helix	trans	-64.7	-28.2	178.8	-172.2	0	0	0	0	113.3	A935 E936 L937 L943	A935-S939 PolarHBondContact O-N 3.03Å; E936-S939 WeakPolarHBondContact O-CB 3.4Å; E936-S939 PolarHBondContact O-N 3.46Å; E936-S939 VanDerWaalsContact O-N 3.16Å; L937-S939 VanDerWaalsContact C-N 3.35Å; L937-S939 PolarHBondContact O-N 2.91Å; S939-L943 WeakPolarHBondContact O-CG 3.47Å; S939-L943 PolarHBondContact O-N 2.92Å
940	I	83	Confident	81.8	Confident	13 Å²	13	59.7 Å²	59.7	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-76.6	-37.9	179.5	-65.1	168.3	0	0	0	110.8	F2 L869 E936 L937 Q938 D942 L943 L944	F2-I940 HydrophobicContact CD1-CD1 4.33Å; F2-I940 HydrophobicContact CE1-CD1 3.37Å; F2-I940 HydrophobicContact CZ-CD1 3.58Å; L869-I940 HydrophobicContact CD1-CG2 4.35Å; L869-I940 HydrophobicContact CD2-CG2 4.26Å; E936-I940 PolarHBondContact O-N 3.22Å; L937-I940 PolarHBondContact O-N 2.9Å; Q938-I940 VanDerWaalsContact C-N 3.26Å; Q938-I940 PolarHBondContact O-N 3.28Å; I940-D942 VanDerWaalsContact C-N 3.28Å; I940-D942 PolarHBondContact O-N 3.01Å; I940-L943 PolarHBondContact O-N 2.63Å; I940-L944 HydrophobicContact CG2-CD1 4.34Å; I940-L944 PolarHBondContact O-N 2.97Å
941	L	85	Confident	82.6	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	32%	0.318	C	S	.	.	H	α-helix	trans	-58.3	-40.1	175.7	-71.8	168.5	0	0	0	112	L869 L915 T918 Q919 L922 L937 Q938 R945	L869-L941 HydrophobicContact CD2-CD2 3.87Å; L915-L941 HydrophobicContact CD2-CD2 3.76Å; T918-L941 HydrophobicContact CG2-CD2 4.02Å; Q919-L941 HydrophobicContact CB-CD1 4.45Å; L922-L941 HydrophobicContact CD2-CD1 4.01Å; L937-L941 PolarHBondContact O-N 3.44Å; Q938-L941 PolarHBondContact O-N 3.36Å; L941-R945 WeakPolarHBondContact O-CD 3.42Å; L941-R945 VanDerWaalsContact O-CG 3.25Å; L941-R945 WeakPolarHBondContact O-CG 3.45Å; L941-R945 PolarHBondContact O-N 3.29Å
942	D	86.9	Confident	83.2	Confident	72 Å²	72	55.1 Å²	55.1	39%	0.385	30%	0.299	S	S	.	.	H	α-helix	trans	-76.6	-30.8	-177.7	-66.2	-39.3	0	0	0	113.5	Q938 I940 R945 N946	Q938-D942 PolarHBondContact NE2-OD2 2.75Å; Q938-D942 PolarHBondContact O-N 2.82Å; I940-D942 VanDerWaalsContact C-N 3.28Å; I940-D942 PolarHBondContact O-N 3.01Å; D942-R945 PolarHBondContact O-N 3.26Å; D942-R945 IonicContact OD1-CZ 2.76Å; D942-R945 IonicContact OD1-NE 2.62Å; D942-R945 IonicContact OD1-NH1 2.72Å; D942-R945 PolarHBondContact OD1-NH1 3.46Å; D942-N946 PolarHBondContact O-N 2.98Å; D942-N946 PolarHBondContact O-ND2 3.25Å
943	L	87.1	Confident	83.8	Confident	83 Å²	83	49.5 Å²	49.5	44%	0.435	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-44.6	170.8	-75.2	167.5	0	0	0	112.1	S939 I940 N946 K947	S939-L943 WeakPolarHBondContact O-CG 3.47Å; S939-L943 PolarHBondContact O-N 2.92Å; I940-L943 PolarHBondContact O-N 2.63Å; L943-N946 PolarHBondContact O-N 2.91Å; L943-K947 PolarHBondContact O-N 3.44Å; L943-K947 VanDerWaalsContact O-N 3.16Å
944	L	87.5	Confident	84.5	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-69.9	-34.2	-179.8	-66.2	171.5	0	0	0	112.2	L869 C872 L876 L915 I940 N946 K947 I948	L869-L944 HydrophobicContact CD2-CD1 3.62Å; C872-L944 HydrophobicContact CB-CD1 4.11Å; L876-L944 HydrophobicContact CD1-CD2 4.3Å; L915-L944 HydrophobicContact CD1-CB 3.95Å; L915-L944 HydrophobicContact CD2-CB 3.87Å; L915-L944 HydrophobicContact CD2-CD1 3.8Å; I940-L944 HydrophobicContact CG2-CD1 4.34Å; I940-L944 PolarHBondContact O-N 2.97Å; L944-N946 VanDerWaalsContact C-N 3.33Å; L944-N946 PolarHBondContact O-N 3.43Å; L944-K947 PolarHBondContact O-N 2.91Å; L944-I948 WeakPolarHBondContact O-CG1 3.37Å; L944-I948 PolarHBondContact O-N 3.18Å; L944-I948 VanDerWaalsContact O-N 3.09Å
945	R	89.3	Confident	84.9	Confident	85 Å²	85	51.2 Å²	51.2	32%	0.321	29%	0.286	S	S	.	.	H	α-helix	trans	-59.7	-41.5	171.5	-71.8	164.2	-172.8	159.4	2	112	L915 L941 D942 I948 S949	L915-R945 HydrophobicContact CD1-CG 4.24Å; L915-R945 PolarHBondContact O-NH2 3.11Å; L941-R945 WeakPolarHBondContact O-CD 3.42Å; L941-R945 VanDerWaalsContact O-CG 3.25Å; L941-R945 WeakPolarHBondContact O-CG 3.45Å; L941-R945 PolarHBondContact O-N 3.29Å; D942-R945 PolarHBondContact O-N 3.26Å; D942-R945 IonicContact OD1-CZ 2.76Å; D942-R945 IonicContact OD1-NE 2.62Å; D942-R945 IonicContact OD1-NH1 2.72Å; D942-R945 PolarHBondContact OD1-NH1 3.46Å; R945-I948 PolarHBondContact O-N 3.4Å; R945-S949 PolarHBondContact O-N 3.31Å
946	N	88.8	Confident	85.1	Confident	107 Å²	107	52.1 Å²	52.1	57%	0.572	28%	0.283	S	S	*	.	H	α-helix	trans	-65.3	-41.5	175.5	-72	-25.2	0	0	0	112.2	D942 L943 L944 I948 S949 I950	D942-N946 PolarHBondContact O-N 2.98Å; D942-N946 PolarHBondContact O-ND2 3.25Å; L943-N946 PolarHBondContact O-N 2.91Å; L944-N946 VanDerWaalsContact C-N 3.33Å; L944-N946 PolarHBondContact O-N 3.43Å; N946-I948 PolarHBondContact O-N 2.87Å; N946-S949 WeakPolarHBondContact O-CB 3.21Å; N946-S949 PolarHBondContact O-N 3.03Å; N946-S949 VanDerWaalsContact O-N 3.12Å; N946-I950 PolarHBondContact O-N 2.88Å
947	K	87.9	Confident	85.4	Confident	31 Å²	31	54 Å²	54	14%	0.135	29%	0.291	C	S	.	.	H	α-helix	trans	-61.6	-40.9	177.6	-174.6	162.5	-173.2	158.5	0	112.8	L876 N877 E880 L943 L944 S949 I950 I951	L876-K947 HydrophobicContact CB-CD 3.93Å; L876-K947 HydrophobicContact CB-CG 4.21Å; L876-K947 HydrophobicContact CD1-CG 4.46Å; L876-K947 WeakPolarHBondContact O-CE 3.32Å; N877-K947 PolarHBondContact OD1-NZ 3.09Å; E880-K947 WeakPolarHBondContact OE2-CE 3.36Å; E880-K947 IonicContact OE2-NZ 2.91Å; E880-K947 PolarHBondContact OE2-NZ 3.26Å; L943-K947 PolarHBondContact O-N 3.44Å; L943-K947 VanDerWaalsContact O-N 3.16Å; L944-K947 PolarHBondContact O-N 2.91Å; K947-S949 VanDerWaalsContact C-N 3.27Å; K947-S949 PolarHBondContact O-N 3.16Å; K947-I950 PolarHBondContact O-N 2.93Å; K947-I951 HydrophobicContact CG-CD1 3.95Å; K947-I951 PolarHBondContact O-N 3.42Å
948	I	88.4	Confident	85.5	Confident	17 Å²	17	54.7 Å²	54.7	9%	0.087	29%	0.293	C	S	.	.	H	α-helix	trans	-56.6	-40.5	173.3	-74.6	166.8	0	0	0	111.6	L876 V908 C911 L915 L944 R945 N946 N952	L876-I948 HydrophobicContact CD1-CD1 4.26Å; L876-I948 HydrophobicContact CD1-CG1 3.75Å; L876-I948 HydrophobicContact CD2-CG1 3.68Å; L876-I948 HydrophobicContact CG-CG1 4.39Å; V908-I948 HydrophobicContact CG1-CG2 3.9Å; C911-I948 HydrophobicContact CB-CD1 4.01Å; C911-I948 HydrophobicContact CB-CG1 4.48Å; L915-I948 HydrophobicContact CD1-CD1 3.45Å; L915-I948 VanDerWaalsContact CD1-CD1 3.45Å; L944-I948 WeakPolarHBondContact O-CG1 3.37Å; L944-I948 PolarHBondContact O-N 3.18Å; L944-I948 VanDerWaalsContact O-N 3.09Å; R945-I948 PolarHBondContact O-N 3.4Å; N946-I948 PolarHBondContact O-N 2.87Å; I948-N952 PolarHBondContact O-N 3.47Å; I948-N952 PolarHBondContact O-ND2 2.89Å
949	S	87.2	Confident	85.1	Confident	87 Å²	87	54.1 Å²	54.1	61%	0.608	30%	0.298	S	S	*	.	H	α-helix	trans	-64.2	-41.2	179.2	-165.1	0	0	0	0	112.7	R945 N946 K947 G953	R945-S949 PolarHBondContact O-N 3.31Å; N946-S949 WeakPolarHBondContact O-CB 3.21Å; N946-S949 PolarHBondContact O-N 3.03Å; N946-S949 VanDerWaalsContact O-N 3.12Å; K947-S949 VanDerWaalsContact C-N 3.27Å; K947-S949 PolarHBondContact O-N 3.16Å; S949-G953 PolarHBondContact O-N 3.32Å
950	I	86.2	Confident	85	Confident	118 Å²	118	56.2 Å²	56.2	61%	0.605	30%	0.304	S	S	*	.	H	α-helix	trans	-67.5	-44.7	-179	-63.3	168.1	0	0	0	111.2	N946 K947 N952 G953 K954	N946-I950 PolarHBondContact O-N 2.88Å; K947-I950 PolarHBondContact O-N 2.93Å; I950-N952 PolarHBondContact O-N 2.99Å; I950-G953 PolarHBondContact O-N 2.74Å; I950-K954 PolarHBondContact O-N 2.75Å
951	I	86.2	Confident	84.7	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-40.7	-177.7	-73.1	169.6	0	0	0	111.7	L876 V879 E880 L883 V908 K947 G953 K954 L955	L876-I951 HydrophobicContact CB-CD1 4.06Å; L876-I951 HydrophobicContact CD2-CD1 3.88Å; L876-I951 WeakPolarHBondContact O-CD1 3.2Å; V879-I951 HydrophobicContact CB-CG2 4.44Å; V879-I951 HydrophobicContact CG1-CG2 3.42Å; V879-I951 VanDerWaalsContact CG1-CG2 3.42Å; E880-I951 HydrophobicContact CB-CD1 4.37Å; L883-I951 HydrophobicContact CD1-CG2 4.24Å; V908-I951 HydrophobicContact CG2-CG2 3.69Å; K947-I951 HydrophobicContact CG-CD1 3.95Å; K947-I951 PolarHBondContact O-N 3.42Å; I951-G953 VanDerWaalsContact C-N 3.31Å; I951-G953 PolarHBondContact O-N 3.02Å; I951-K954 PolarHBondContact O-N 3.34Å; I951-L955 HydrophobicContact CG2-CD1 3.93Å; I951-L955 WeakPolarHBondContact O-CG 3.38Å; I951-L955 PolarHBondContact O-N 3.03Å; I951-L955 VanDerWaalsContact O-N 3.14Å
952	N	87.1	Confident	84.2	Confident	58 Å²	58	59.5 Å²	59.5	31%	0.31	32%	0.324	S	S	.	.	H	α-helix	trans	-60.2	-40.5	175.6	-78.9	-65.9	0	0	0	112.1	V908 I948 I950 K954 L955 D956	V908-N952 WeakPolarHBondContact CG1-ND2 3.28Å; I948-N952 PolarHBondContact O-N 3.47Å; I948-N952 PolarHBondContact O-ND2 2.89Å; I950-N952 PolarHBondContact O-N 2.99Å; N952-K954 PolarHBondContact O-N 3.26Å; N952-L955 PolarHBondContact O-N 3.14Å; N952-D956 PolarHBondContact O-N 2.85Å
953	G	85.1	Confident	83.8	Confident	38 Å²	38	61.1 Å²	61.1	39%	0.392	33%	0.329	S	S	.	.	H	α-helix	trans	-59.2	-45.6	176.3	0	0	0	0	0	113.1	S949 I950 I951 L955 D956 E957	S949-G953 PolarHBondContact O-N 3.32Å; I950-G953 PolarHBondContact O-N 2.74Å; I951-G953 VanDerWaalsContact C-N 3.31Å; I951-G953 PolarHBondContact O-N 3.02Å; G953-L955 PolarHBondContact O-N 3.24Å; G953-D956 PolarHBondContact O-N 2.97Å; G953-E957 PolarHBondContact O-N 2.88Å
954	K	83.6	Confident	83.5	Confident	57 Å²	57	63.5 Å²	63.5	25%	0.248	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-41.7	176	-78.2	-158.2	168.5	-153.7	0	112.9	L883 E887 I950 I951 N952 D956 E957 W958	L883-K954 HydrophobicContact CB-CD 4.38Å; L883-K954 HydrophobicContact CD1-CB 3.99Å; L883-K954 HydrophobicContact CD1-CD 4.39Å; E887-K954 IonicContact OE1-NZ 3.71Å; E887-K954 PolarHBondContact OE1-NZ 3.3Å; E887-K954 IonicContact OE2-NZ 3.49Å; E887-K954 PolarHBondContact OE2-NZ 2.71Å; I950-K954 PolarHBondContact O-N 2.75Å; I951-K954 PolarHBondContact O-N 3.34Å; N952-K954 PolarHBondContact O-N 3.26Å; K954-D956 PolarHBondContact O-N 3.26Å; K954-E957 PolarHBondContact O-N 3.26Å; K954-W958 WeakPolarHBondContact O-CB 3.47Å; K954-W958 PolarHBondContact O-N 2.99Å
955	L	83.4	Confident	82.9	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-62.2	-31.1	-179.8	-73.5	162.9	0	0	0	112.6	L883 A901 H904 R905 I951 N952 G953 A959	L883-L955 HydrophobicContact CD1-CD2 4.49Å; L883-L955 HydrophobicContact CD1-CG 4.33Å; L883-L955 HydrophobicContact CD2-CD2 4.04Å; A901-L955 HydrophobicContact CB-CD2 4.48Å; H904-L955 HydrophobicContact CB-CD1 4.12Å; H904-L955 HydrophobicContact CB-CD2 3.78Å; R905-L955 HydrophobicContact CG-CD1 4.08Å; I951-L955 HydrophobicContact CG2-CD1 3.93Å; I951-L955 WeakPolarHBondContact O-CG 3.38Å; I951-L955 PolarHBondContact O-N 3.03Å; I951-L955 VanDerWaalsContact O-N 3.14Å; N952-L955 PolarHBondContact O-N 3.14Å; G953-L955 PolarHBondContact O-N 3.24Å; L955-A959 PolarHBondContact O-N 3.38Å; L955-A959 VanDerWaalsContact O-N 3.15Å
956	D	83	Confident	82.1	Confident	81 Å²	81	64.7 Å²	64.7	43%	0.433	35%	0.351	S	S	.	.	H	α-helix	trans	-75.4	-39.5	177.4	-71	-8.9	0	0	0	112.5	R905 N952 G953 K954 W958 A959 L960	R905-D956 IonicContact CZ-OD1 3.61Å; R905-D956 IonicContact NH2-OD1 3.9Å; R905-D956 PolarHBondContact NH2-OD1 2.69Å; N952-D956 PolarHBondContact O-N 2.85Å; G953-D956 PolarHBondContact O-N 2.97Å; K954-D956 PolarHBondContact O-N 3.26Å; D956-W958 VanDerWaalsContact C-N 3.27Å; D956-W958 PolarHBondContact O-N 3.32Å; D956-A959 PolarHBondContact O-N 2.88Å; D956-L960 PolarHBondContact O-N 3.37Å
957	E	81.2	Confident	81.7	Confident	134 Å²	134	65.4 Å²	65.4	63%	0.626	35%	0.349	S	S	*	.	H	α-helix	trans	-62	-36.6	171.3	-65.6	-175.3	155.7	0	0	111.9	G953 K954 L960 T961	G953-E957 PolarHBondContact O-N 2.88Å; K954-E957 PolarHBondContact O-N 3.26Å; E957-L960 PolarHBondContact O-N 3.03Å; E957-T961 PolarHBondContact O-N 3.38Å; E957-T961 VanDerWaalsContact O-N 3.14Å; E957-T961 PolarHBondContact O-OG1 3.44Å
958	W	79.1	Confident	81.3	Confident	24 Å²	24	66.9 Å²	66.9	9%	0.091	36%	0.357	C	S	.	.	H	α-helix	trans	-65.1	-42.8	176.4	-122.8	51.4	0	0	0	112.8	L883 S886 R897 L900 A901 K954 D956 T961 N962	L883-W958 HydrophobicContact CD2-CD2 4.31Å; L883-W958 HydrophobicContact CD2-CG 4.43Å; S886-W958 VanDerWaalsContact CB-CZ2 3.44Å; S886-W958 WeakPolarHBondContact OG-CZ2 3.47Å; R897-W958 HydrophobicContact CB-CE3 4.28Å; R897-W958 HydrophobicContact CB-CH2 3.62Å; R897-W958 HydrophobicContact CB-CZ2 4.32Å; R897-W958 HydrophobicContact CB-CZ3 3.61Å; R897-W958 HydrophobicContact CG-CH2 3.46Å; R897-W958 VanDerWaalsContact CG-CH2 3.46Å; R897-W958 HydrophobicContact CG-CZ2 3.92Å; R897-W958 HydrophobicContact CG-CZ3 4.02Å; R897-W958 WeakPolarHBondContact O-CZ3 3.27Å; L900-W958 HydrophobicContact CB-CZ3 4.32Å; L900-W958 HydrophobicContact CD2-CH2 3.98Å; L900-W958 HydrophobicContact CD2-CZ3 4.03Å; L900-W958 HydrophobicContact CG-CZ3 4.48Å; A901-W958 HydrophobicContact CB-CE3 4.28Å; K954-W958 WeakPolarHBondContact O-CB 3.47Å; K954-W958 PolarHBondContact O-N 2.99Å; D956-W958 VanDerWaalsContact C-N 3.27Å; D956-W958 PolarHBondContact O-N 3.32Å; W958-T961 PolarHBondContact O-N 3Å; W958-N962 PolarHBondContact O-N 3.08Å; W958-N962 VanDerWaalsContact O-N 3.16Å; W958-N962 PolarHBondContact O-ND2 3.26Å
959	A	77.4	Confident	80.9	Confident	46 Å²	46	66.3 Å²	66.3	38%	0.38	35%	0.354	S	S	.	.	H	α-helix	trans	-61.5	-45	176.4	0	0	0	0	0	112.3	L955 D956 T961 N962 E963	L955-A959 PolarHBondContact O-N 3.38Å; L955-A959 VanDerWaalsContact O-N 3.15Å; D956-A959 PolarHBondContact O-N 2.88Å; A959-T961 VanDerWaalsContact C-N 3.29Å; A959-T961 PolarHBondContact O-N 2.76Å; A959-N962 PolarHBondContact O-N 2.87Å; A959-E963 PolarHBondContact O-N 3.01Å
960	L	81	Confident	80.6	Confident	118 Å²	118	66.4 Å²	66.4	62%	0.618	35%	0.351	S	S	*	.	H	α-helix	trans	-59.7	-38.6	176.3	-75.3	163.4	0	0	0	112.4	D956 E957 K964	D956-L960 PolarHBondContact O-N 3.37Å; E957-L960 PolarHBondContact O-N 3.03Å; L960-K964 PolarHBondContact O-N 2.96Å
961	T	78	Confident	80.5	Confident	68 Å²	68	67.8 Å²	67.8	42%	0.417	36%	0.355	S	S	.	.	H	α-helix	trans	-67.9	-43	-179.8	-59.2	0	0	0	0	112	E957 W958 A959 K964 I965	E957-T961 PolarHBondContact O-N 3.38Å; E957-T961 VanDerWaalsContact O-N 3.14Å; E957-T961 PolarHBondContact O-OG1 3.44Å; W958-T961 PolarHBondContact O-N 3Å; A959-T961 VanDerWaalsContact C-N 3.29Å; A959-T961 PolarHBondContact O-N 2.76Å; T961-K964 WeakPolarHBondContact O-CB 3.47Å; T961-K964 PolarHBondContact O-N 2.7Å; T961-I965 HydrophobicContact CG2-CD1 4.21Å; T961-I965 WeakPolarHBondContact O-CG1 3.48Å; T961-I965 PolarHBondContact O-N 3.37Å; T961-I965 VanDerWaalsContact O-N 3.15Å
962	N	74.4	Confident	80.4	Confident	15 Å²	15	69 Å²	69	8%	0.08	36%	0.361	C	S	.	.	H	α-helix	trans	-66.1	-37.5	177.9	-69.9	-30.2	0	0	0	112.6	R897 W958 A959 K964 I965 T966	R897-N962 WeakPolarHBondContact CB-ND2 3.24Å; R897-N962 WeakPolarHBondContact CD-OD1 3Å; W958-N962 PolarHBondContact O-N 3.08Å; W958-N962 VanDerWaalsContact O-N 3.16Å; W958-N962 PolarHBondContact O-ND2 3.26Å; A959-N962 PolarHBondContact O-N 2.87Å; N962-K964 VanDerWaalsContact C-N 3.3Å; N962-K964 PolarHBondContact O-N 3.26Å; N962-I965 PolarHBondContact O-N 3.3Å; N962-T966 WeakPolarHBondContact O-CB 3.42Å; N962-T966 PolarHBondContact O-N 2.88Å; N962-T966 PolarHBondContact O-OG1 2.99Å
963	E	76.9	Confident	80.2	Confident	106 Å²	106	68.9 Å²	68.9	50%	0.495	36%	0.358	S	S	.	.	H	α-helix	trans	-61	-40	175.4	-162.3	-161.6	130.7	0	0	111.8	A959 K967	A959-E963 PolarHBondContact O-N 3.01Å; E963-K967 WeakPolarHBondContact O-CG 3.2Å; E963-K967 PolarHBondContact O-N 2.77Å; E963-K967 WeakPolarHBondContact OE1-CE 3.09Å; E963-K967 IonicContact OE1-NZ 3.52Å; E963-K967 PolarHBondContact OE1-NZ 2.96Å
964	K	81	Confident	80.2	Confident	132 Å²	132	73.9 Å²	73.9	57%	0.574	37%	0.369	S	S	*	.	H	α-helix	trans	-64.7	-49.5	176.4	-171.8	-169.2	177.7	-147.4	0	112.1	L960 T961 N962 T966 K967 E968	L960-K964 PolarHBondContact O-N 2.96Å; T961-K964 WeakPolarHBondContact O-CB 3.47Å; T961-K964 PolarHBondContact O-N 2.7Å; N962-K964 VanDerWaalsContact C-N 3.3Å; N962-K964 PolarHBondContact O-N 3.26Å; K964-T966 VanDerWaalsContact C-N 3.3Å; K964-T966 PolarHBondContact O-N 3.29Å; K964-K967 PolarHBondContact O-N 3.32Å; K964-E968 WeakPolarHBondContact CE-OE1 3.33Å; K964-E968 IonicContact NZ-OE1 2.96Å; K964-E968 PolarHBondContact NZ-OE1 3.03Å; K964-E968 PolarHBondContact O-N 2.81Å; K964-E968 VanDerWaalsContact O-N 3.15Å
965	I	74.6	Confident	80.4	Confident	34 Å²	34	75.6 Å²	75.6	17%	0.174	38%	0.377	C	S	.	.	H	α-helix	trans	-58.7	-45	179.4	-66	168	0	0	0	110.4	P894 T961 N962 K967 E968 V969	P894-I965 HydrophobicContact CG-CG2 4.11Å; T961-I965 HydrophobicContact CG2-CD1 4.21Å; T961-I965 WeakPolarHBondContact O-CG1 3.48Å; T961-I965 PolarHBondContact O-N 3.37Å; T961-I965 VanDerWaalsContact O-N 3.15Å; N962-I965 PolarHBondContact O-N 3.3Å; I965-K967 VanDerWaalsContact C-N 3.3Å; I965-K967 PolarHBondContact O-N 3.22Å; I965-E968 PolarHBondContact O-N 3.3Å; I965-V969 HydrophobicContact CG2-CG2 4.44Å; I965-V969 WeakPolarHBondContact O-CG2 3.48Å; I965-V969 PolarHBondContact O-N 2.92Å; I965-V969 VanDerWaalsContact O-N 3.11Å
966	T	72.9	Confident	80.6	Confident	82 Å²	82	75.5 Å²	75.5	50%	0.503	38%	0.376	S	S	.	.	H	α-helix	trans	-56.8	-43.3	180	-54.2	0	0	0	0	111.9	N962 K964 V969 V970	N962-T966 WeakPolarHBondContact O-CB 3.42Å; N962-T966 PolarHBondContact O-N 2.88Å; N962-T966 PolarHBondContact O-OG1 2.99Å; K964-T966 VanDerWaalsContact C-N 3.3Å; K964-T966 PolarHBondContact O-N 3.29Å; T966-V969 PolarHBondContact O-N 2.86Å; T966-V970 WeakPolarHBondContact O-CG2 3.41Å; T966-V970 PolarHBondContact O-N 2.7Å
967	K	80.7	Confident	80.8	Confident	122 Å²	122	76.3 Å²	76.3	53%	0.53	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-46.9	176.6	-73.6	166.8	171.5	172	0	112.3	E963 K964 I965 V969 V970 E971	E963-K967 WeakPolarHBondContact O-CG 3.2Å; E963-K967 PolarHBondContact O-N 2.77Å; E963-K967 WeakPolarHBondContact OE1-CE 3.09Å; E963-K967 IonicContact OE1-NZ 3.52Å; E963-K967 PolarHBondContact OE1-NZ 2.96Å; K964-K967 PolarHBondContact O-N 3.32Å; I965-K967 VanDerWaalsContact C-N 3.3Å; I965-K967 PolarHBondContact O-N 3.22Å; K967-V969 VanDerWaalsContact C-N 3.26Å; K967-V969 PolarHBondContact O-N 2.99Å; K967-V970 PolarHBondContact O-N 3.43Å; K967-E971 PolarHBondContact O-N 3.08Å
968	E	80.9	Confident	81.1	Confident	62 Å²	62	74.2 Å²	74.2	29%	0.29	37%	0.369	S	S	.	.	H	α-helix	trans	-62.7	-30	-179.2	-69	-179.5	-168	0	0	113.1	K964 I965 L972 K1031	K964-E968 WeakPolarHBondContact CE-OE1 3.33Å; K964-E968 IonicContact NZ-OE1 2.96Å; K964-E968 PolarHBondContact NZ-OE1 3.03Å; K964-E968 PolarHBondContact O-N 2.81Å; K964-E968 VanDerWaalsContact O-N 3.15Å; I965-E968 PolarHBondContact O-N 3.3Å; E968-L972 WeakPolarHBondContact O-CG 3.42Å; E968-L972 PolarHBondContact O-N 2.84Å; E968-K1031 IonicContact OE2-NZ 3.55Å; E968-K1031 PolarHBondContact OE2-NZ 3.49Å
969	V	79.9	Confident	81.5	Confident	4 Å²	4	74.2 Å²	74.2	2%	0.024	37%	0.371	C	S	.	.	H	α-helix	trans	-79.6	-37.8	178.8	-177.1	0	0	0	0	112.6	I965 T966 K967 E971 L972 Q973 I1028 K1031 Q1032	I965-V969 HydrophobicContact CG2-CG2 4.44Å; I965-V969 WeakPolarHBondContact O-CG2 3.48Å; I965-V969 PolarHBondContact O-N 2.92Å; I965-V969 VanDerWaalsContact O-N 3.11Å; T966-V969 PolarHBondContact O-N 2.86Å; K967-V969 VanDerWaalsContact C-N 3.26Å; K967-V969 PolarHBondContact O-N 2.99Å; V969-E971 VanDerWaalsContact C-N 3.26Å; V969-E971 PolarHBondContact O-N 3.21Å; V969-L972 PolarHBondContact O-N 3.49Å; V969-L972 VanDerWaalsContact O-N 3.07Å; V969-Q973 HydrophobicContact CG1-CG 4.11Å; V969-Q973 WeakPolarHBondContact O-CG 3.41Å; V969-Q973 PolarHBondContact O-N 2.72Å; V969-I1028 HydrophobicContact CG1-CG2 4.23Å; V969-K1031 HydrophobicContact CG2-CB 3.49Å; V969-K1031 VanDerWaalsContact CG2-CB 3.49Å; V969-K1031 HydrophobicContact CG2-CD 4.07Å; V969-K1031 HydrophobicContact CG2-CG 4.44Å; V969-Q1032 VanDerWaalsContact CG1-CD 3.45Å; V969-Q1032 HydrophobicContact CG1-CG 3.92Å; V969-Q1032 VanDerWaalsContact CG1-OE1 3.28Å
970	V	80.6	Confident	82.2	Confident	90 Å²	90	73.8 Å²	73.8	55%	0.545	36%	0.361	S	S	.	.	H	α-helix	trans	-59.6	-38.2	175.4	171.4	0	0	0	0	111.3	T966 K967 K974	T966-V970 WeakPolarHBondContact O-CG2 3.41Å; T966-V970 PolarHBondContact O-N 2.7Å; K967-V970 PolarHBondContact O-N 3.43Å; V970-K974 PolarHBondContact O-N 2.72Å; V970-K974 VanDerWaalsContact O-N 3.16Å
971	E	83.4	Confident	82.5	Confident	146 Å²	146	71 Å²	71	68%	0.682	36%	0.355	S	S	*	.	H	α-helix	trans	-64.9	-39.1	173.8	-68.1	-175.4	166.2	0	0	112.8	K967 V969 K975	K967-E971 PolarHBondContact O-N 3.08Å; V969-E971 VanDerWaalsContact C-N 3.26Å; V969-E971 PolarHBondContact O-N 3.21Å; E971-K975 PolarHBondContact O-N 2.88Å; E971-K975 VanDerWaalsContact O-N 3.17Å
972	L	84.5	Confident	83	Confident	29 Å²	29	71.7 Å²	71.7	15%	0.152	36%	0.356	C	S	.	.	H	α-helix	trans	-71.8	-43.8	178.3	-73	167.7	0	0	0	112.6	E968 V969 K974 K975 F976 K1027 I1028 K1031	E968-L972 WeakPolarHBondContact O-CG 3.42Å; E968-L972 PolarHBondContact O-N 2.84Å; V969-L972 PolarHBondContact O-N 3.49Å; V969-L972 VanDerWaalsContact O-N 3.07Å; L972-K974 VanDerWaalsContact C-N 3.33Å; L972-K974 PolarHBondContact O-N 2.75Å; L972-K975 PolarHBondContact O-N 3.46Å; L972-K975 VanDerWaalsContact O-N 3.15Å; L972-F976 PolarHBondContact O-N 3.33Å; L972-K1027 HydrophobicContact CD1-CB 4.23Å; L972-K1027 HydrophobicContact CD2-CB 4.06Å; L972-K1027 HydrophobicContact CD2-CD 4.49Å; L972-I1028 HydrophobicContact CB-CG1 3.69Å; L972-K1031 HydrophobicContact CD1-CD 3.96Å
973	Q	82.9	Confident	83.7	Confident	56 Å²	56	71 Å²	71	26%	0.262	35%	0.353	S	S	.	.	H	α-helix	trans	-56.5	-47.1	175.2	-74.9	-176.7	-8.6	0	0	111	V969 K975 F976 F977 I1028	V969-Q973 HydrophobicContact CG1-CG 4.11Å; V969-Q973 WeakPolarHBondContact O-CG 3.41Å; V969-Q973 PolarHBondContact O-N 2.72Å; Q973-K975 PolarHBondContact O-N 2.76Å; Q973-F976 PolarHBondContact O-N 3.14Å; Q973-F977 VanDerWaalsContact O-CD2 3.26Å; Q973-F977 WeakPolarHBondContact O-CD2 3.16Å; Q973-F977 PolarHBondContact O-N 2.85Å; Q973-F977 VanDerWaalsContact O-N 3.12Å; Q973-I1028 HydrophobicContact CG-CD1 4.35Å; Q973-I1028 HydrophobicContact CG-CG2 4.19Å
