G4V9B2_SCHMA Loading...

Putative tpr repeat nuclear phosphoprotein

AlphaFold DB , UniProt , Accession G4V9B2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,091 aa.

						>G4V9B2_SCHMA|G4V9B2
MDISVNSDYGGLPTENTIEIPLRGGDEIIELDTDQLPDGEEVLNILNQEKAPLQIWITVAIAYYKKKLYDDFEKVLEEAYLNAADLQPYHDSDLVRLLDMLANYYGRKAYKEKSKDKKNQLIAQATRLFTSADRIDMYDQKHLLGRAFFFIYEGENWSQADSQLNFVLNQGAPSVPAYLGKACIAFNKKEYRNALGFYRKALRLQPNCPATVRLGMGHCFFRLGNMEKARLAFKRALDLDPECVGALVGLAVLDLNEKTQESIKQGVQKLSRAYNLDSTNPMVLNHLADHFFYKKEYAKVHRLALHAFYNTETESIRAESCYQMARAFHIQENYDNAFQYYYLATQLASSTFILPFYGLGQMYLHRNDLEHAAMSFERVLKDNPNNYETLKILGSLYAQSNKPDKRTQSKQLFKQVTESQPEDVEAWIEYAQLLDNDINGALDAYSKALTILENIQLEIAPEILNNIAALHFTKGEYDKSSEFFTRSYDRILEEQRNEENECGGDSSGLTNDDYYHGLSITVRYNQARLHEAQGRSDLAEEIYKSILLRHPSYIECYLRLGCIARDRGQIRDASIWFKEALDVDQDNPDAWTLIGLLHLGKNEVEQAQKKFDRIIRQPAYRADAFARICLGNIWLTTLHHPIKDKDKRKRHQDRALSFYKAVLCADPRNIWAAHGIGCVLAHKGFVNEARDVFAQVREATADFPDVWINIAHIYVEQKQYTAAIQMYENCIKKFSRQNNTELLQYLARAHFKAGQLKECKTMLLKARHVKPWDPVLTFNLAFVQKRLAVTVLQDETSSFSSVCEAIADLNMARCTFNHLSKLNEVLNQAMAADEARICQDLLSQAKYHLDRAKSREEQERVVRKRQEEEREAQRKRQLELQQQAEQMRLDRERRLEEERGRFLEKAKQIIIEPVVEEKKSRRSGGGNRKRDDFIASGDEESSESSNEAAAGDRSENVDSVGQQKQKKIGNKRQSSESKEGNLLRKKSRFSNSRDDGLSAKQRMRIVSKAIVSDSSDSSSSGEDEQEHQARAAALARKILSSDDDDGSESEDQSPPMTGRQQQQSMDSSPSDLSDSSSPRRHNEHRSKPRRV
					

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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	29.2	Very low	31	Very low	18 Å²	18	67.6 Å²	67.6	9%	0.089	42%	0.421	C	S	.	.				0	-62.3	0	-73.9	-153.5	-91	0	0	115.2	I3 S4 V5 Y64 F72 M100 N103 Y104	M1-I3 PolarHBondContact O-N 3.05Å; M1-S4 WeakPolarHBondContact CA-OG 3.44Å; M1-S4 PolarHBondContact N-OG 3.19Å; M1-S4 VanDerWaalsContact N-OG 3.13Å; M1-S4 PolarHBondContact O-N 3.45Å; M1-S4 PolarHBondContact O-OG 3.25Å; M1-V5 HydrophobicContact CB-CG2 4.08Å; M1-V5 HydrophobicContact CG-CG2 4.27Å; M1-V5 WeakPolarHBondContact O-CB 3.45Å; M1-V5 WeakPolarHBondContact O-CG2 3.45Å; M1-V5 PolarHBondContact O-N 3.39Å; M1-V5 HydrophobicContact SD-CG2 4.37Å; M1-Y64 HydrophobicContact CB-CE1 4.28Å; M1-Y64 HydrophobicContact CB-CE2 4.18Å; M1-Y64 WeakPolarHBondContact CB-OH 3.44Å; M1-Y64 HydrophobicContact CE-CE2 3.94Å; M1-Y64 HydrophobicContact SD-CD2 4.29Å; M1-Y64 HydrophobicContact SD-CE2 3.82Å; M1-F72 HydrophobicContact CE-CE1 3.92Å; M1-F72 HydrophobicContact CE-CZ 3.97Å; M1-F72 HydrophobicContact SD-CE1 4.28Å; M1-F72 HydrophobicContact SD-CZ 3.74Å; M1-M100 WeakPolarHBondContact CE-O 3.44Å; M1-N103 HydrophobicContact CE-CB 4.17Å; M1-N103 HydrophobicContact CG-CB 4.28Å; M1-Y104 HydrophobicContact CE-CD2 4.04Å; M1-Y104 HydrophobicContact CE-CG 4.32Å
2	D	34.3	Very low	30.6	Very low	72 Å²	72	74.6 Å²	74.6	39%	0.385	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-8.5	-173.9	-52.7	-17.5	0	0	0	116.3	N6 Y64 R107	D2-N6 PolarHBondContact O-ND2 3.35Å; D2-Y64 WeakPolarHBondContact OD1-CE1 3.42Å; D2-Y64 PolarHBondContact OD1-OH 3.18Å; D2-R107 IonicContact OD1-CZ 3.38Å; D2-R107 IonicContact OD1-NH1 3.77Å; D2-R107 PolarHBondContact OD1-NH1 3.38Å; D2-R107 IonicContact OD2-CZ 3.79Å; D2-R107 VanDerWaalsContact OD2-CZ 3.27Å; D2-R107 IonicContact OD2-NH1 3.56Å; D2-R107 PolarHBondContact OD2-NH1 2.83Å; D2-R107 IonicContact OD2-NH2 3.37Å; D2-R107 PolarHBondContact OD2-NH2 2.95Å
3	I	31.3	Very low	30.7	Very low	55 Å²	55	76.5 Å²	76.5	28%	0.282	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.4	-4.5	176.3	-37.6	158.3	0	0	0	111.3	M1 P176 L179	M1-I3 PolarHBondContact O-N 3.05Å; I3-P176 HydrophobicContact CB-CG 4.31Å; I3-P176 HydrophobicContact CG2-CG 3.92Å; I3-L179 HydrophobicContact CD1-CD1 3.78Å; I3-L179 HydrophobicContact CG2-CD1 4.47Å