974	K	85.7	Confident	84.2	Confident	143 Å²	143	67 Å²	67	62%	0.622	34%	0.338	S	S	*	.	H	α-helix	trans	-55.5	-50.7	174.2	-177	-177.5	174.7	-175.5	0	111.4	V970 L972 F976 F977 D978	V970-K974 PolarHBondContact O-N 2.72Å; V970-K974 VanDerWaalsContact O-N 3.16Å; L972-K974 VanDerWaalsContact C-N 3.33Å; L972-K974 PolarHBondContact O-N 2.75Å; K974-F976 VanDerWaalsContact C-N 3.26Å; K974-F976 PolarHBondContact O-N 3.35Å; K974-F977 PolarHBondContact O-N 3.13Å; K974-D978 VanDerWaalsContact O-CG 3.27Å; K974-D978 PolarHBondContact O-N 2.81Å
975	K	86.8	Confident	84.6	Confident	93 Å²	93	64 Å²	64	40%	0.404	33%	0.332	S	S	.	.	H	α-helix	trans	-60.9	-32.6	179.3	-166	-169.1	171	-158.8	0	112.7	E971 L972 Q973 I979 T1024	E971-K975 PolarHBondContact O-N 2.88Å; E971-K975 VanDerWaalsContact O-N 3.17Å; L972-K975 PolarHBondContact O-N 3.46Å; L972-K975 VanDerWaalsContact O-N 3.15Å; Q973-K975 PolarHBondContact O-N 2.76Å; K975-I979 HydrophobicContact CG-CD1 4.22Å; K975-I979 WeakPolarHBondContact O-CD1 3.39Å; K975-I979 VanDerWaalsContact O-CG1 3.28Å; K975-I979 WeakPolarHBondContact O-CG1 3.42Å; K975-I979 PolarHBondContact O-N 2.76Å; K975-T1024 HydrophobicContact CB-CG2 4.45Å; K975-T1024 HydrophobicContact CD-CG2 3.69Å; K975-T1024 HydrophobicContact CG-CG2 4.01Å
976	F	88.6	Confident	85.2	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.4	-53	173.6	174.2	-89.5	0	0	0	111.6	L972 Q973 K974 D978 I979 H980 L1021 A1025 I1028 I1039 E1042	L972-F976 PolarHBondContact O-N 3.33Å; Q973-F976 PolarHBondContact O-N 3.14Å; K974-F976 VanDerWaalsContact C-N 3.26Å; K974-F976 PolarHBondContact O-N 3.35Å; F976-D978 VanDerWaalsContact C-N 3.32Å; F976-D978 PolarHBondContact O-N 3.44Å; F976-I979 PolarHBondContact O-N 3.49Å; F976-I979 VanDerWaalsContact O-N 3.16Å; F976-H980 HydrophobicContact CE1-CB 4.09Å; F976-H980 HydrophobicContact CZ-CB 4.38Å; F976-H980 WeakPolarHBondContact O-CB 3.37Å; F976-H980 PolarHBondContact O-N 2.86Å; F976-L1021 HydrophobicContact CD2-CD1 3.6Å; F976-L1021 HydrophobicContact CD2-CG 4.4Å; F976-L1021 HydrophobicContact CE2-CD1 3.31Å; F976-L1021 HydrophobicContact CE2-CG 3.82Å; F976-L1021 HydrophobicContact CG-CD1 4.35Å; F976-L1021 HydrophobicContact CZ-CD1 3.86Å; F976-L1021 HydrophobicContact CZ-CG 4.48Å; F976-A1025 HydrophobicContact CD2-CB 4.09Å; F976-A1025 HydrophobicContact CE2-CB 3.94Å; F976-I1028 HydrophobicContact CB-CD1 3.55Å; F976-I1028 HydrophobicContact CG-CD1 4.18Å; F976-I1039 HydrophobicContact CB-CD1 4.46Å; F976-I1039 HydrophobicContact CD1-CD1 3.63Å; F976-I1039 HydrophobicContact CD1-CG1 3.73Å; F976-I1039 HydrophobicContact CD1-CG2 4.35Å; F976-I1039 HydrophobicContact CD2-CG2 3.99Å; F976-I1039 HydrophobicContact CE1-CB 4.24Å; F976-I1039 HydrophobicContact CE1-CD1 4.07Å; F976-I1039 HydrophobicContact CE1-CG1 3.6Å; F976-I1039 HydrophobicContact CE1-CG2 4.16Å; F976-I1039 HydrophobicContact CE2-CG2 3.77Å; F976-I1039 HydrophobicContact CG-CD1 4.01Å; F976-I1039 HydrophobicContact CG-CG1 4.38Å; F976-I1039 HydrophobicContact CG-CG2 4.28Å; F976-I1039 HydrophobicContact CZ-CB 4.26Å; F976-I1039 HydrophobicContact CZ-CG1 4.13Å; F976-I1039 HydrophobicContact CZ-CG2 3.86Å; F976-E1042 HydrophobicContact CZ-CB 4.36Å
977	F	86.6	Confident	85.9	Confident	98 Å²	98	60.3 Å²	60.3	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-65	-35.1	-177.7	-72.2	-63.9	0	0	0	112.9	Q973 K974 I979 H980 A981 I1039 E1042	Q973-F977 VanDerWaalsContact O-CD2 3.26Å; Q973-F977 WeakPolarHBondContact O-CD2 3.16Å; Q973-F977 PolarHBondContact O-N 2.85Å; Q973-F977 VanDerWaalsContact O-N 3.12Å; K974-F977 PolarHBondContact O-N 3.13Å; F977-I979 PolarHBondContact O-N 2.66Å; F977-H980 PolarHBondContact O-N 3.38Å; F977-A981 WeakPolarHBondContact O-CB 3.28Å; F977-A981 PolarHBondContact O-N 3.24Å; F977-I1039 HydrophobicContact CE2-CD1 4.3Å; F977-I1039 HydrophobicContact CZ-CD1 4.21Å; F977-I1039 HydrophobicContact CZ-CG1 4.27Å; F977-E1042 WeakPolarHBondContact CE1-OE2 3.39Å
978	D	87.8	Confident	86.2	Confident	90 Å²	90	58.7 Å²	58.7	48%	0.481	31%	0.306	S	S	.	.	H	α-helix	trans	-56.3	-49	172	-69.8	-24.3	0	0	0	110.8	K974 F976 D982	K974-D978 VanDerWaalsContact O-CG 3.27Å; K974-D978 PolarHBondContact O-N 2.81Å; F976-D978 VanDerWaalsContact C-N 3.32Å; F976-D978 PolarHBondContact O-N 3.44Å; D978-D982 PolarHBondContact O-N 2.91Å
979	I	88.1	Confident	86.5	Confident	24 Å²	24	60 Å²	60	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-71.4	-37.1	179.4	-60	165	0	0	0	111.8	K975 F976 F977 D982 V983 S1020 L1021 T1024	K975-I979 HydrophobicContact CG-CD1 4.22Å; K975-I979 WeakPolarHBondContact O-CD1 3.39Å; K975-I979 VanDerWaalsContact O-CG1 3.28Å; K975-I979 WeakPolarHBondContact O-CG1 3.42Å; K975-I979 PolarHBondContact O-N 2.76Å; F976-I979 PolarHBondContact O-N 3.49Å; F976-I979 VanDerWaalsContact O-N 3.16Å; F977-I979 PolarHBondContact O-N 2.66Å; I979-D982 WeakPolarHBondContact O-CB 3.32Å; I979-D982 PolarHBondContact O-N 2.66Å; I979-V983 HydrophobicContact CG2-CG2 4.32Å; I979-V983 WeakPolarHBondContact O-CG2 3.49Å; I979-V983 PolarHBondContact O-N 3.1Å; I979-S1020 WeakPolarHBondContact CD1-OG 3.42Å; I979-L1021 HydrophobicContact CB-CD1 4.09Å; I979-L1021 HydrophobicContact CG2-CB 3.86Å; I979-L1021 HydrophobicContact CG2-CD1 3.96Å; I979-L1021 HydrophobicContact CG2-CG 4.5Å; I979-T1024 HydrophobicContact CD1-CG2 3.82Å
980	H	90.4	Very high	86.7	Confident	37 Å²	37	60 Å²	60	17%	0.171	31%	0.314	C	S	.	.	H	α-helix	trans	-62.4	-46.8	179.4	-176.7	-100.4	0	0	0	111	F976 F977 V983 A984 L1021 E1042	F976-H980 HydrophobicContact CE1-CB 4.09Å; F976-H980 HydrophobicContact CZ-CB 4.38Å; F976-H980 WeakPolarHBondContact O-CB 3.37Å; F976-H980 PolarHBondContact O-N 2.86Å; F977-H980 PolarHBondContact O-N 3.38Å; H980-V983 PolarHBondContact O-N 2.9Å; H980-A984 VanDerWaalsContact O-CB 3.24Å; H980-A984 WeakPolarHBondContact O-CB 3.47Å; H980-A984 PolarHBondContact O-N 3.5Å; H980-L1021 HydrophobicContact CB-CD1 3.89Å; H980-E1042 IonicContact CE1-OE2 3.87Å
981	A	88.4	Confident	87	Confident	60 Å²	60	59.5 Å²	59.5	50%	0.496	31%	0.306	S	S	.	.	H	α-helix	trans	-61.7	-43.2	176.1	0	0	0	0	0	111.9	F977 A984 C985	F977-A981 WeakPolarHBondContact O-CB 3.28Å; F977-A981 PolarHBondContact O-N 3.24Å; A981-A984 PolarHBondContact O-N 3.08Å; A981-C985 WeakPolarHBondContact O-CB 3.36Å; A981-C985 PolarHBondContact O-N 3.22Å
982	D	88.1	Confident	87.1	Confident	83 Å²	83	55 Å²	55	44%	0.444	29%	0.291	S	S	.	.	H	α-helix	trans	-54.7	-60	174.4	-117.6	44.6	0	0	0	111.1	D978 I979 A984 C985 E986 K1017	D978-D982 PolarHBondContact O-N 2.91Å; I979-D982 WeakPolarHBondContact O-CB 3.32Å; I979-D982 PolarHBondContact O-N 2.66Å; D982-A984 VanDerWaalsContact C-N 3.33Å; D982-A984 PolarHBondContact O-N 3.27Å; D982-C985 WeakPolarHBondContact O-CB 3.45Å; D982-C985 PolarHBondContact O-N 3.42Å; D982-C985 VanDerWaalsContact O-N 3.17Å; D982-E986 VanDerWaalsContact O-CG 3.28Å; D982-E986 WeakPolarHBondContact O-CG 3.31Å; D982-E986 PolarHBondContact O-N 3.26Å; D982-K1017 IonicContact OD2-NZ 3.99Å; D982-K1017 PolarHBondContact OD2-NZ 2.92Å
983	V	88.6	Confident	87.1	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-63.6	-37.9	-176.9	175.5	0	0	0	0	111.7	I979 H980 C985 E986 L987 K1017 V1018 L1046	I979-V983 HydrophobicContact CG2-CG2 4.32Å; I979-V983 WeakPolarHBondContact O-CG2 3.49Å; I979-V983 PolarHBondContact O-N 3.1Å; H980-V983 PolarHBondContact O-N 2.9Å; V983-C985 VanDerWaalsContact C-N 3.3Å; V983-C985 PolarHBondContact O-N 2.9Å; V983-E986 PolarHBondContact O-N 3.43Å; V983-L987 HydrophobicContact CG1-CD1 3.97Å; V983-L987 HydrophobicContact CG1-CG 4.29Å; V983-L987 VanDerWaalsContact O-CG 3.3Å; V983-L987 WeakPolarHBondContact O-CG 3.16Å; V983-L987 PolarHBondContact O-N 2.92Å; V983-K1017 HydrophobicContact CG2-CB 3.42Å; V983-K1017 VanDerWaalsContact CG2-CB 3.42Å; V983-K1017 HydrophobicContact CG2-CD 4.19Å; V983-K1017 HydrophobicContact CG2-CG 4.45Å; V983-V1018 HydrophobicContact CG1-CG2 4.04Å; V983-L1046 HydrophobicContact CB-CD2 3.59Å; V983-L1046 HydrophobicContact CG1-CD2 3.48Å; V983-L1046 VanDerWaalsContact CG1-CD2 3.48Å; V983-L1046 HydrophobicContact CG1-CG 3.88Å
984	A	87.7	Confident	87.2	Confident	22 Å²	22	54.3 Å²	54.3	18%	0.182	29%	0.289	C	S	.	.	H	α-helix	trans	-64.1	-35.5	177.3	0	0	0	0	0	112.6	H980 A981 D982 N988 L1046	H980-A984 VanDerWaalsContact O-CB 3.24Å; H980-A984 WeakPolarHBondContact O-CB 3.47Å; H980-A984 PolarHBondContact O-N 3.5Å; A981-A984 PolarHBondContact O-N 3.08Å; D982-A984 VanDerWaalsContact C-N 3.33Å; D982-A984 PolarHBondContact O-N 3.27Å; A984-N988 PolarHBondContact O-N 3.49Å; A984-N988 VanDerWaalsContact O-N 3.12Å; A984-N988 PolarHBondContact O-ND2 2.98Å; A984-N988 PolarHBondContact O-OD1 3.42Å; A984-L1046 HydrophobicContact CB-CD1 3.93Å; A984-L1046 HydrophobicContact CB-CD2 4.37Å
985	C	89	Confident	87	Confident	68 Å²	68	52.3 Å²	52.3	46%	0.459	29%	0.293	S	S	.	.	H	α-helix	trans	-65.3	-49.3	175	-164.4	0	0	0	0	111.5	A981 D982 V983 L987 N988 L989	A981-C985 WeakPolarHBondContact O-CB 3.36Å; A981-C985 PolarHBondContact O-N 3.22Å; D982-C985 WeakPolarHBondContact O-CB 3.45Å; D982-C985 PolarHBondContact O-N 3.42Å; D982-C985 VanDerWaalsContact O-N 3.17Å; V983-C985 VanDerWaalsContact C-N 3.3Å; V983-C985 PolarHBondContact O-N 2.9Å; C985-L987 VanDerWaalsContact C-N 3.31Å; C985-L987 PolarHBondContact O-N 3.01Å; C985-N988 WeakPolarHBondContact O-CB 3.38Å; C985-N988 PolarHBondContact O-N 2.98Å; C985-N988 VanDerWaalsContact O-N 3.13Å; C985-L989 WeakPolarHBondContact O-CG 3.44Å; C985-L989 PolarHBondContact O-N 2.68Å; C985-L989 VanDerWaalsContact O-N 3.09Å
986	E	87.6	Confident	86.8	Confident	38 Å²	38	54.7 Å²	54.7	18%	0.178	31%	0.305	C	S	.	.	H	α-helix	trans	-62.3	-37.6	-179.5	-50.7	-82.5	-139.5	0	0	111.7	D982 V983 L989 T990 Y1010 L1014 K1017	D982-E986 VanDerWaalsContact O-CG 3.28Å; D982-E986 WeakPolarHBondContact O-CG 3.31Å; D982-E986 PolarHBondContact O-N 3.26Å; V983-E986 PolarHBondContact O-N 3.43Å; E986-L989 PolarHBondContact O-N 2.91Å; E986-T990 WeakPolarHBondContact O-CG2 3.22Å; E986-T990 PolarHBondContact O-N 2.93Å; E986-T990 PolarHBondContact O-OG1 2.83Å; E986-Y1010 PolarHBondContact OE2-OH 3.09Å; E986-L1014 HydrophobicContact CB-CD1 3.77Å; E986-L1014 HydrophobicContact CB-CD2 3.63Å; E986-L1014 HydrophobicContact CB-CG 4.37Å; E986-L1014 HydrophobicContact CG-CD2 3.75Å; E986-K1017 IonicContact OE1-NZ 2.65Å; E986-K1017 PolarHBondContact OE1-NZ 3.3Å
987	L	88.2	Confident	86.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-68.8	-36	175.4	-66.2	176.6	0	0	0	112.5	V983 C985 L989 T990 E991 L1011 L1014 L1046 R1049 W1050 L1053	V983-L987 HydrophobicContact CG1-CD1 3.97Å; V983-L987 HydrophobicContact CG1-CG 4.29Å; V983-L987 VanDerWaalsContact O-CG 3.3Å; V983-L987 WeakPolarHBondContact O-CG 3.16Å; V983-L987 PolarHBondContact O-N 2.92Å; C985-L987 VanDerWaalsContact C-N 3.31Å; C985-L987 PolarHBondContact O-N 3.01Å; L987-L989 VanDerWaalsContact C-N 3.34Å; L987-T990 WeakPolarHBondContact CA-OG1 3.36Å; L987-T990 PolarHBondContact O-OG1 2.71Å; L987-E991 WeakPolarHBondContact O-CB 3.35Å; L987-E991 PolarHBondContact O-N 2.62Å; L987-L1011 HydrophobicContact CD2-CD2 4.19Å; L987-L1014 HydrophobicContact CD2-CD1 4.07Å; L987-L1046 HydrophobicContact CD1-CD1 3.86Å; L987-L1046 HydrophobicContact CD1-CG 3.97Å; L987-R1049 HydrophobicContact CD1-CB 4.31Å; L987-R1049 HydrophobicContact CD1-CG 4.23Å; L987-W1050 HydrophobicContact CD1-CB 4.09Å; L987-W1050 HydrophobicContact CD2-CB 3.87Å; L987-W1050 HydrophobicContact CD2-CG 4.31Å; L987-L1053 HydrophobicContact CB-CD1 4.44Å; L987-L1053 HydrophobicContact CD2-CD1 4.02Å
988	N	86.9	Confident	85.8	Confident	89 Å²	89	52.6 Å²	52.6	48%	0.476	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-39.2	173.7	-65.9	-21.6	0	0	0	112.1	A984 C985 S992 R1049	A984-N988 PolarHBondContact O-N 3.49Å; A984-N988 VanDerWaalsContact O-N 3.12Å; A984-N988 PolarHBondContact O-ND2 2.98Å; A984-N988 PolarHBondContact O-OD1 3.42Å; C985-N988 WeakPolarHBondContact O-CB 3.38Å; C985-N988 PolarHBondContact O-N 2.98Å; C985-N988 VanDerWaalsContact O-N 3.13Å; N988-S992 WeakPolarHBondContact O-CB 3.25Å; N988-S992 PolarHBondContact O-N 2.83Å; N988-R1049 VanDerWaalsContact OD1-CZ 3.27Å; N988-R1049 PolarHBondContact OD1-NH1 2.82Å; N988-R1049 PolarHBondContact OD1-NH2 2.85Å
989	L	86.9	Confident	85	Confident	90 Å²	90	53.5 Å²	53.5	47%	0.471	32%	0.315	S	S	.	.	H	α-helix	trans	-69.8	-51.1	179.3	-67.5	171.3	0	0	0	111.2	C985 E986 L987 E991 S992 D993	C985-L989 WeakPolarHBondContact O-CG 3.44Å; C985-L989 PolarHBondContact O-N 2.68Å; C985-L989 VanDerWaalsContact O-N 3.09Å; E986-L989 PolarHBondContact O-N 2.91Å; L987-L989 VanDerWaalsContact C-N 3.34Å; L989-E991 PolarHBondContact O-N 3.31Å; L989-S992 VanDerWaalsContact O-CB 3.32Å; L989-S992 WeakPolarHBondContact O-CB 3.28Å; L989-S992 PolarHBondContact O-N 2.69Å; L989-S992 VanDerWaalsContact O-N 3.15Å; L989-D993 PolarHBondContact O-N 3.24Å
990	T	85.2	Confident	84.7	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-59.7	-42.3	177.8	47.3	0	0	0	0	112.8	E986 L987 S992 D993 I994 Y1010 L1011	E986-T990 WeakPolarHBondContact O-CG2 3.22Å; E986-T990 PolarHBondContact O-N 2.93Å; E986-T990 PolarHBondContact O-OG1 2.83Å; L987-T990 WeakPolarHBondContact CA-OG1 3.36Å; L987-T990 PolarHBondContact O-OG1 2.71Å; T990-S992 VanDerWaalsContact C-N 3.31Å; T990-S992 PolarHBondContact O-N 3.44Å; T990-D993 PolarHBondContact O-N 2.97Å; T990-I994 WeakPolarHBondContact O-CB 3.03Å; T990-I994 VanDerWaalsContact O-CD1 3.3Å; T990-I994 WeakPolarHBondContact O-CD1 3.23Å; T990-I994 WeakPolarHBondContact O-CG1 3.37Å; T990-I994 PolarHBondContact O-N 3.21Å; T990-Y1010 HydrophobicContact CG2-CD1 3.27Å; T990-Y1010 HydrophobicContact CG2-CE1 3.61Å; T990-Y1010 HydrophobicContact CG2-CG 4.25Å; T990-L1011 HydrophobicContact CG2-CD2 4.05Å; T990-L1011 HydrophobicContact CG2-CG 4.42Å
991	E	85.7	Confident	84.3	Confident	80 Å²	80	57.7 Å²	57.7	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-64	-35.4	177.1	-171.5	167.1	176.1	0	0	112.3	L987 L989 S995 R1049 L1053	L987-E991 WeakPolarHBondContact O-CB 3.35Å; L987-E991 PolarHBondContact O-N 2.62Å; L989-E991 PolarHBondContact O-N 3.31Å; E991-S995 WeakPolarHBondContact O-CB 3.18Å; E991-S995 PolarHBondContact O-N 2.67Å; E991-S995 PolarHBondContact O-OG 3.11Å; E991-R1049 IonicContact OE2-CZ 3.85Å; E991-R1049 VanDerWaalsContact OE2-CZ 3.27Å; E991-R1049 IonicContact OE2-NE 2.65Å; E991-R1049 PolarHBondContact OE2-NE 3.41Å; E991-R1049 IonicContact OE2-NH2 3.31Å; E991-R1049 PolarHBondContact OE2-NH2 3.47Å; E991-L1053 HydrophobicContact CB-CD1 4.23Å; E991-L1053 HydrophobicContact CB-CD2 4.04Å; E991-L1053 HydrophobicContact CG-CD2 3.95Å
992	S	85.6	Confident	84.1	Confident	53 Å²	53	61 Å²	61	37%	0.371	35%	0.345	S	S	.	.	H	α-helix	trans	-65.4	-44.6	170.6	154.2	0	0	0	0	112.5	N988 L989 T990 S995 Q996	N988-S992 WeakPolarHBondContact O-CB 3.25Å; N988-S992 PolarHBondContact O-N 2.83Å; L989-S992 VanDerWaalsContact O-CB 3.32Å; L989-S992 WeakPolarHBondContact O-CB 3.28Å; L989-S992 PolarHBondContact O-N 2.69Å; L989-S992 VanDerWaalsContact O-N 3.15Å; T990-S992 VanDerWaalsContact C-N 3.31Å; T990-S992 PolarHBondContact O-N 3.44Å; S992-S995 WeakPolarHBondContact O-CB 3.47Å; S992-S995 PolarHBondContact O-N 2.87Å; S992-Q996 WeakPolarHBondContact O-CG 3.47Å; S992-Q996 PolarHBondContact O-N 2.95Å; S992-Q996 PolarHBondContact O-NE2 3.39Å; S992-Q996 VanDerWaalsContact O-NE2 3.09Å; S992-Q996 PolarHBondContact OG-NE2 3.22Å; S992-Q996 VanDerWaalsContact OG-NE2 3.08Å
993	D	85	Confident	84	Confident	59 Å²	59	58.9 Å²	58.9	32%	0.316	34%	0.336	S	S	.	.	H	α-helix	trans	-74.6	-39.7	-176.1	-69.5	0.4	0	0	0	112.2	L989 T990 S995 Q996 C997 Q1007	L989-D993 PolarHBondContact O-N 3.24Å; T990-D993 PolarHBondContact O-N 2.97Å; D993-S995 PolarHBondContact O-N 3.37Å; D993-Q996 CarbonylContact O-C 3.4Å; D993-Q996 WeakPolarHBondContact O-CA 3.48Å; D993-Q996 WeakPolarHBondContact O-CB 3.39Å; D993-Q996 PolarHBondContact O-N 2.96Å; D993-C997 PolarHBondContact O-N 2.98Å; D993-C997 PolarHBondContact O-SG 3.35Å; D993-Q1007 VanDerWaalsContact CB-CD 3.46Å; D993-Q1007 HydrophobicContact CB-CG 4.18Å; D993-Q1007 PolarHBondContact OD2-NE2 3.08Å
994	I	84.3	Confident	83.9	Confident	11 Å²	11	58.8 Å²	58.8	6%	0.056	34%	0.336	C	S	.	.	H	α-helix	trans	-57.5	-41.7	171.8	-69.4	159.9	0	0	0	110	T990 Q996 C997 L1004 Q1007 L1011 L1053 T1057	T990-I994 WeakPolarHBondContact O-CB 3.03Å; T990-I994 VanDerWaalsContact O-CD1 3.3Å; T990-I994 WeakPolarHBondContact O-CD1 3.23Å; T990-I994 WeakPolarHBondContact O-CG1 3.37Å; T990-I994 PolarHBondContact O-N 3.21Å; I994-Q996 PolarHBondContact O-N 2.72Å; I994-C997 PolarHBondContact O-N 2.85Å; I994-L1004 HydrophobicContact CG2-CD2 4.43Å; I994-Q1007 HydrophobicContact CD1-CB 4.35Å; I994-Q1007 HydrophobicContact CG1-CB 3.65Å; I994-Q1007 HydrophobicContact CG1-CG 3.99Å; I994-L1011 HydrophobicContact CD1-CD1 3.89Å; I994-L1053 HydrophobicContact CD1-CD2 4.38Å; I994-T1057 HydrophobicContact CD1-CG2 4.35Å; I994-T1057 VanDerWaalsContact CD1-OG1 3.3Å; I994-T1057 WeakPolarHBondContact CD1-OG1 3.09Å; I994-T1057 HydrophobicContact CG1-CG2 4.25Å
995	S	82.4	Confident	83.8	Confident	100 Å²	100	62.6 Å²	62.6	70%	0.699	35%	0.348	S	S	*	.	H	α-helix	trans	-65.3	-20.1	174.5	-58.5	0	0	0	0	113.7	E991 S992 D993	E991-S995 WeakPolarHBondContact O-CB 3.18Å; E991-S995 PolarHBondContact O-N 2.67Å; E991-S995 PolarHBondContact O-OG 3.11Å; S992-S995 WeakPolarHBondContact O-CB 3.47Å; S992-S995 PolarHBondContact O-N 2.87Å; D993-S995 PolarHBondContact O-N 3.37Å
996	Q	82.5	Confident	83.8	Confident	143 Å²	143	62.2 Å²	62.2	67%	0.668	35%	0.35	S	S	*	.	H	α-helix	trans	-93.6	-22.8	175.7	-72.6	169.9	76.6	0	0	113.3	S992 D993 I994 G998	S992-Q996 WeakPolarHBondContact O-CG 3.47Å; S992-Q996 PolarHBondContact O-N 2.95Å; S992-Q996 PolarHBondContact O-NE2 3.39Å; S992-Q996 VanDerWaalsContact O-NE2 3.09Å; S992-Q996 PolarHBondContact OG-NE2 3.22Å; S992-Q996 VanDerWaalsContact OG-NE2 3.08Å; D993-Q996 CarbonylContact O-C 3.4Å; D993-Q996 WeakPolarHBondContact O-CA 3.48Å; D993-Q996 WeakPolarHBondContact O-CB 3.39Å; D993-Q996 PolarHBondContact O-N 2.96Å; I994-Q996 PolarHBondContact O-N 2.72Å; Q996-G998 VanDerWaalsContact C-N 3.3Å; Q996-G998 PolarHBondContact O-N 3.42Å
997	C	78.1	Confident	83.8	Confident	10 Å²	10	61.6 Å²	61.6	7%	0.068	35%	0.347	C	S	.	.	H	α-helix	trans	-63.8	-31.3	178.4	-68	0	0	0	0	113.6	D993 I994 N999 D1000 C1003 L1004	D993-C997 PolarHBondContact O-N 2.98Å; D993-C997 PolarHBondContact O-SG 3.35Å; I994-C997 PolarHBondContact O-N 2.85Å; C997-N999 PolarHBondContact O-N 2.86Å; C997-D1000 WeakPolarHBondContact O-CB 3.5Å; C997-D1000 PolarHBondContact O-N 3.42Å; C997-C1003 WeakPolarHBondContact CA-SG 3.27Å; C997-C1003 HydrophobicContact CB-CB 3.56Å; C997-C1003 WeakPolarHBondContact CB-SG 3.32Å; C997-C1003 WeakPolarHBondContact SG-CB 3.49Å; C997-C1003 CovalentContact SG-SG 2.04Å; C997-C1003 PolarHBondContact SG-SG 3.45Å; C997-L1004 HydrophobicContact CB-CD2 3.84Å; C997-L1004 HydrophobicContact CB-CG 3.98Å
998	G	74.8	Confident	83.9	Confident	44 Å²	44	62.1 Å²	62.1	45%	0.454	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	-125.7	-171.8	0	0	0	0	0	111	Q996	Q996-G998 VanDerWaalsContact C-N 3.3Å; Q996-G998 PolarHBondContact O-N 3.42Å
999	N	72.7	Confident	83.9	Confident	109 Å²	109	61.7 Å²	61.7	58%	0.583	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	8.3	175.7	-68.9	7.6	0	0	0	113.6	C997 H1001 A1064 T1067	C997-N999 PolarHBondContact O-N 2.86Å; N999-H1001 PolarHBondContact O-N 3.27Å; N999-A1064 WeakPolarHBondContact O-CB 3.41Å; N999-T1067 PolarHBondContact ND2-OG1 3.24Å
1000	D	80.4	Confident	84.1	Confident	83 Å²	83	61.8 Å²	61.8	44%	0.444	34%	0.342	S	S	.	.			trans	-66.7	101.8	177.3	177.6	4.2	0	0	0	110.7	C997 L1002 C1003 L1004	C997-D1000 WeakPolarHBondContact O-CB 3.5Å; C997-D1000 PolarHBondContact O-N 3.42Å; D1000-L1002 PolarHBondContact O-N 3.25Å; D1000-L1002 WeakPolarHBondContact OD1-CA 3.5Å; D1000-L1002 WeakPolarHBondContact OD1-CB 3.4Å; D1000-L1002 PolarHBondContact OD1-N 3.2Å; D1000-C1003 HydrophobicContact CB-CB 3.83Å; D1000-C1003 PolarHBondContact O-N 3.47Å; D1000-C1003 VanDerWaalsContact O-N 3.12Å; D1000-C1003 PolarHBondContact OD1-N 3.27Å; D1000-C1003 VanDerWaalsContact OD2-CB 3.31Å; D1000-C1003 WeakPolarHBondContact OD2-CB 3.06Å; D1000-L1004 WeakPolarHBondContact O-CB 3.49Å; D1000-L1004 WeakPolarHBondContact O-CG 3.32Å; D1000-L1004 PolarHBondContact O-N 2.95Å
1001	H	82.9	Confident	84.3	Confident	67 Å²	67	61.7 Å²	61.7	31%	0.31	34%	0.341	S	S	.	.	H	α-helix	trans	-56.2	-30.8	176.7	167.7	-93.6	0	0	0	113.4	N999 K1005 L1061 A1064	N999-H1001 PolarHBondContact O-N 3.27Å; H1001-K1005 WeakPolarHBondContact O-CB 3.32Å; H1001-K1005 PolarHBondContact O-N 3.15Å; H1001-K1005 VanDerWaalsContact O-N 3.09Å; H1001-L1061 HydrophobicContact CB-CD1 4.49Å; H1001-L1061 WeakPolarHBondContact CD2-CD1 3.38Å; H1001-L1061 WeakPolarHBondContact O-CD1 3.39Å; H1001-A1064 HydrophobicContact CB-CB 4.32Å
1002	L	83.5	Confident	84.5	Confident	130 Å²	130	62.5 Å²	62.5	68%	0.681	34%	0.344	S	S	*	.	H	α-helix	trans	-72.8	-43.6	175.3	-65.4	173.6	0	0	0	111.2	D1000 A1006	D1000-L1002 PolarHBondContact O-N 3.25Å; D1000-L1002 WeakPolarHBondContact OD1-CA 3.5Å; D1000-L1002 WeakPolarHBondContact OD1-CB 3.4Å; D1000-L1002 PolarHBondContact OD1-N 3.2Å; L1002-A1006 WeakPolarHBondContact O-CB 3.43Å; L1002-A1006 PolarHBondContact O-N 2.96Å
1003	C	86.3	Confident	84.7	Confident	37 Å²	37	63.5 Å²	63.5	25%	0.25	35%	0.351	C	S	.	.	H	α-helix	trans	-64.4	-50.9	176	-173.3	0	0	0	0	111.7	C997 D1000 K1005 A1006 Q1007	C997-C1003 WeakPolarHBondContact CA-SG 3.27Å; C997-C1003 HydrophobicContact CB-CB 3.56Å; C997-C1003 WeakPolarHBondContact CB-SG 3.32Å; C997-C1003 WeakPolarHBondContact SG-CB 3.49Å; C997-C1003 CovalentContact SG-SG 2.04Å; C997-C1003 PolarHBondContact SG-SG 3.45Å; D1000-C1003 HydrophobicContact CB-CB 3.83Å; D1000-C1003 PolarHBondContact O-N 3.47Å; D1000-C1003 VanDerWaalsContact O-N 3.12Å; D1000-C1003 PolarHBondContact OD1-N 3.27Å; D1000-C1003 VanDerWaalsContact OD2-CB 3.31Å; D1000-C1003 WeakPolarHBondContact OD2-CB 3.06Å; C1003-K1005 VanDerWaalsContact C-N 3.27Å; C1003-K1005 PolarHBondContact O-N 2.98Å; C1003-A1006 PolarHBondContact O-N 2.99Å; C1003-A1006 VanDerWaalsContact O-N 3.14Å; C1003-Q1007 WeakPolarHBondContact O-CG 3.46Å; C1003-Q1007 PolarHBondContact O-N 2.98Å
1004	L	85.6	Confident	84.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-57.5	-40.3	177	-71.1	172.6	0	0	0	111.8	I994 C997 D1000 Q1007 L1008 T1057 Q1060 L1061 A1064	I994-L1004 HydrophobicContact CG2-CD2 4.43Å; C997-L1004 HydrophobicContact CB-CD2 3.84Å; C997-L1004 HydrophobicContact CB-CG 3.98Å; D1000-L1004 WeakPolarHBondContact O-CB 3.49Å; D1000-L1004 WeakPolarHBondContact O-CG 3.32Å; D1000-L1004 PolarHBondContact O-N 2.95Å; L1004-Q1007 PolarHBondContact O-N 3.3Å; L1004-L1008 VanDerWaalsContact O-CB 3.31Å; L1004-L1008 WeakPolarHBondContact O-CB 3.43Å; L1004-L1008 PolarHBondContact O-N 3.41Å; L1004-T1057 HydrophobicContact CD2-CG2 4.26Å; L1004-T1057 WeakPolarHBondContact O-CG2 3.29Å; L1004-Q1060 HydrophobicContact CD1-CB 4.08Å; L1004-Q1060 HydrophobicContact CD2-CB 4.09Å; L1004-L1061 HydrophobicContact CB-CD1 3.82Å; L1004-A1064 HydrophobicContact CD1-CB 3.83Å
1005	K	86.9	Confident	85.2	Confident	102 Å²	102	66.5 Å²	66.5	44%	0.443	36%	0.357	S	S	.	.	H	α-helix	trans	-66.8	-42.2	176.7	-175.3	171.1	-178	173.1	0	112.5	H1001 C1003 L1008 D1009 L1061	H1001-K1005 WeakPolarHBondContact O-CB 3.32Å; H1001-K1005 PolarHBondContact O-N 3.15Å; H1001-K1005 VanDerWaalsContact O-N 3.09Å; C1003-K1005 VanDerWaalsContact C-N 3.27Å; C1003-K1005 PolarHBondContact O-N 2.98Å; K1005-L1008 PolarHBondContact O-N 2.99Å; K1005-D1009 PolarHBondContact O-N 3.4Å; K1005-L1061 HydrophobicContact CB-CD1 3.99Å; K1005-L1061 HydrophobicContact CB-CD2 4.5Å
1006	A	87.8	Confident	85.6	Confident	59 Å²	59	66 Å²	66	49%	0.488	35%	0.352	S	S	.	.	H	α-helix	trans	-61.8	-43	175.5	0	0	0	0	0	111.7	L1002 C1003 D1009 Y1010	L1002-A1006 WeakPolarHBondContact O-CB 3.43Å; L1002-A1006 PolarHBondContact O-N 2.96Å; C1003-A1006 PolarHBondContact O-N 2.99Å; C1003-A1006 VanDerWaalsContact O-N 3.14Å; A1006-D1009 PolarHBondContact O-N 3.28Å; A1006-Y1010 PolarHBondContact O-N 2.72Å
1007	Q	89	Confident	86	Confident	25 Å²	25	62.1 Å²	62.1	12%	0.117	33%	0.333	C	S	.	.	H	α-helix	trans	-67.5	-39.4	176.3	-68.1	-60.5	-25.7	0	0	112.6	D993 I994 C1003 L1004 D1009 Y1010 L1011	D993-Q1007 VanDerWaalsContact CB-CD 3.46Å; D993-Q1007 HydrophobicContact CB-CG 4.18Å; D993-Q1007 PolarHBondContact OD2-NE2 3.08Å; I994-Q1007 HydrophobicContact CD1-CB 4.35Å; I994-Q1007 HydrophobicContact CG1-CB 3.65Å; I994-Q1007 HydrophobicContact CG1-CG 3.99Å; C1003-Q1007 WeakPolarHBondContact O-CG 3.46Å; C1003-Q1007 PolarHBondContact O-N 2.98Å; L1004-Q1007 PolarHBondContact O-N 3.3Å; Q1007-D1009 VanDerWaalsContact C-N 3.33Å; Q1007-D1009 PolarHBondContact O-N 3.44Å; Q1007-Y1010 WeakPolarHBondContact O-CB 3.41Å; Q1007-Y1010 PolarHBondContact O-N 3.35Å; Q1007-L1011 PolarHBondContact O-N 3.47Å
1008	L	89.2	Confident	86.5	Confident	11 Å²	11	61.7 Å²	61.7	6%	0.058	33%	0.33	C	S	.	.	H	α-helix	trans	-63.5	-36.6	174.5	178.3	60.3	0	0	0	112.3	L1004 K1005 K1012 T1057 K1058 L1061	L1004-L1008 VanDerWaalsContact O-CB 3.31Å; L1004-L1008 WeakPolarHBondContact O-CB 3.43Å; L1004-L1008 PolarHBondContact O-N 3.41Å; K1005-L1008 PolarHBondContact O-N 2.99Å; L1008-K1012 WeakPolarHBondContact O-CE 3.37Å; L1008-K1012 VanDerWaalsContact O-CG 3.32Å; L1008-K1012 WeakPolarHBondContact O-CG 3.41Å; L1008-K1012 PolarHBondContact O-N 3.49Å; L1008-T1057 HydrophobicContact CB-CG2 3.92Å; L1008-K1058 HydrophobicContact CD1-CG 3.96Å; L1008-K1058 HydrophobicContact CD2-CG 4.14Å; L1008-L1061 HydrophobicContact CD2-CD2 3.79Å
1009	D	87.4	Confident	87.2	Confident	80 Å²	80	63.6 Å²	63.6	43%	0.428	33%	0.329	S	S	.	.	H	α-helix	trans	-73.8	-32.6	173.8	-75.3	-23.9	0	0	0	112.4	K1005 A1006 Q1007 K1012 S1013	K1005-D1009 PolarHBondContact O-N 3.4Å; A1006-D1009 PolarHBondContact O-N 3.28Å; Q1007-D1009 VanDerWaalsContact C-N 3.33Å; Q1007-D1009 PolarHBondContact O-N 3.44Å; D1009-K1012 PolarHBondContact O-N 2.67Å; D1009-K1012 IonicContact OD1-NZ 2.82Å; D1009-K1012 PolarHBondContact OD1-NZ 3.06Å; D1009-S1013 PolarHBondContact O-N 2.75Å
1010	Y	90.2	Very high	88	Confident	92 Å²	92	60 Å²	60	36%	0.361	31%	0.313	S	S	.	.	H	α-helix	trans	-64.7	-46.6	170.6	-167.8	-80	0	0	0	111.9	E986 T990 A1006 Q1007 K1012 S1013 L1014	E986-Y1010 PolarHBondContact OE2-OH 3.09Å; T990-Y1010 HydrophobicContact CG2-CD1 3.27Å; T990-Y1010 HydrophobicContact CG2-CE1 3.61Å; T990-Y1010 HydrophobicContact CG2-CG 4.25Å; A1006-Y1010 PolarHBondContact O-N 2.72Å; Q1007-Y1010 WeakPolarHBondContact O-CB 3.41Å; Q1007-Y1010 PolarHBondContact O-N 3.35Å; Y1010-K1012 VanDerWaalsContact C-N 3.27Å; Y1010-K1012 PolarHBondContact O-N 3.32Å; Y1010-S1013 WeakPolarHBondContact O-CA 3.48Å; Y1010-S1013 VanDerWaalsContact O-CB 3.28Å; Y1010-S1013 WeakPolarHBondContact O-CB 3.17Å; Y1010-S1013 PolarHBondContact O-N 3.08Å; Y1010-S1013 PolarHBondContact O-OG 2.85Å; Y1010-L1014 HydrophobicContact CD1-CD1 4.44Å; Y1010-L1014 HydrophobicContact CD1-CG 4.39Å; Y1010-L1014 HydrophobicContact CE1-CD1 4.23Å; Y1010-L1014 HydrophobicContact CE1-CD2 3.97Å; Y1010-L1014 HydrophobicContact CE1-CG 4.19Å; Y1010-L1014 PolarHBondContact O-N 3.41Å
1011	L	90	Very high	88.4	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.6	-37.5	175.4	-77.1	176.2	0	0	0	112.3	L987 T990 I994 Q1007 S1013 L1014 W1050 L1053 T1057	L987-L1011 HydrophobicContact CD2-CD2 4.19Å; T990-L1011 HydrophobicContact CG2-CD2 4.05Å; T990-L1011 HydrophobicContact CG2-CG 4.42Å; I994-L1011 HydrophobicContact CD1-CD1 3.89Å; Q1007-L1011 PolarHBondContact O-N 3.47Å; L1011-S1013 VanDerWaalsContact C-N 3.28Å; L1011-S1013 PolarHBondContact O-N 3.31Å; L1011-L1014 HydrophobicContact CD2-CD1 4.35Å; L1011-L1014 PolarHBondContact O-N 3.45Å; L1011-W1050 PolarHBondContact O-NE1 3.5Å; L1011-L1053 HydrophobicContact CD1-CB 4.03Å; L1011-L1053 HydrophobicContact CD2-CB 4.28Å; L1011-T1057 WeakPolarHBondContact CD1-OG1 3.43Å
1012	K	89.4	Confident	88.6	Confident	97 Å²	97	56.7 Å²	56.7	42%	0.422	29%	0.294	S	S	.	.	H	α-helix	trans	-62.5	-35.4	173	-68.6	164.5	-156.8	158.5	0	112.2	L1008 D1009 Y1010 L1014 R1015 L1054	L1008-K1012 WeakPolarHBondContact O-CE 3.37Å; L1008-K1012 VanDerWaalsContact O-CG 3.32Å; L1008-K1012 WeakPolarHBondContact O-CG 3.41Å; L1008-K1012 PolarHBondContact O-N 3.49Å; D1009-K1012 PolarHBondContact O-N 2.67Å; D1009-K1012 IonicContact OD1-NZ 2.82Å; D1009-K1012 PolarHBondContact OD1-NZ 3.06Å; Y1010-K1012 VanDerWaalsContact C-N 3.27Å; Y1010-K1012 PolarHBondContact O-N 3.32Å; K1012-L1014 VanDerWaalsContact C-N 3.26Å; K1012-L1014 PolarHBondContact O-N 2.94Å; K1012-R1015 PolarHBondContact O-N 3.34Å; K1012-L1054 HydrophobicContact CG-CD1 4.39Å
1013	S	90.9	Very high	88.8	Confident	74 Å²	74	55.2 Å²	55.2	52%	0.517	28%	0.283	S	S	.	.	H	α-helix	trans	-66.6	-24.2	-179.1	84.5	0	0	0	0	113.8	D1009 Y1010 L1011 R1015 P1016	D1009-S1013 PolarHBondContact O-N 2.75Å; Y1010-S1013 WeakPolarHBondContact O-CA 3.48Å; Y1010-S1013 VanDerWaalsContact O-CB 3.28Å; Y1010-S1013 WeakPolarHBondContact O-CB 3.17Å; Y1010-S1013 PolarHBondContact O-N 3.08Å; Y1010-S1013 PolarHBondContact O-OG 2.85Å; L1011-S1013 VanDerWaalsContact C-N 3.28Å; L1011-S1013 PolarHBondContact O-N 3.31Å; S1013-R1015 VanDerWaalsContact C-N 3.31Å; S1013-R1015 PolarHBondContact O-N 2.9Å; S1013-P1016 WeakPolarHBondContact O-CD 3.48Å
1014	L	89.5	Confident	88.8	Confident	4 Å²	4	53.4 Å²	53.4	2%	0.021	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-16.5	-179.8	-62.1	179.4	0	0	0	114.2	E986 L987 Y1010 L1011 K1012 P1016 K1017 V1018	E986-L1014 HydrophobicContact CB-CD1 3.77Å; E986-L1014 HydrophobicContact CB-CD2 3.63Å; E986-L1014 HydrophobicContact CB-CG 4.37Å; E986-L1014 HydrophobicContact CG-CD2 3.75Å; L987-L1014 HydrophobicContact CD2-CD1 4.07Å; Y1010-L1014 HydrophobicContact CD1-CD1 4.44Å; Y1010-L1014 HydrophobicContact CD1-CG 4.39Å; Y1010-L1014 HydrophobicContact CE1-CD1 4.23Å; Y1010-L1014 HydrophobicContact CE1-CD2 3.97Å; Y1010-L1014 HydrophobicContact CE1-CG 4.19Å; Y1010-L1014 PolarHBondContact O-N 3.41Å; L1011-L1014 HydrophobicContact CD2-CD1 4.35Å; L1011-L1014 PolarHBondContact O-N 3.45Å; K1012-L1014 VanDerWaalsContact C-N 3.26Å; K1012-L1014 PolarHBondContact O-N 2.94Å; L1014-P1016 VanDerWaalsContact C-CD 3.44Å; L1014-K1017 WeakPolarHBondContact O-CB 3.41Å; L1014-K1017 PolarHBondContact O-N 3.15Å; L1014-V1018 PolarHBondContact O-N 2.83Å
1015	R	90.5	Very high	88.8	Confident	129 Å²	129	53.7 Å²	53.7	49%	0.487	27%	0.273	S	S	.	.	H	α-helix	trans	-47.6	-45.5	-175.6	-178.3	174.8	-66.1	-142.4	-7.5	114.4	K1012 S1013 K1017 V1018 D1019 W1050	K1012-R1015 PolarHBondContact O-N 3.34Å; S1013-R1015 VanDerWaalsContact C-N 3.31Å; S1013-R1015 PolarHBondContact O-N 2.9Å; R1015-K1017 VanDerWaalsContact C-N 3.3Å; R1015-K1017 PolarHBondContact O-N 3.43Å; R1015-V1018 WeakPolarHBondContact O-CB 3.32Å; R1015-V1018 PolarHBondContact O-N 2.87Å; R1015-V1018 VanDerWaalsContact O-N 3.13Å; R1015-D1019 WeakPolarHBondContact CG-OD2 3.44Å; R1015-D1019 PolarHBondContact O-N 2.85Å; R1015-W1050 HydrophobicContact CB-CH2 4.1Å; R1015-W1050 HydrophobicContact CB-CZ2 3.81Å; R1015-W1050 HydrophobicContact CG-CH2 4.01Å; R1015-W1050 HydrophobicContact CG-CZ2 4.26Å
1016	P	90.9	Very high	88.7	Confident	90 Å²	90	53.3 Å²	53.3	58%	0.584	28%	0.28	S	S	*	.	H	α-helix	trans	-65.2	-29	-179.5	-21.1	35	0	0	0	114	S1013 L1014 S1020	S1013-P1016 WeakPolarHBondContact O-CD 3.48Å; L1014-P1016 VanDerWaalsContact C-CD 3.44Å; P1016-S1020 WeakPolarHBondContact O-CB 3.22Å; P1016-S1020 PolarHBondContact O-N 3.23Å
1017	K	89.1	Confident	88.5	Confident	62 Å²	62	54.4 Å²	54.4	27%	0.27	27%	0.273	S	S	.	.	H	α-helix	trans	-69.3	-43.5	172.8	-63.3	-168.8	176.4	-168.4	0	110.3	D982 V983 E986 L1014 R1015 S1020 L1021	D982-K1017 IonicContact OD2-NZ 3.99Å; D982-K1017 PolarHBondContact OD2-NZ 2.92Å; V983-K1017 HydrophobicContact CG2-CB 3.42Å; V983-K1017 VanDerWaalsContact CG2-CB 3.42Å; V983-K1017 HydrophobicContact CG2-CD 4.19Å; V983-K1017 HydrophobicContact CG2-CG 4.45Å; E986-K1017 IonicContact OE1-NZ 2.65Å; E986-K1017 PolarHBondContact OE1-NZ 3.3Å; L1014-K1017 WeakPolarHBondContact O-CB 3.41Å; L1014-K1017 PolarHBondContact O-N 3.15Å; R1015-K1017 VanDerWaalsContact C-N 3.3Å; R1015-K1017 PolarHBondContact O-N 3.43Å; K1017-S1020 PolarHBondContact O-N 2.82Å; K1017-L1021 PolarHBondContact O-N 2.73Å
1018	V	89.2	Confident	88.1	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-44.8	177.2	-179.1	0	0	0	0	111.5	V983 L1014 R1015 S1020 L1021 K1022 C1047 W1050	V983-V1018 HydrophobicContact CG1-CG2 4.04Å; L1014-V1018 PolarHBondContact O-N 2.83Å; R1015-V1018 WeakPolarHBondContact O-CB 3.32Å; R1015-V1018 PolarHBondContact O-N 2.87Å; R1015-V1018 VanDerWaalsContact O-N 3.13Å; V1018-S1020 PolarHBondContact O-N 2.67Å; V1018-L1021 WeakPolarHBondContact O-CB 3.4Å; V1018-L1021 PolarHBondContact O-N 3.27Å; V1018-K1022 PolarHBondContact O-N 2.86Å; V1018-C1047 HydrophobicContact CG1-CB 4.39Å; V1018-C1047 VanDerWaalsContact CG1-SG 3.56Å; V1018-W1050 HydrophobicContact CG1-CE3 4.04Å; V1018-W1050 HydrophobicContact CG1-CZ3 4.44Å; V1018-W1050 HydrophobicContact CG2-CB 4.44Å; V1018-W1050 HydrophobicContact CG2-CD2 4.02Å; V1018-W1050 HydrophobicContact CG2-CE3 4.29Å; V1018-W1050 HydrophobicContact CG2-CG 4.06Å
1019	D	89.5	Confident	87.6	Confident	83 Å²	83	55.4 Å²	55.4	44%	0.444	28%	0.279	S	S	.	.	H	α-helix	trans	-65.3	-38.3	176.2	-68.2	-32	0	0	0	111.7	R1015 L1021 K1022 E1023	R1015-D1019 WeakPolarHBondContact CG-OD2 3.44Å; R1015-D1019 PolarHBondContact O-N 2.85Å; D1019-L1021 VanDerWaalsContact C-N 3.29Å; D1019-L1021 PolarHBondContact O-N 3.2Å; D1019-K1022 PolarHBondContact O-N 2.9Å; D1019-E1023 PolarHBondContact O-N 3.29Å
1020	S	89.4	Confident	86.9	Confident	35 Å²	35	55.4 Å²	55.4	25%	0.245	29%	0.29	C	S	.	.	H	α-helix	trans	-67.7	-25.1	174.1	-173.8	0	0	0	0	113.7	I979 P1016 K1017 V1018 T1024	I979-S1020 WeakPolarHBondContact CD1-OG 3.42Å; P1016-S1020 WeakPolarHBondContact O-CB 3.22Å; P1016-S1020 PolarHBondContact O-N 3.23Å; K1017-S1020 PolarHBondContact O-N 2.82Å; V1018-S1020 PolarHBondContact O-N 2.67Å; S1020-T1024 PolarHBondContact O-N 2.9Å; S1020-T1024 VanDerWaalsContact O-N 3.13Å; S1020-T1024 PolarHBondContact O-OG1 2.83Å; S1020-T1024 VanDerWaalsContact O-OG1 3.13Å
1021	L	89.6	Confident	86.1	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-73.3	-41.5	174.3	-174.9	68.6	0	0	0	111.3	F976 I979 H980 K1017 V1018 D1019 E1023 T1024 A1025 L1046	F976-L1021 HydrophobicContact CD2-CD1 3.6Å; F976-L1021 HydrophobicContact CD2-CG 4.4Å; F976-L1021 HydrophobicContact CE2-CD1 3.31Å; F976-L1021 HydrophobicContact CE2-CG 3.82Å; F976-L1021 HydrophobicContact CG-CD1 4.35Å; F976-L1021 HydrophobicContact CZ-CD1 3.86Å; F976-L1021 HydrophobicContact CZ-CG 4.48Å; I979-L1021 HydrophobicContact CB-CD1 4.09Å; I979-L1021 HydrophobicContact CG2-CB 3.86Å; I979-L1021 HydrophobicContact CG2-CD1 3.96Å; I979-L1021 HydrophobicContact CG2-CG 4.5Å; H980-L1021 HydrophobicContact CB-CD1 3.89Å; K1017-L1021 PolarHBondContact O-N 2.73Å; V1018-L1021 WeakPolarHBondContact O-CB 3.4Å; V1018-L1021 PolarHBondContact O-N 3.27Å; D1019-L1021 VanDerWaalsContact C-N 3.29Å; D1019-L1021 PolarHBondContact O-N 3.2Å; L1021-E1023 VanDerWaalsContact C-N 3.32Å; L1021-T1024 PolarHBondContact O-N 2.75Å; L1021-T1024 PolarHBondContact O-OG1 2.69Å; L1021-T1024 VanDerWaalsContact O-OG1 3.11Å; L1021-A1025 WeakPolarHBondContact O-CB 3.43Å; L1021-A1025 PolarHBondContact O-N 3.39Å; L1021-L1046 HydrophobicContact CD2-CB 4.38Å; L1021-L1046 HydrophobicContact CD2-CD2 3.81Å
1022	K	86.1	Confident	85	Confident	79 Å²	79	57.1 Å²	57.1	34%	0.343	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-43.2	171.6	-65.6	178	-175.6	177.4	0	110.5	V1018 D1019 A1025 V1026 C1047 E1051	V1018-K1022 PolarHBondContact O-N 2.86Å; D1019-K1022 PolarHBondContact O-N 2.9Å; K1022-A1025 PolarHBondContact O-N 2.76Å; K1022-V1026 WeakPolarHBondContact O-CG2 3.15Å; K1022-V1026 PolarHBondContact O-N 3.03Å; K1022-V1026 VanDerWaalsContact O-N 3.13Å; K1022-C1047 WeakPolarHBondContact CE-SG 3.3Å; K1022-E1051 IonicContact NZ-OE1 3.49Å
1023	E	88.3	Confident	83.5	Confident	98 Å²	98	55.4 Å²	55.4	46%	0.458	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-35.7	180	-153.9	-148.7	-170.9	0	0	113.5	D1019 L1021 K1027	D1019-E1023 PolarHBondContact O-N 3.29Å; L1021-E1023 VanDerWaalsContact C-N 3.32Å; E1023-K1027 WeakPolarHBondContact O-CD 3.05Å; E1023-K1027 VanDerWaalsContact O-CG 3.29Å; E1023-K1027 WeakPolarHBondContact O-CG 3.32Å; E1023-K1027 PolarHBondContact O-N 3.27Å; E1023-K1027 WeakPolarHBondContact OE1-CE 3.29Å; E1023-K1027 IonicContact OE1-NZ 3.62Å; E1023-K1027 PolarHBondContact OE1-NZ 3.22Å; E1023-K1027 IonicContact OE2-NZ 2.65Å; E1023-K1027 PolarHBondContact OE2-NZ 3.42Å
1024	T	87.2	Confident	81.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-74.6	-39.7	175.4	46.7	0	0	0	0	112.6	K975 I979 S1020 L1021 V1026 K1027 I1028	K975-T1024 HydrophobicContact CB-CG2 4.45Å; K975-T1024 HydrophobicContact CD-CG2 3.69Å; K975-T1024 HydrophobicContact CG-CG2 4.01Å; I979-T1024 HydrophobicContact CD1-CG2 3.82Å; S1020-T1024 PolarHBondContact O-N 2.9Å; S1020-T1024 VanDerWaalsContact O-N 3.13Å; S1020-T1024 PolarHBondContact O-OG1 2.83Å; S1020-T1024 VanDerWaalsContact O-OG1 3.13Å; L1021-T1024 PolarHBondContact O-N 2.75Å; L1021-T1024 PolarHBondContact O-OG1 2.69Å; L1021-T1024 VanDerWaalsContact O-OG1 3.11Å; T1024-V1026 PolarHBondContact O-N 3.35Å; T1024-K1027 PolarHBondContact O-N 3.33Å; T1024-I1028 WeakPolarHBondContact O-CG1 3.35Å; T1024-I1028 PolarHBondContact O-N 3.3Å; T1024-I1028 VanDerWaalsContact O-N 3.14Å
1025	A	84.8	Confident	80	Confident	5 Å²	5	62.3 Å²	62.3	4%	0.041	35%	0.347	C	S	.	.	H	α-helix	trans	-55.5	-52.5	173.9	0	0	0	0	0	111.4	F976 L1021 K1022 K1027 I1028 I1029 I1039	F976-A1025 HydrophobicContact CD2-CB 4.09Å; F976-A1025 HydrophobicContact CE2-CB 3.94Å; L1021-A1025 WeakPolarHBondContact O-CB 3.43Å; L1021-A1025 PolarHBondContact O-N 3.39Å; K1022-A1025 PolarHBondContact O-N 2.76Å; A1025-K1027 VanDerWaalsContact C-N 3.27Å; A1025-K1027 PolarHBondContact O-N 3.26Å; A1025-I1028 PolarHBondContact O-N 2.85Å; A1025-I1029 WeakPolarHBondContact O-CD1 3.5Å; A1025-I1029 WeakPolarHBondContact O-CG1 3.49Å; A1025-I1029 PolarHBondContact O-N 3.31Å; A1025-I1039 HydrophobicContact CB-CG2 3.73Å
1026	V	84.6	Confident	78.5	Confident	95 Å²	95	57.6 Å²	57.6	58%	0.576	33%	0.331	S	S	*	.	H	α-helix	trans	-58	-37.2	178.5	171.2	0	0	0	0	112.2	K1022 T1024 I1028 A1030	K1022-V1026 WeakPolarHBondContact O-CG2 3.15Å; K1022-V1026 PolarHBondContact O-N 3.03Å; K1022-V1026 VanDerWaalsContact O-N 3.13Å; T1024-V1026 PolarHBondContact O-N 3.35Å; V1026-I1028 VanDerWaalsContact C-N 3.34Å; V1026-I1028 PolarHBondContact O-N 2.72Å; V1026-A1030 VanDerWaalsContact O-CB 3.26Å; V1026-A1030 WeakPolarHBondContact O-CB 3.43Å; V1026-A1030 PolarHBondContact O-N 2.73Å
1027	K	83.4	Confident	77.1	Confident	81 Å²	81	59.8 Å²	59.8	35%	0.352	33%	0.333	S	S	.	.	H	α-helix	trans	-71.5	-24.3	178	-74.8	170.8	-174.6	171.5	0	114.1	L972 E1023 T1024 A1025	L972-K1027 HydrophobicContact CD1-CB 4.23Å; L972-K1027 HydrophobicContact CD2-CB 4.06Å; L972-K1027 HydrophobicContact CD2-CD 4.49Å; E1023-K1027 WeakPolarHBondContact O-CD 3.05Å; E1023-K1027 VanDerWaalsContact O-CG 3.29Å; E1023-K1027 WeakPolarHBondContact O-CG 3.32Å; E1023-K1027 PolarHBondContact O-N 3.27Å; E1023-K1027 WeakPolarHBondContact OE1-CE 3.29Å; E1023-K1027 IonicContact OE1-NZ 3.62Å; E1023-K1027 PolarHBondContact OE1-NZ 3.22Å; E1023-K1027 IonicContact OE2-NZ 2.65Å; E1023-K1027 PolarHBondContact OE2-NZ 3.42Å; T1024-K1027 PolarHBondContact O-N 3.33Å; A1025-K1027 VanDerWaalsContact C-N 3.27Å; A1025-K1027 PolarHBondContact O-N 3.26Å
1028	I	81.7	Confident	76.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-79.1	-48.8	173	-61.6	161	0	0	0	109.4	V969 L972 Q973 F976 T1024 A1025 V1026 A1030 K1031 Q1032 L1036 I1039	V969-I1028 HydrophobicContact CG1-CG2 4.23Å; L972-I1028 HydrophobicContact CB-CG1 3.69Å; Q973-I1028 HydrophobicContact CG-CD1 4.35Å; Q973-I1028 HydrophobicContact CG-CG2 4.19Å; F976-I1028 HydrophobicContact CB-CD1 3.55Å; F976-I1028 HydrophobicContact CG-CD1 4.18Å; T1024-I1028 WeakPolarHBondContact O-CG1 3.35Å; T1024-I1028 PolarHBondContact O-N 3.3Å; T1024-I1028 VanDerWaalsContact O-N 3.14Å; A1025-I1028 PolarHBondContact O-N 2.85Å; V1026-I1028 VanDerWaalsContact C-N 3.34Å; V1026-I1028 PolarHBondContact O-N 2.72Å; I1028-A1030 VanDerWaalsContact C-N 3.26Å; I1028-A1030 PolarHBondContact O-N 3.45Å; I1028-K1031 CarbonylContact O-C 3.36Å; I1028-K1031 WeakPolarHBondContact O-CA 3.32Å; I1028-K1031 PolarHBondContact O-N 2.75Å; I1028-Q1032 PolarHBondContact O-N 2.94Å; I1028-L1036 HydrophobicContact CG2-CD1 3.36Å; I1028-I1039 HydrophobicContact CD1-CD1 3.77Å
1029	I	77.1	Confident	75.8	Confident	57 Å²	57	59.6 Å²	59.6	29%	0.292	34%	0.343	S	S	.	.	H	α-helix	trans	-57	-40.7	178.5	-62.1	159	0	0	0	110.7	A1025 K1031 Q1032 E1040	A1025-I1029 WeakPolarHBondContact O-CD1 3.5Å; A1025-I1029 WeakPolarHBondContact O-CG1 3.49Å; A1025-I1029 PolarHBondContact O-N 3.31Å; I1029-K1031 PolarHBondContact O-N 2.7Å; I1029-Q1032 CarbonylContact O-C 3.56Å; I1029-E1040 HydrophobicContact CD1-CG 3.6Å; I1029-E1040 HydrophobicContact CG1-CG 4.42Å
1030	A	74.7	Confident	75.2	Confident	81 Å²	81	59.6 Å²	59.6	67%	0.669	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	3.1	174.9	0	0	0	0	0	115.4	V1026 I1028	V1026-A1030 VanDerWaalsContact O-CB 3.26Å; V1026-A1030 WeakPolarHBondContact O-CB 3.43Å; V1026-A1030 PolarHBondContact O-N 2.73Å; I1028-A1030 VanDerWaalsContact C-N 3.26Å; I1028-A1030 PolarHBondContact O-N 3.45Å
1031	K	73.3	Confident	74.8	Confident	75 Å²	75	60.3 Å²	60.3	33%	0.326	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.4	-16	177.3	-66.2	-167.6	-179.9	-173.7	0	114.8	E968 V969 L972 I1028 I1029	E968-K1031 IonicContact OE2-NZ 3.55Å; E968-K1031 PolarHBondContact OE2-NZ 3.49Å; V969-K1031 HydrophobicContact CG2-CB 3.49Å; V969-K1031 VanDerWaalsContact CG2-CB 3.49Å; V969-K1031 HydrophobicContact CG2-CD 4.07Å; V969-K1031 HydrophobicContact CG2-CG 4.44Å; L972-K1031 HydrophobicContact CD1-CD 3.96Å; I1028-K1031 CarbonylContact O-C 3.36Å; I1028-K1031 WeakPolarHBondContact O-CA 3.32Å; I1028-K1031 PolarHBondContact O-N 2.75Å; I1029-K1031 PolarHBondContact O-N 2.7Å
1032	Q	65.5	Low	74.5	Confident	53 Å²	53	63.3 Å²	63.3	25%	0.248	36%	0.363	C	S	.	.			trans	-126.3	98.4	167.5	-91.4	176	-27.3	0	0	107	V969 I1028 I1029 D1034	V969-Q1032 VanDerWaalsContact CG1-CD 3.45Å; V969-Q1032 HydrophobicContact CG1-CG 3.92Å; V969-Q1032 VanDerWaalsContact CG1-OE1 3.28Å; I1028-Q1032 PolarHBondContact O-N 2.94Å; I1029-Q1032 CarbonylContact O-C 3.56Å; Q1032-D1034 PolarHBondContact O-N 3.02Å
1033	G	58.4	Low	74.4	Confident	61 Å²	61	59.9 Å²	59.9	63%	0.629	35%	0.349	S	S	*	.			trans	-62.7	-30.8	-177.6	0	0	0	0	0	113.3
1034	D	53.7	Low	74.2	Confident	116 Å²	116	57.8 Å²	57.8	62%	0.62	35%	0.345	S	S	*	.	S	Bend	trans	-147.1	156.1	171.5	-94.2	-57.7	0	0	0	110	Q1032	Q1032-D1034 PolarHBondContact O-N 3.02Å
1035	P	52.9	Low	74.2	Confident	106 Å²	106	64 Å²	64	69%	0.688	37%	0.374	S	S	*	.	S	Bend	cis	-119.2	101.4	-7	34.2	-17.8	0	0	0	111.1
1036	L	59.2	Low	74.3	Confident	30 Å²	30	64.3 Å²	64.3	16%	0.157	38%	0.375	C	S	.	.			trans	-126.7	33.6	-175.2	-87.5	175.6	0	0	0	116	I1028 A1038 I1039 E1040	I1028-L1036 HydrophobicContact CG2-CD1 3.36Å; L1036-A1038 HydrophobicContact CD2-CB 4.49Å; L1036-A1038 PolarHBondContact O-N 3.22Å; L1036-I1039 HydrophobicContact CB-CB 4.39Å; L1036-I1039 HydrophobicContact CD1-CD1 4.1Å; L1036-I1039 HydrophobicContact CD2-CB 4.13Å; L1036-I1039 HydrophobicContact CD2-CD1 3.94Å; L1036-I1039 HydrophobicContact CD2-CG1 3.85Å; L1036-I1039 PolarHBondContact O-N 3.49Å; L1036-E1040 PolarHBondContact O-N 2.93Å
1037	H	62.7	Low	74.4	Confident	136 Å²	136	60.1 Å²	60.1	63%	0.63	35%	0.35	S	S	*	.	H	α-helix	trans	-48	-27.3	158.2	-69.6	-29.8	0	0	0	113.4	E1040 A1041	H1037-E1040 IonicContact CE1-OE2 3.86Å; H1037-E1040 IonicContact ND1-OE2 2.75Å; H1037-E1040 PolarHBondContact ND1-OE2 3.46Å; H1037-A1041 WeakPolarHBondContact O-CB 3.49Å; H1037-A1041 PolarHBondContact O-N 3.5Å