4	S	31.9	Very low	31.9	Very low	42 Å²	42	78.2 Å²	78.2	29%	0.294	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-27.6	-178.8	64	0	0	0	0	113.4	M1 N6 S7	M1-S4 WeakPolarHBondContact CA-OG 3.44Å; M1-S4 PolarHBondContact N-OG 3.19Å; M1-S4 VanDerWaalsContact N-OG 3.13Å; M1-S4 PolarHBondContact O-N 3.45Å; M1-S4 PolarHBondContact O-OG 3.25Å; S4-N6 PolarHBondContact O-N 3.1Å; S4-S7 PolarHBondContact O-N 3.42Å; S4-S7 PolarHBondContact O-OG 3.44Å
5	V	33.4	Very low	33.3	Very low	18 Å²	18	83.3 Å²	83.3	11%	0.109	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-20.2	158.2	178	0	0	0	0	110.3	M1 I61 Y64	M1-V5 HydrophobicContact CB-CG2 4.08Å; M1-V5 HydrophobicContact CG-CG2 4.27Å; M1-V5 WeakPolarHBondContact O-CB 3.45Å; M1-V5 WeakPolarHBondContact O-CG2 3.45Å; M1-V5 PolarHBondContact O-N 3.39Å; M1-V5 HydrophobicContact SD-CG2 4.37Å; V5-I61 HydrophobicContact CG1-CG1 4.33Å; V5-I61 HydrophobicContact CG1-CG2 3.82Å; V5-Y64 HydrophobicContact CG1-CD1 4.44Å; V5-Y64 HydrophobicContact CG2-CD1 4.24Å; V5-Y64 HydrophobicContact CG2-CE1 4.27Å
6	N	34.5	Very low	35.5	Very low	56 Å²	56	83.2 Å²	83.2	30%	0.299	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	18.1	178.8	-75.1	-24.8	0	0	0	112.8	D2 S4 D8 Y9	D2-N6 PolarHBondContact O-ND2 3.35Å; S4-N6 PolarHBondContact O-N 3.1Å; N6-D8 PolarHBondContact O-N 3.1Å; N6-Y9 HydrophobicContact CB-CD2 3.82Å; N6-Y9 HydrophobicContact CB-CE2 3.52Å; N6-Y9 VanDerWaalsContact CG-CE2 3.46Å; N6-Y9 WeakPolarHBondContact O-CD2 3.47Å
7	S	33.2	Very low	38	Very low	67 Å²	67	81.4 Å²	81.4	47%	0.469	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-26.5	171	52.1	0	0	0	0	112.1	S4 Y9	S4-S7 PolarHBondContact O-N 3.42Å; S4-S7 PolarHBondContact O-OG 3.44Å; S7-Y9 PolarHBondContact O-N 2.87Å
8	D	30.4	Very low	40.4	Very low	100 Å²	100	77.8 Å²	77.8	54%	0.535	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	24.3	-167.2	-51.6	-13.1	0	0	0	111.4	N6 G10 R96	N6-D8 PolarHBondContact O-N 3.1Å; D8-G10 PolarHBondContact O-N 3.27Å; D8-R96 IonicContact OD2-NH2 2.63Å
9	Y	30.2	Very low	42.6	Very low	170 Å²	170	80.1 Å²	80.1	67%	0.667	46%	0.464	S	S	*	.			trans	-72.3	56.8	169.7	-80.9	-48.2	0	0	0	111.9	N6 S7	N6-Y9 HydrophobicContact CB-CD2 3.82Å; N6-Y9 HydrophobicContact CB-CE2 3.52Å; N6-Y9 VanDerWaalsContact CG-CE2 3.46Å; N6-Y9 WeakPolarHBondContact O-CD2 3.47Å; S7-Y9 PolarHBondContact O-N 2.87Å
10	G	25.6	Very low	44.6	Very low	62 Å²	62	76.1 Å²	76.1	64%	0.639	44%	0.441	S	S	*	.	S	Bend	trans	-119.4	50.8	-176.9	0	0	0	0	0	113.2	D8 L12	D8-G10 PolarHBondContact O-N 3.27Å; G10-L12 PolarHBondContact O-N 3.18Å
11	G	27.1	Very low	46.2	Very low	84 Å²	84	75.3 Å²	75.3	87%	0.866	44%	0.438	S	S	*	.	S	Bend	trans	72.8	-6.8	163.1	0	0	0	0	0	118.2
12	L	25.9	Very low	48.5	Very low	151 Å²	151	76.7 Å²	76.7	79%	0.791	45%	0.446	S	S	*	.			trans	-69.6	141.1	168.5	-74.3	158.6	0	0	0	110	G10	G10-L12 PolarHBondContact O-N 3.18Å
13	P	32.4	Very low	50.1	Low	99 Å²	99	81.8 Å²	81.8	64%	0.643	46%	0.46	S	S	*	.			trans	-61.3	145.6	169.1	29.1	-33.9	0	0	0	109	E15	P13-E15 PolarHBondContact O-N 2.94Å; P13-E15 VanDerWaalsContact O-N 3.14Å
14	T	46.8	Very low	51.7	Low	101 Å²	101	83.1 Å²	83.1	62%	0.62	49%	0.487	S	S	*	.			trans	-68.5	109.1	158.1	45.5	0	0	0	0	106.8	N16	T14-N16 PolarHBondContact O-N 2.91Å; T14-N16 VanDerWaalsContact O-N 3.11Å; T14-N16 PolarHBondContact O-OD1 3.33Å
15	E	53.7	Low	53.3	Low	154 Å²	154	83.5 Å²	83.5	72%	0.72	50%	0.497	S	S	*	.			trans	-58.5	114.2	163.9	-73.8	155.5	173.4	0	0	106.7	P13 T17	P13-E15 PolarHBondContact O-N 2.94Å; P13-E15 VanDerWaalsContact O-N 3.14Å; E15-T17 PolarHBondContact O-N 3.28Å
16	N	67.5	Low	54.9	Low	82 Å²	82	90.8 Å²	90.8	44%	0.439	54%	0.536	S	S	.	.	S	Bend	trans	-71.3	-18.4	-177.1	-82.7	24	0	0	0	111.3	T14 T33	T14-N16 PolarHBondContact O-N 2.91Å; T14-N16 VanDerWaalsContact O-N 3.11Å; T14-N16 PolarHBondContact O-OD1 3.33Å; N16-T33 WeakPolarHBondContact O-CB 3.27Å; N16-T33 WeakPolarHBondContact O-CG2 3.32Å; N16-T33 PolarHBondContact O-N 2.98Å; N16-T33 PolarHBondContact O-OG1 2.77Å