1038	A	70.3	Confident	74.6	Confident	59 Å²	59	64.1 Å²	64.1	49%	0.488	36%	0.363	S	S	.	.	H	α-helix	trans	-61.6	-49.2	171.8	0	0	0	0	0	112.4	L1036 A1041 E1042	L1036-A1038 HydrophobicContact CD2-CB 4.49Å; L1036-A1038 PolarHBondContact O-N 3.22Å; A1038-A1041 PolarHBondContact O-N 3.33Å; A1038-E1042 WeakPolarHBondContact O-CB 3.33Å; A1038-E1042 WeakPolarHBondContact O-CG 3.45Å; A1038-E1042 PolarHBondContact O-N 3.44Å
1039	I	80.2	Confident	74.9	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-70.9	-36	178.7	-81.5	-175.3	0	0	0	111.4	F976 F977 A1025 I1028 L1036 S1043	F976-I1039 HydrophobicContact CB-CD1 4.46Å; F976-I1039 HydrophobicContact CD1-CD1 3.63Å; F976-I1039 HydrophobicContact CD1-CG1 3.73Å; F976-I1039 HydrophobicContact CD1-CG2 4.35Å; F976-I1039 HydrophobicContact CD2-CG2 3.99Å; F976-I1039 HydrophobicContact CE1-CB 4.24Å; F976-I1039 HydrophobicContact CE1-CD1 4.07Å; F976-I1039 HydrophobicContact CE1-CG1 3.6Å; F976-I1039 HydrophobicContact CE1-CG2 4.16Å; F976-I1039 HydrophobicContact CE2-CG2 3.77Å; F976-I1039 HydrophobicContact CG-CD1 4.01Å; F976-I1039 HydrophobicContact CG-CG1 4.38Å; F976-I1039 HydrophobicContact CG-CG2 4.28Å; F976-I1039 HydrophobicContact CZ-CB 4.26Å; F976-I1039 HydrophobicContact CZ-CG1 4.13Å; F976-I1039 HydrophobicContact CZ-CG2 3.86Å; F977-I1039 HydrophobicContact CE2-CD1 4.3Å; F977-I1039 HydrophobicContact CZ-CD1 4.21Å; F977-I1039 HydrophobicContact CZ-CG1 4.27Å; A1025-I1039 HydrophobicContact CB-CG2 3.73Å; I1028-I1039 HydrophobicContact CD1-CD1 3.77Å; L1036-I1039 HydrophobicContact CB-CB 4.39Å; L1036-I1039 HydrophobicContact CD1-CD1 4.1Å; L1036-I1039 HydrophobicContact CD2-CB 4.13Å; L1036-I1039 HydrophobicContact CD2-CD1 3.94Å; L1036-I1039 HydrophobicContact CD2-CG1 3.85Å; L1036-I1039 PolarHBondContact O-N 3.49Å; I1039-S1043 WeakPolarHBondContact O-CB 3.5Å; I1039-S1043 PolarHBondContact O-N 2.99Å
1040	E	77.3	Confident	75.6	Confident	84 Å²	84	65.6 Å²	65.6	39%	0.393	36%	0.364	S	S	.	.	H	α-helix	trans	-62.7	-45.4	171.3	-67.9	-172.1	123.6	0	0	112	I1029 L1036 H1037 S1044	I1029-E1040 HydrophobicContact CD1-CG 3.6Å; I1029-E1040 HydrophobicContact CG1-CG 4.42Å; L1036-E1040 PolarHBondContact O-N 2.93Å; H1037-E1040 IonicContact CE1-OE2 3.86Å; H1037-E1040 IonicContact ND1-OE2 2.75Å; H1037-E1040 PolarHBondContact ND1-OE2 3.46Å; E1040-S1044 WeakPolarHBondContact O-CB 3.42Å; E1040-S1044 PolarHBondContact O-N 2.89Å; E1040-S1044 PolarHBondContact O-OG 3.44Å
1041	A	80.1	Confident	76.3	Confident	50 Å²	50	66 Å²	66	41%	0.413	35%	0.353	S	S	.	.	H	α-helix	trans	-67.5	-48.2	179.9	0	0	0	0	0	111.7	H1037 A1038 S1044 Q1045	H1037-A1041 WeakPolarHBondContact O-CB 3.49Å; H1037-A1041 PolarHBondContact O-N 3.5Å; A1038-A1041 PolarHBondContact O-N 3.33Å; A1041-S1044 PolarHBondContact O-N 3.09Å; A1041-Q1045 WeakPolarHBondContact O-CB 3.27Å; A1041-Q1045 PolarHBondContact O-N 2.91Å
1042	E	82.7	Confident	76.9	Confident	63 Å²	63	64.6 Å²	64.6	29%	0.294	36%	0.359	S	S	.	.	H	α-helix	trans	-59.1	-51	176.6	-78.7	-176.9	176.2	0	0	111.3	F976 F977 H980 A1038 S1044 Q1045 L1046	F976-E1042 HydrophobicContact CZ-CB 4.36Å; F977-E1042 WeakPolarHBondContact CE1-OE2 3.39Å; H980-E1042 IonicContact CE1-OE2 3.87Å; A1038-E1042 WeakPolarHBondContact O-CB 3.33Å; A1038-E1042 WeakPolarHBondContact O-CG 3.45Å; A1038-E1042 PolarHBondContact O-N 3.44Å; E1042-S1044 PolarHBondContact O-N 3.01Å; E1042-Q1045 PolarHBondContact O-N 2.89Å; E1042-L1046 WeakPolarHBondContact O-CB 3.43Å; E1042-L1046 PolarHBondContact O-N 3.28Å
1043	S	84.8	Confident	78	Confident	8 Å²	8	63 Å²	63	6%	0.056	35%	0.352	C	S	.	.	H	α-helix	trans	-57.7	-48.2	176.2	-169.9	0	0	0	0	111.3	I1039 Q1045 L1046 C1047	I1039-S1043 WeakPolarHBondContact O-CB 3.5Å; I1039-S1043 PolarHBondContact O-N 2.99Å; S1043-Q1045 PolarHBondContact O-N 3.37Å; S1043-L1046 PolarHBondContact O-N 2.82Å; S1043-C1047 WeakPolarHBondContact O-CB 3.49Å; S1043-C1047 PolarHBondContact O-N 3.34Å; S1043-C1047 PolarHBondContact O-SG 2.94Å
1044	S	83.4	Confident	79.4	Confident	53 Å²	53	61 Å²	61	37%	0.371	33%	0.327	S	S	.	.	H	α-helix	trans	-67.6	-33.6	-180	-61.5	0	0	0	0	113.7	E1040 A1041 E1042 R1048	E1040-S1044 WeakPolarHBondContact O-CB 3.42Å; E1040-S1044 PolarHBondContact O-N 2.89Å; E1040-S1044 PolarHBondContact O-OG 3.44Å; A1041-S1044 PolarHBondContact O-N 3.09Å; E1042-S1044 PolarHBondContact O-N 3.01Å; S1044-R1048 WeakPolarHBondContact O-CB 3.46Å; S1044-R1048 WeakPolarHBondContact O-CG 3.18Å; S1044-R1048 PolarHBondContact O-N 2.94Å; S1044-R1048 VanDerWaalsContact O-N 3.14Å; S1044-R1048 PolarHBondContact O-NE 3.49Å
1045	Q	86.5	Confident	81	Confident	131 Å²	131	60 Å²	60	61%	0.612	32%	0.318	S	S	*	.	H	α-helix	trans	-69.9	-45	176.9	176.7	177.8	-8.3	0	0	110.3	A1041 E1042 S1043 R1048 R1049	A1041-Q1045 WeakPolarHBondContact O-CB 3.27Å; A1041-Q1045 PolarHBondContact O-N 2.91Å; E1042-Q1045 PolarHBondContact O-N 2.89Å; S1043-Q1045 PolarHBondContact O-N 3.37Å; Q1045-R1048 PolarHBondContact O-N 3.45Å; Q1045-R1049 PolarHBondContact O-N 2.91Å
1046	L	87.1	Confident	82.5	Confident	11 Å²	11	57.3 Å²	57.3	6%	0.058	30%	0.302	C	S	.	.	H	α-helix	trans	-69.7	-37.4	-178.8	-154.4	68.9	0	0	0	112	V983 A984 L987 L1021 E1042 S1043 R1049 W1050	V983-L1046 HydrophobicContact CB-CD2 3.59Å; V983-L1046 HydrophobicContact CG1-CD2 3.48Å; V983-L1046 VanDerWaalsContact CG1-CD2 3.48Å; V983-L1046 HydrophobicContact CG1-CG 3.88Å; A984-L1046 HydrophobicContact CB-CD1 3.93Å; A984-L1046 HydrophobicContact CB-CD2 4.37Å; L987-L1046 HydrophobicContact CD1-CD1 3.86Å; L987-L1046 HydrophobicContact CD1-CG 3.97Å; L1021-L1046 HydrophobicContact CD2-CB 4.38Å; L1021-L1046 HydrophobicContact CD2-CD2 3.81Å; E1042-L1046 WeakPolarHBondContact O-CB 3.43Å; E1042-L1046 PolarHBondContact O-N 3.28Å; S1043-L1046 PolarHBondContact O-N 2.82Å; L1046-R1049 PolarHBondContact O-N 3.32Å; L1046-W1050 PolarHBondContact O-N 2.69Å
1047	C	87.3	Confident	83.8	Confident	7 Å²	7	55.9 Å²	55.9	5%	0.047	30%	0.295	C	S	.	.	H	α-helix	trans	-62	-47.5	171.9	-65.2	0	0	0	0	111.8	V1018 K1022 S1043 R1049 W1050 E1051	V1018-C1047 HydrophobicContact CG1-CB 4.39Å; V1018-C1047 VanDerWaalsContact CG1-SG 3.56Å; K1022-C1047 WeakPolarHBondContact CE-SG 3.3Å; S1043-C1047 WeakPolarHBondContact O-CB 3.49Å; S1043-C1047 PolarHBondContact O-N 3.34Å; S1043-C1047 PolarHBondContact O-SG 2.94Å; C1047-R1049 VanDerWaalsContact C-N 3.31Å; C1047-R1049 PolarHBondContact O-N 2.87Å; C1047-W1050 PolarHBondContact O-N 2.75Å; C1047-E1051 WeakPolarHBondContact O-CB 3.37Å; C1047-E1051 WeakPolarHBondContact O-CG 3.36Å; C1047-E1051 PolarHBondContact O-N 3.17Å
1048	R	87.7	Confident	84.9	Confident	165 Å²	165	53.1 Å²	53.1	62%	0.623	28%	0.281	S	S	*	.	H	α-helix	trans	-60.7	-37.3	175.9	-82.2	178.6	-87.2	166.9	-13.5	112.7	S1044 Q1045 G1052	S1044-R1048 WeakPolarHBondContact O-CB 3.46Å; S1044-R1048 WeakPolarHBondContact O-CG 3.18Å; S1044-R1048 PolarHBondContact O-N 2.94Å; S1044-R1048 VanDerWaalsContact O-N 3.14Å; S1044-R1048 PolarHBondContact O-NE 3.49Å; Q1045-R1048 PolarHBondContact O-N 3.45Å; R1048-G1052 PolarHBondContact O-N 2.78Å
1049	R	88.5	Confident	85.6	Confident	79 Å²	79	54.3 Å²	54.3	30%	0.298	28%	0.279	S	S	.	.	H	α-helix	trans	-64.7	-45	175.7	-174.9	-179.9	177.2	-158.7	2.5	111.9	L987 N988 E991 Q1045 L1046 C1047 L1053	L987-R1049 HydrophobicContact CD1-CB 4.31Å; L987-R1049 HydrophobicContact CD1-CG 4.23Å; N988-R1049 VanDerWaalsContact OD1-CZ 3.27Å; N988-R1049 PolarHBondContact OD1-NH1 2.82Å; N988-R1049 PolarHBondContact OD1-NH2 2.85Å; E991-R1049 IonicContact OE2-CZ 3.85Å; E991-R1049 VanDerWaalsContact OE2-CZ 3.27Å; E991-R1049 IonicContact OE2-NE 2.65Å; E991-R1049 PolarHBondContact OE2-NE 3.41Å; E991-R1049 IonicContact OE2-NH2 3.31Å; E991-R1049 PolarHBondContact OE2-NH2 3.47Å; Q1045-R1049 PolarHBondContact O-N 2.91Å; L1046-R1049 PolarHBondContact O-N 3.32Å; C1047-R1049 VanDerWaalsContact C-N 3.31Å; C1047-R1049 PolarHBondContact O-N 2.87Å; R1049-L1053 HydrophobicContact CG-CD1 4.18Å; R1049-L1053 WeakPolarHBondContact O-CB 3.42Å; R1049-L1053 WeakPolarHBondContact O-CG 3.45Å; R1049-L1053 PolarHBondContact O-N 2.99Å
1050	W	91.4	Very high	85.7	Confident	9 Å²	9	57.4 Å²	57.4	3%	0.034	29%	0.294	C	S	.	.	H	α-helix	trans	-64.4	-43.5	175.8	170.9	71.2	0	0	0	112.3	L987 L1011 R1015 V1018 L1046 C1047 L1054	L987-W1050 HydrophobicContact CD1-CB 4.09Å; L987-W1050 HydrophobicContact CD2-CB 3.87Å; L987-W1050 HydrophobicContact CD2-CG 4.31Å; L1011-W1050 PolarHBondContact O-NE1 3.5Å; R1015-W1050 HydrophobicContact CB-CH2 4.1Å; R1015-W1050 HydrophobicContact CB-CZ2 3.81Å; R1015-W1050 HydrophobicContact CG-CH2 4.01Å; R1015-W1050 HydrophobicContact CG-CZ2 4.26Å; V1018-W1050 HydrophobicContact CG1-CE3 4.04Å; V1018-W1050 HydrophobicContact CG1-CZ3 4.44Å; V1018-W1050 HydrophobicContact CG2-CB 4.44Å; V1018-W1050 HydrophobicContact CG2-CD2 4.02Å; V1018-W1050 HydrophobicContact CG2-CE3 4.29Å; V1018-W1050 HydrophobicContact CG2-CG 4.06Å; L1046-W1050 PolarHBondContact O-N 2.69Å; C1047-W1050 PolarHBondContact O-N 2.75Å; W1050-L1054 HydrophobicContact CH2-CD1 4.5Å; W1050-L1054 HydrophobicContact CZ2-CD1 3.76Å; W1050-L1054 VanDerWaalsContact O-CB 3.23Å; W1050-L1054 WeakPolarHBondContact O-CB 3.27Å; W1050-L1054 PolarHBondContact O-N 2.86Å
1051	E	88.5	Confident	85.9	Confident	91 Å²	91	54.9 Å²	54.9	43%	0.425	28%	0.282	S	S	.	.	H	α-helix	trans	-62.8	-43.9	176.7	-73.7	163.3	-167.9	0	0	111.5	K1022 C1047 L1054 E1055	K1022-E1051 IonicContact NZ-OE1 3.49Å; C1047-E1051 WeakPolarHBondContact O-CB 3.37Å; C1047-E1051 WeakPolarHBondContact O-CG 3.36Å; C1047-E1051 PolarHBondContact O-N 3.17Å; E1051-L1054 PolarHBondContact O-N 3.29Å; E1051-E1055 PolarHBondContact O-N 3.49Å; E1051-E1055 VanDerWaalsContact O-N 3.1Å
1052	G	86.9	Confident	85.9	Confident	44 Å²	44	55.3 Å²	55.3	45%	0.454	28%	0.283	S	S	.	.	H	α-helix	trans	-65.9	-41.6	177.6	0	0	0	0	0	114.1	R1048 E1055 S1056	R1048-G1052 PolarHBondContact O-N 2.78Å; G1052-E1055 PolarHBondContact O-N 3.32Å; G1052-S1056 VanDerWaalsContact O-CB 3.32Å; G1052-S1056 WeakPolarHBondContact O-CB 3.34Å; G1052-S1056 PolarHBondContact O-N 3Å
1053	L	87.7	Confident	85.4	Confident	19 Å²	19	58.2 Å²	58.2	10%	0.099	30%	0.296	C	S	.	.	H	α-helix	trans	-62.6	-44.1	172.5	-79.2	165.4	0	0	0	111.1	L987 E991 I994 L1011 R1049 E1055 S1056 T1057	L987-L1053 HydrophobicContact CB-CD1 4.44Å; L987-L1053 HydrophobicContact CD2-CD1 4.02Å; E991-L1053 HydrophobicContact CB-CD1 4.23Å; E991-L1053 HydrophobicContact CB-CD2 4.04Å; E991-L1053 HydrophobicContact CG-CD2 3.95Å; I994-L1053 HydrophobicContact CD1-CD2 4.38Å; L1011-L1053 HydrophobicContact CD1-CB 4.03Å; L1011-L1053 HydrophobicContact CD2-CB 4.28Å; R1049-L1053 HydrophobicContact CG-CD1 4.18Å; R1049-L1053 WeakPolarHBondContact O-CB 3.42Å; R1049-L1053 WeakPolarHBondContact O-CG 3.45Å; R1049-L1053 PolarHBondContact O-N 2.99Å; L1053-E1055 VanDerWaalsContact C-N 3.29Å; L1053-E1055 PolarHBondContact O-N 3.05Å; L1053-S1056 PolarHBondContact O-N 3.26Å; L1053-T1057 PolarHBondContact O-N 2.9Å; L1053-T1057 PolarHBondContact O-OG1 2.96Å
1054	L	88.4	Confident	84.5	Confident	20 Å²	20	58.2 Å²	58.2	11%	0.105	30%	0.297	C	S	.	.	H	α-helix	trans	-65.9	-27.4	-178.2	-176.5	146.7	0	0	0	113.4	K1012 W1050 E1051 K1058	K1012-L1054 HydrophobicContact CG-CD1 4.39Å; W1050-L1054 HydrophobicContact CH2-CD1 4.5Å; W1050-L1054 HydrophobicContact CZ2-CD1 3.76Å; W1050-L1054 VanDerWaalsContact O-CB 3.23Å; W1050-L1054 WeakPolarHBondContact O-CB 3.27Å; W1050-L1054 PolarHBondContact O-N 2.86Å; E1051-L1054 PolarHBondContact O-N 3.29Å; L1054-K1058 WeakPolarHBondContact O-CG 3.49Å
1055	E	86.8	Confident	83.3	Confident	94 Å²	94	59.4 Å²	59.4	44%	0.439	30%	0.302	S	S	.	.	H	α-helix	trans	-79.2	-47.4	169.3	-139.8	63.6	-143.2	0	0	111.5	E1051 G1052 L1053 T1057 K1058 D1059	E1051-E1055 PolarHBondContact O-N 3.49Å; E1051-E1055 VanDerWaalsContact O-N 3.1Å; G1052-E1055 PolarHBondContact O-N 3.32Å; L1053-E1055 VanDerWaalsContact C-N 3.29Å; L1053-E1055 PolarHBondContact O-N 3.05Å; E1055-T1057 VanDerWaalsContact C-N 3.31Å; E1055-T1057 PolarHBondContact O-N 3.17Å; E1055-K1058 WeakPolarHBondContact O-CA 3.44Å; E1055-K1058 WeakPolarHBondContact O-CB 3.43Å; E1055-K1058 PolarHBondContact O-N 3.04Å; E1055-K1058 VanDerWaalsContact OE1-CD 3.27Å; E1055-K1058 WeakPolarHBondContact OE1-CD 3.25Å; E1055-K1058 IonicContact OE1-NZ 3.99Å; E1055-K1058 PolarHBondContact OE1-NZ 3.15Å; E1055-K1058 IonicContact OE2-NZ 3.76Å; E1055-K1058 PolarHBondContact OE2-NZ 3.47Å; E1055-D1059 PolarHBondContact O-N 3.17Å
1056	S	85.5	Confident	81.7	Confident	50 Å²	50	60.4 Å²	60.4	35%	0.35	31%	0.306	S	S	.	.	H	α-helix	trans	-53.3	-43.3	179.3	-175.7	0	0	0	0	113.1	G1052 L1053 K1058 D1059 Q1060	G1052-S1056 VanDerWaalsContact O-CB 3.32Å; G1052-S1056 WeakPolarHBondContact O-CB 3.34Å; G1052-S1056 PolarHBondContact O-N 3Å; L1053-S1056 PolarHBondContact O-N 3.26Å; S1056-K1058 VanDerWaalsContact C-N 3.33Å; S1056-K1058 PolarHBondContact O-N 3.19Å; S1056-D1059 PolarHBondContact O-N 3.4Å; S1056-Q1060 WeakPolarHBondContact O-CG 3.48Å; S1056-Q1060 PolarHBondContact O-N 2.94Å
1057	T	85.8	Confident	79.8	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-71	-24.2	177.7	-37.4	0	0	0	0	113.1	I994 L1004 L1008 L1011 L1053 E1055 L1061	I994-T1057 HydrophobicContact CD1-CG2 4.35Å; I994-T1057 VanDerWaalsContact CD1-OG1 3.3Å; I994-T1057 WeakPolarHBondContact CD1-OG1 3.09Å; I994-T1057 HydrophobicContact CG1-CG2 4.25Å; L1004-T1057 HydrophobicContact CD2-CG2 4.26Å; L1004-T1057 WeakPolarHBondContact O-CG2 3.29Å; L1008-T1057 HydrophobicContact CB-CG2 3.92Å; L1011-T1057 WeakPolarHBondContact CD1-OG1 3.43Å; L1053-T1057 PolarHBondContact O-N 2.9Å; L1053-T1057 PolarHBondContact O-OG1 2.96Å; E1055-T1057 VanDerWaalsContact C-N 3.31Å; E1055-T1057 PolarHBondContact O-N 3.17Å; T1057-L1061 VanDerWaalsContact O-CB 3.22Å; T1057-L1061 WeakPolarHBondContact O-CB 3.35Å; T1057-L1061 PolarHBondContact O-N 3.3Å
1058	K	86.1	Confident	77.7	Confident	78 Å²	78	68.1 Å²	68.1	34%	0.339	35%	0.349	S	S	.	.	H	α-helix	trans	-70.4	-45.2	169.9	-63.7	163.6	-174.5	167.2	0	110.7	L1008 L1054 E1055 S1056 L1061 S1062	L1008-K1058 HydrophobicContact CD1-CG 3.96Å; L1008-K1058 HydrophobicContact CD2-CG 4.14Å; L1054-K1058 WeakPolarHBondContact O-CG 3.49Å; E1055-K1058 WeakPolarHBondContact O-CA 3.44Å; E1055-K1058 WeakPolarHBondContact O-CB 3.43Å; E1055-K1058 PolarHBondContact O-N 3.04Å; E1055-K1058 VanDerWaalsContact OE1-CD 3.27Å; E1055-K1058 WeakPolarHBondContact OE1-CD 3.25Å; E1055-K1058 IonicContact OE1-NZ 3.99Å; E1055-K1058 PolarHBondContact OE1-NZ 3.15Å; E1055-K1058 IonicContact OE2-NZ 3.76Å; E1055-K1058 PolarHBondContact OE2-NZ 3.47Å; S1056-K1058 VanDerWaalsContact C-N 3.33Å; S1056-K1058 PolarHBondContact O-N 3.19Å; K1058-L1061 PolarHBondContact O-N 3.39Å; K1058-L1061 VanDerWaalsContact O-N 3.17Å; K1058-S1062 PolarHBondContact O-N 3.2Å
1059	D	84.2	Confident	75.9	Confident	84 Å²	84	69.2 Å²	69.2	45%	0.449	36%	0.361	S	S	.	.	H	α-helix	trans	-62.2	-46.4	-179.1	-70.3	-15.9	0	0	0	110.1	E1055 S1056 L1061 S1062 Q1063	E1055-D1059 PolarHBondContact O-N 3.17Å; S1056-D1059 PolarHBondContact O-N 3.4Å; D1059-L1061 PolarHBondContact O-N 3.11Å; D1059-S1062 PolarHBondContact O-N 3.24Å; D1059-S1062 PolarHBondContact O-OG 2.65Å; D1059-Q1063 WeakPolarHBondContact O-CG 3.08Å; D1059-Q1063 PolarHBondContact O-N 2.93Å; D1059-Q1063 PolarHBondContact O-NE2 3.36Å
1060	Q	82.4	Confident	73.2	Confident	66 Å²	66	69.4 Å²	69.4	31%	0.308	37%	0.374	S	S	.	.	H	α-helix	trans	-58.8	-43.4	172.1	-71.8	175.4	-11	0	0	112.3	L1004 S1056 S1062 Q1063 A1064	L1004-Q1060 HydrophobicContact CD1-CB 4.08Å; L1004-Q1060 HydrophobicContact CD2-CB 4.09Å; S1056-Q1060 WeakPolarHBondContact O-CG 3.48Å; S1056-Q1060 PolarHBondContact O-N 2.94Å; Q1060-S1062 VanDerWaalsContact C-N 3.31Å; Q1060-S1062 PolarHBondContact O-N 3.02Å; Q1060-Q1063 PolarHBondContact O-N 2.58Å; Q1060-A1064 WeakPolarHBondContact O-CB 3.2Å; Q1060-A1064 PolarHBondContact O-N 2.91Å
1061	L	82.7	Confident	70.1	Confident	30 Å²	30	75 Å²	75	16%	0.157	40%	0.404	C	S	.	.	H	α-helix	trans	-63.3	-37	177.2	-168.5	71	0	0	0	112	H1001 L1004 K1005 L1008 T1057 K1058 D1059 Q1063 T1065	H1001-L1061 HydrophobicContact CB-CD1 4.49Å; H1001-L1061 WeakPolarHBondContact CD2-CD1 3.38Å; H1001-L1061 WeakPolarHBondContact O-CD1 3.39Å; L1004-L1061 HydrophobicContact CB-CD1 3.82Å; K1005-L1061 HydrophobicContact CB-CD1 3.99Å; K1005-L1061 HydrophobicContact CB-CD2 4.5Å; L1008-L1061 HydrophobicContact CD2-CD2 3.79Å; T1057-L1061 VanDerWaalsContact O-CB 3.22Å; T1057-L1061 WeakPolarHBondContact O-CB 3.35Å; T1057-L1061 PolarHBondContact O-N 3.3Å; K1058-L1061 PolarHBondContact O-N 3.39Å; K1058-L1061 VanDerWaalsContact O-N 3.17Å; D1059-L1061 PolarHBondContact O-N 3.11Å; L1061-Q1063 VanDerWaalsContact C-N 3.34Å; L1061-T1065 PolarHBondContact O-N 2.89Å; L1061-T1065 PolarHBondContact O-OG1 3.33Å; L1061-T1065 VanDerWaalsContact O-OG1 3.14Å
1062	S	79.1	Confident	67.2	Low	60 Å²	60	75.3 Å²	75.3	42%	0.42	41%	0.409	S	S	.	.	H	α-helix	trans	-69.7	-29.7	176	78.6	0	0	0	0	113.2	K1058 D1059 Q1060 T1065 H1066	K1058-S1062 PolarHBondContact O-N 3.2Å; D1059-S1062 PolarHBondContact O-N 3.24Å; D1059-S1062 PolarHBondContact O-OG 2.65Å; Q1060-S1062 VanDerWaalsContact C-N 3.31Å; Q1060-S1062 PolarHBondContact O-N 3.02Å; S1062-T1065 WeakPolarHBondContact CA-OG1 3.43Å; S1062-T1065 PolarHBondContact O-OG1 3.12Å; S1062-H1066 PolarHBondContact O-CD2 3.43Å
1063	Q	72.8	Confident	64.5	Low	124 Å²	124	79.3 Å²	79.3	58%	0.579	42%	0.415	S	S	*	.	H	α-helix	trans	-78.6	-43.3	175.4	-69.1	166.7	38.1	0	0	111	D1059 Q1060 L1061 T1065 H1066	D1059-Q1063 WeakPolarHBondContact O-CG 3.08Å; D1059-Q1063 PolarHBondContact O-N 2.93Å; D1059-Q1063 PolarHBondContact O-NE2 3.36Å; Q1060-Q1063 PolarHBondContact O-N 2.58Å; L1061-Q1063 VanDerWaalsContact C-N 3.34Å; Q1063-T1065 VanDerWaalsContact C-N 3.26Å; Q1063-T1065 PolarHBondContact O-N 2.93Å; Q1063-H1066 PolarHBondContact O-N 3.3Å
1064	A	66.1	Low	61.9	Low	8 Å²	8	85.4 Å²	85.4	7%	0.066	44%	0.441	C	S	.	.	H	α-helix	trans	-59	-33.9	175.6	0	0	0	0	0	112.9	N999 H1001 L1004 Q1060 H1066 T1067	N999-A1064 WeakPolarHBondContact O-CB 3.41Å; H1001-A1064 HydrophobicContact CB-CB 4.32Å; L1004-A1064 HydrophobicContact CD1-CB 3.83Å; Q1060-A1064 WeakPolarHBondContact O-CB 3.2Å; Q1060-A1064 PolarHBondContact O-N 2.91Å; A1064-H1066 PolarHBondContact O-N 3.49Å; A1064-T1067 PolarHBondContact O-N 3.08Å
1065	T	57	Low	59.2	Low	77 Å²	77	89.8 Å²	89.8	47%	0.472	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-8.1	172.8	41.7	0	0	0	0	115	L1061 S1062 Q1063	L1061-T1065 PolarHBondContact O-N 2.89Å; L1061-T1065 PolarHBondContact O-OG1 3.33Å; L1061-T1065 VanDerWaalsContact O-OG1 3.14Å; S1062-T1065 WeakPolarHBondContact CA-OG1 3.43Å; S1062-T1065 PolarHBondContact O-OG1 3.12Å; Q1063-T1065 VanDerWaalsContact C-N 3.26Å; Q1063-T1065 PolarHBondContact O-N 2.93Å
1066	H	54.2	Low	56.6	Low	152 Å²	152	91 Å²	91	70%	0.704	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-1.7	-179.7	-80.9	-57.1	0	0	0	114.6	S1062 Q1063 A1064	S1062-H1066 PolarHBondContact O-CD2 3.43Å; Q1063-H1066 PolarHBondContact O-N 3.3Å; A1064-H1066 PolarHBondContact O-N 3.49Å
1067	T	46.3	Very low	53.9	Low	46 Å²	46	93.3 Å²	93.3	28%	0.282	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-5.1	-171.9	59.2	0	0	0	0	116.4	N999 A1064 C1070 D1071	N999-T1067 PolarHBondContact ND2-OG1 3.24Å; A1064-T1067 PolarHBondContact O-N 3.08Å; T1067-C1070 CarbonylContact O-C 3.56Å; T1067-C1070 WeakPolarHBondContact O-CA 2.9Å; T1067-D1071 PolarHBondContact O-N 3.42Å
1068	D	43.4	Very low	51.2	Low	134 Å²	134	99.2 Å²	99.2	72%	0.717	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	17	160.9	-86.6	12.8	0	0	0	112
1069	E	50.6	Low	48.4	Very low	188 Å²	188	101.1 Å²	101.1	88%	0.879	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	61.7	148.6	-166.1	176	-143.4	0	0	110.8
1070	C	31.1	Very low	45.6	Very low	84 Å²	84	101.9 Å²	101.9	57%	0.568	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	cis	-160.8	156.1	-14.1	-168	0	0	0	0	109.4	T1067	T1067-C1070 CarbonylContact O-C 3.56Å; T1067-C1070 WeakPolarHBondContact O-CA 2.9Å
1071	D	26.8	Very low	43.1	Very low	125 Å²	125	104 Å²	104	67%	0.668	59%	0.592	S	S	*	*			trans	60.3	89.8	172.1	-84	-52.8	0	0	0	116.3	T1067	T1067-D1071 PolarHBondContact O-N 3.42Å
1072	D	28	Very low	40.4	Very low	99 Å²	99	112.5 Å²	112.5	53%	0.529	63%	0.629	S	S	.	*				66.9	163.3	108.5	-165.9	24.9	0	0	0	118.8	K1074	D1072-K1074 IonicContact OD2-NZ 3.19Å
1073	Q	30.5	Very low	37.9	Very low	127 Å²	127	112.8 Å²	112.8	59%	0.593	64%	0.641	S	S	*	*			trans	80	91.9	160.9	-44	-149.6	23.7	0	0	115.8
1074	K	31.9	Very low	35.9	Very low	148 Å²	148	115.1 Å²	115.1	64%	0.643	65%	0.649	S	S	*	*				88.9	152.3	87.5	-81.8	159.2	-144.3	165.5	0	111	D1072	D1072-K1074 IonicContact OD2-NZ 3.19Å
1075	T	31.2	Very low	34	Very low	111 Å²	111	122.6 Å²	122.6	68%	0.681	68%	0.683	S	S	*	*			cis	-144	148	7.3	-0.1	0	0	0	0	106.7
1076	V	32.2	Very low	32.6	Very low	121 Å²	121	122.3 Å²	122.3	73%	0.733	70%	0.695	S	S	*	*				44	122.2	94	-168.2	0	0	0	0	110.8
1077	S	29.8	Very low	31.2	Very low	97 Å²	97	121.8 Å²	121.8	68%	0.678	70%	0.702	S	S	*	*				-177	151.4	84.6	52.3	0	0	0	0	114.8
1078	V	28.5	Very low	30.2	Very low	124 Å²	124	124.2 Å²	124.2	75%	0.752	72%	0.721	S	S	*	*				62.2	130.7	129.6	165	0	0	0	0	118.9
1079	T	26.9	Very low	29.4	Very low	118 Å²	118	126.8 Å²	126.8	72%	0.724	73%	0.734	S	S	*	*			cis	175	156.6	-33.8	26.4	0	0	0	0	106.7
1080	A	26.8	Very low	28.2	Very low	100 Å²	100	122.9 Å²	122.9	83%	0.826	73%	0.727	S	S	*	*			trans	39.9	107.3	146.5	0	0	0	0	0	120.7
1081	S	29.2	Very low	28	Very low	110 Å²	110	122.9 Å²	122.9	77%	0.769	73%	0.734	S	S	*	*				-158.3	121.1	124.5	-166	0	0	0	0	107.8
1082	F	25.6	Very low	28.3	Very low	209 Å²	209	124.4 Å²	124.4	92%	0.917	74%	0.742	S	S	*	*				53.1	110.7	74.7	-116.2	-80.1	0	0	0	113.7
1083	G	27.6	Very low	28.6	Very low	66 Å²	66	129.9 Å²	129.9	68%	0.68	76%	0.761	S	S	*	*			trans	138.5	117	154.7	0	0	0	0	0	117.8
1084	K	30.6	Very low	28.4	Very low	174 Å²	174	132 Å²	132	76%	0.757	77%	0.771	S	S	*	*			trans	73.9	117.2	148.9	-58.6	-164.6	165.3	-91.8	0	117.6
1085	E	26.2	Very low	28.1	Very low	165 Å²	165	133.8 Å²	133.8	77%	0.771	78%	0.781	S	S	*	*				67.9	114.3	69.1	-65.9	170.3	147.5	0	0	111.8
1086	G	26.2	Very low	27.9	Very low	70 Å²	70	131.8 Å²	131.8	72%	0.722	78%	0.783	S	S	*	*			trans	179.9	23.5	-175.1	0	0	0	0	0	123.8
1087	V	25.9	Very low	27.6	Very low	142 Å²	142	135.7 Å²	135.7	86%	0.861	79%	0.79	S	S	*	*			trans	69.7	160.6	158	-177.8	0	0	0	0	117.8
1088	S	24.5	Very low	27.4	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	79%	0.791	S	S	*	*			trans	60.1	85.7	166.2	46.2	0	0	0	0	118.4
1089	L	27.4	Very low	27.5	Very low	187 Å²	187	135.8 Å²	135.8	98%	0.979	79%	0.791	S	S	*	*			trans	-59.2	129.9	139.4	-83.5	157.7	0	0	0	108.5
1090	S	25.3	Very low	27.4	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	79%	0.793	S	S	*	*			trans	-122.3	162.7	175.6	48.7	0	0	0	0	109.8
1091	A	27.5	Very low	27.5	Very low	85 Å²	85	134 Å²	134	70%	0.702	79%	0.788	S	S	*	*			trans	77.5	119.8	-171.8	0	0	0	0	0	115.6
1092	D	33	Very low	27.5	Very low	156 Å²	156	134.3 Å²	134.3	83%	0.834	79%	0.786	S	S	*	*			cis	-145.2	137.1	-8.5	-80.2	-49.7	0	0	0	110.4
1093	K	33.2	Very low	27.5	Very low	214 Å²	214	132.7 Å²	132.7	93%	0.93	78%	0.781	S	S	*	*			trans	-164.2	69	167.7	-134.5	178.1	-173.6	-178.1	0	115.3
1094	E	26.3	Very low	27.6	Very low	172 Å²	172	137.5 Å²	137.5	80%	0.804	79%	0.786	S	S	*	*			trans	-125.8	120.4	158.3	-75.3	-174.1	165.7	0	0	107.6
1095	E	25.7	Very low	27.3	Very low	186 Å²	186	137.7 Å²	137.7	87%	0.869	79%	0.789	S	S	*	*				81.2	146.3	103.4	-66.2	-161.1	164.6	0	0	114.4
1096	G	26.8	Very low	27.4	Very low	69 Å²	69	138.3 Å²	138.3	71%	0.711	79%	0.794	S	S	*	*			cis	157.3	111.8	-5.1	0	0	0	0	0	113
1097	K	26.5	Very low	27.6	Very low	203 Å²	203	139.3 Å²	139.3	88%	0.883	79%	0.79	S	S	*	*			trans	-154.1	115.7	160.7	-105.7	161.6	-173.3	175.2	0	107.3
1098	S	26.4	Very low	27.7	Very low	101 Å²	101	138.8 Å²	138.8	71%	0.706	79%	0.787	S	S	*	*				75.6	113.8	99.4	-163.9	0	0	0	0	111.1
1099	T	29.2	Very low	28.1	Very low	122 Å²	122	141.8 Å²	141.8	75%	0.748	80%	0.796	S	S	*	*			cis	-157.8	142.8	10	4.7	0	0	0	0	107.1
1100	A	26.6	Very low	28.1	Very low	93 Å²	93	142.4 Å²	142.4	77%	0.769	79%	0.793	S	S	*	*				50.7	135.9	84	0	0	0	0	0	114.2
1101	A	27.2	Very low	28.6	Very low	87 Å²	87	143.4 Å²	143.4	72%	0.719	80%	0.8	S	S	*	*			cis	-168	-158.7	-8.1	0	0	0	0	0	108.5
1102	T	30	Very low	28.6	Very low	117 Å²	117	143.2 Å²	143.2	72%	0.718	81%	0.807	S	S	*	*			trans	76.8	104.6	176.1	-31.7	0	0	0	0	112.9
1103	E	25.7	Very low	28.5	Very low	175 Å²	175	140.6 Å²	140.6	82%	0.818	81%	0.806	S	S	*	*			cis	71.3	83.9	18.9	-161.6	-178.3	-134.6	0	0	115.6
1104	Q	29.5	Very low	28.2	Very low	167 Å²	167	139.8 Å²	139.8	78%	0.78	81%	0.806	S	S	*	*			trans	-163.5	102.8	152.6	-104.8	158.5	34	0	0	106.9
1105	Q	24.6	Very low	28.3	Very low	177 Å²	177	138.3 Å²	138.3	83%	0.827	81%	0.808	S	S	*	*				64.7	106.7	82.4	-72.1	-171.3	-24.9	0	0	114.8
1106	M	28	Very low	28.6	Very low	179 Å²	179	138.8 Å²	138.8	88%	0.882	81%	0.808	S	S	*	*			trans	-164.7	129.1	135.4	-111.6	172.5	67.2	0	0	113
1107	S	29.4	Very low	28.7	Very low	90 Å²	90	143.5 Å²	143.5	63%	0.629	82%	0.816	S	S	*	*			trans	30.6	111.5	152.7	53.3	0	0	0	0	119.8
1108	V	29.7	Very low	28.9	Very low	131 Å²	131	142.7 Å²	142.7	79%	0.794	82%	0.815	S	S	*	*				72.1	112.1	70.9	172.8	0	0	0	0	113.5
1109	D	31.4	Very low	29	Very low	161 Å²	161	147.4 Å²	147.4	86%	0.861	83%	0.826	S	S	*	*				-161.8	119	116	-108.1	-26.3	0	0	0	110.6
1110	E	28.1	Very low	29.1	Very low	200 Å²	200	148.5 Å²	148.5	94%	0.935	82%	0.822	S	S	*	*			trans	-103.1	122.9	173.1	-79.6	-167.8	126.1	0	0	110.7
1111	S	35.5	Very low	29.7	Very low	126 Å²	126	148.3 Å²	148.3	88%	0.881	82%	0.816	S	S	*	*			trans	-150.8	140.5	157.5	62.6	0	0	0	0	110.3
1112	G	27.7	Very low	30.6	Very low	82 Å²	82	152.4 Å²	152.4	85%	0.845	82%	0.817	S	S	*	*			cis	155.5	69.7	-3.2	0	0	0	0	0	112.2
1113	A	30.5	Very low	31.9	Very low	100 Å²	100	149.5 Å²	149.5	83%	0.826	80%	0.8	S	S	*	*			trans	-138.2	83.6	-174.9	0	0	0	0	0	112.3
1114	Q	26.4	Very low	33.6	Very low	197 Å²	197	144.2 Å²	144.2	92%	0.921	79%	0.786	S	S	*	*			trans	-89.1	121	179.2	-165.2	-179.8	25.6	0	0	110.5
1115	V	29.7	Very low	35.4	Very low	141 Å²	141	142.1 Å²	142.1	86%	0.855	78%	0.78	S	S	*	*			trans	-123.9	148.3	173.4	-176.8	0	0	0	0	110.1
1116	K	31.5	Very low	37.4	Very low	196 Å²	196	139.7 Å²	139.7	85%	0.852	76%	0.763	S	S	*	*			trans	-81.4	160.1	-157.6	-63.4	172.7	-179.6	173.4	0	114.8
1117	L	28.8	Very low	39.3	Very low	168 Å²	168	131.8 Å²	131.8	88%	0.88	73%	0.725	S	S	*	*			trans	-57.2	147.7	158.3	-63.3	152.5	0	0	0	111.8
1118	E	30.7	Very low	41.3	Very low	186 Å²	186	130.9 Å²	130.9	87%	0.869	72%	0.715	S	S	*	*			trans	-152	146.1	151.1	-117.5	156.1	-141	0	0	110.1	E1120	E1118-E1120 PolarHBondContact O-N 3.39Å
1119	E	28.8	Very low	43.5	Very low	200 Å²	200	127.4 Å²	127.4	94%	0.935	70%	0.7	S	S	*	*			trans	-93.4	89.8	-161.8	-63.2	179.1	116.4	0	0	113.4
1120	E	32.1	Very low	45.6	Very low	145 Å²	145	124.6 Å²	124.6	68%	0.678	68%	0.682	S	S	*	*			trans	-126.7	112.7	176.6	-69.6	-164.6	143.2	0	0	114.3	E1118 R1126	E1118-E1120 PolarHBondContact O-N 3.39Å; E1120-R1126 PolarHBondContact O-NH1 3.18Å
1121	S	38.2	Very low	47.8	Very low	89 Å²	89	116.3 Å²	116.3	62%	0.622	65%	0.648	S	S	*	*			trans	20.1	106.8	167.1	60.7	0	0	0	0	117.6	T1123	S1121-T1123 VanDerWaalsContact C-N 3.3Å; S1121-T1123 PolarHBondContact O-N 3.17Å
1122	F	45.9	Very low	49.8	Very low	173 Å²	173	114.9 Å²	114.9	76%	0.759	63%	0.63	S	S	*	*			trans	-74.3	74.1	175.5	-149.2	-98.3	0	0	0	111.4	L1127	F1122-L1127 HydrophobicContact CD1-CD1 4.4Å; F1122-L1127 HydrophobicContact CE1-CD1 3.73Å; F1122-L1127 HydrophobicContact CZ-CD1 4.15Å; F1122-L1127 HydrophobicContact CZ-CD2 4.4Å
1123	T	58.2	Low	52.3	Low	57 Å²	57	113.4 Å²	113.4	35%	0.35	61%	0.61	S	S	.	*			trans	-85.4	148.8	175.6	61.8	0	0	0	0	111.5	S1121 D1125 R1126	S1121-T1123 VanDerWaalsContact C-N 3.3Å; S1121-T1123 PolarHBondContact O-N 3.17Å; T1123-D1125 PolarHBondContact O-N 2.9Å; T1123-R1126 PolarHBondContact O-N 3.12Å; T1123-R1126 VanDerWaalsContact O-N 3.14Å
1124	A	60.6	Low	54.8	Low	63 Å²	63	109.6 Å²	109.6	52%	0.521	58%	0.575	S	S	.	*	H	α-helix	trans	-58.4	-38.5	175.9	0	0	0	0	0	111.5	R1126 L1127 V1128	A1124-R1126 PolarHBondContact O-N 3.23Å; A1124-L1127 PolarHBondContact O-N 3.3Å; A1124-V1128 WeakPolarHBondContact O-CG2 3.28Å; A1124-V1128 PolarHBondContact O-N 3.49Å
1125	D	67.3	Low	57.3	Low	123 Å²	123	102 Å²	102	66%	0.658	55%	0.547	S	S	*	.	H	α-helix	trans	-56	-35.2	177.6	-36.3	-56.8	0	0	0	112.5	T1123 V1128 A1129	T1123-D1125 PolarHBondContact O-N 2.9Å; D1125-V1128 PolarHBondContact O-N 3.41Å; D1125-A1129 VanDerWaalsContact O-CB 3.31Å; D1125-A1129 WeakPolarHBondContact O-CB 3.43Å; D1125-A1129 PolarHBondContact O-N 3.12Å
1126	R	67.5	Low	59.8	Low	126 Å²	126	100.7 Å²	100.7	48%	0.475	54%	0.535	S	S	.	.	H	α-helix	trans	-72.9	-33	179.3	-162.5	175.2	-170.7	163.6	8.9	112.1	E1120 T1123 A1124 Q1130	E1120-R1126 PolarHBondContact O-NH1 3.18Å; T1123-R1126 PolarHBondContact O-N 3.12Å; T1123-R1126 VanDerWaalsContact O-N 3.14Å; A1124-R1126 PolarHBondContact O-N 3.23Å; R1126-Q1130 WeakPolarHBondContact O-CG 3.34Å; R1126-Q1130 PolarHBondContact O-N 3.43Å; R1126-Q1130 VanDerWaalsContact O-N 3.08Å
1127	L	67.7	Low	62.3	Low	14 Å²	14	93.7 Å²	93.7	7%	0.073	51%	0.511	C	S	.	.	H	α-helix	trans	-75.1	-37.1	172.7	-74.8	170.3	0	0	0	112.1	F1122 A1124 Q1130 A1131 L1241 L1244	F1122-L1127 HydrophobicContact CD1-CD1 4.4Å; F1122-L1127 HydrophobicContact CE1-CD1 3.73Å; F1122-L1127 HydrophobicContact CZ-CD1 4.15Å; F1122-L1127 HydrophobicContact CZ-CD2 4.4Å; A1124-L1127 PolarHBondContact O-N 3.3Å; L1127-Q1130 PolarHBondContact O-N 3.12Å; L1127-A1131 WeakPolarHBondContact O-CB 3.47Å; L1127-A1131 PolarHBondContact O-N 3.4Å; L1127-L1241 HydrophobicContact CB-CD2 4.17Å; L1127-L1244 HydrophobicContact CD1-CD1 3.3Å
1128	V	71.9	Confident	64.9	Low	70 Å²	70	87 Å²	87	42%	0.424	48%	0.475	S	S	.	.	H	α-helix	trans	-63.5	-44.6	171.9	173.9	0	0	0	0	110.3	A1124 D1125 Q1130 A1131 N1132	A1124-V1128 WeakPolarHBondContact O-CG2 3.28Å; A1124-V1128 PolarHBondContact O-N 3.49Å; D1125-V1128 PolarHBondContact O-N 3.41Å; V1128-Q1130 VanDerWaalsContact C-N 3.32Å; V1128-Q1130 PolarHBondContact O-N 2.78Å; V1128-A1131 PolarHBondContact O-N 3.47Å; V1128-N1132 VanDerWaalsContact O-CG 3.28Å; V1128-N1132 PolarHBondContact O-N 3.45Å; V1128-N1132 PolarHBondContact O-OD1 2.86Å
1129	A	75.2	Confident	67.4	Low	59 Å²	59	81.5 Å²	81.5	49%	0.488	45%	0.454	S	S	.	.	H	α-helix	trans	-61.5	-37.9	175	0	0	0	0	0	112.9	D1125 A1133	D1125-A1129 VanDerWaalsContact O-CB 3.31Å; D1125-A1129 WeakPolarHBondContact O-CB 3.43Å; D1125-A1129 PolarHBondContact O-N 3.12Å; A1129-A1133 WeakPolarHBondContact O-CB 3.22Å; A1129-A1133 PolarHBondContact O-N 2.82Å
1130	Q	74.4	Confident	70.2	Confident	102 Å²	102	75.1 Å²	75.1	48%	0.477	43%	0.432	S	S	.	.	H	α-helix	trans	-67.9	-40.8	172.7	-79.1	-178	-34.5	0	0	112.6	R1126 L1127 V1128 L1134	R1126-Q1130 WeakPolarHBondContact O-CG 3.34Å; R1126-Q1130 PolarHBondContact O-N 3.43Å; R1126-Q1130 VanDerWaalsContact O-N 3.08Å; L1127-Q1130 PolarHBondContact O-N 3.12Å; V1128-Q1130 VanDerWaalsContact C-N 3.32Å; V1128-Q1130 PolarHBondContact O-N 2.78Å; Q1130-L1134 VanDerWaalsContact O-CB 3.25Å; Q1130-L1134 WeakPolarHBondContact O-CB 3.46Å; Q1130-L1134 PolarHBondContact O-N 3.02Å
1131	A	74.9	Confident	72.7	Confident	26 Å²	26	68.8 Å²	68.8	22%	0.215	40%	0.403	C	S	.	.	H	α-helix	trans	-63.5	-42.7	176.8	0	0	0	0	0	111.7	L1127 V1128 L1134 A1135 L1241	L1127-A1131 WeakPolarHBondContact O-CB 3.47Å; L1127-A1131 PolarHBondContact O-N 3.4Å; V1128-A1131 PolarHBondContact O-N 3.47Å; A1131-L1134 PolarHBondContact O-N 3.37Å; A1131-A1135 PolarHBondContact O-N 3.41Å; A1131-L1241 HydrophobicContact CB-CD1 4.34Å
1132	N	77.3	Confident	74.9	Confident	95 Å²	95	68.4 Å²	68.4	51%	0.508	39%	0.392	S	S	.	.	H	α-helix	trans	-64.7	-52.1	177	-67.3	7.8	0	0	0	111.5	V1128 L1134 A1135 D1136	V1128-N1132 VanDerWaalsContact O-CG 3.28Å; V1128-N1132 PolarHBondContact O-N 3.45Å; V1128-N1132 PolarHBondContact O-OD1 2.86Å; N1132-L1134 PolarHBondContact O-N 3.03Å; N1132-L1134 VanDerWaalsContact O-N 3.14Å; N1132-A1135 WeakPolarHBondContact O-CA 3.43Å; N1132-A1135 WeakPolarHBondContact O-CB 3.39Å; N1132-A1135 PolarHBondContact O-N 3.23Å; N1132-D1136 VanDerWaalsContact O-CG 3.28Å; N1132-D1136 PolarHBondContact O-N 2.85Å
1133	A	81.6	Confident	76.9	Confident	51 Å²	51	64.6 Å²	64.6	42%	0.421	38%	0.379	S	S	.	.	H	α-helix	trans	-61.4	-26.4	178.8	0	0	0	0	0	113	A1129 S1137	A1129-A1133 WeakPolarHBondContact O-CB 3.22Å; A1129-A1133 PolarHBondContact O-N 2.82Å; A1133-S1137 WeakPolarHBondContact O-CB 3.27Å; A1133-S1137 PolarHBondContact O-N 2.75Å; A1133-S1137 PolarHBondContact O-OG 3.4Å
1134	L	82.3	Confident	78.2	Confident	20 Å²	20	65.6 Å²	65.6	11%	0.105	38%	0.382	C	S	.	.	H	α-helix	trans	-77.4	-38.2	172.2	-167	79.7	0	0	0	112.3	Q1130 A1131 N1132 S1137 I1138 L1230 H1233 A1234	Q1130-L1134 VanDerWaalsContact O-CB 3.25Å; Q1130-L1134 WeakPolarHBondContact O-CB 3.46Å; Q1130-L1134 PolarHBondContact O-N 3.02Å; A1131-L1134 PolarHBondContact O-N 3.37Å; N1132-L1134 PolarHBondContact O-N 3.03Å; N1132-L1134 VanDerWaalsContact O-N 3.14Å; L1134-S1137 WeakPolarHBondContact O-CB 3.4Å; L1134-S1137 PolarHBondContact O-N 2.76Å; L1134-I1138 HydrophobicContact CG-CD1 4.3Å; L1134-I1138 WeakPolarHBondContact O-CG1 3.41Å; L1134-I1138 PolarHBondContact O-N 3.45Å; L1134-L1230 HydrophobicContact CD1-CD2 3.71Å; L1134-H1233 HydrophobicContact CD1-CB 4.06Å; L1134-H1233 HydrophobicContact CD2-CB 4.15Å; L1134-A1234 HydrophobicContact CD2-CB 3.6Å
1135	A	78.7	Confident	79.3	Confident	38 Å²	38	64 Å²	64	31%	0.314	37%	0.365	S	S	.	.	H	α-helix	trans	-61.2	-46.9	172.3	0	0	0	0	0	110.8	A1131 N1132 S1137 I1138 V1139	A1131-A1135 PolarHBondContact O-N 3.41Å; N1132-A1135 WeakPolarHBondContact O-CA 3.43Å; N1132-A1135 WeakPolarHBondContact O-CB 3.39Å; N1132-A1135 PolarHBondContact O-N 3.23Å; A1135-S1137 PolarHBondContact O-N 2.9Å; A1135-I1138 PolarHBondContact O-N 3.35Å; A1135-V1139 WeakPolarHBondContact O-CG2 3.42Å; A1135-V1139 PolarHBondContact O-N 3.46Å
1136	D	82.2	Confident	80.1	Confident	113 Å²	113	62 Å²	62	60%	0.604	35%	0.353	S	S	*	.	H	α-helix	trans	-54.5	-41.5	172.8	-58.7	-29.2	0	0	0	111.4	N1132 S1140	N1132-D1136 VanDerWaalsContact O-CG 3.28Å; N1132-D1136 PolarHBondContact O-N 2.85Å; D1136-S1140 VanDerWaalsContact O-CB 3.31Å; D1136-S1140 WeakPolarHBondContact O-CB 3.35Å; D1136-S1140 PolarHBondContact O-N 3.22Å
1137	S	85.1	Confident	81	Confident	50 Å²	50	60.5 Å²	60.5	35%	0.35	35%	0.351	S	S	.	.	H	α-helix	trans	-69.6	-32.9	177.9	-60.3	0	0	0	0	113.1	A1133 L1134 A1135 V1141 L1230	A1133-S1137 WeakPolarHBondContact O-CB 3.27Å; A1133-S1137 PolarHBondContact O-N 2.75Å; A1133-S1137 PolarHBondContact O-OG 3.4Å; L1134-S1137 WeakPolarHBondContact O-CB 3.4Å; L1134-S1137 PolarHBondContact O-N 2.76Å; A1135-S1137 PolarHBondContact O-N 2.9Å; S1137-V1141 WeakPolarHBondContact O-CG2 3.43Å; S1137-V1141 PolarHBondContact O-N 3.01Å; S1137-L1230 WeakPolarHBondContact O-CD1 3.29Å
1138	I	82.2	Confident	81.6	Confident	26 Å²	26	60.1 Å²	60.1	13%	0.133	35%	0.349	C	S	.	.	H	α-helix	trans	-71.2	-51.8	176.1	-73.7	166.5	0	0	0	109.6	L1134 A1135 S1140 V1141 E1142 L1230 A1234	L1134-I1138 HydrophobicContact CG-CD1 4.3Å; L1134-I1138 WeakPolarHBondContact O-CG1 3.41Å; L1134-I1138 PolarHBondContact O-N 3.45Å; A1135-I1138 PolarHBondContact O-N 3.35Å; I1138-S1140 VanDerWaalsContact C-N 3.28Å; I1138-S1140 PolarHBondContact O-N 3.18Å; I1138-V1141 CarbonylContact O-C 3.58Å; I1138-V1141 WeakPolarHBondContact O-CA 3.45Å; I1138-V1141 PolarHBondContact O-N 3.07Å; I1138-E1142 HydrophobicContact CG2-CG 4.19Å; I1138-E1142 WeakPolarHBondContact O-CG 3.17Å; I1138-E1142 PolarHBondContact O-N 3.37Å; I1138-L1230 HydrophobicContact CD1-CB 4.3Å; I1138-L1230 HydrophobicContact CG1-CB 3.63Å; I1138-L1230 HydrophobicContact CG1-CD1 4.34Å; I1138-A1234 HydrophobicContact CD1-CB 3.89Å
1139	V	84.4	Confident	82.1	Confident	71 Å²	71	62.7 Å²	62.7	43%	0.43	36%	0.357	S	S	.	.	H	α-helix	trans	-55.5	-44.9	176.9	174.2	0	0	0	0	110.6	A1135 V1141 E1142 D1143	A1135-V1139 WeakPolarHBondContact O-CG2 3.42Å; A1135-V1139 PolarHBondContact O-N 3.46Å; V1139-V1141 PolarHBondContact O-N 3.29Å; V1139-V1141 VanDerWaalsContact O-N 3.15Å; V1139-E1142 PolarHBondContact O-N 3.47Å; V1139-E1142 VanDerWaalsContact O-N 3.11Å; V1139-D1143 PolarHBondContact O-N 3.4Å
1140	S	86.9	Confident	82.6	Confident	66 Å²	66	64.8 Å²	64.8	46%	0.462	36%	0.355	S	S	.	.	H	α-helix	trans	-63	-20.3	176.1	179.6	0	0	0	0	114.5	D1136 I1138 L1144	D1136-S1140 VanDerWaalsContact O-CB 3.31Å; D1136-S1140 WeakPolarHBondContact O-CB 3.35Å; D1136-S1140 PolarHBondContact O-N 3.22Å; I1138-S1140 VanDerWaalsContact C-N 3.28Å; I1138-S1140 PolarHBondContact O-N 3.18Å; S1140-L1144 WeakPolarHBondContact O-CD1 3.45Å; S1140-L1144 VanDerWaalsContact O-CG 3.3Å; S1140-L1144 WeakPolarHBondContact O-CG 3.38Å
1141	V	85.3	Confident	83.2	Confident	12 Å²	12	63 Å²	63	7%	0.073	35%	0.349	C	S	.	.	H	α-helix	trans	-93.2	-31.4	173	174.9	0	0	0	0	111.3	S1137 I1138 V1139 L1144 L1145 H1223 K1226 H1227 L1230	S1137-V1141 WeakPolarHBondContact O-CG2 3.43Å; S1137-V1141 PolarHBondContact O-N 3.01Å; I1138-V1141 CarbonylContact O-C 3.58Å; I1138-V1141 WeakPolarHBondContact O-CA 3.45Å; I1138-V1141 PolarHBondContact O-N 3.07Å; V1139-V1141 PolarHBondContact O-N 3.29Å; V1139-V1141 VanDerWaalsContact O-N 3.15Å; V1141-L1144 CarbonylContact O-C 3.6Å; V1141-L1144 PolarHBondContact O-N 3.02Å; V1141-L1145 HydrophobicContact CG1-CD1 4.37Å; V1141-L1145 WeakPolarHBondContact O-CG 2.97Å; V1141-L1145 PolarHBondContact O-N 3.36Å; V1141-H1223 WeakPolarHBondContact CG1-O 3.39Å; V1141-K1226 HydrophobicContact CG1-CB 4.25Å; V1141-K1226 HydrophobicContact CG2-CB 4.33Å; V1141-H1227 HydrophobicContact CG1-CB 3.88Å; V1141-L1230 HydrophobicContact CB-CD1 4.4Å; V1141-L1230 HydrophobicContact CG2-CD1 3.81Å
1142	E	84.3	Confident	83.6	Confident	82 Å²	82	64.8 Å²	64.8	38%	0.383	35%	0.352	S	S	.	.	H	α-helix	trans	-63.4	-44.4	170.9	-69.2	173.1	151.1	0	0	110.9	I1138 V1139 L1144 L1145 I1146 H1227	I1138-E1142 HydrophobicContact CG2-CG 4.19Å; I1138-E1142 WeakPolarHBondContact O-CG 3.17Å; I1138-E1142 PolarHBondContact O-N 3.37Å; V1139-E1142 PolarHBondContact O-N 3.47Å; V1139-E1142 VanDerWaalsContact O-N 3.11Å; E1142-L1144 VanDerWaalsContact C-N 3.29Å; E1142-L1144 PolarHBondContact O-N 2.87Å; E1142-L1145 WeakPolarHBondContact O-CB 3.32Å; E1142-L1145 PolarHBondContact O-N 2.92Å; E1142-I1146 VanDerWaalsContact O-CG1 3.31Å; E1142-I1146 WeakPolarHBondContact O-CG1 3.4Å; E1142-I1146 PolarHBondContact O-N 3.23Å; E1142-H1227 IonicContact OE1-NE2 3.7Å
1143	D	86.2	Confident	83.8	Confident	93 Å²	93	62.8 Å²	62.8	50%	0.497	35%	0.349	S	S	.	.	H	α-helix	trans	-54.9	-43.2	170.7	-77.2	-31	0	0	0	112.1	V1139 L1145 I1146 E1147	V1139-D1143 PolarHBondContact O-N 3.4Å; D1143-L1145 VanDerWaalsContact C-N 3.3Å; D1143-L1145 PolarHBondContact O-N 2.77Å; D1143-I1146 PolarHBondContact O-N 3.08Å; D1143-E1147 PolarHBondContact O-N 3.35Å
1144	L	86.6	Confident	84	Confident	77 Å²	77	65 Å²	65	40%	0.403	35%	0.35	S	S	.	.	H	α-helix	trans	-74.6	-16.7	178.2	-73.8	175	0	0	0	113.8	S1140 V1141 E1142 H1223	S1140-L1144 WeakPolarHBondContact O-CD1 3.45Å; S1140-L1144 VanDerWaalsContact O-CG 3.3Å; S1140-L1144 WeakPolarHBondContact O-CG 3.38Å; V1141-L1144 CarbonylContact O-C 3.6Å; V1141-L1144 PolarHBondContact O-N 3.02Å; E1142-L1144 VanDerWaalsContact C-N 3.29Å; E1142-L1144 PolarHBondContact O-N 2.87Å; L1144-H1223 PolarHBondContact O-ND1 3.24Å
1145	L	83.8	Confident	84.1	Confident	31 Å²	31	64.7 Å²	64.7	16%	0.162	35%	0.349	C	S	.	.	H	α-helix	trans	-81.9	-46.8	168.7	-74	165.3	0	0	0	109.6	V1141 E1142 D1143 E1147 S1148 E1149 N1220 H1223 H1227	V1141-L1145 HydrophobicContact CG1-CD1 4.37Å; V1141-L1145 WeakPolarHBondContact O-CG 2.97Å; V1141-L1145 PolarHBondContact O-N 3.36Å; E1142-L1145 WeakPolarHBondContact O-CB 3.32Å; E1142-L1145 PolarHBondContact O-N 2.92Å; D1143-L1145 VanDerWaalsContact C-N 3.3Å; D1143-L1145 PolarHBondContact O-N 2.77Å; L1145-E1147 VanDerWaalsContact C-N 3.33Å; L1145-E1147 PolarHBondContact O-N 2.97Å; L1145-S1148 CarbonylContact O-C 3.59Å; L1145-S1148 WeakPolarHBondContact O-CA 3.44Å; L1145-S1148 WeakPolarHBondContact O-CB 3.37Å; L1145-S1148 PolarHBondContact O-N 3.18Å; L1145-S1148 PolarHBondContact O-OG 3.04Å; L1145-E1149 PolarHBondContact O-N 3.06Å; L1145-N1220 WeakPolarHBondContact CD2-OD1 3.27Å; L1145-H1223 HydrophobicContact CD2-CB 3.61Å; L1145-H1223 HydrophobicContact CG-CB 4.03Å; L1145-H1227 HydrophobicContact CD1-CB 4.26Å
1146	I	84.4	Confident	84.3	Confident	81 Å²	81	69.5 Å²	69.5	42%	0.415	37%	0.365	S	S	.	.	H	α-helix	trans	-57.1	-42.7	175.8	-69.4	163.3	0	0	0	111.4	E1142 D1143 S1148 E1149 K1150	E1142-I1146 VanDerWaalsContact O-CG1 3.31Å; E1142-I1146 WeakPolarHBondContact O-CG1 3.4Å; E1142-I1146 PolarHBondContact O-N 3.23Å; D1143-I1146 PolarHBondContact O-N 3.08Å; I1146-S1148 VanDerWaalsContact C-N 3.32Å; I1146-S1148 PolarHBondContact O-N 3.49Å; I1146-E1149 PolarHBondContact O-N 2.95Å; I1146-K1150 WeakPolarHBondContact O-CG 3.47Å; I1146-K1150 PolarHBondContact O-N 3.16Å; I1146-K1150 VanDerWaalsContact O-N 3.09Å
1147	E	84.8	Confident	84.4	Confident	94 Å²	94	67.4 Å²	67.4	44%	0.439	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-36.7	175.6	-156.9	63.1	-149.9	0	0	111.7	D1143 L1145 E1149 K1150 D1151	D1143-E1147 PolarHBondContact O-N 3.35Å; L1145-E1147 VanDerWaalsContact C-N 3.33Å; L1145-E1147 PolarHBondContact O-N 2.97Å; E1147-E1149 VanDerWaalsContact C-N 3.32Å; E1147-E1149 PolarHBondContact O-N 2.97Å; E1147-K1150 WeakPolarHBondContact O-CB 3.44Å; E1147-K1150 PolarHBondContact O-N 2.94Å; E1147-K1150 IonicContact OE1-NZ 2.7Å; E1147-K1150 WeakPolarHBondContact OE2-CD 3.31Å; E1147-K1150 IonicContact OE2-NZ 2.72Å; E1147-K1150 PolarHBondContact OE2-NZ 3.15Å; E1147-D1151 PolarHBondContact O-N 3.44Å
1148	S	81.5	Confident	84.4	Confident	5 Å²	5	69.6 Å²	69.6	4%	0.035	36%	0.362	C	S	.	.	H	α-helix	trans	-66.3	-33.8	173.9	83.2	0	0	0	0	112.4	L1145 I1146 D1151 F1152 N1220	L1145-S1148 CarbonylContact O-C 3.59Å; L1145-S1148 WeakPolarHBondContact O-CA 3.44Å; L1145-S1148 WeakPolarHBondContact O-CB 3.37Å; L1145-S1148 PolarHBondContact O-N 3.18Å; L1145-S1148 PolarHBondContact O-OG 3.04Å; I1146-S1148 VanDerWaalsContact C-N 3.32Å; I1146-S1148 PolarHBondContact O-N 3.49Å; S1148-D1151 PolarHBondContact O-N 2.99Å; S1148-F1152 WeakPolarHBondContact O-CD2 3.3Å; S1148-F1152 PolarHBondContact O-N 3.18Å; S1148-N1220 PolarHBondContact OG-ND2 3.27Å
1149	E	82.3	Confident	84.5	Confident	125 Å²	125	71.8 Å²	71.8	58%	0.584	37%	0.371	S	S	*	.	H	α-helix	trans	-66.6	-36.9	173.8	-70	-175.4	160.9	0	0	111.9	L1145 I1146 E1147 F1152 A1153	L1145-E1149 PolarHBondContact O-N 3.06Å; I1146-E1149 PolarHBondContact O-N 2.95Å; E1147-E1149 VanDerWaalsContact C-N 3.32Å; E1147-E1149 PolarHBondContact O-N 2.97Å; E1149-F1152 PolarHBondContact O-N 3.36Å; E1149-A1153 WeakPolarHBondContact O-CB 3.43Å; E1149-A1153 PolarHBondContact O-N 3.08Å
1150	K	85.6	Confident	84.4	Confident	102 Å²	102	72.8 Å²	72.8	44%	0.443	37%	0.371	S	S	.	.	H	α-helix	trans	-63	-43.6	170.9	-63.6	171	-162.2	162.3	0	111.6	I1146 E1147 A1153 Q1154	I1146-K1150 WeakPolarHBondContact O-CG 3.47Å; I1146-K1150 PolarHBondContact O-N 3.16Å; I1146-K1150 VanDerWaalsContact O-N 3.09Å; E1147-K1150 WeakPolarHBondContact O-CB 3.44Å; E1147-K1150 PolarHBondContact O-N 2.94Å; E1147-K1150 IonicContact OE1-NZ 2.7Å; E1147-K1150 WeakPolarHBondContact OE2-CD 3.31Å; E1147-K1150 IonicContact OE2-NZ 2.72Å; E1147-K1150 PolarHBondContact OE2-NZ 3.15Å; K1150-A1153 PolarHBondContact O-N 3.24Å; K1150-Q1154 WeakPolarHBondContact O-CG 3.46Å; K1150-Q1154 PolarHBondContact O-N 2.73Å
1151	D	86	Confident	84.3	Confident	66 Å²	66	74 Å²	74	35%	0.353	37%	0.372	S	S	.	.	H	α-helix	trans	-62.7	-40.8	175.2	-92.6	-15.5	0	0	0	111.9	E1147 S1148 Q1154 L1155 L1216	E1147-D1151 PolarHBondContact O-N 3.44Å; S1148-D1151 PolarHBondContact O-N 2.99Å; D1151-Q1154 PolarHBondContact O-N 3.38Å; D1151-L1155 PolarHBondContact O-N 2.71Å; D1151-L1216 HydrophobicContact CB-CD1 3.79Å; D1151-L1216 HydrophobicContact CB-CD2 4.03Å