17	T	79	Confident	56.6	Low	52 Å²	52	95.1 Å²	95.1	32%	0.319	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.8	141.9	174.8	42.6	0	0	0	0	110.3	E15 E30 L31	E15-T17 PolarHBondContact O-N 3.28Å; T17-E30 HydrophobicContact CG2-CB 4.28Å; T17-L31 CarbonylContact C-O 3.56Å; T17-L31 WeakPolarHBondContact CA-O 3.37Å
18	I	80.6	Confident	58.9	Low	18 Å²	18	95.7 Å²	95.7	9%	0.092	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.2	121.4	164.7	-66.5	170.4	0	0	0	107.4	I20 L31 T33 I55 V59 A62	I18-I20 HydrophobicContact CG2-CG1 4.38Å; I18-L31 HydrophobicContact CB-CB 4.46Å; I18-L31 PolarHBondContact N-O 2.65Å; I18-L31 PolarHBondContact O-N 2.82Å; I18-T33 HydrophobicContact CD1-CG2 3.75Å; I18-T33 HydrophobicContact CG1-CG2 3.67Å; I18-I55 HydrophobicContact CG2-CG2 3.99Å; I18-V59 HydrophobicContact CD1-CG2 4.01Å; I18-V59 HydrophobicContact CG2-CG2 4.17Å; I18-A62 HydrophobicContact CD1-CB 4.16Å
19	E	83.1	Confident	61.3	Low	120 Å²	120	93.5 Å²	93.5	56%	0.561	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	117.9	177.7	-71.2	177.8	-160.2	0	0	110.6	I28	E19-I28 HydrophobicContact CB-CG2 3.61Å; E19-I28 HydrophobicContact CG-CG2 3.93Å
20	I	82.5	Confident	63.8	Low	0 Å²	0	92.1 Å²	92.1	0%	0	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	113.7	175.7	-46.5	178.1	0	0	0	108.7	I18 I28 I29 L31 I45 L46 A51 I55	I18-I20 HydrophobicContact CG2-CG1 4.38Å; I20-I28 WeakPolarHBondContact O-CA 3.43Å; I20-I29 HydrophobicContact CB-CB 4.27Å; I20-I29 PolarHBondContact N-O 3.1Å; I20-I29 PolarHBondContact O-N 3.13Å; I20-L31 HydrophobicContact CD1-CB 4.39Å; I20-L31 HydrophobicContact CD1-CD1 4.1Å; I20-I45 HydrophobicContact CD1-CG2 4.25Å; I20-L46 HydrophobicContact CD1-CD2 4.04Å; I20-L46 HydrophobicContact CG2-CD2 4.23Å; I20-A51 HydrophobicContact CG2-CB 3.87Å; I20-I55 HydrophobicContact CG1-CG2 4.09Å
21	P	78.7	Confident	66.5	Low	60 Å²	60	89.6 Å²	89.6	39%	0.39	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	135.8	-177.1	29.9	-34.1	0	0	0	111.7	I55	P21-I55 VanDerWaalsContact CD-CD1 3.43Å; P21-I55 HydrophobicContact CG-CD1 4.28Å
22	L	77.3	Confident	69.1	Low	48 Å²	48	88 Å²	88	25%	0.251	48%	0.482	S	S	.	.			trans	-81.2	148.4	177.9	-70.3	172.4	0	0	0	112.7	G24 E27 I29 E49	L22-G24 VanDerWaalsContact C-N 3.32Å; L22-G24 PolarHBondContact O-N 3.48Å; L22-E27 WeakPolarHBondContact CB-O 3.42Å; L22-E27 HydrophobicContact CD1-CB 3.72Å; L22-E27 PolarHBondContact N-O 3.14Å; L22-E27 VanDerWaalsContact N-O 3.09Å; L22-I29 HydrophobicContact CD1-CG1 4.48Å; L22-I29 HydrophobicContact CD2-CD1 3.66Å; L22-I29 HydrophobicContact CD2-CG1 3.86Å; L22-I29 HydrophobicContact CG-CG1 4.26Å; L22-E49 WeakPolarHBondContact CA-OE2 3.43Å; L22-E49 HydrophobicContact CD2-CG 3.81Å; L22-E49 WeakPolarHBondContact CD2-OE2 3.29Å
23	R	67.7	Low	71.6	Confident	179 Å²	179	82.2 Å²	82.2	68%	0.675	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	68.3	-170.2	-163.4	179.9	171.9	-147.7	-6.3	113.4	E49	R23-E49 WeakPolarHBondContact CB-OE2 3.42Å; R23-E49 PolarHBondContact N-OE2 3.17Å
24	G	65	Low	73.6	Confident	83 Å²	83	81.9 Å²	81.9	86%	0.856	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	143.8	12.6	168.8	0	0	0	0	0	116.6	L22	L22-G24 VanDerWaalsContact C-N 3.32Å; L22-G24 PolarHBondContact O-N 3.48Å
25	G	65.2	Low	75.2	Confident	49 Å²	49	84.3 Å²	84.3	51%	0.505	45%	0.45	S	S	.	.	S	Bend	trans	-152.1	178.1	175.1	0	0	0	0	0	111.8	E27	G25-E27 PolarHBondContact O-N 3.03Å
26	D	66.2	Low	76.3	Confident	172 Å²	172	78.3 Å²	78.3	92%	0.92	42%	0.423	S	S	*	.	S	Bend	trans	-82.8	11.4	177.1	-58.6	-36.2	0	0	0	112.6