1152	F	83.4	Confident	84.2	Confident	62 Å²	62	74.1 Å²	74.1	27%	0.272	37%	0.373	S	S	.	.	H	α-helix	trans	-62.2	-43.4	172.1	-88.5	-70.6	0	0	0	112	S1148 E1149 Q1154 L1155 Q1156 V1213 L1216 I1217 N1220	S1148-F1152 WeakPolarHBondContact O-CD2 3.3Å; S1148-F1152 PolarHBondContact O-N 3.18Å; E1149-F1152 PolarHBondContact O-N 3.36Å; F1152-Q1154 PolarHBondContact O-N 3.48Å; F1152-L1155 PolarHBondContact O-N 3.1Å; F1152-Q1156 WeakPolarHBondContact O-CB 2.86Å; F1152-Q1156 PolarHBondContact O-N 2.78Å; F1152-V1213 HydrophobicContact CE1-CG1 4.46Å; F1152-L1216 HydrophobicContact CE1-CB 4.38Å; F1152-L1216 HydrophobicContact CE2-CB 3.96Å; F1152-L1216 HydrophobicContact CZ-CB 3.8Å; F1152-I1217 HydrophobicContact CE1-CG1 4.23Å; F1152-I1217 HydrophobicContact CZ-CG1 3.83Å; F1152-N1220 HydrophobicContact CE2-CB 4.18Å
1153	A	82.9	Confident	84.2	Confident	54 Å²	54	72.5 Å²	72.5	45%	0.446	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-39.3	175.9	0	0	0	0	0	112.3	E1149 K1150 Q1156 S1157	E1149-A1153 WeakPolarHBondContact O-CB 3.43Å; E1149-A1153 PolarHBondContact O-N 3.08Å; K1150-A1153 PolarHBondContact O-N 3.24Å; A1153-Q1156 PolarHBondContact O-N 3.44Å; A1153-S1157 PolarHBondContact O-N 3.38Å
1154	Q	84.8	Confident	84.1	Confident	97 Å²	97	71.7 Å²	71.7	45%	0.453	37%	0.366	S	S	.	.	H	α-helix	trans	-63.7	-40.5	172.8	-75.8	-168.3	49.6	0	0	112.7	K1150 D1151 F1152 K1158	K1150-Q1154 WeakPolarHBondContact O-CG 3.46Å; K1150-Q1154 PolarHBondContact O-N 2.73Å; D1151-Q1154 PolarHBondContact O-N 3.38Å; F1152-Q1154 PolarHBondContact O-N 3.48Å; Q1154-K1158 WeakPolarHBondContact O-CD 3.28Å; Q1154-K1158 WeakPolarHBondContact O-CG 3.43Å; Q1154-K1158 PolarHBondContact O-N 3.33Å
1155	L	85.6	Confident	83.9	Confident	14 Å²	14	70.4 Å²	70.4	7%	0.073	36%	0.361	C	S	.	.	H	α-helix	trans	-69.8	-37.1	174.1	-71.7	-168.5	0	0	0	112	D1151 F1152 S1157 K1158 F1159 L1209 K1212 V1213 L1216	D1151-L1155 PolarHBondContact O-N 2.71Å; F1152-L1155 PolarHBondContact O-N 3.1Å; L1155-S1157 VanDerWaalsContact C-N 3.34Å; L1155-S1157 PolarHBondContact O-N 3.4Å; L1155-K1158 CarbonylContact O-C 3.57Å; L1155-K1158 PolarHBondContact O-N 3.13Å; L1155-F1159 WeakPolarHBondContact O-CB 3.38Å; L1155-F1159 WeakPolarHBondContact O-CD2 3.48Å; L1155-F1159 PolarHBondContact O-N 2.56Å; L1155-L1209 HydrophobicContact CD2-CD2 3.97Å; L1155-K1212 HydrophobicContact CD1-CB 3.93Å; L1155-K1212 HydrophobicContact CD2-CB 4.31Å; L1155-K1212 HydrophobicContact CD2-CD 4.4Å; L1155-V1213 HydrophobicContact CD1-CB 4.46Å; L1155-V1213 HydrophobicContact CD1-CG2 3.65Å; L1155-L1216 HydrophobicContact CD1-CD1 3.55Å; L1155-L1216 HydrophobicContact CG-CD1 4.22Å
1156	Q	81.9	Confident	83.8	Confident	138 Å²	138	71.7 Å²	71.7	65%	0.645	37%	0.37	S	S	*	.	H	α-helix	trans	-60.4	-43.8	175.3	-175.1	179.6	0.6	0	0	111.1	F1152 A1153 F1159 Q1160	F1152-Q1156 WeakPolarHBondContact O-CB 2.86Å; F1152-Q1156 PolarHBondContact O-N 2.78Å; A1153-Q1156 PolarHBondContact O-N 3.44Å; Q1156-F1159 PolarHBondContact O-N 3.04Å; Q1156-Q1160 PolarHBondContact O-N 2.95Å
1157	S	84.4	Confident	83.6	Confident	69 Å²	69	72.9 Å²	72.9	48%	0.483	37%	0.374	S	S	.	.	H	α-helix	trans	-57.5	-49.3	173	-169.5	0	0	0	0	111.6	A1153 L1155 F1159 Q1160 D1161	A1153-S1157 PolarHBondContact O-N 3.38Å; L1155-S1157 VanDerWaalsContact C-N 3.34Å; L1155-S1157 PolarHBondContact O-N 3.4Å; S1157-F1159 VanDerWaalsContact C-N 3.29Å; S1157-F1159 PolarHBondContact O-N 3.02Å; S1157-Q1160 WeakPolarHBondContact O-CA 3.23Å; S1157-Q1160 WeakPolarHBondContact O-CB 3.23Å; S1157-Q1160 PolarHBondContact O-N 3.33Å; S1157-D1161 PolarHBondContact O-N 3.19Å
1158	K	86	Confident	83.6	Confident	96 Å²	96	71.3 Å²	71.3	42%	0.417	38%	0.377	S	S	.	.	H	α-helix	trans	-65.3	-28.5	178.1	-69.8	160.4	-175.1	156.3	0	113.2	Q1154 L1155 V1162 L1209	Q1154-K1158 WeakPolarHBondContact O-CD 3.28Å; Q1154-K1158 WeakPolarHBondContact O-CG 3.43Å; Q1154-K1158 PolarHBondContact O-N 3.33Å; L1155-K1158 CarbonylContact O-C 3.57Å; L1155-K1158 PolarHBondContact O-N 3.13Å; K1158-V1162 WeakPolarHBondContact O-CG2 3.45Å; K1158-V1162 PolarHBondContact O-N 3.22Å; K1158-L1209 HydrophobicContact CB-CD2 3.98Å
1159	F	84	Confident	83.7	Confident	73 Å²	73	71.6 Å²	71.6	32%	0.32	38%	0.379	S	S	.	.	H	α-helix	trans	-72.9	-38	169.3	-98.1	-79.2	0	0	0	112.1	L1155 Q1156 S1157 V1162 S1163 L1206 L1209 V1213	L1155-F1159 WeakPolarHBondContact O-CB 3.38Å; L1155-F1159 WeakPolarHBondContact O-CD2 3.48Å; L1155-F1159 PolarHBondContact O-N 2.56Å; Q1156-F1159 PolarHBondContact O-N 3.04Å; S1157-F1159 VanDerWaalsContact C-N 3.29Å; S1157-F1159 PolarHBondContact O-N 3.02Å; F1159-V1162 PolarHBondContact O-N 3.14Å; F1159-S1163 PolarHBondContact O-N 3.49Å; F1159-L1206 HydrophobicContact CD1-CD2 4.05Å; F1159-L1206 HydrophobicContact CE1-CD2 3.64Å; F1159-L1209 HydrophobicContact CD2-CB 4.23Å; F1159-L1209 HydrophobicContact CD2-CD1 4.34Å; F1159-L1209 HydrophobicContact CE2-CB 3.56Å; F1159-L1209 HydrophobicContact CE2-CD1 4.42Å; F1159-L1209 HydrophobicContact CE2-CG 4.49Å; F1159-L1209 HydrophobicContact CG-CD1 4.46Å; F1159-L1209 HydrophobicContact CZ-CB 3.72Å; F1159-V1213 HydrophobicContact CD2-CG2 4.47Å; F1159-V1213 HydrophobicContact CE2-CG2 3.66Å; F1159-V1213 HydrophobicContact CZ-CG2 4.47Å
1160	Q	82.1	Confident	83.5	Confident	92 Å²	92	68.2 Å²	68.2	43%	0.43	37%	0.369	S	S	.	.	H	α-helix	trans	-66.4	-41	176.7	-168.1	62.9	53.3	0	0	111.4	Q1156 S1157 V1162 S1163 N1164	Q1156-Q1160 PolarHBondContact O-N 2.95Å; S1157-Q1160 WeakPolarHBondContact O-CA 3.23Å; S1157-Q1160 WeakPolarHBondContact O-CB 3.23Å; S1157-Q1160 PolarHBondContact O-N 3.33Å; Q1160-V1162 PolarHBondContact O-N 3.16Å; Q1160-S1163 PolarHBondContact O-N 3.35Å; Q1160-S1163 VanDerWaalsContact O-N 3.14Å; Q1160-N1164 PolarHBondContact NE2-OD1 3.2Å; Q1160-N1164 VanDerWaalsContact O-CB 3.31Å; Q1160-N1164 WeakPolarHBondContact O-CB 3.38Å; Q1160-N1164 PolarHBondContact O-N 2.83Å; Q1160-N1164 PolarHBondContact O-ND2 3.26Å; Q1160-N1164 PolarHBondContact O-OD1 3.04Å
1161	D	84	Confident	83.3	Confident	92 Å²	92	66.4 Å²	66.4	49%	0.492	37%	0.369	S	S	.	.	H	α-helix	trans	-57.1	-40	172.8	-71.9	-32.4	0	0	0	112	S1157 T1165	S1157-D1161 PolarHBondContact O-N 3.19Å; D1161-T1165 PolarHBondContact O-N 3.14Å; D1161-T1165 VanDerWaalsContact O-N 3.15Å; D1161-T1165 PolarHBondContact O-OG1 3.2Å
1162	V	84.5	Confident	83.1	Confident	13 Å²	13	66.9 Å²	66.9	8%	0.079	37%	0.369	C	S	.	.	H	α-helix	trans	-69.5	-43.9	174.5	173.2	0	0	0	0	111.2	K1158 F1159 Q1160 T1165 V1166 M1202 L1206 L1209	K1158-V1162 WeakPolarHBondContact O-CG2 3.45Å; K1158-V1162 PolarHBondContact O-N 3.22Å; F1159-V1162 PolarHBondContact O-N 3.14Å; Q1160-V1162 PolarHBondContact O-N 3.16Å; V1162-T1165 WeakPolarHBondContact CA-OG1 3.34Å; V1162-T1165 PolarHBondContact O-N 2.81Å; V1162-T1165 PolarHBondContact O-OG1 3.34Å; V1162-T1165 VanDerWaalsContact O-OG1 3.13Å; V1162-V1166 WeakPolarHBondContact O-CG2 3.44Å; V1162-V1166 PolarHBondContact O-N 3.02Å; V1162-M1202 HydrophobicContact CG1-CE 3.91Å; V1162-M1202 WeakPolarHBondContact O-CE 3.32Å; V1162-L1206 HydrophobicContact CG1-CD1 4.26Å; V1162-L1206 HydrophobicContact CG1-CD2 3.65Å; V1162-L1206 HydrophobicContact CG1-CG 3.79Å; V1162-L1209 HydrophobicContact CG2-CD1 4.09Å
1163	S	82.5	Confident	82.9	Confident	48 Å²	48	66.5 Å²	66.5	34%	0.336	37%	0.372	S	S	.	.	H	α-helix	trans	-59.6	-51.1	175.7	-162.5	0	0	0	0	111.5	F1159 Q1160 T1165 V1166 E1167	F1159-S1163 PolarHBondContact O-N 3.49Å; Q1160-S1163 PolarHBondContact O-N 3.35Å; Q1160-S1163 VanDerWaalsContact O-N 3.14Å; S1163-T1165 PolarHBondContact O-N 3.3Å; S1163-T1165 VanDerWaalsContact O-N 3.16Å; S1163-V1166 PolarHBondContact O-N 3.48Å; S1163-E1167 WeakPolarHBondContact O-CB 3.17Å; S1163-E1167 WeakPolarHBondContact O-CG 3.47Å; S1163-E1167 PolarHBondContact O-N 3.26Å; S1163-E1167 PolarHBondContact OG-OE1 2.94Å
1164	N	84.8	Confident	82.6	Confident	77 Å²	77	69.7 Å²	69.7	41%	0.412	38%	0.377	S	S	.	.	H	α-helix	trans	-53	-38.7	176.6	-65.9	-15.6	0	0	0	111.7	Q1160 A1168	Q1160-N1164 PolarHBondContact NE2-OD1 3.2Å; Q1160-N1164 VanDerWaalsContact O-CB 3.31Å; Q1160-N1164 WeakPolarHBondContact O-CB 3.38Å; Q1160-N1164 PolarHBondContact O-N 2.83Å; Q1160-N1164 PolarHBondContact O-ND2 3.26Å; Q1160-N1164 PolarHBondContact O-OD1 3.04Å; N1164-A1168 VanDerWaalsContact O-CB 3.31Å; N1164-A1168 WeakPolarHBondContact O-CB 3.24Å; N1164-A1168 PolarHBondContact O-N 3.02Å
1165	T	83	Confident	82.3	Confident	49 Å²	49	69.7 Å²	69.7	30%	0.301	38%	0.377	S	S	.	.	H	α-helix	trans	-81.2	-26	178.6	43.5	0	0	0	0	113.8	D1161 V1162 S1163 C1169 M1202	D1161-T1165 PolarHBondContact O-N 3.14Å; D1161-T1165 VanDerWaalsContact O-N 3.15Å; D1161-T1165 PolarHBondContact O-OG1 3.2Å; V1162-T1165 WeakPolarHBondContact CA-OG1 3.34Å; V1162-T1165 PolarHBondContact O-N 2.81Å; V1162-T1165 PolarHBondContact O-OG1 3.34Å; V1162-T1165 VanDerWaalsContact O-OG1 3.13Å; S1163-T1165 PolarHBondContact O-N 3.3Å; S1163-T1165 VanDerWaalsContact O-N 3.16Å; T1165-C1169 PolarHBondContact O-N 3.32Å; T1165-C1169 VanDerWaalsContact O-N 3.15Å; T1165-C1169 PolarHBondContact O-SG 3.21Å; T1165-M1202 WeakPolarHBondContact OG1-CE 3.48Å
1166	V	81.8	Confident	81.9	Confident	58 Å²	58	69.7 Å²	69.7	35%	0.352	38%	0.377	S	S	.	.	H	α-helix	trans	-69.8	-46.7	168.4	174.8	0	0	0	0	109.5	V1162 S1163 A1168 C1169 S1170 M1202	V1162-V1166 WeakPolarHBondContact O-CG2 3.44Å; V1162-V1166 PolarHBondContact O-N 3.02Å; S1163-V1166 PolarHBondContact O-N 3.48Å; V1166-A1168 VanDerWaalsContact C-N 3.34Å; V1166-A1168 PolarHBondContact O-N 3Å; V1166-C1169 PolarHBondContact O-N 3.46Å; V1166-C1169 VanDerWaalsContact O-N 3.13Å; V1166-S1170 WeakPolarHBondContact O-CB 3.38Å; V1166-S1170 PolarHBondContact O-N 3.11Å; V1166-M1202 HydrophobicContact CB-CE 4.37Å; V1166-M1202 HydrophobicContact CG2-CE 3.45Å; V1166-M1202 VanDerWaalsContact CG2-CE 3.45Å
1167	E	80.7	Confident	81.3	Confident	106 Å²	106	67.3 Å²	67.3	50%	0.495	37%	0.368	S	S	.	.	H	α-helix	trans	-59.2	-43.2	176.8	-72.9	168.4	-131.8	0	0	111.5	S1163 C1169 S1170 C1171	S1163-E1167 WeakPolarHBondContact O-CB 3.17Å; S1163-E1167 WeakPolarHBondContact O-CG 3.47Å; S1163-E1167 PolarHBondContact O-N 3.26Å; S1163-E1167 PolarHBondContact OG-OE1 2.94Å; E1167-C1169 PolarHBondContact O-N 3.36Å; E1167-S1170 PolarHBondContact O-N 2.7Å; E1167-C1171 WeakPolarHBondContact O-CB 3.49Å; E1167-C1171 PolarHBondContact O-N 3.04Å
1168	A	83.5	Confident	80.7	Confident	61 Å²	61	68 Å²	68	50%	0.504	37%	0.367	S	S	.	.	H	α-helix	trans	-61.5	-41.1	173.8	0	0	0	0	0	112.6	N1164 V1166 H1172	N1164-A1168 VanDerWaalsContact O-CB 3.31Å; N1164-A1168 WeakPolarHBondContact O-CB 3.24Å; N1164-A1168 PolarHBondContact O-N 3.02Å; V1166-A1168 VanDerWaalsContact C-N 3.34Å; V1166-A1168 PolarHBondContact O-N 3Å; A1168-H1172 WeakPolarHBondContact O-CB 3.44Å; A1168-H1172 PolarHBondContact O-N 3.44Å; A1168-H1172 VanDerWaalsContact O-N 3.09Å
1169	C	83.3	Confident	80	Confident	11 Å²	11	70.2 Å²	70.2	7%	0.074	37%	0.373	C	S	.	.	H	α-helix	trans	-68.5	-42.8	175.8	-66.8	0	0	0	0	111.8	T1165 V1166 E1167 H1172 V1173 I1195 L1199	T1165-C1169 PolarHBondContact O-N 3.32Å; T1165-C1169 VanDerWaalsContact O-N 3.15Å; T1165-C1169 PolarHBondContact O-SG 3.21Å; V1166-C1169 PolarHBondContact O-N 3.46Å; V1166-C1169 VanDerWaalsContact O-N 3.13Å; E1167-C1169 PolarHBondContact O-N 3.36Å; C1169-H1172 PolarHBondContact O-N 2.9Å; C1169-V1173 WeakPolarHBondContact O-CG2 3.1Å; C1169-V1173 PolarHBondContact O-N 3.45Å; C1169-I1195 HydrophobicContact CB-CG2 3.91Å; C1169-L1199 HydrophobicContact CB-CD2 4.04Å; C1169-L1199 HydrophobicContact CB-CG 4.42Å
1170	S	78.2	Confident	79	Confident	54 Å²	54	69.1 Å²	69.1	38%	0.378	37%	0.372	S	S	.	.	H	α-helix	trans	-63.3	-47.5	177.7	-179.4	0	0	0	0	111.8	V1166 E1167 H1172 V1173 H1174	V1166-S1170 WeakPolarHBondContact O-CB 3.38Å; V1166-S1170 PolarHBondContact O-N 3.11Å; E1167-S1170 PolarHBondContact O-N 2.7Å; S1170-H1172 VanDerWaalsContact C-N 3.27Å; S1170-H1172 PolarHBondContact O-N 2.65Å; S1170-V1173 PolarHBondContact O-N 3.07Å; S1170-V1173 VanDerWaalsContact O-N 3.09Å; S1170-H1174 PolarHBondContact O-CD2 3.18Å; S1170-H1174 VanDerWaalsContact O-CD2 3.29Å; S1170-H1174 PolarHBondContact O-N 3.45Å
1171	C	81.3	Confident	77.9	Confident	65 Å²	65	72.1 Å²	72.1	44%	0.439	39%	0.386	S	S	.	.	H	α-helix	trans	-59.6	-38.3	174.5	-174.3	0	0	0	0	111.5	E1167 H1174 Q1175	E1167-C1171 WeakPolarHBondContact O-CB 3.49Å; E1167-C1171 PolarHBondContact O-N 3.04Å; C1171-H1174 PolarHBondContact O-N 2.97Å; C1171-Q1175 VanDerWaalsContact O-CG 3.26Å; C1171-Q1175 WeakPolarHBondContact O-CG 3.23Å; C1171-Q1175 PolarHBondContact O-N 3.22Å; C1171-Q1175 PolarHBondContact SG-NE2 3.4Å; C1171-Q1175 VanDerWaalsContact SG-NE2 3.41Å
1172	H	81.8	Confident	76.8	Confident	76 Å²	76	74.4 Å²	74.4	35%	0.352	39%	0.391	S	S	.	.	H	α-helix	trans	-66.1	-41.9	173.4	-164.4	43.5	0	0	0	112.3	A1168 C1169 S1170 Q1175 L1176	A1168-H1172 WeakPolarHBondContact O-CB 3.44Å; A1168-H1172 PolarHBondContact O-N 3.44Å; A1168-H1172 VanDerWaalsContact O-N 3.09Å; C1169-H1172 PolarHBondContact O-N 2.9Å; S1170-H1172 VanDerWaalsContact C-N 3.27Å; S1170-H1172 PolarHBondContact O-N 2.65Å; H1172-Q1175 PolarHBondContact O-N 3.38Å; H1172-L1176 VanDerWaalsContact O-CG 3.31Å; H1172-L1176 WeakPolarHBondContact O-CG 3.38Å; H1172-L1176 PolarHBondContact O-N 2.89Å
1173	V	79.7	Confident	75.5	Confident	54 Å²	54	80 Å²	80	33%	0.327	42%	0.417	S	S	.	.	H	α-helix	trans	-61.4	-45.6	173.6	170.6	0	0	0	0	111.5	C1169 S1170 Q1175 L1176 L1177 I1195	C1169-V1173 WeakPolarHBondContact O-CG2 3.1Å; C1169-V1173 PolarHBondContact O-N 3.45Å; S1170-V1173 PolarHBondContact O-N 3.07Å; S1170-V1173 VanDerWaalsContact O-N 3.09Å; V1173-Q1175 VanDerWaalsContact C-N 3.33Å; V1173-Q1175 PolarHBondContact O-N 3.4Å; V1173-L1176 PolarHBondContact O-N 3.08Å; V1173-L1177 HydrophobicContact CG1-CD1 3.98Å; V1173-L1177 HydrophobicContact CG1-CG 4.38Å; V1173-L1177 WeakPolarHBondContact O-CG 3.44Å; V1173-L1177 PolarHBondContact O-N 2.96Å; V1173-I1195 HydrophobicContact CG2-CD1 4.13Å; V1173-I1195 HydrophobicContact CG2-CG2 4.11Å
1174	H	76.9	Confident	74.1	Confident	120 Å²	120	87.1 Å²	87.1	56%	0.556	44%	0.441	S	S	*	.	H	α-helix	trans	-60.4	-39.3	174.9	-80.9	-71.7	0	0	0	112.6	S1170 C1171 L1176 L1177 D1178	S1170-H1174 PolarHBondContact O-CD2 3.18Å; S1170-H1174 VanDerWaalsContact O-CD2 3.29Å; S1170-H1174 PolarHBondContact O-N 3.45Å; C1171-H1174 PolarHBondContact O-N 2.97Å; H1174-L1176 VanDerWaalsContact C-N 3.28Å; H1174-L1176 PolarHBondContact O-N 3.27Å; H1174-L1177 PolarHBondContact O-N 2.89Å; H1174-D1178 WeakPolarHBondContact O-CB 3.5Å; H1174-D1178 PolarHBondContact O-N 3.2Å
1175	Q	79	Confident	72.6	Confident	97 Å²	97	86.8 Å²	86.8	45%	0.453	45%	0.445	S	S	.	.	H	α-helix	trans	-66.3	-26.7	173.9	-72.5	171.2	24.4	0	0	113.6	C1171 H1172 V1173 R1179	C1171-Q1175 VanDerWaalsContact O-CG 3.26Å; C1171-Q1175 WeakPolarHBondContact O-CG 3.23Å; C1171-Q1175 PolarHBondContact O-N 3.22Å; C1171-Q1175 PolarHBondContact SG-NE2 3.4Å; C1171-Q1175 VanDerWaalsContact SG-NE2 3.41Å; H1172-Q1175 PolarHBondContact O-N 3.38Å; V1173-Q1175 VanDerWaalsContact C-N 3.33Å; V1173-Q1175 PolarHBondContact O-N 3.4Å; Q1175-R1179 WeakPolarHBondContact O-CD 3.4Å; Q1175-R1179 VanDerWaalsContact O-CG 3.32Å; Q1175-R1179 WeakPolarHBondContact O-CG 3.38Å
1176	L	76.3	Confident	71.3	Confident	15 Å²	15	89.4 Å²	89.4	8%	0.079	47%	0.471	C	S	.	.	H	α-helix	trans	-79.6	-37.3	173.3	-63.3	170.1	0	0	0	111	H1172 V1173 H1174 R1179 T1180 L1188 T1191 I1195	H1172-L1176 VanDerWaalsContact O-CG 3.31Å; H1172-L1176 WeakPolarHBondContact O-CG 3.38Å; H1172-L1176 PolarHBondContact O-N 2.89Å; V1173-L1176 PolarHBondContact O-N 3.08Å; H1174-L1176 VanDerWaalsContact C-N 3.28Å; H1174-L1176 PolarHBondContact O-N 3.27Å; L1176-R1179 PolarHBondContact O-N 3.26Å; L1176-T1180 PolarHBondContact O-N 3.25Å; L1176-L1188 HydrophobicContact CB-CD2 4.33Å; L1176-L1188 HydrophobicContact CD2-CD2 3.75Å; L1176-L1188 HydrophobicContact CG-CD2 4.49Å; L1176-T1191 HydrophobicContact CD1-CG2 4.04Å; L1176-T1191 HydrophobicContact CD2-CG2 4.12Å; L1176-I1195 HydrophobicContact CD1-CD1 3.86Å
1177	L	70.6	Confident	70.2	Confident	87 Å²	87	94.5 Å²	94.5	46%	0.455	49%	0.491	S	S	.	.	H	α-helix	trans	-65.8	-47.1	174.9	-70.4	170	0	0	0	112.2	V1173 H1174 R1179 T1180 E1181	V1173-L1177 HydrophobicContact CG1-CD1 3.98Å; V1173-L1177 HydrophobicContact CG1-CG 4.38Å; V1173-L1177 WeakPolarHBondContact O-CG 3.44Å; V1173-L1177 PolarHBondContact O-N 2.96Å; H1174-L1177 PolarHBondContact O-N 2.89Å; L1177-R1179 PolarHBondContact O-N 3.26Å; L1177-R1179 VanDerWaalsContact O-N 3.09Å; L1177-T1180 WeakPolarHBondContact CA-OG1 3.43Å; L1177-T1180 WeakPolarHBondContact O-CA 3.44Å; L1177-T1180 PolarHBondContact O-N 3.18Å; L1177-T1180 PolarHBondContact O-OG1 2.93Å; L1177-E1181 PolarHBondContact O-N 3.18Å
1178	D	71.8	Confident	69.1	Low	85 Å²	85	91.7 Å²	91.7	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-59.5	-23.9	176.7	-177.5	72.8	0	0	0	113	H1174 K1182	H1174-D1178 WeakPolarHBondContact O-CB 3.5Å; H1174-D1178 PolarHBondContact O-N 3.2Å; D1178-K1182 WeakPolarHBondContact O-CG 3.42Å; D1178-K1182 PolarHBondContact O-NZ 3.48Å; D1178-K1182 IonicContact OD1-NZ 4Å; D1178-K1182 PolarHBondContact OD1-NZ 2.97Å; D1178-K1182 IonicContact OD2-NZ 2.64Å; D1178-K1182 PolarHBondContact OD2-NZ 3.23Å
1179	R	69.4	Low	68.1	Low	142 Å²	142	96.8 Å²	96.8	54%	0.536	49%	0.485	S	S	.	.	H	α-helix	trans	-80.9	-37.9	169.6	-69.2	174.2	-174	-179.6	3.3	112.9	Q1175 L1176 L1177 E1181 K1182 E1183	Q1175-R1179 WeakPolarHBondContact O-CD 3.4Å; Q1175-R1179 VanDerWaalsContact O-CG 3.32Å; Q1175-R1179 WeakPolarHBondContact O-CG 3.38Å; L1176-R1179 PolarHBondContact O-N 3.26Å; L1177-R1179 PolarHBondContact O-N 3.26Å; L1177-R1179 VanDerWaalsContact O-N 3.09Å; R1179-E1181 VanDerWaalsContact C-N 3.35Å; R1179-E1181 PolarHBondContact O-N 2.83Å; R1179-K1182 PolarHBondContact O-N 3.02Å; R1179-E1183 PolarHBondContact O-N 3.42Å
1180	T	62.9	Low	67.2	Low	49 Å²	49	101 Å²	101	30%	0.301	51%	0.513	S	S	.	.	H	α-helix	trans	-57.9	-45.2	176.2	53	0	0	0	0	113	L1176 L1177 K1182 E1183 K1184 L1188	L1176-T1180 PolarHBondContact O-N 3.25Å; L1177-T1180 WeakPolarHBondContact CA-OG1 3.43Å; L1177-T1180 WeakPolarHBondContact O-CA 3.44Å; L1177-T1180 PolarHBondContact O-N 3.18Å; L1177-T1180 PolarHBondContact O-OG1 2.93Å; T1180-K1182 VanDerWaalsContact C-N 3.27Å; T1180-K1182 PolarHBondContact O-N 3.42Å; T1180-E1183 PolarHBondContact O-N 3.01Å; T1180-K1184 PolarHBondContact O-N 3.33Å; T1180-L1188 HydrophobicContact CG2-CD1 3.12Å
1181	E	60.8	Low	66.8	Low	156 Å²	156	101.2 Å²	101.2	73%	0.729	51%	0.512	S	S	*	.	H	α-helix	trans	-64.3	-34.4	-178.3	-64.5	-175.4	163.7	0	0	112.1	L1177 R1179	L1177-E1181 PolarHBondContact O-N 3.18Å; R1179-E1181 VanDerWaalsContact C-N 3.35Å; R1179-E1181 PolarHBondContact O-N 2.83Å
1182	K	59.4	Low	66.4	Low	140 Å²	140	100.8 Å²	100.8	61%	0.609	51%	0.507	S	S	*	.	H	α-helix	trans	-79	-36.3	179.2	-68.5	-178.1	-175.4	71.5	0	113.6	D1178 R1179 T1180	D1178-K1182 WeakPolarHBondContact O-CG 3.42Å; D1178-K1182 PolarHBondContact O-NZ 3.48Å; D1178-K1182 IonicContact OD1-NZ 4Å; D1178-K1182 PolarHBondContact OD1-NZ 2.97Å; D1178-K1182 IonicContact OD2-NZ 2.64Å; D1178-K1182 PolarHBondContact OD2-NZ 3.23Å; R1179-K1182 PolarHBondContact O-N 3.02Å; T1180-K1182 VanDerWaalsContact C-N 3.27Å; T1180-K1182 PolarHBondContact O-N 3.42Å
1183	E	58.5	Low	66.1	Low	131 Å²	131	100 Å²	100	61%	0.612	51%	0.508	S	S	*	.	H	α-helix	trans	-113.7	-16.1	-164.9	-60.6	-171.6	149.9	0	0	115.2	R1179 T1180 C1185	R1179-E1183 PolarHBondContact O-N 3.42Å; T1180-E1183 PolarHBondContact O-N 3.01Å; E1183-C1185 PolarHBondContact O-N 2.96Å; E1183-C1185 PolarHBondContact O-SG 3.11Å
1184	K	52.3	Low	66.2	Low	196 Å²	196	101.5 Å²	101.5	85%	0.852	52%	0.518	S	S	*	.			trans	54	20	-178.2	-63.8	-169.7	174.7	-173.2	0	115.5	T1180	T1180-K1184 PolarHBondContact O-N 3.33Å
1185	C	53	Low	66.3	Low	71 Å²	71	96.4 Å²	96.4	48%	0.48	50%	0.495	S	S	.	.			trans	-81.1	129.4	-177.5	-70.6	0	0	0	0	112.8	E1183 E1187	E1183-C1185 PolarHBondContact O-N 2.96Å; E1183-C1185 PolarHBondContact O-SG 3.11Å; C1185-E1187 VanDerWaalsContact C-N 3.27Å; C1185-E1187 PolarHBondContact O-N 3.14Å
1186	A	56.8	Low	66.2	Low	104 Å²	104	95.5 Å²	95.5	86%	0.86	49%	0.493	S	S	*	.	S	Bend	trans	-84.4	16.4	-175.6	0	0	0	0	0	114.9
1187	E	58	Low	66.5	Low	164 Å²	164	97.5 Å²	97.5	77%	0.766	51%	0.508	S	S	*	.			trans	-101.9	1.4	-160.7	-59.2	-166.1	142.5	0	0	115.4	C1185 R1189 P1190	C1185-E1187 VanDerWaalsContact C-N 3.27Å; C1185-E1187 PolarHBondContact O-N 3.14Å; E1187-R1189 VanDerWaalsContact C-N 3.29Å; E1187-R1189 PolarHBondContact O-N 3.1Å; E1187-P1190 WeakPolarHBondContact O-CD 3.46Å
1188	L	58.3	Low	67	Low	48 Å²	48	98.8 Å²	98.8	25%	0.251	51%	0.51	S	S	.	.			trans	-73.1	-7.3	-168.8	-78.3	157.3	0	0	0	116.9	L1176 T1180 T1191 V1192	L1176-L1188 HydrophobicContact CB-CD2 4.33Å; L1176-L1188 HydrophobicContact CD2-CD2 3.75Å; L1176-L1188 HydrophobicContact CG-CD2 4.49Å; T1180-L1188 HydrophobicContact CG2-CD1 3.12Å; L1188-T1191 PolarHBondContact O-N 3.32Å; L1188-V1192 PolarHBondContact O-N 3.13Å
1189	R	61.7	Low	67.5	Low	167 Å²	167	97.6 Å²	97.6	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-54.2	-37.8	-174.7	-173.7	173.7	-80.2	-179.9	-11.2	114.8	E1187 T1191	E1187-R1189 VanDerWaalsContact C-N 3.29Å; E1187-R1189 PolarHBondContact O-N 3.1Å; R1189-T1191 VanDerWaalsContact C-N 3.33Å; R1189-T1191 PolarHBondContact O-N 3.4Å
1190	P	64.8	Low	68	Low	100 Å²	100	95.1 Å²	95.1	65%	0.649	50%	0.498	S	S	*	.	H	α-helix	trans	-66.2	-31.3	177.5	-20.7	34.2	0	0	0	113.7	E1187 P1194	E1187-P1190 WeakPolarHBondContact O-CD 3.46Å; P1190-P1194 WeakPolarHBondContact O-CD 3.33Å
1191	T	69.6	Low	69	Low	58 Å²	58	96.3 Å²	96.3	36%	0.356	51%	0.505	S	S	.	.	H	α-helix	trans	-78.6	-26.5	-174.8	-34.3	0	0	0	0	112.5	L1176 L1188 R1189 I1195	L1176-T1191 HydrophobicContact CD1-CG2 4.04Å; L1176-T1191 HydrophobicContact CD2-CG2 4.12Å; L1188-T1191 PolarHBondContact O-N 3.32Å; R1189-T1191 VanDerWaalsContact C-N 3.33Å; R1189-T1191 PolarHBondContact O-N 3.4Å; T1191-I1195 WeakPolarHBondContact O-CG1 3.43Å
1192	V	72.8	Confident	70.1	Confident	57 Å²	57	89.5 Å²	89.5	35%	0.345	47%	0.473	S	S	.	.	H	α-helix	trans	-79.9	-34.7	-175.5	176.5	0	0	0	0	112.7	L1188 I1195 L1196	L1188-V1192 PolarHBondContact O-N 3.13Å; V1192-I1195 WeakPolarHBondContact O-CB 3.25Å; V1192-I1195 PolarHBondContact O-N 3.01Å; V1192-I1195 VanDerWaalsContact O-N 3.1Å; V1192-L1196 HydrophobicContact CG1-CD1 3.91Å; V1192-L1196 HydrophobicContact CG1-CG 4.06Å; V1192-L1196 PolarHBondContact O-N 3.16Å; V1192-L1196 VanDerWaalsContact O-N 3.12Å