27	E	71.5	Confident	76.9	Confident	146 Å²	146	76.5 Å²	76.5	68%	0.682	42%	0.415	S	S	*	.			trans	-87.6	147.9	-179.5	-67.2	-177.5	-177.7	0	0	111.6	L22 G25	L22-E27 WeakPolarHBondContact CB-O 3.42Å; L22-E27 HydrophobicContact CD1-CB 3.72Å; L22-E27 PolarHBondContact N-O 3.14Å; L22-E27 VanDerWaalsContact N-O 3.09Å; G25-E27 PolarHBondContact O-N 3.03Å
28	I	81	Confident	77.1	Confident	80 Å²	80	80 Å²	80	41%	0.41	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	136.2	-170.8	-61.9	176.7	0	0	0	108.7	E19 I20	E19-I28 HydrophobicContact CB-CG2 3.61Å; E19-I28 HydrophobicContact CG-CG2 3.93Å; I20-I28 WeakPolarHBondContact O-CA 3.43Å
29	I	80.9	Confident	77.1	Confident	54 Å²	54	79.2 Å²	79.2	28%	0.277	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	112.4	165.3	-64.6	171.4	0	0	0	107.9	I20 L22 I45	I20-I29 HydrophobicContact CB-CB 4.27Å; I20-I29 PolarHBondContact N-O 3.1Å; I20-I29 PolarHBondContact O-N 3.13Å; L22-I29 HydrophobicContact CD1-CG1 4.48Å; L22-I29 HydrophobicContact CD2-CD1 3.66Å; L22-I29 HydrophobicContact CD2-CG1 3.86Å; L22-I29 HydrophobicContact CG-CG1 4.26Å; I29-I45 HydrophobicContact CD1-CG2 3.68Å
30	E	81.6	Confident	77.2	Confident	140 Å²	140	79.1 Å²	79.1	65%	0.654	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	119.5	167.8	-68.8	177.4	-148.2	0	0	110.1	T17	T17-E30 HydrophobicContact CG2-CB 4.28Å
31	L	82.9	Confident	77.3	Confident	9 Å²	9	84.8 Å²	84.8	5%	0.047	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	112.5	176.9	-172.8	155.4	0	0	0	110.2	T17 I18 I20 T33 L36 V42	T17-L31 CarbonylContact C-O 3.56Å; T17-L31 WeakPolarHBondContact CA-O 3.37Å; I18-L31 HydrophobicContact CB-CB 4.46Å; I18-L31 PolarHBondContact N-O 2.65Å; I18-L31 PolarHBondContact O-N 2.82Å; I20-L31 HydrophobicContact CD1-CB 4.39Å; I20-L31 HydrophobicContact CD1-CD1 4.1Å; L31-T33 PolarHBondContact O-N 3.02Å; L31-L36 HydrophobicContact CD2-CD2 3.55Å; L31-V42 HydrophobicContact CD1-CG1 3.83Å; L31-V42 HydrophobicContact CD1-CG2 3.83Å
32	D	82.2	Confident	77.6	Confident	50 Å²	50	82 Å²	82	27%	0.267	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	113.2	178.9	179.9	12.3	0	0	0	111.1	D34 Q35 L36	D32-D34 PolarHBondContact O-N 3.22Å; D32-D34 WeakPolarHBondContact OD1-CB 3.45Å; D32-D34 PolarHBondContact OD1-N 3.42Å; D32-Q35 HydrophobicContact CB-CB 4.42Å; D32-Q35 CarbonylContact O-C 3.57Å; D32-Q35 PolarHBondContact O-N 2.92Å; D32-Q35 VanDerWaalsContact O-N 3.09Å; D32-Q35 PolarHBondContact OD2-NE2 2.89Å; D32-L36 PolarHBondContact O-N 2.91Å
33	T	77.2	Confident	78	Confident	31 Å²	31	79.9 Å²	79.9	19%	0.19	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.3	176.4	63.6	0	0	0	0	113	N16 I18 L31 A62 K66	N16-T33 WeakPolarHBondContact O-CB 3.27Å; N16-T33 WeakPolarHBondContact O-CG2 3.32Å; N16-T33 PolarHBondContact O-N 2.98Å; N16-T33 PolarHBondContact O-OG1 2.77Å; I18-T33 HydrophobicContact CD1-CG2 3.75Å; I18-T33 HydrophobicContact CG1-CG2 3.67Å; L31-T33 PolarHBondContact O-N 3.02Å; T33-A62 HydrophobicContact CG2-CB 4.28Å; T33-K66 WeakPolarHBondContact O-CE 3.24Å
34	D	76	Confident	78.9	Confident	91 Å²	91	75.7 Å²	75.7	49%	0.487	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-26.3	173.3	-104.3	-35.5	0	0	0	112.6	D32 K66	D32-D34 PolarHBondContact O-N 3.22Å; D32-D34 WeakPolarHBondContact OD1-CB 3.45Å; D32-D34 PolarHBondContact OD1-N 3.42Å; D34-K66 VanDerWaalsContact CA-NZ 3.32Å; D34-K66 WeakPolarHBondContact O-CE 3.43Å; D34-K66 PolarHBondContact O-NZ 3.28Å; D34-K66 IonicContact OD1-NZ 2.64Å; D34-K66 PolarHBondContact OD1-NZ 3.33Å
35	Q	78.8	Confident	79.8	Confident	153 Å²	153	74 Å²	74	72%	0.715	39%	0.387	S	S	*	.	S	Bend	trans	-129.5	63.5	-178.1	-66.6	174	98.5	0	0	111.6	D32	D32-Q35 HydrophobicContact CB-CB 4.42Å; D32-Q35 CarbonylContact O-C 3.57Å; D32-Q35 PolarHBondContact O-N 2.92Å; D32-Q35 VanDerWaalsContact O-N 3.09Å; D32-Q35 PolarHBondContact OD2-NE2 2.89Å