1193	V	75.6	Confident	71.2	Confident	59 Å²	59	86 Å²	86	36%	0.358	46%	0.462	S	S	.	.	H	α-helix	trans	-58.5	-46.4	-175.3	167.6	0	0	0	0	113.7	F678 I1195 L1196 S1197	F678-V1193 HydrophobicContact CD2-CG2 4.46Å; F678-V1193 HydrophobicContact CE2-CG1 3.71Å; F678-V1193 HydrophobicContact CE2-CG2 4.36Å; F678-V1193 HydrophobicContact CZ-CG1 4.36Å; V1193-I1195 PolarHBondContact O-N 3.39Å; V1193-L1196 PolarHBondContact O-N 3.09Å; V1193-S1197 PolarHBondContact O-N 3.19Å; V1193-S1197 VanDerWaalsContact O-N 3.12Å
1194	P	80.7	Confident	72.4	Confident	85 Å²	85	83.3 Å²	83.3	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-63.1	-28.4	176.6	-24	35.2	0	0	0	113.7	P1190 K1198	P1190-P1194 WeakPolarHBondContact O-CD 3.33Å; P1194-K1198 WeakPolarHBondContact O-CB 3.33Å; P1194-K1198 PolarHBondContact O-N 3.33Å
1195	I	80.7	Confident	74	Confident	14 Å²	14	79.6 Å²	79.6	7%	0.072	44%	0.441	C	S	.	.	H	α-helix	trans	-70.5	-46.5	177.2	-49.4	173.4	0	0	0	109.6	C1169 V1173 L1176 T1191 V1192 V1193 K1198 L1199	C1169-I1195 HydrophobicContact CB-CG2 3.91Å; V1173-I1195 HydrophobicContact CG2-CD1 4.13Å; V1173-I1195 HydrophobicContact CG2-CG2 4.11Å; L1176-I1195 HydrophobicContact CD1-CD1 3.86Å; T1191-I1195 WeakPolarHBondContact O-CG1 3.43Å; V1192-I1195 WeakPolarHBondContact O-CB 3.25Å; V1192-I1195 PolarHBondContact O-N 3.01Å; V1192-I1195 VanDerWaalsContact O-N 3.1Å; V1193-I1195 PolarHBondContact O-N 3.39Å; I1195-K1198 PolarHBondContact O-N 3Å; I1195-L1199 HydrophobicContact CG2-CD1 4.14Å; I1195-L1199 WeakPolarHBondContact O-CG 3.2Å; I1195-L1199 PolarHBondContact O-N 2.84Å
1196	L	76.9	Confident	75.5	Confident	77 Å²	77	79.1 Å²	79.1	40%	0.403	43%	0.433	S	S	.	.	H	α-helix	trans	-60.7	-49.3	179	-67.4	174.8	0	0	0	111.9	V1192 V1193 K1198 L1199 E1200	V1192-L1196 HydrophobicContact CG1-CD1 3.91Å; V1192-L1196 HydrophobicContact CG1-CG 4.06Å; V1192-L1196 PolarHBondContact O-N 3.16Å; V1192-L1196 VanDerWaalsContact O-N 3.12Å; V1193-L1196 PolarHBondContact O-N 3.09Å; L1196-K1198 VanDerWaalsContact C-N 3.25Å; L1196-K1198 PolarHBondContact O-N 3.47Å; L1196-L1199 WeakPolarHBondContact O-CB 3.44Å; L1196-L1199 PolarHBondContact O-N 2.62Å; L1196-E1200 WeakPolarHBondContact O-CG 3.48Å; L1196-E1200 PolarHBondContact O-N 3.33Å
1197	S	81.2	Confident	76.8	Confident	57 Å²	57	80.3 Å²	80.3	40%	0.399	42%	0.419	S	S	.	.	H	α-helix	trans	-60	-35.5	177.8	177.6	0	0	0	0	112.6	V1193 T1201	V1193-S1197 PolarHBondContact O-N 3.19Å; V1193-S1197 VanDerWaalsContact O-N 3.12Å; S1197-T1201 PolarHBondContact O-N 3.11Å; S1197-T1201 VanDerWaalsContact O-N 3.08Å; S1197-T1201 PolarHBondContact O-OG1 3.01Å
1198	K	82.1	Confident	78.1	Confident	115 Å²	115	78 Å²	78	50%	0.5	41%	0.41	S	S	.	.	H	α-helix	trans	-68	-40	174.6	-165.4	169.6	-175.7	177	0	111.9	P1194 I1195 L1196 T1201 M1202	P1194-K1198 WeakPolarHBondContact O-CB 3.33Å; P1194-K1198 PolarHBondContact O-N 3.33Å; I1195-K1198 PolarHBondContact O-N 3Å; L1196-K1198 VanDerWaalsContact C-N 3.25Å; L1196-K1198 PolarHBondContact O-N 3.47Å; K1198-T1201 WeakPolarHBondContact O-CB 3.44Å; K1198-T1201 PolarHBondContact O-N 3.35Å; K1198-M1202 HydrophobicContact CG-SD 4.26Å; K1198-M1202 WeakPolarHBondContact O-CG 3.37Å; K1198-M1202 PolarHBondContact O-N 3.08Å; K1198-M1202 VanDerWaalsContact O-N 3.11Å
1199	L	81.5	Confident	79.4	Confident	59 Å²	59	76.6 Å²	76.6	31%	0.309	40%	0.402	S	S	.	.	H	α-helix	trans	-66.3	-41.1	175	-69.4	168.3	0	0	0	112.4	C1169 I1195 L1196 T1201 M1202 D1203	C1169-L1199 HydrophobicContact CB-CD2 4.04Å; C1169-L1199 HydrophobicContact CB-CG 4.42Å; I1195-L1199 HydrophobicContact CG2-CD1 4.14Å; I1195-L1199 WeakPolarHBondContact O-CG 3.2Å; I1195-L1199 PolarHBondContact O-N 2.84Å; L1196-L1199 WeakPolarHBondContact O-CB 3.44Å; L1196-L1199 PolarHBondContact O-N 2.62Å; L1199-T1201 VanDerWaalsContact C-N 3.34Å; L1199-T1201 PolarHBondContact O-N 3.1Å; L1199-M1202 PolarHBondContact O-N 2.91Å; L1199-D1203 PolarHBondContact O-N 3.09Å
1200	E	80.8	Confident	80.4	Confident	90 Å²	90	72 Å²	72	42%	0.421	40%	0.396	S	S	.	.	H	α-helix	trans	-61.2	-41.3	174.3	-69.6	175.2	147.6	0	0	112.1	L1196 M1202 S1204	L1196-E1200 WeakPolarHBondContact O-CG 3.48Å; L1196-E1200 PolarHBondContact O-N 3.33Å; E1200-M1202 PolarHBondContact O-N 2.97Å; E1200-S1204 PolarHBondContact O-N 3.19Å; E1200-S1204 PolarHBondContact O-OG 2.96Å; E1200-S1204 VanDerWaalsContact O-OG 3.14Å
1201	T	83.9	Confident	81.5	Confident	75 Å²	75	74.9 Å²	74.9	46%	0.46	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-33.6	173.2	-56	0	0	0	0	111.6	S1197 K1198 L1199 K1205	S1197-T1201 PolarHBondContact O-N 3.11Å; S1197-T1201 VanDerWaalsContact O-N 3.08Å; S1197-T1201 PolarHBondContact O-OG1 3.01Å; K1198-T1201 WeakPolarHBondContact O-CB 3.44Å; K1198-T1201 PolarHBondContact O-N 3.35Å; L1199-T1201 VanDerWaalsContact C-N 3.34Å; L1199-T1201 PolarHBondContact O-N 3.1Å; T1201-K1205 PolarHBondContact O-N 3.45Å
1202	M	84	Confident	82.3	Confident	12 Å²	12	77.2 Å²	77.2	6%	0.059	40%	0.403	C	S	.	.	H	α-helix	trans	-82.5	-35.1	-178.3	-70.9	172.3	59.8	0	0	113.6	V1162 T1165 V1166 K1198 L1199 E1200 S1204 K1205 L1206	V1162-M1202 HydrophobicContact CG1-CE 3.91Å; V1162-M1202 WeakPolarHBondContact O-CE 3.32Å; T1165-M1202 WeakPolarHBondContact OG1-CE 3.48Å; V1166-M1202 HydrophobicContact CB-CE 4.37Å; V1166-M1202 HydrophobicContact CG2-CE 3.45Å; V1166-M1202 VanDerWaalsContact CG2-CE 3.45Å; K1198-M1202 HydrophobicContact CG-SD 4.26Å; K1198-M1202 WeakPolarHBondContact O-CG 3.37Å; K1198-M1202 PolarHBondContact O-N 3.08Å; K1198-M1202 VanDerWaalsContact O-N 3.11Å; L1199-M1202 PolarHBondContact O-N 2.91Å; E1200-M1202 PolarHBondContact O-N 2.97Å; M1202-S1204 VanDerWaalsContact C-N 3.25Å; M1202-S1204 PolarHBondContact O-N 3.14Å; M1202-K1205 CarbonylContact O-C 3.56Å; M1202-K1205 PolarHBondContact O-N 3.48Å; M1202-K1205 VanDerWaalsContact O-N 3.11Å; M1202-L1206 WeakPolarHBondContact O-CG 3.41Å; M1202-L1206 PolarHBondContact O-N 3.27Å
1203	D	81.4	Confident	82.9	Confident	68 Å²	68	76.2 Å²	76.2	36%	0.364	40%	0.398	S	S	.	.	H	α-helix	trans	-56.7	-41.3	167.6	163.3	71	0	0	0	111.3	L1199 K1205 L1206 K1207	L1199-D1203 PolarHBondContact O-N 3.09Å; D1203-K1205 VanDerWaalsContact C-N 3.34Å; D1203-K1205 PolarHBondContact O-N 2.78Å; D1203-L1206 PolarHBondContact O-N 3.44Å; D1203-K1207 WeakPolarHBondContact O-CG 3.27Å; D1203-K1207 PolarHBondContact O-N 3.13Å; D1203-K1207 WeakPolarHBondContact OD1-CE 3.31Å; D1203-K1207 IonicContact OD1-NZ 3.62Å; D1203-K1207 PolarHBondContact OD1-NZ 3.35Å; D1203-K1207 WeakPolarHBondContact OD2-CE 3.34Å; D1203-K1207 IonicContact OD2-NZ 2.99Å; D1203-K1207 PolarHBondContact OD2-NZ 3.37Å
1204	S	85.2	Confident	83.4	Confident	74 Å²	74	80 Å²	80	52%	0.517	41%	0.409	S	S	.	.	H	α-helix	trans	-61.2	-40.3	173.8	-59.6	0	0	0	0	112.5	E1200 M1202 M1208	E1200-S1204 PolarHBondContact O-N 3.19Å; E1200-S1204 PolarHBondContact O-OG 2.96Å; E1200-S1204 VanDerWaalsContact O-OG 3.14Å; M1202-S1204 VanDerWaalsContact C-N 3.25Å; M1202-S1204 PolarHBondContact O-N 3.14Å; S1204-M1208 PolarHBondContact O-N 2.99Å
1205	K	84.8	Confident	83.6	Confident	118 Å²	118	79.2 Å²	79.2	51%	0.513	40%	0.403	S	S	.	.	H	α-helix	trans	-67.9	-41.8	173.4	-71	-177.3	178.1	-172.7	0	112.3	T1201 M1202 D1203 K1207 M1208 L1209	T1201-K1205 PolarHBondContact O-N 3.45Å; M1202-K1205 CarbonylContact O-C 3.56Å; M1202-K1205 PolarHBondContact O-N 3.48Å; M1202-K1205 VanDerWaalsContact O-N 3.11Å; D1203-K1205 VanDerWaalsContact C-N 3.34Å; D1203-K1205 PolarHBondContact O-N 2.78Å; K1205-K1207 VanDerWaalsContact C-N 3.34Å; K1205-K1207 PolarHBondContact O-N 3.49Å; K1205-M1208 PolarHBondContact O-N 2.81Å; K1205-L1209 WeakPolarHBondContact O-CG 3.2Å; K1205-L1209 PolarHBondContact O-N 2.95Å
1206	L	84	Confident	83.9	Confident	61 Å²	61	79.6 Å²	79.6	32%	0.319	41%	0.405	S	S	.	.	H	α-helix	trans	-59.3	-42.7	175.9	-77	168.8	0	0	0	111.8	F1159 V1162 M1202 D1203 M1208 L1209 S1210	F1159-L1206 HydrophobicContact CD1-CD2 4.05Å; F1159-L1206 HydrophobicContact CE1-CD2 3.64Å; V1162-L1206 HydrophobicContact CG1-CD1 4.26Å; V1162-L1206 HydrophobicContact CG1-CD2 3.65Å; V1162-L1206 HydrophobicContact CG1-CG 3.79Å; M1202-L1206 WeakPolarHBondContact O-CG 3.41Å; M1202-L1206 PolarHBondContact O-N 3.27Å; D1203-L1206 PolarHBondContact O-N 3.44Å; L1206-M1208 PolarHBondContact O-N 3.3Å; L1206-L1209 PolarHBondContact O-N 3.44Å; L1206-S1210 WeakPolarHBondContact O-CB 3.5Å; L1206-S1210 PolarHBondContact O-N 3.29Å
1207	K	84.9	Confident	84.3	Confident	128 Å²	128	79.4 Å²	79.4	56%	0.557	40%	0.404	S	S	*	.	H	α-helix	trans	-62.4	-39.9	175.4	-74.5	163.7	177.8	163.2	0	112.3	D1203 K1205 K1211	D1203-K1207 WeakPolarHBondContact O-CG 3.27Å; D1203-K1207 PolarHBondContact O-N 3.13Å; D1203-K1207 WeakPolarHBondContact OD1-CE 3.31Å; D1203-K1207 IonicContact OD1-NZ 3.62Å; D1203-K1207 PolarHBondContact OD1-NZ 3.35Å; D1203-K1207 WeakPolarHBondContact OD2-CE 3.34Å; D1203-K1207 IonicContact OD2-NZ 2.99Å; D1203-K1207 PolarHBondContact OD2-NZ 3.37Å; K1205-K1207 VanDerWaalsContact C-N 3.34Å; K1205-K1207 PolarHBondContact O-N 3.49Å; K1207-K1211 PolarHBondContact O-N 3.22Å; K1207-K1211 VanDerWaalsContact O-N 3.17Å
1208	M	85.3	Confident	84.5	Confident	117 Å²	117	81 Å²	81	58%	0.576	41%	0.408	S	S	*	.	H	α-helix	trans	-66.9	-46.5	174.1	-168	-161.3	-63.9	0	0	112.1	S1204 K1205 L1206 K1211 K1212	S1204-M1208 PolarHBondContact O-N 2.99Å; K1205-M1208 PolarHBondContact O-N 2.81Å; L1206-M1208 PolarHBondContact O-N 3.3Å; M1208-K1211 PolarHBondContact O-N 3.46Å; M1208-K1212 PolarHBondContact O-N 3.49Å; M1208-K1212 VanDerWaalsContact O-N 3.09Å
1209	L	85.8	Confident	84.6	Confident	17 Å²	17	79.2 Å²	79.2	9%	0.089	40%	0.403	C	S	.	.	H	α-helix	trans	-63.8	-42.5	179.1	-71	171.5	0	0	0	111.7	L1155 K1158 F1159 V1162 K1205 L1206 K1211 K1212 V1213	L1155-L1209 HydrophobicContact CD2-CD2 3.97Å; K1158-L1209 HydrophobicContact CB-CD2 3.98Å; F1159-L1209 HydrophobicContact CD2-CB 4.23Å; F1159-L1209 HydrophobicContact CD2-CD1 4.34Å; F1159-L1209 HydrophobicContact CE2-CB 3.56Å; F1159-L1209 HydrophobicContact CE2-CD1 4.42Å; F1159-L1209 HydrophobicContact CE2-CG 4.49Å; F1159-L1209 HydrophobicContact CG-CD1 4.46Å; F1159-L1209 HydrophobicContact CZ-CB 3.72Å; V1162-L1209 HydrophobicContact CG2-CD1 4.09Å; K1205-L1209 WeakPolarHBondContact O-CG 3.2Å; K1205-L1209 PolarHBondContact O-N 2.95Å; L1206-L1209 PolarHBondContact O-N 3.44Å; L1209-K1211 VanDerWaalsContact C-N 3.33Å; L1209-K1211 PolarHBondContact O-N 3.49Å; L1209-K1212 PolarHBondContact O-N 2.97Å; L1209-K1212 VanDerWaalsContact O-N 3.12Å; L1209-V1213 WeakPolarHBondContact O-CG2 3.37Å; L1209-V1213 PolarHBondContact O-N 3.12Å
1210	S	82.3	Confident	84.8	Confident	71 Å²	71	78.2 Å²	78.2	50%	0.497	40%	0.398	S	S	.	.	H	α-helix	trans	-57.2	-43.4	173.9	178.5	0	0	0	0	112.1	L1206 K1212 V1213 K1214	L1206-S1210 WeakPolarHBondContact O-CB 3.5Å; L1206-S1210 PolarHBondContact O-N 3.29Å; S1210-K1212 PolarHBondContact O-N 3.11Å; S1210-V1213 PolarHBondContact O-N 2.83Å; S1210-K1214 PolarHBondContact O-N 3.4Å
1211	K	87.7	Confident	85.1	Confident	160 Å²	160	78.2 Å²	78.2	70%	0.696	40%	0.398	S	S	*	.	H	α-helix	trans	-62.3	-41.3	174.6	-170.7	178.3	179.3	-177.1	0	112.1	K1207 M1208 L1209 K1214 T1215	K1207-K1211 PolarHBondContact O-N 3.22Å; K1207-K1211 VanDerWaalsContact O-N 3.17Å; M1208-K1211 PolarHBondContact O-N 3.46Å; L1209-K1211 VanDerWaalsContact C-N 3.33Å; L1209-K1211 PolarHBondContact O-N 3.49Å; K1211-K1214 PolarHBondContact O-N 3.15Å; K1211-T1215 PolarHBondContact O-N 3.44Å; K1211-T1215 VanDerWaalsContact O-N 3.16Å; K1211-T1215 PolarHBondContact O-OG1 3.24Å
1212	K	86.4	Confident	85.2	Confident	107 Å²	107	78.6 Å²	78.6	47%	0.465	40%	0.397	S	S	.	.	H	α-helix	trans	-66.6	-43.4	176.8	-71.3	-173.3	176.9	-173.2	0	112.6	L1155 M1208 L1209 S1210 K1214 T1215 L1216	L1155-K1212 HydrophobicContact CD1-CB 3.93Å; L1155-K1212 HydrophobicContact CD2-CB 4.31Å; L1155-K1212 HydrophobicContact CD2-CD 4.4Å; M1208-K1212 PolarHBondContact O-N 3.49Å; M1208-K1212 VanDerWaalsContact O-N 3.09Å; L1209-K1212 PolarHBondContact O-N 2.97Å; L1209-K1212 VanDerWaalsContact O-N 3.12Å; S1210-K1212 PolarHBondContact O-N 3.11Å; K1212-K1214 VanDerWaalsContact C-N 3.34Å; K1212-K1214 PolarHBondContact O-N 3.4Å; K1212-T1215 WeakPolarHBondContact CA-OG1 3.47Å; K1212-T1215 PolarHBondContact O-N 3.42Å; K1212-T1215 PolarHBondContact O-OG1 2.98Å; K1212-L1216 PolarHBondContact O-N 2.63Å
1213	V	85.6	Confident	85.4	Confident	37 Å²	37	79.2 Å²	79.2	22%	0.224	40%	0.4	C	S	.	.	H	α-helix	trans	-56.8	-48.2	173.3	167	0	0	0	0	110.3	F1152 L1155 F1159 L1209 S1210 T1215 L1216 I1217	F1152-V1213 HydrophobicContact CE1-CG1 4.46Å; L1155-V1213 HydrophobicContact CD1-CB 4.46Å; L1155-V1213 HydrophobicContact CD1-CG2 3.65Å; F1159-V1213 HydrophobicContact CD2-CG2 4.47Å; F1159-V1213 HydrophobicContact CE2-CG2 3.66Å; F1159-V1213 HydrophobicContact CZ-CG2 4.47Å; L1209-V1213 WeakPolarHBondContact O-CG2 3.37Å; L1209-V1213 PolarHBondContact O-N 3.12Å; S1210-V1213 PolarHBondContact O-N 2.83Å; V1213-T1215 PolarHBondContact O-N 3.16Å; V1213-L1216 PolarHBondContact O-N 3.25Å; V1213-L1216 VanDerWaalsContact O-N 3.15Å; V1213-I1217 HydrophobicContact CG1-CD1 3.74Å; V1213-I1217 HydrophobicContact CG1-CG1 4.31Å; V1213-I1217 WeakPolarHBondContact O-CG1 3.48Å; V1213-I1217 PolarHBondContact O-N 3.43Å
1214	K	85.4	Confident	85.5	Confident	137 Å²	137	81.4 Å²	81.4	60%	0.596	41%	0.406	S	S	*	.	H	α-helix	trans	-58.4	-46.9	179.3	-174.8	167.5	-178.2	171.9	0	112.2	S1210 K1211 K1212 L1216 I1217 D1218	S1210-K1214 PolarHBondContact O-N 3.4Å; K1211-K1214 PolarHBondContact O-N 3.15Å; K1212-K1214 VanDerWaalsContact C-N 3.34Å; K1212-K1214 PolarHBondContact O-N 3.4Å; K1214-L1216 VanDerWaalsContact C-N 3.3Å; K1214-L1216 PolarHBondContact O-N 3.49Å; K1214-I1217 PolarHBondContact O-N 2.95Å; K1214-D1218 VanDerWaalsContact O-CG 3.3Å; K1214-D1218 PolarHBondContact O-N 2.98Å
1215	T	86.7	Confident	85.6	Confident	70 Å²	70	85 Å²	85	43%	0.429	41%	0.408	S	S	.	.	H	α-helix	trans	-63.6	-31.8	177.6	45.4	0	0	0	0	113.7	K1211 K1212 V1213 I1219	K1211-T1215 PolarHBondContact O-N 3.44Å; K1211-T1215 VanDerWaalsContact O-N 3.16Å; K1211-T1215 PolarHBondContact O-OG1 3.24Å; K1212-T1215 WeakPolarHBondContact CA-OG1 3.47Å; K1212-T1215 PolarHBondContact O-N 3.42Å; K1212-T1215 PolarHBondContact O-OG1 2.98Å; V1213-T1215 PolarHBondContact O-N 3.16Å; T1215-I1219 WeakPolarHBondContact O-CD1 3.47Å; T1215-I1219 VanDerWaalsContact O-CG1 3.25Å; T1215-I1219 WeakPolarHBondContact O-CG1 3.43Å; T1215-I1219 PolarHBondContact O-N 2.78Å; T1215-I1219 VanDerWaalsContact O-N 3.17Å
1216	L	86.2	Confident	85.6	Confident	21 Å²	21	83.8 Å²	83.8	11%	0.11	40%	0.403	C	S	.	.	H	α-helix	trans	-75.4	-32.6	174.2	-74.4	174.3	0	0	0	112.9	D1151 F1152 L1155 K1212 V1213 K1214 I1219 N1220	D1151-L1216 HydrophobicContact CB-CD1 3.79Å; D1151-L1216 HydrophobicContact CB-CD2 4.03Å; F1152-L1216 HydrophobicContact CE1-CB 4.38Å; F1152-L1216 HydrophobicContact CE2-CB 3.96Å; F1152-L1216 HydrophobicContact CZ-CB 3.8Å; L1155-L1216 HydrophobicContact CD1-CD1 3.55Å; L1155-L1216 HydrophobicContact CG-CD1 4.22Å; K1212-L1216 PolarHBondContact O-N 2.63Å; V1213-L1216 PolarHBondContact O-N 3.25Å; V1213-L1216 VanDerWaalsContact O-N 3.15Å; K1214-L1216 VanDerWaalsContact C-N 3.3Å; K1214-L1216 PolarHBondContact O-N 3.49Å; L1216-I1219 PolarHBondContact O-N 2.95Å; L1216-N1220 VanDerWaalsContact O-CB 3.27Å; L1216-N1220 WeakPolarHBondContact O-CB 3.48Å; L1216-N1220 PolarHBondContact O-N 2.9Å
1217	I	84	Confident	85.8	Confident	73 Å²	73	83.4 Å²	83.4	37%	0.374	40%	0.399	S	S	.	.	H	α-helix	trans	-61.9	-48	170.5	-67.2	168.8	0	0	0	109.5	F1152 V1213 K1214 I1219 N1220 E1221	F1152-I1217 HydrophobicContact CE1-CG1 4.23Å; F1152-I1217 HydrophobicContact CZ-CG1 3.83Å; V1213-I1217 HydrophobicContact CG1-CD1 3.74Å; V1213-I1217 HydrophobicContact CG1-CG1 4.31Å; V1213-I1217 WeakPolarHBondContact O-CG1 3.48Å; V1213-I1217 PolarHBondContact O-N 3.43Å; K1214-I1217 PolarHBondContact O-N 2.95Å; I1217-I1219 PolarHBondContact O-N 3.28Å; I1217-N1220 PolarHBondContact O-N 3.31Å; I1217-E1221 HydrophobicContact CG2-CG 4.45Å; I1217-E1221 WeakPolarHBondContact O-CB 3.23Å; I1217-E1221 PolarHBondContact O-N 3.06Å
1218	D	86	Confident	85.7	Confident	91 Å²	91	82 Å²	82	49%	0.487	40%	0.395	S	S	.	.	H	α-helix	trans	-58.9	-35.6	178.2	-63.2	-35.1	0	0	0	112.1	K1214 N1222	K1214-D1218 VanDerWaalsContact O-CG 3.3Å; K1214-D1218 PolarHBondContact O-N 2.98Å; D1218-N1222 PolarHBondContact O-N 3.06Å
1219	I	85.6	Confident	85.7	Confident	77 Å²	77	81.1 Å²	81.1	40%	0.395	40%	0.396	S	S	.	.	H	α-helix	trans	-74.3	-48.2	175.9	-69.9	164.7	0	0	0	111.8	T1215 L1216 I1217 E1221 N1222 H1223	T1215-I1219 WeakPolarHBondContact O-CD1 3.47Å; T1215-I1219 VanDerWaalsContact O-CG1 3.25Å; T1215-I1219 WeakPolarHBondContact O-CG1 3.43Å; T1215-I1219 PolarHBondContact O-N 2.78Å; T1215-I1219 VanDerWaalsContact O-N 3.17Å; L1216-I1219 PolarHBondContact O-N 2.95Å; I1217-I1219 PolarHBondContact O-N 3.28Å; I1219-E1221 PolarHBondContact O-N 3.19Å; I1219-N1222 WeakPolarHBondContact O-CB 3.11Å; I1219-N1222 PolarHBondContact O-N 3.04Å; I1219-N1222 VanDerWaalsContact O-N 3.1Å; I1219-H1223 PolarHBondContact O-CD2 3.21Å; I1219-H1223 PolarHBondContact O-N 3.37Å
1220	N	85.3	Confident	85.7	Confident	39 Å²	39	81.9 Å²	81.9	21%	0.209	40%	0.4	C	S	.	.	H	α-helix	trans	-64.2	-41.7	-179	-173.7	-22.7	0	0	0	110.7	L1145 S1148 F1152 L1216 I1217 N1222 H1223 K1224	L1145-N1220 WeakPolarHBondContact CD2-OD1 3.27Å; S1148-N1220 PolarHBondContact OG-ND2 3.27Å; F1152-N1220 HydrophobicContact CE2-CB 4.18Å; L1216-N1220 VanDerWaalsContact O-CB 3.27Å; L1216-N1220 WeakPolarHBondContact O-CB 3.48Å; L1216-N1220 PolarHBondContact O-N 2.9Å; I1217-N1220 PolarHBondContact O-N 3.31Å; N1220-N1222 VanDerWaalsContact C-N 3.28Å; N1220-N1222 PolarHBondContact O-N 2.95Å; N1220-H1223 PolarHBondContact O-N 3.49Å; N1220-H1223 VanDerWaalsContact O-N 3.14Å; N1220-K1224 WeakPolarHBondContact O-CB 3.23Å; N1220-K1224 PolarHBondContact O-N 3.43Å
1221	E	86.2	Confident	85.6	Confident	90 Å²	90	79.7 Å²	79.7	42%	0.421	39%	0.385	S	S	.	.	H	α-helix	trans	-57.7	-39.1	171.6	-80.1	-160.7	-151.4	0	0	112.7	I1217 I1219 R1225	I1217-E1221 HydrophobicContact CG2-CG 4.45Å; I1217-E1221 WeakPolarHBondContact O-CB 3.23Å; I1217-E1221 PolarHBondContact O-N 3.06Å; I1219-E1221 PolarHBondContact O-N 3.19Å; E1221-R1225 WeakPolarHBondContact O-CB 3.37Å; E1221-R1225 WeakPolarHBondContact O-CD 3.21Å; E1221-R1225 WeakPolarHBondContact O-CG 3.39Å; E1221-R1225 PolarHBondContact O-N 3.26Å; E1221-R1225 IonicContact OE2-CZ 2.71Å; E1221-R1225 IonicContact OE2-NE 3.26Å; E1221-R1225 IonicContact OE2-NH2 2.7Å; E1221-R1225 PolarHBondContact OE2-NH2 3.36Å
1222	N	86.7	Confident	85.3	Confident	83 Å²	83	76.3 Å²	76.3	44%	0.444	38%	0.378	S	S	.	.	H	α-helix	trans	-66.4	-43	175.8	-169.9	-5.7	0	0	0	111.4	D1218 I1219 N1220 R1225 K1226	D1218-N1222 PolarHBondContact O-N 3.06Å; I1219-N1222 WeakPolarHBondContact O-CB 3.11Å; I1219-N1222 PolarHBondContact O-N 3.04Å; I1219-N1222 VanDerWaalsContact O-N 3.1Å; N1220-N1222 VanDerWaalsContact C-N 3.28Å; N1220-N1222 PolarHBondContact O-N 2.95Å; N1222-R1225 PolarHBondContact O-N 3.39Å; N1222-K1226 WeakPolarHBondContact O-CG 3.29Å; N1222-K1226 PolarHBondContact O-N 3.44Å
1223	H	87.8	Confident	85.1	Confident	24 Å²	24	76.1 Å²	76.1	11%	0.111	38%	0.378	C	S	.	.	H	α-helix	trans	-64.5	-43.3	175.9	-65.8	-179.4	0	0	0	111.7	V1141 L1144 L1145 I1219 N1220 K1226 H1227	V1141-H1223 WeakPolarHBondContact CG1-O 3.39Å; L1144-H1223 PolarHBondContact O-ND1 3.24Å; L1145-H1223 HydrophobicContact CD2-CB 3.61Å; L1145-H1223 HydrophobicContact CG-CB 4.03Å; I1219-H1223 PolarHBondContact O-CD2 3.21Å; I1219-H1223 PolarHBondContact O-N 3.37Å; N1220-H1223 PolarHBondContact O-N 3.49Å; N1220-H1223 VanDerWaalsContact O-N 3.14Å; H1223-K1226 WeakPolarHBondContact O-CB 3.32Å; H1223-K1226 PolarHBondContact O-N 3.01Å; H1223-H1227 PolarHBondContact O-N 2.95Å
1224	K	84.7	Confident	84.7	Confident	115 Å²	115	75.3 Å²	75.3	50%	0.5	38%	0.375	S	S	.	.	H	α-helix	trans	-61.6	-44.3	175.1	-177.5	175	175.6	178.2	0	112.4	N1220 K1226 H1227 E1228	N1220-K1224 WeakPolarHBondContact O-CB 3.23Å; N1220-K1224 PolarHBondContact O-N 3.43Å; K1224-K1226 VanDerWaalsContact C-N 3.33Å; K1224-K1226 PolarHBondContact O-N 3Å; K1224-H1227 PolarHBondContact O-N 3.44Å; K1224-E1228 WeakPolarHBondContact CE-OE1 3.46Å; K1224-E1228 WeakPolarHBondContact O-CG 3.42Å; K1224-E1228 PolarHBondContact O-N 3.12Å
1225	R	85.5	Confident	84.2	Confident	148 Å²	148	75 Å²	75	56%	0.558	37%	0.374	S	S	*	.	H	α-helix	trans	-60.8	-40	174.8	-70.1	166.9	-160.5	-177.5	7.4	111.7	E1221 N1222 E1228 V1229	E1221-R1225 WeakPolarHBondContact O-CB 3.37Å; E1221-R1225 WeakPolarHBondContact O-CD 3.21Å; E1221-R1225 WeakPolarHBondContact O-CG 3.39Å; E1221-R1225 PolarHBondContact O-N 3.26Å; E1221-R1225 IonicContact OE2-CZ 2.71Å; E1221-R1225 IonicContact OE2-NE 3.26Å; E1221-R1225 IonicContact OE2-NH2 2.7Å; E1221-R1225 PolarHBondContact OE2-NH2 3.36Å; N1222-R1225 PolarHBondContact O-N 3.39Å; R1225-E1228 PolarHBondContact O-N 3.19Å; R1225-V1229 WeakPolarHBondContact O-CG2 3.42Å; R1225-V1229 PolarHBondContact O-N 3.34Å; R1225-V1229 VanDerWaalsContact O-N 3.09Å
1226	K	85.4	Confident	83.7	Confident	94 Å²	94	74.8 Å²	74.8	41%	0.409	38%	0.375	S	S	.	.	H	α-helix	trans	-62.2	-46.6	172.3	-69.9	172.3	-175.6	176.7	0	111.7	V1141 N1222 H1223 K1224 E1228 V1229 L1230	V1141-K1226 HydrophobicContact CG1-CB 4.25Å; V1141-K1226 HydrophobicContact CG2-CB 4.33Å; N1222-K1226 WeakPolarHBondContact O-CG 3.29Å; N1222-K1226 PolarHBondContact O-N 3.44Å; H1223-K1226 WeakPolarHBondContact O-CB 3.32Å; H1223-K1226 PolarHBondContact O-N 3.01Å; K1224-K1226 VanDerWaalsContact C-N 3.33Å; K1224-K1226 PolarHBondContact O-N 3Å; K1226-E1228 VanDerWaalsContact C-N 3.34Å; K1226-E1228 PolarHBondContact O-N 3.43Å; K1226-V1229 PolarHBondContact O-N 2.75Å; K1226-L1230 WeakPolarHBondContact O-CG 3.4Å; K1226-L1230 PolarHBondContact O-N 2.8Å