36	L	77.5	Confident	80.8	Confident	28 Å²	28	71.7 Å²	71.7	15%	0.147	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-57.6	129.9	175.2	-66.4	172.4	0	0	0	111.6	L31 D32 A62 Y63 K66 L68	L31-L36 HydrophobicContact CD2-CD2 3.55Å; D32-L36 PolarHBondContact O-N 2.91Å; L36-A62 HydrophobicContact CD1-CB 4.13Å; L36-A62 HydrophobicContact CD2-CB 3.93Å; L36-Y63 HydrophobicContact CB-CD1 4.41Å; L36-Y63 HydrophobicContact CB-CE1 3.92Å; L36-Y63 HydrophobicContact CD1-CD1 3.71Å; L36-Y63 HydrophobicContact CD1-CE1 4.06Å; L36-Y63 HydrophobicContact CD1-CG 3.98Å; L36-Y63 HydrophobicContact CG-CE1 4.46Å; L36-K66 HydrophobicContact CD1-CB 4.1Å; L36-K66 HydrophobicContact CD1-CG 3.84Å; L36-L68 HydrophobicContact CD1-CD1 4.37Å
37	P	80	Confident	81.7	Confident	43 Å²	43	65.9 Å²	65.9	28%	0.279	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-67.9	171.5	169.8	-15.2	28.8	0	0	0	112.5	E41 V42 Y63	P37-E41 HydrophobicContact CB-CB 4.42Å; P37-V42 HydrophobicContact CB-CG2 3.85Å; P37-V42 HydrophobicContact CG-CG2 3.81Å; P37-Y63 WeakPolarHBondContact O-CE1 3.46Å; P37-Y63 PolarHBondContact O-OH 3.27Å
38	D	82.4	Confident	82.3	Confident	127 Å²	127	64.9 Å²	64.9	68%	0.679	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-57.8	139.1	172.1	-84.2	-7.5	0	0	0	110.2	E40 E41 V42	D38-E40 PolarHBondContact O-N 3.34Å; D38-E41 HydrophobicContact CB-CG 4.46Å; D38-E41 PolarHBondContact O-N 2.89Å; D38-V42 PolarHBondContact O-N 3.34Å
39	G	81	Confident	82.3	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-55.6	-34.1	-171.7	0	0	0	0	0	113.8	E41 V42 L43 D71	G39-E41 PolarHBondContact O-N 3.28Å; G39-V42 PolarHBondContact O-N 3.38Å; G39-L43 WeakPolarHBondContact O-CB 3.4Å; G39-L43 WeakPolarHBondContact O-CD1 3.49Å; G39-L43 WeakPolarHBondContact O-CG 3.39Å; G39-L43 PolarHBondContact O-N 2.93Å; G39-D71 PolarHBondContact N-OD1 3.12Å
40	E	85.1	Confident	82.3	Confident	118 Å²	118	64.5 Å²	64.5	55%	0.551	32%	0.322	S	S	*	.	H	α-helix	trans	-69.6	-28.3	178.6	-74.6	165.8	-142.1	0	0	113.3	D38 N44 K74	D38-E40 PolarHBondContact O-N 3.34Å; E40-N44 WeakPolarHBondContact O-CB 3.32Å; E40-N44 PolarHBondContact O-N 2.99Å; E40-N44 VanDerWaalsContact O-N 3.16Å; E40-N44 PolarHBondContact O-ND2 3.05Å; E40-K74 IonicContact OE1-NZ 3.58Å; E40-K74 PolarHBondContact OE1-NZ 2.96Å
41	E	84.4	Confident	82.4	Confident	119 Å²	119	57.9 Å²	57.9	56%	0.556	29%	0.291	S	S	*	.	H	α-helix	trans	-71.4	-44.9	173.1	-61.1	-170.2	143.4	0	0	110.7	P37 D38 G39 N44 I45	P37-E41 HydrophobicContact CB-CB 4.42Å; D38-E41 HydrophobicContact CB-CG 4.46Å; D38-E41 PolarHBondContact O-N 2.89Å; G39-E41 PolarHBondContact O-N 3.28Å; E41-N44 WeakPolarHBondContact O-CB 3.45Å; E41-N44 PolarHBondContact O-N 3.26Å; E41-I45 WeakPolarHBondContact O-CG1 3.34Å; E41-I45 PolarHBondContact O-N 3.3Å
42	V	85.7	Confident	82.5	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-68.6	-37.9	-180	-176.5	0	0	0	0	111.6	L31 P37 D38 G39 N44 I45 L46 V59 Y63	L31-V42 HydrophobicContact CD1-CG1 3.83Å; L31-V42 HydrophobicContact CD1-CG2 3.83Å; P37-V42 HydrophobicContact CB-CG2 3.85Å; P37-V42 HydrophobicContact CG-CG2 3.81Å; D38-V42 PolarHBondContact O-N 3.34Å; G39-V42 PolarHBondContact O-N 3.38Å; V42-N44 VanDerWaalsContact C-N 3.34Å; V42-N44 PolarHBondContact O-N 3.42Å; V42-I45 PolarHBondContact O-N 2.99Å; V42-L46 HydrophobicContact CG1-CD1 3.9Å; V42-L46 HydrophobicContact CG1-CG 4.19Å; V42-L46 WeakPolarHBondContact O-CB 3.28Å; V42-L46 VanDerWaalsContact O-CG 3.28Å; V42-L46 WeakPolarHBondContact O-CG 3.4Å; V42-L46 PolarHBondContact O-N 2.91Å; V42-V59 HydrophobicContact CG1-CG1 3.79Å; V42-Y63 WeakPolarHBondContact CG2-OH 3.12Å