1227	H	87.6	Confident	83.2	Confident	52 Å²	52	74.4 Å²	74.4	24%	0.241	37%	0.374	C	S	.	.	H	α-helix	trans	-60.4	-41.1	177.4	176	-104.1	0	0	0	112	V1141 E1142 L1145 H1223 K1224 V1229 L1230 S1231	V1141-H1227 HydrophobicContact CG1-CB 3.88Å; E1142-H1227 IonicContact OE1-NE2 3.7Å; L1145-H1227 HydrophobicContact CD1-CB 4.26Å; H1223-H1227 PolarHBondContact O-N 2.95Å; K1224-H1227 PolarHBondContact O-N 3.44Å; H1227-V1229 PolarHBondContact O-N 3.49Å; H1227-L1230 PolarHBondContact O-N 3.33Å; H1227-S1231 WeakPolarHBondContact O-CB 3.49Å; H1227-S1231 PolarHBondContact O-N 2.94Å
1228	E	83.9	Confident	82.7	Confident	99 Å²	99	75.8 Å²	75.8	46%	0.463	38%	0.382	S	S	.	.	H	α-helix	trans	-64.1	-39.7	175.6	-73.3	172.3	-171.3	0	0	112.4	K1224 R1225 K1226 T1232	K1224-E1228 WeakPolarHBondContact CE-OE1 3.46Å; K1224-E1228 WeakPolarHBondContact O-CG 3.42Å; K1224-E1228 PolarHBondContact O-N 3.12Å; R1225-E1228 PolarHBondContact O-N 3.19Å; K1226-E1228 VanDerWaalsContact C-N 3.34Å; K1226-E1228 PolarHBondContact O-N 3.43Å; E1228-T1232 WeakPolarHBondContact O-CB 3.36Å; E1228-T1232 WeakPolarHBondContact O-CG2 3.5Å; E1228-T1232 PolarHBondContact O-N 2.97Å; E1228-T1232 PolarHBondContact O-OG1 3.24Å
1229	V	85.1	Confident	82.1	Confident	99 Å²	99	74.3 Å²	74.3	60%	0.6	38%	0.382	S	S	*	.	H	α-helix	trans	-65.7	-43	173.9	170.5	0	0	0	0	111.9	R1225 K1226 H1227 T1232 H1233	R1225-V1229 WeakPolarHBondContact O-CG2 3.42Å; R1225-V1229 PolarHBondContact O-N 3.34Å; R1225-V1229 VanDerWaalsContact O-N 3.09Å; K1226-V1229 PolarHBondContact O-N 2.75Å; H1227-V1229 PolarHBondContact O-N 3.49Å; V1229-T1232 WeakPolarHBondContact CA-OG1 3.24Å; V1229-T1232 PolarHBondContact O-OG1 3Å; V1229-H1233 PolarHBondContact O-N 3.33Å
1230	L	85.4	Confident	81.4	Confident	33 Å²	33	74.2 Å²	74.2	17%	0.173	38%	0.382	C	S	.	.	H	α-helix	trans	-69.5	-42	177.4	-67.9	169.3	0	0	0	111.9	L1134 S1137 I1138 V1141 K1226 H1227 T1232 H1233 A1234	L1134-L1230 HydrophobicContact CD1-CD2 3.71Å; S1137-L1230 WeakPolarHBondContact O-CD1 3.29Å; I1138-L1230 HydrophobicContact CD1-CB 4.3Å; I1138-L1230 HydrophobicContact CG1-CB 3.63Å; I1138-L1230 HydrophobicContact CG1-CD1 4.34Å; V1141-L1230 HydrophobicContact CB-CD1 4.4Å; V1141-L1230 HydrophobicContact CG2-CD1 3.81Å; K1226-L1230 WeakPolarHBondContact O-CG 3.4Å; K1226-L1230 PolarHBondContact O-N 2.8Å; H1227-L1230 PolarHBondContact O-N 3.33Å; L1230-T1232 PolarHBondContact O-N 3.02Å; L1230-H1233 CarbonylContact O-C 3.58Å; L1230-H1233 WeakPolarHBondContact O-CB 3.46Å; L1230-H1233 PolarHBondContact O-N 2.96Å; L1230-A1234 WeakPolarHBondContact O-CB 3.4Å; L1230-A1234 PolarHBondContact O-N 3.05Å
1231	S	80	Confident	80.6	Confident	25 Å²	25	74.9 Å²	74.9	18%	0.175	39%	0.385	C	S	.	.	H	α-helix	trans	-64.2	-36.7	176.7	-173.4	0	0	0	0	112.5	H1227 A1234 K1235	H1227-S1231 WeakPolarHBondContact O-CB 3.49Å; H1227-S1231 PolarHBondContact O-N 2.94Å; S1231-A1234 PolarHBondContact O-N 3.49Å; S1231-K1235 WeakPolarHBondContact O-CD 3.36Å; S1231-K1235 VanDerWaalsContact O-CG 3.31Å; S1231-K1235 WeakPolarHBondContact O-CG 3.34Å; S1231-K1235 PolarHBondContact O-N 3.28Å; S1231-K1235 PolarHBondContact OG-NZ 3.46Å
1232	T	81.2	Confident	79.8	Confident	89 Å²	89	74 Å²	74	55%	0.546	39%	0.386	S	S	.	.	H	α-helix	trans	-71.4	-36.1	173.3	47.3	0	0	0	0	112.2	E1228 V1229 L1230 A1234 S1236	E1228-T1232 WeakPolarHBondContact O-CB 3.36Å; E1228-T1232 WeakPolarHBondContact O-CG2 3.5Å; E1228-T1232 PolarHBondContact O-N 2.97Å; E1228-T1232 PolarHBondContact O-OG1 3.24Å; V1229-T1232 WeakPolarHBondContact CA-OG1 3.24Å; V1229-T1232 PolarHBondContact O-OG1 3Å; L1230-T1232 PolarHBondContact O-N 3.02Å; T1232-A1234 VanDerWaalsContact C-N 3.34Å; T1232-S1236 PolarHBondContact O-N 3.23Å; T1232-S1236 VanDerWaalsContact O-N 3.16Å
1233	H	82.4	Confident	78.9	Confident	103 Å²	103	76.9 Å²	76.9	48%	0.477	40%	0.395	S	S	.	.	H	α-helix	trans	-63.1	-40.4	169	-156.3	102.8	0	0	0	111.6	L1134 V1229 L1230 S1236 C1237	L1134-H1233 HydrophobicContact CD1-CB 4.06Å; L1134-H1233 HydrophobicContact CD2-CB 4.15Å; V1229-H1233 PolarHBondContact O-N 3.33Å; L1230-H1233 CarbonylContact O-C 3.58Å; L1230-H1233 WeakPolarHBondContact O-CB 3.46Å; L1230-H1233 PolarHBondContact O-N 2.96Å; H1233-S1236 WeakPolarHBondContact O-CA 3.39Å; H1233-S1236 VanDerWaalsContact O-CB 3.3Å; H1233-S1236 WeakPolarHBondContact O-CB 3.42Å; H1233-S1236 PolarHBondContact O-N 3.39Å; H1233-S1236 VanDerWaalsContact O-N 3.09Å; H1233-C1237 VanDerWaalsContact CD2-SG 3.59Å; H1233-C1237 PolarHBondContact O-N 3.1Å
1234	A	77.3	Confident	77.9	Confident	19 Å²	19	78.6 Å²	78.6	16%	0.157	40%	0.404	C	S	.	.	H	α-helix	trans	-64.9	-43.1	179.7	0	0	0	0	0	111.7	L1134 I1138 L1230 S1231 T1232 S1236 C1237 L1238	L1134-A1234 HydrophobicContact CD2-CB 3.6Å; I1138-A1234 HydrophobicContact CD1-CB 3.89Å; L1230-A1234 WeakPolarHBondContact O-CB 3.4Å; L1230-A1234 PolarHBondContact O-N 3.05Å; S1231-A1234 PolarHBondContact O-N 3.49Å; T1232-A1234 VanDerWaalsContact C-N 3.34Å; A1234-S1236 PolarHBondContact O-N 3.33Å; A1234-C1237 PolarHBondContact O-N 3.18Å; A1234-L1238 WeakPolarHBondContact O-CB 3.32Å; A1234-L1238 WeakPolarHBondContact O-CG 3.41Å; A1234-L1238 PolarHBondContact O-N 3.41Å
1235	K	76.4	Confident	76.9	Confident	132 Å²	132	79 Å²	79	57%	0.574	41%	0.408	S	S	*	.	H	α-helix	trans	-59.4	-35.5	172.3	-72.9	158.4	-178	144.2	0	112.1	S1231 A1239	S1231-K1235 WeakPolarHBondContact O-CD 3.36Å; S1231-K1235 VanDerWaalsContact O-CG 3.31Å; S1231-K1235 WeakPolarHBondContact O-CG 3.34Å; S1231-K1235 PolarHBondContact O-N 3.28Å; S1231-K1235 PolarHBondContact OG-NZ 3.46Å; K1235-A1239 VanDerWaalsContact O-CB 3.28Å; K1235-A1239 WeakPolarHBondContact O-CB 3.19Å; K1235-A1239 PolarHBondContact O-N 3.13Å
1236	S	75.8	Confident	75.8	Confident	65 Å²	65	76.8 Å²	76.8	46%	0.455	41%	0.407	S	S	.	.	H	α-helix	trans	-69.3	-46.1	173.8	-167.6	0	0	0	0	112.4	T1232 H1233 A1234 A1239 N1240	T1232-S1236 PolarHBondContact O-N 3.23Å; T1232-S1236 VanDerWaalsContact O-N 3.16Å; H1233-S1236 WeakPolarHBondContact O-CA 3.39Å; H1233-S1236 VanDerWaalsContact O-CB 3.3Å; H1233-S1236 WeakPolarHBondContact O-CB 3.42Å; H1233-S1236 PolarHBondContact O-N 3.39Å; H1233-S1236 VanDerWaalsContact O-N 3.09Å; A1234-S1236 PolarHBondContact O-N 3.33Å; S1236-A1239 PolarHBondContact O-N 3.26Å; S1236-N1240 PolarHBondContact O-N 2.98Å; S1236-N1240 PolarHBondContact O-ND2 2.89Å; S1236-N1240 VanDerWaalsContact O-ND2 3.08Å
1237	C	75.9	Confident	74.6	Confident	12 Å²	12	74.8 Å²	74.8	8%	0.081	41%	0.405	C	S	.	.	H	α-helix	trans	-60.3	-45.8	174.5	-71.8	0	0	0	0	112.1	H1233 A1234 N1240 L1241	H1233-C1237 VanDerWaalsContact CD2-SG 3.59Å; H1233-C1237 PolarHBondContact O-N 3.1Å; A1234-C1237 PolarHBondContact O-N 3.18Å; C1237-N1240 PolarHBondContact O-N 2.86Å; C1237-L1241 WeakPolarHBondContact O-CG 3.5Å; C1237-L1241 PolarHBondContact O-N 2.83Å
1238	L	72.8	Confident	73.1	Confident	103 Å²	103	75.9 Å²	75.9	54%	0.539	42%	0.415	S	S	.	.	H	α-helix	trans	-63	-42.1	175.8	-72.7	169.7	0	0	0	111.9	A1234 N1240 L1241 V1242	A1234-L1238 WeakPolarHBondContact O-CB 3.32Å; A1234-L1238 WeakPolarHBondContact O-CG 3.41Å; A1234-L1238 PolarHBondContact O-N 3.41Å; L1238-N1240 VanDerWaalsContact C-N 3.29Å; L1238-N1240 PolarHBondContact O-N 3.39Å; L1238-L1241 PolarHBondContact O-N 3.01Å; L1238-V1242 WeakPolarHBondContact O-CB 3.49Å; L1238-V1242 VanDerWaalsContact O-CG2 3.31Å; L1238-V1242 WeakPolarHBondContact O-CG2 3.42Å; L1238-V1242 PolarHBondContact O-N 3.34Å
1239	A	72.5	Confident	71.7	Confident	59 Å²	59	74.6 Å²	74.6	49%	0.488	41%	0.414	S	S	.	.	H	α-helix	trans	-60.3	-39	174.2	0	0	0	0	0	112.2	K1235 S1236 F1243	K1235-A1239 VanDerWaalsContact O-CB 3.28Å; K1235-A1239 WeakPolarHBondContact O-CB 3.19Å; K1235-A1239 PolarHBondContact O-N 3.13Å; S1236-A1239 PolarHBondContact O-N 3.26Å; A1239-F1243 VanDerWaalsContact O-CB 3.25Å; A1239-F1243 WeakPolarHBondContact O-CB 3.46Å; A1239-F1243 PolarHBondContact O-N 3.29Å
1240	N	71.4	Confident	70.1	Confident	76 Å²	76	72.7 Å²	72.7	41%	0.406	41%	0.409	S	S	.	.	H	α-helix	trans	-69.2	-39	175.3	-69.7	-39.3	0	0	0	112.6	S1236 C1237 L1238 F1243 L1244	S1236-N1240 PolarHBondContact O-N 2.98Å; S1236-N1240 PolarHBondContact O-ND2 2.89Å; S1236-N1240 VanDerWaalsContact O-ND2 3.08Å; C1237-N1240 PolarHBondContact O-N 2.86Å; L1238-N1240 VanDerWaalsContact C-N 3.29Å; L1238-N1240 PolarHBondContact O-N 3.39Å; N1240-F1243 PolarHBondContact O-N 2.82Å; N1240-L1244 WeakPolarHBondContact O-CG 3.15Å; N1240-L1244 PolarHBondContact O-N 3.29Å
1241	L	69.2	Low	68.3	Low	53 Å²	53	76.6 Å²	76.6	28%	0.277	42%	0.424	S	S	.	.	H	α-helix	trans	-66.2	-45.6	175	-72.2	169.4	0	0	0	111.6	L1127 A1131 C1237 L1238 F1243 L1244 E1245	L1127-L1241 HydrophobicContact CB-CD2 4.17Å; A1131-L1241 HydrophobicContact CB-CD1 4.34Å; C1237-L1241 WeakPolarHBondContact O-CG 3.5Å; C1237-L1241 PolarHBondContact O-N 2.83Å; L1238-L1241 PolarHBondContact O-N 3.01Å; L1241-F1243 VanDerWaalsContact C-N 3.32Å; L1241-F1243 PolarHBondContact O-N 3.44Å; L1241-L1244 WeakPolarHBondContact O-CB 3.35Å; L1241-L1244 PolarHBondContact O-N 3.24Å; L1241-E1245 PolarHBondContact O-N 3.45Å
1242	V	69.7	Low	66.8	Low	72 Å²	72	81.9 Å²	81.9	44%	0.436	44%	0.444	S	S	.	.	H	α-helix	trans	-65	-34.8	175.2	171.2	0	0	0	0	111.4	L1238 E1245 N1246	L1238-V1242 WeakPolarHBondContact O-CB 3.49Å; L1238-V1242 VanDerWaalsContact O-CG2 3.31Å; L1238-V1242 WeakPolarHBondContact O-CG2 3.42Å; L1238-V1242 PolarHBondContact O-N 3.34Å; V1242-E1245 PolarHBondContact O-N 3.48Å; V1242-N1246 WeakPolarHBondContact CG1-ND2 3.39Å; V1242-N1246 WeakPolarHBondContact O-CB 3.4Å; V1242-N1246 PolarHBondContact O-N 3.31Å; V1242-N1246 PolarHBondContact O-ND2 2.81Å
1243	F	67.9	Low	65.1	Low	142 Å²	142	84.2 Å²	84.2	62%	0.623	45%	0.447	S	S	*	.	H	α-helix	trans	-65.6	-40.4	172.3	-178.9	-95.2	0	0	0	112.1	A1239 N1240 L1241 S1247	A1239-F1243 VanDerWaalsContact O-CB 3.25Å; A1239-F1243 WeakPolarHBondContact O-CB 3.46Å; A1239-F1243 PolarHBondContact O-N 3.29Å; N1240-F1243 PolarHBondContact O-N 2.82Å; L1241-F1243 VanDerWaalsContact C-N 3.32Å; L1241-F1243 PolarHBondContact O-N 3.44Å; F1243-S1247 VanDerWaalsContact O-CB 3.28Å; F1243-S1247 WeakPolarHBondContact O-CB 3.35Å; F1243-S1247 PolarHBondContact O-N 2.97Å; F1243-S1247 PolarHBondContact O-OG 3.43Å
1244	L	65.6	Low	63.5	Low	60 Å²	60	85.3 Å²	85.3	31%	0.314	45%	0.453	S	S	.	.	H	α-helix	trans	-65.7	-45	173.5	-79.8	165.3	0	0	0	111.9	L1127 N1240 L1241 S1247 V1248	L1127-L1244 HydrophobicContact CD1-CD1 3.3Å; N1240-L1244 WeakPolarHBondContact O-CG 3.15Å; N1240-L1244 PolarHBondContact O-N 3.29Å; L1241-L1244 WeakPolarHBondContact O-CB 3.35Å; L1241-L1244 PolarHBondContact O-N 3.24Å; L1244-S1247 CarbonylContact O-C 3.57Å; L1244-S1247 WeakPolarHBondContact O-CB 3.46Å; L1244-S1247 PolarHBondContact O-N 3.29Å; L1244-V1248 WeakPolarHBondContact O-CB 3.24Å; L1244-V1248 VanDerWaalsContact O-CG2 3.31Å; L1244-V1248 WeakPolarHBondContact O-CG2 3.48Å; L1244-V1248 PolarHBondContact O-N 2.85Å
1245	E	63.5	Low	62.3	Low	125 Å²	125	91 Å²	91	58%	0.584	47%	0.47	S	S	*	.	H	α-helix	trans	-61	-49.3	177.2	-173.4	179.1	-162.4	0	0	111.2	L1241 V1242 S1247 V1248 V1249	L1241-E1245 PolarHBondContact O-N 3.45Å; V1242-E1245 PolarHBondContact O-N 3.48Å; E1245-S1247 VanDerWaalsContact C-N 3.27Å; E1245-S1247 PolarHBondContact O-N 3.14Å; E1245-V1248 CarbonylContact O-C 3.57Å; E1245-V1248 PolarHBondContact O-N 3.45Å; E1245-V1248 VanDerWaalsContact O-N 3.1Å; E1245-V1249 HydrophobicContact CG-CG2 4.4Å; E1245-V1249 WeakPolarHBondContact O-CG2 3.38Å; E1245-V1249 PolarHBondContact O-N 2.93Å
1246	N	63.3	Low	60.8	Low	101 Å²	101	92.4 Å²	92.4	54%	0.54	48%	0.476	S	S	.	.	H	α-helix	trans	-59.9	-37.4	175	-81.7	-77	0	0	0	112.1	V1242 A1250	V1242-N1246 WeakPolarHBondContact CG1-ND2 3.39Å; V1242-N1246 WeakPolarHBondContact O-CB 3.4Å; V1242-N1246 PolarHBondContact O-N 3.31Å; V1242-N1246 PolarHBondContact O-ND2 2.81Å; N1246-A1250 WeakPolarHBondContact O-CB 3.4Å; N1246-A1250 PolarHBondContact O-N 3Å
1247	S	60.5	Low	59.4	Low	51 Å²	51	100.3 Å²	100.3	36%	0.357	50%	0.496	S	S	.	.	H	α-helix	trans	-65.9	-39.6	174.6	-62.8	0	0	0	0	112.3	F1243 L1244 E1245 F1251	F1243-S1247 VanDerWaalsContact O-CB 3.28Å; F1243-S1247 WeakPolarHBondContact O-CB 3.35Å; F1243-S1247 PolarHBondContact O-N 2.97Å; F1243-S1247 PolarHBondContact O-OG 3.43Å; L1244-S1247 CarbonylContact O-C 3.57Å; L1244-S1247 WeakPolarHBondContact O-CB 3.46Å; L1244-S1247 PolarHBondContact O-N 3.29Å; E1245-S1247 VanDerWaalsContact C-N 3.27Å; E1245-S1247 PolarHBondContact O-N 3.14Å; S1247-F1251 VanDerWaalsContact O-CB 3.3Å; S1247-F1251 WeakPolarHBondContact O-CB 3.41Å; S1247-F1251 PolarHBondContact O-N 3.09Å
1248	V	56.4	Low	58	Low	75 Å²	75	107 Å²	107	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-68.5	-45.6	176	167.8	0	0	0	0	110.9	L1244 E1245 A1250 F1251 F1252	L1244-V1248 WeakPolarHBondContact O-CB 3.24Å; L1244-V1248 VanDerWaalsContact O-CG2 3.31Å; L1244-V1248 WeakPolarHBondContact O-CG2 3.48Å; L1244-V1248 PolarHBondContact O-N 2.85Å; E1245-V1248 CarbonylContact O-C 3.57Å; E1245-V1248 PolarHBondContact O-N 3.45Å; E1245-V1248 VanDerWaalsContact O-N 3.1Å; V1248-A1250 PolarHBondContact O-N 3.44Å; V1248-F1251 WeakPolarHBondContact O-CB 3.5Å; V1248-F1251 PolarHBondContact O-N 3.06Å; V1248-F1252 HydrophobicContact CG1-CD2 3.69Å; V1248-F1252 HydrophobicContact CG1-CE2 3.76Å; V1248-F1252 WeakPolarHBondContact O-CD2 3.47Å; V1248-F1252 PolarHBondContact O-N 3.32Å
1249	V	53.4	Low	56.1	Low	72 Å²	72	105.9 Å²	105.9	44%	0.436	54%	0.537	S	S	.	.	H	α-helix	trans	-61.2	-43.5	175.1	171.5	0	0	0	0	110.8	E1245 F1252 F1253	E1245-V1249 HydrophobicContact CG-CG2 4.4Å; E1245-V1249 WeakPolarHBondContact O-CG2 3.38Å; E1245-V1249 PolarHBondContact O-N 2.93Å; V1249-F1252 PolarHBondContact O-N 3.36Å; V1249-F1253 HydrophobicContact CG1-CD2 4.3Å; V1249-F1253 PolarHBondContact O-N 3.45Å
1250	A	50.7	Low	54.6	Low	59 Å²	59	106.8 Å²	106.8	49%	0.488	54%	0.54	S	S	.	.	H	α-helix	trans	-62.2	-43	174.3	0	0	0	0	0	112	N1246 V1248 F1253 Q1254	N1246-A1250 WeakPolarHBondContact O-CB 3.4Å; N1246-A1250 PolarHBondContact O-N 3Å; V1248-A1250 PolarHBondContact O-N 3.44Å; A1250-F1253 PolarHBondContact O-N 3.13Å; A1250-Q1254 WeakPolarHBondContact O-CB 3.4Å; A1250-Q1254 PolarHBondContact O-N 3.06Å
1251	F	48.5	Very low	52.8	Low	115 Å²	115	106.7 Å²	106.7	50%	0.504	56%	0.557	S	S	.	*	H	α-helix	trans	-62.5	-43.2	175.3	-174.3	-102	0	0	0	111.8	S1247 V1248 Q1254 R1255	S1247-F1251 VanDerWaalsContact O-CB 3.3Å; S1247-F1251 WeakPolarHBondContact O-CB 3.41Å; S1247-F1251 PolarHBondContact O-N 3.09Å; V1248-F1251 WeakPolarHBondContact O-CB 3.5Å; V1248-F1251 PolarHBondContact O-N 3.06Å; F1251-Q1254 PolarHBondContact O-N 2.92Å; F1251-R1255 VanDerWaalsContact O-CB 3.3Å; F1251-R1255 WeakPolarHBondContact O-CB 3.39Å; F1251-R1255 PolarHBondContact O-N 3.18Å
1252	F	47.8	Very low	51.2	Low	136 Å²	136	113 Å²	113	60%	0.596	58%	0.582	S	S	*	*	H	α-helix	trans	-65.2	-41	174.1	-88.3	-72.6	0	0	0	112.6	V1248 V1249 R1255 K1256	V1248-F1252 HydrophobicContact CG1-CD2 3.69Å; V1248-F1252 HydrophobicContact CG1-CE2 3.76Å; V1248-F1252 WeakPolarHBondContact O-CD2 3.47Å; V1248-F1252 PolarHBondContact O-N 3.32Å; V1249-F1252 PolarHBondContact O-N 3.36Å; F1252-R1255 CarbonylContact O-C 3.56Å; F1252-R1255 PolarHBondContact O-N 2.69Å; F1252-K1256 WeakPolarHBondContact O-CB 3.42Å; F1252-K1256 PolarHBondContact O-N 3.45Å
1253	F	47.2	Very low	49.6	Very low	138 Å²	138	120.3 Å²	120.3	61%	0.605	60%	0.602	S	S	*	*	H	α-helix	trans	-62.9	-42.4	173.5	-109.8	-86.3	0	0	0	112.1	V1249 A1250 R1255 K1256 R1257	V1249-F1253 HydrophobicContact CG1-CD2 4.3Å; V1249-F1253 PolarHBondContact O-N 3.45Å; A1250-F1253 PolarHBondContact O-N 3.13Å; F1253-R1255 VanDerWaalsContact C-N 3.28Å; F1253-R1255 PolarHBondContact O-N 3.02Å; F1253-K1256 PolarHBondContact O-N 3.01Å; F1253-R1257 PolarHBondContact O-N 3.08Å; F1253-R1257 VanDerWaalsContact O-N 3.09Å
1254	Q	48.6	Very low	48	Very low	126 Å²	126	119.9 Å²	119.9	59%	0.589	61%	0.605	S	S	*	*	H	α-helix	trans	-66.8	-30.4	176.8	-159.8	-178.3	61.5	0	0	111.9	A1250 F1251	A1250-Q1254 WeakPolarHBondContact O-CB 3.4Å; A1250-Q1254 PolarHBondContact O-N 3.06Å; F1251-Q1254 PolarHBondContact O-N 2.92Å
1255	R	50.4	Low	46.4	Very low	139 Å²	139	124.2 Å²	124.2	53%	0.525	63%	0.628	S	S	.	*	H	α-helix	trans	-79.4	-31.9	173.4	-162.3	168.8	-173.3	152.6	-2.2	113.1	F1251 F1252 F1253 R1257 K1258	F1251-R1255 VanDerWaalsContact O-CB 3.3Å; F1251-R1255 WeakPolarHBondContact O-CB 3.39Å; F1251-R1255 PolarHBondContact O-N 3.18Å; F1252-R1255 CarbonylContact O-C 3.56Å; F1252-R1255 PolarHBondContact O-N 2.69Å; F1253-R1255 VanDerWaalsContact C-N 3.28Å; F1253-R1255 PolarHBondContact O-N 3.02Å; R1255-R1257 VanDerWaalsContact C-N 3.3Å; R1255-R1257 PolarHBondContact O-N 3.26Å; R1255-K1258 CarbonylContact O-C 3.59Å; R1255-K1258 VanDerWaalsContact O-C 3.3Å; R1255-K1258 VanDerWaalsContact O-CA 3.3Å; R1255-K1258 WeakPolarHBondContact O-CA 3.01Å; R1255-K1258 PolarHBondContact O-N 3.02Å
1256	K	46.5	Very low	45	Very low	161 Å²	161	125 Å²	125	70%	0.7	64%	0.636	S	S	*	*	H	α-helix	trans	-65.5	-32.5	172.4	-161.4	171.1	-174.3	175.9	0	111.5	F1252 F1253 K1258	F1252-K1256 WeakPolarHBondContact O-CB 3.42Å; F1252-K1256 PolarHBondContact O-N 3.45Å; F1253-K1256 PolarHBondContact O-N 3.01Å; K1256-K1258 PolarHBondContact O-N 3.1Å
1257	R	45.8	Very low	43.4	Very low	232 Å²	232	126.5 Å²	126.5	88%	0.875	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	-9.2	164.8	-83.5	-172.6	172.1	179.8	-0.7	114.7	F1253 R1255	F1253-R1257 PolarHBondContact O-N 3.08Å; F1253-R1257 VanDerWaalsContact O-N 3.09Å; R1255-R1257 VanDerWaalsContact C-N 3.3Å; R1255-R1257 PolarHBondContact O-N 3.26Å
1258	K	46.7	Very low	42.2	Very low	152 Å²	152	133.2 Å²	133.2	66%	0.661	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	38.3	-177.9	-70.5	-176.1	175.3	178.8	0	113.5	R1255 K1256 S1260	R1255-K1258 CarbonylContact O-C 3.59Å; R1255-K1258 VanDerWaalsContact O-C 3.3Å; R1255-K1258 VanDerWaalsContact O-CA 3.3Å; R1255-K1258 WeakPolarHBondContact O-CA 3.01Å; R1255-K1258 PolarHBondContact O-N 3.02Å; K1256-K1258 PolarHBondContact O-N 3.1Å; K1258-S1260 PolarHBondContact O-N 3.03Å; K1258-S1260 PolarHBondContact O-OG 3.4Å; K1258-S1260 VanDerWaalsContact O-OG 3.06Å
1259	G	33.7	Very low	40.9	Very low	80 Å²	80	137.3 Å²	137.3	83%	0.825	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.4	12.9	145.1	0	0	0	0	0	119.7
1260	S	40.3	Very low	39.8	Very low	78 Å²	78	141.4 Å²	141.4	55%	0.545	70%	0.701	S	S	.	*			trans	-108.7	100.7	-177.2	35.9	0	0	0	0	110.1	K1258	K1258-S1260 PolarHBondContact O-N 3.03Å; K1258-S1260 PolarHBondContact O-OG 3.4Å; K1258-S1260 VanDerWaalsContact O-OG 3.06Å
1261	G	32.4	Very low	38.8	Very low	73 Å²	73	142.7 Å²	142.7	75%	0.753	72%	0.72	S	S	*	*			trans	-79.6	117.5	-179.9	0	0	0	0	0	112.3
1262	F	36.5	Very low	37.9	Very low	187 Å²	187	146.7 Å²	146.7	82%	0.82	74%	0.737	S	S	*	*			trans	-150.3	112.2	156.8	-138.9	-91.5	0	0	0	107.5	I1264	F1262-I1264 HydrophobicContact CD1-CG1 4.12Å
1263	W	35.7	Very low	37	Very low	225 Å²	225	145.2 Å²	145.2	85%	0.852	75%	0.75	S	S	*	*			trans	-95.4	142.1	169.8	-67.4	91.3	0	0	0	107.8
1264	I	35.6	Very low	36.2	Very low	133 Å²	133	146 Å²	146	68%	0.682	76%	0.76	S	S	*	*			trans	-122.7	109.7	175	-61.9	178.2	0	0	0	106.4	F1262 L1266	F1262-I1264 HydrophobicContact CD1-CG1 4.12Å; I1264-L1266 HydrophobicContact CG2-CG 4.48Å
1265	D	32	Very low	35.3	Very low	150 Å²	150	145.8 Å²	145.8	80%	0.802	76%	0.762	S	S	*	*			trans	-72.8	129.3	170.5	-64.1	-52.1	0	0	0	109.4
1266	L	33.8	Very low	34.2	Very low	143 Å²	143	147 Å²	147	75%	0.749	77%	0.774	S	S	*	*			trans	-111.3	76.9	175.6	-78.7	170.9	0	0	0	110.4	I1264 F1268	I1264-L1266 HydrophobicContact CG2-CG 4.48Å; L1266-F1268 PolarHBondContact O-N 3.1Å
1267	N	29.9	Very low	33.4	Very low	131 Å²	131	143 Å²	143	70%	0.701	78%	0.778	S	S	*	*			trans	-72	109.8	167.5	-89.3	6.3	0	0	0	110.3	E1269	N1267-E1269 PolarHBondContact O-N 3.14Å
1268	F	33.7	Very low	32.5	Very low	193 Å²	193	140.5 Å²	140.5	85%	0.846	78%	0.776	S	S	*	*			trans	-94	63.2	169.5	-106.1	-89.4	0	0	0	111.9	L1266 N1270	L1266-F1268 PolarHBondContact O-N 3.1Å; F1268-N1270 PolarHBondContact O-N 2.84Å
1269	E	29.7	Very low	31.7	Very low	161 Å²	161	138.8 Å²	138.8	75%	0.752	78%	0.783	S	S	*	*			trans	-75.5	82.4	171.3	-69.4	-174.8	114.6	0	0	111.2	N1267	N1267-E1269 PolarHBondContact O-N 3.14Å
1270	N	29.9	Very low	31.5	Very low	158 Å²	158	146.9 Å²	146.9	85%	0.845	81%	0.806	S	S	*	*			trans	-172.3	62.3	157.6	-98.7	-46.9	0	0	0	113	F1268 K1272	F1268-N1270 PolarHBondContact O-N 2.84Å; N1270-K1272 VanDerWaalsContact C-N 3.29Å; N1270-K1272 PolarHBondContact O-N 3.46Å
1271	G	29.5	Very low	31	Very low	86 Å²	86	150.4 Å²	150.4	89%	0.887	82%	0.819	S	S	*	*			trans	-76	59.2	-178.9	0	0	0	0	0	115.7
1272	K	30.4	Very low	30.9	Very low	198 Å²	198	154.4 Å²	154.4	86%	0.861	82%	0.823	S	S	*	*	S	Bend	trans	-130.8	130.5	166.5	-80.2	-171.8	175.2	-177.8	0	109.7	N1270	N1270-K1272 VanDerWaalsContact C-N 3.29Å; N1270-K1272 PolarHBondContact O-N 3.46Å
1273	A	28.8	Very low	30.6	Very low	105 Å²	105	152.6 Å²	152.6	87%	0.868	82%	0.823	S	S	*	*	S	Bend	trans	70.6	70.1	-165.9	0	0	0	0	0	113.9
1274	L	30	Very low	30.3	Very low	156 Å²	156	148.4 Å²	148.4	82%	0.817	82%	0.821	S	S	*	*			trans	-166.7	86.1	156.9	-105.9	165	0	0	0	107.2
1275	D	29.3	Very low	30	Very low	120 Å²	120	149.3 Å²	149.3	64%	0.642	83%	0.83	S	S	*	*			trans	-115	19.8	174.6	-155	-19.1	0	0	0	110.7	K906	K906-D1275 PolarHBondContact NZ-O 2.77Å; K906-D1275 IonicContact NZ-OD1 3.86Å; K906-D1275 PolarHBondContact NZ-OD1 3.36Å
1276	E	29.1	Very low	29.9	Very low	166 Å²	166	149.3 Å²	149.3	78%	0.776	83%	0.831	S	S	*	*			trans	-106.6	82.6	170	-71.6	165.9	176.3	0	0	105.9	H1278	E1276-H1278 PolarHBondContact O-N 2.91Å
1277	G	29.4	Very low	29.6	Very low	75 Å²	75	149.7 Å²	149.7	77%	0.773	84%	0.837	S	S	*	*			trans	-90.9	47.7	-159.6	0	0	0	0	0	116.1	S1279	G1277-S1279 PolarHBondContact O-N 2.82Å
1278	H	26.8	Very low	29.6	Very low	181 Å²	181	151.2 Å²	151.2	84%	0.838	85%	0.848	S	S	*	*			trans	-65.1	132	169	-77.4	-89.3	0	0	0	110.5	E1276	E1276-H1278 PolarHBondContact O-N 2.91Å
1279	S	30.4	Very low	29.2	Very low	115 Å²	115	147.7 Å²	147.7	80%	0.804	85%	0.848	S	S	*	*			trans	-139.8	71.3	-175.6	174.3	0	0	0	0	111.3	G1277	G1277-S1279 PolarHBondContact O-N 2.82Å
1280	L	27.6	Very low	29.2	Very low	251 Å²	251	146.5 Å²	146.5	100%	1.314	86%	0.857	S	S	*	*			trans	47.4	0	169.7	-81.4	162.5	0	0	0	116.2

Retrieved 1,280 of 1,280 residues in 822.8 ms (Link to these results)

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