43	L	86.6	Confident	82.7	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.026	30%	0.297	C	S	.	.	H	α-helix	trans	-59.3	-43.6	170.8	-75.1	167.4	0	0	0	111.8	G39 I45 N47 W56 K74 V75 E78	G39-L43 WeakPolarHBondContact O-CB 3.4Å; G39-L43 WeakPolarHBondContact O-CD1 3.49Å; G39-L43 WeakPolarHBondContact O-CG 3.39Å; G39-L43 PolarHBondContact O-N 2.93Å; L43-I45 PolarHBondContact O-N 3.04Å; L43-N47 VanDerWaalsContact O-CB 3.29Å; L43-N47 WeakPolarHBondContact O-CB 3.49Å; L43-N47 PolarHBondContact O-N 2.61Å; L43-N47 PolarHBondContact O-ND2 2.83Å; L43-W56 HydrophobicContact CD2-CH2 4.27Å; L43-W56 HydrophobicContact CD2-CZ3 3.6Å; L43-K74 HydrophobicContact CD1-CB 3.96Å; L43-K74 HydrophobicContact CD1-CD 4.44Å; L43-V75 HydrophobicContact CD2-CB 4.44Å; L43-V75 HydrophobicContact CD2-CG2 4Å; L43-V75 HydrophobicContact CG-CG2 4.21Å; L43-E78 HydrophobicContact CD2-CB 3.78Å; L43-E78 HydrophobicContact CD2-CG 4.01Å
44	N	85	Confident	83.1	Confident	90 Å²	90	62.9 Å²	62.9	48%	0.481	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-43.9	175.4	-87.3	-68.1	0	0	0	112	E40 E41 V42 Q48	E40-N44 WeakPolarHBondContact O-CB 3.32Å; E40-N44 PolarHBondContact O-N 2.99Å; E40-N44 VanDerWaalsContact O-N 3.16Å; E40-N44 PolarHBondContact O-ND2 3.05Å; E41-N44 WeakPolarHBondContact O-CB 3.45Å; E41-N44 PolarHBondContact O-N 3.26Å; V42-N44 VanDerWaalsContact C-N 3.34Å; V42-N44 PolarHBondContact O-N 3.42Å; N44-Q48 WeakPolarHBondContact O-CB 3.42Å; N44-Q48 WeakPolarHBondContact O-CG 3.42Å; N44-Q48 PolarHBondContact O-N 2.67Å; N44-Q48 PolarHBondContact O-NE2 3.32Å
45	I	85	Confident	83.6	Confident	49 Å²	49	59.5 Å²	59.5	25%	0.251	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-53.9	176.9	-66.5	163.6	0	0	0	110.9	I20 I29 E41 V42 L43 N47 Q48 E49	I20-I45 HydrophobicContact CD1-CG2 4.25Å; I29-I45 HydrophobicContact CD1-CG2 3.68Å; E41-I45 WeakPolarHBondContact O-CG1 3.34Å; E41-I45 PolarHBondContact O-N 3.3Å; V42-I45 PolarHBondContact O-N 2.99Å; L43-I45 PolarHBondContact O-N 3.04Å; I45-N47 VanDerWaalsContact C-N 3.28Å; I45-N47 PolarHBondContact O-N 2.74Å; I45-Q48 PolarHBondContact O-N 2.92Å; I45-E49 PolarHBondContact O-N 3.46Å; I45-E49 VanDerWaalsContact O-N 3.07Å
46	L	85.7	Confident	84.2	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61	-36.3	-176.6	-68	171	0	0	0	112.5	I20 V42 K50 A51 I55 W56 V59	I20-L46 HydrophobicContact CD1-CD2 4.04Å; I20-L46 HydrophobicContact CG2-CD2 4.23Å; V42-L46 HydrophobicContact CG1-CD1 3.9Å; V42-L46 HydrophobicContact CG1-CG 4.19Å; V42-L46 WeakPolarHBondContact O-CB 3.28Å; V42-L46 VanDerWaalsContact O-CG 3.28Å; V42-L46 WeakPolarHBondContact O-CG 3.4Å; V42-L46 PolarHBondContact O-N 2.91Å; L46-K50 WeakPolarHBondContact O-CA 3.34Å; L46-K50 PolarHBondContact O-N 3.11Å; L46-A51 HydrophobicContact CB-CB 4.41Å; L46-A51 HydrophobicContact CD2-CB 3.52Å; L46-A51 PolarHBondContact O-N 2.8Å; L46-A51 VanDerWaalsContact O-N 3.07Å; L46-I55 HydrophobicContact CD2-CG2 4Å; L46-W56 HydrophobicContact CB-CD2 4.2Å; L46-W56 HydrophobicContact CB-CE3 4.47Å; L46-W56 HydrophobicContact CB-CH2 3.85Å; L46-W56 HydrophobicContact CB-CZ2 3.5Å; L46-W56 HydrophobicContact CB-CZ3 4.33Å; L46-W56 HydrophobicContact CD1-CD2 3.91Å; L46-W56 HydrophobicContact CD1-CE3 3.87Å; L46-W56 HydrophobicContact CD1-CG 4.4Å; L46-W56 HydrophobicContact CD1-CZ3 4.22Å; L46-V59 HydrophobicContact CD1-CG1 4.34Å
47	N	85.4	Confident	84.7	Confident	50 Å²	50	51 Å²	51	27%	0.267	26%	0.257	S	S	.	.	H	α-helix	trans	-73.7	-41.5	176.3	-77.5	-50.2	0	0	0	113.3	L43 I45 K50 W56 E78 N82	L43-N47 VanDerWaalsContact O-CB 3.29Å; L43-N47 WeakPolarHBondContact O-CB 3.49Å; L43-N47 PolarHBondContact O-N 2.61Å; L43-N47 PolarHBondContact O-ND2 2.83Å; I45-N47 VanDerWaalsContact C-N 3.28Å; I45-N47 PolarHBondContact O-N 2.74Å; N47-K50 PolarHBondContact O-N 2.68Å; N47-W56 WeakPolarHBondContact OD1-CH2 3.27Å; N47-E78 PolarHBondContact ND2-OE2 3.47Å; N47-N82 PolarHBondContact OD1-ND2 2.91Å
48	Q	83.5	Confident	85.1	Confident	125 Å²	125	51.6 Å²	51.6	58%	0.584	26%	0.26	S	S	*	.	H	α-helix	trans	-66.4	-45.1	-179.1	-75.4	172.7	45.9	0	0	111.5	N44 I45 K50	N44-Q48 WeakPolarHBondContact O-CB 3.42Å; N44-Q48 WeakPolarHBondContact O-CG 3.42Å; N44-Q48 PolarHBondContact O-N 2.67Å; N44-Q48 PolarHBondContact O-NE2 3.32Å; I45-Q48 PolarHBondContact O-N 2.92Å; Q48-K50 VanDerWaalsContact C-N 3.31Å; Q48-K50 PolarHBondContact O-N 3.06Å
49	E	81.6	Confident	85.3	Confident	47 Å²	47	45.5 Å²	45.5	22%	0.22	23%	0.228	C	C	.	.	H	α-helix	trans	-79.9	-12.6	-179.1	-57.3	-52.2	136.4	0	0	113.3	L22 R23 I45	L22-E49 WeakPolarHBondContact CA-OE2 3.43Å; L22-E49 HydrophobicContact CD2-CG 3.81Å; L22-E49 WeakPolarHBondContact CD2-OE2 3.29Å; R23-E49 WeakPolarHBondContact CB-OE2 3.42Å; R23-E49 PolarHBondContact N-OE2 3.17Å; I45-E49 PolarHBondContact O-N 3.46Å; I45-E49 VanDerWaalsContact O-N 3.07Å
50	K	81	Confident	85.7	Confident	79 Å²	79	45.5 Å²	45.5	34%	0.343	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	51.6	-170	-74.2	-178	160.4	-96.4	0	111.7	L46 N47 Q48 D85	L46-K50 WeakPolarHBondContact O-CA 3.34Å; L46-K50 PolarHBondContact O-N 3.11Å; N47-K50 PolarHBondContact O-N 2.68Å; Q48-K50 VanDerWaalsContact C-N 3.31Å; Q48-K50 PolarHBondContact O-N 3.06Å; K50-D85 PolarHBondContact NZ-O 2.85Å; K50-D85 IonicContact NZ-OD1 2.79Å; K50-D85 PolarHBondContact NZ-OD1 2.89Å
51	A	82.8	Confident	85.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.008	21%	0.205	C	C	.	.			trans	-58.9	136.5	-178.1	0	0	0	0	0	112.1	I20 L46 W56	I20-A51 HydrophobicContact CG2-CB 3.87Å; L46-A51 HydrophobicContact CB-CB 4.41Å; L46-A51 HydrophobicContact CD2-CB 3.52Å; L46-A51 PolarHBondContact O-N 2.8Å; L46-A51 VanDerWaalsContact O-N 3.07Å; A51-W56 VanDerWaalsContact O-CD1 3.3Å; A51-W56 PolarHBondContact O-NE1 2.89Å
52	P	85.1	Confident	86	Confident	65 Å²	65	35.3 Å²	35.3	42%	0.422	18%	0.181	S	C	.	.			trans	-53.3	144.3	179.2	-29.9	34.9	0	0	0	114.4	Q54 I55	P52-Q54 PolarHBondContact O-N 3.12Å; P52-I55 HydrophobicContact CG-CD1 4.5Å; P52-I55 WeakPolarHBondContact O-CB 3.16Å; P52-I55 PolarHBondContact O-N 3.38Å
53	L	86.2	Confident	86.2	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-52.9	-32.2	-175.3	-177	61.3	0	0	0	114.2	I55 W56 I57 A79 L86 Y89 D93 L94 L97	L53-I55 PolarHBondContact O-N 2.94Å; L53-W56 HydrophobicContact CD1-CB 4.49Å; L53-W56 WeakPolarHBondContact O-CB 3.48Å; L53-W56 PolarHBondContact O-N 2.87Å; L53-I57 HydrophobicContact CG-CD1 4.32Å; L53-I57 WeakPolarHBondContact O-CG1 3.29Å; L53-I57 PolarHBondContact O-N 3.12Å; L53-A79 HydrophobicContact CD1-CB 4.33Å; L53-L86 HydrophobicContact CD1-CD1 4.24Å; L53-Y89 HydrophobicContact CB-CG 4.46Å; L53-Y89 HydrophobicContact CD2-CD1 4.26Å; L53-Y89 HydrophobicContact CD2-CD2 4.06Å; L53-Y89 HydrophobicContact CD2-CG 3.83Å; L53-D93 HydrophobicContact CD2-CB 4.08Å; L53-D93 HydrophobicContact CG-CB 4.39Å; L53-L94 HydrophobicContact CD2-CB 4.35Å; L53-L97 HydrophobicContact CD1-CD1 4.25Å; L53-L97 HydrophobicContact CD1-CD2 4.25Å
54	Q	86.1	Confident	86.2	Confident	127 Å²	127	35.8 Å²	35.8	59%	0.593	18%	0.183	S	C	*	.	H	α-helix	trans	-57.3	-35.9	174.6	-175.7	179.3	-15.8	0	0	112.6	P52 I57 T58	P52-Q54 PolarHBondContact O-N 3.12Å; Q54-I57 PolarHBondContact O-N 3.44Å; Q54-T58 PolarHBondContact O-N 3.06Å; Q54-T58 VanDerWaalsContact O-N 3.08Å
55	I	87.4	Confident	86.2	Confident	21 Å²	21	37.1 Å²	37.1	11%	0.108	18%	0.184	C	C	.	.	H	α-helix	trans	-73.2	-40.7	-179.3	-54.8	-175.6	0	0	0	110.9	I18 I20 P21 L46 P52 L53 I57 T58 V59	I18-I55 HydrophobicContact CG2-CG2 3.99Å; I20-I55 HydrophobicContact CG1-CG2 4.09Å; P21-I55 VanDerWaalsContact CD-CD1 3.43Å; P21-I55 HydrophobicContact CG-CD1 4.28Å; L46-I55 HydrophobicContact CD2-CG2 4Å; P52-I55 HydrophobicContact CG-CD1 4.5Å; P52-I55 WeakPolarHBondContact O-CB 3.16Å; P52-I55 PolarHBondContact O-N 3.38Å; L53-I55 PolarHBondContact O-N 2.94Å; I55-I57 PolarHBondContact O-N 2.95Å; I55-T58 WeakPolarHBondContact CA-OG1 3.38Å; I55-T58 PolarHBondContact O-N 3.23Å; I55-T58 PolarHBondContact O-OG1 3.42Å; I55-V59 HydrophobicContact CG2-CG2 4.21Å; I55-V59 WeakPolarHBondContact O-CB 3.32Å; I55-V59 VanDerWaalsContact O-CG2 3.31Å; I55-V59 WeakPolarHBondContact O-CG2 3.31Å; I55-V59 PolarHBondContact O-N 2.7Å
56	W	89.8	Confident	86.2	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-55.4	-39.8	172	-68.3	79.4	0	0	0	111.5	L43 L46 N47 A51 L53 A60 V75 E78 A79 L86	L43-W56 HydrophobicContact CD2-CH2 4.27Å; L43-W56 HydrophobicContact CD2-CZ3 3.6Å; L46-W56 HydrophobicContact CB-CD2 4.2Å; L46-W56 HydrophobicContact CB-CE3 4.47Å; L46-W56 HydrophobicContact CB-CH2 3.85Å; L46-W56 HydrophobicContact CB-CZ2 3.5Å; L46-W56 HydrophobicContact CB-CZ3 4.33Å; L46-W56 HydrophobicContact CD1-CD2 3.91Å; L46-W56 HydrophobicContact CD1-CE3 3.87Å; L46-W56 HydrophobicContact CD1-CG 4.4Å; L46-W56 HydrophobicContact CD1-CZ3 4.22Å; N47-W56 WeakPolarHBondContact OD1-CH2 3.27Å; A51-W56 VanDerWaalsContact O-CD1 3.3Å; A51-W56 PolarHBondContact O-NE1 2.89Å; L53-W56 HydrophobicContact CD1-CB 4.49Å; L53-W56 WeakPolarHBondContact O-CB 3.48Å; L53-W56 PolarHBondContact O-N 2.87Å; W56-A60 VanDerWaalsContact O-CB 3.28Å; W56-A60 WeakPolarHBondContact O-CB 3.41Å; W56-A60 PolarHBondContact O-N 3.39Å; W56-V75 HydrophobicContact CE3-CG1 4.12Å; W56-E78 HydrophobicContact CH2-CB 4.39Å; W56-E78 HydrophobicContact CZ3-CB 3.97Å; W56-A79 HydrophobicContact CB-CB 4.07Å; W56-A79 HydrophobicContact CD2-CB 3.95Å; W56-A79 HydrophobicContact CE3-CB 3.64Å; W56-A79 HydrophobicContact CG-CB 4.18Å; W56-A79 HydrophobicContact CZ3-CB 4.3Å; W56-L86 HydrophobicContact CZ2-CD1 4.43Å; W56-L86 HydrophobicContact CZ2-CD2 4.4Å
57	I	88	Confident	86.1	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-71.6	-38.3	178.6	-64.4	169.7	0	0	0	112	L53 Q54 I55 I61 D93 R96 L97 M100	L53-I57 HydrophobicContact CG-CD1 4.32Å; L53-I57 WeakPolarHBondContact O-CG1 3.29Å; L53-I57 PolarHBondContact O-N 3.12Å; Q54-I57 PolarHBondContact O-N 3.44Å; I55-I57 PolarHBondContact O-N 2.95Å; I57-I61 HydrophobicContact CG2-CD1 4.07Å; I57-I61 WeakPolarHBondContact O-CB 3.46Å; I57-I61 WeakPolarHBondContact O-CD1 3.44Å; I57-I61 VanDerWaalsContact O-CG1 3.27Å; I57-I61 WeakPolarHBondContact O-CG1 3.25Å; I57-I61 PolarHBondContact O-N 3.37Å; I57-D93 HydrophobicContact CD1-CB 3.99Å; I57-D93 WeakPolarHBondContact CD1-O 3.27Å; I57-R96 HydrophobicContact CD1-CB 4.41Å; I57-R96 HydrophobicContact CD1-CG 4.38Å; I57-R96 HydrophobicContact CG2-CG 4.3Å; I57-L97 HydrophobicContact CD1-CB 4.36Å; I57-L97 HydrophobicContact CG1-CD1 4.07Å; I57-M100 HydrophobicContact CG2-CE 4.33Å; I57-M100 HydrophobicContact CG2-SD 3.95Å
58	T	88.3	Confident	86.2	Confident	55 Å²	55	47.1 Å²	47.1	34%	0.337	23%	0.227	S	C	.	.	H	α-helix	trans	-70.8	-40.7	176	54.7	0	0	0	0	112.2	Q54 I55 I61 A62	Q54-T58 PolarHBondContact O-N 3.06Å; Q54-T58 VanDerWaalsContact O-N 3.08Å; I55-T58 WeakPolarHBondContact CA-OG1 3.38Å; I55-T58 PolarHBondContact O-N 3.23Å; I55-T58 PolarHBondContact O-OG1 3.42Å; T58-I61 WeakPolarHBondContact O-CB 3.27Å; T58-I61 PolarHBondContact O-N 3.38Å; T58-A62 PolarHBondContact O-N 3.41Å
59	V	88.3	Confident	86.4	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.9	-48.2	173.2	169.1	0	0	0	0	110.8	I18 V42 L46 I55 I61 A62 Y63 V75	I18-V59 HydrophobicContact CD1-CG2 4.01Å; I18-V59 HydrophobicContact CG2-CG2 4.17Å; V42-V59 HydrophobicContact CG1-CG1 3.79Å; L46-V59 HydrophobicContact CD1-CG1 4.34Å; I55-V59 HydrophobicContact CG2-CG2 4.21Å; I55-V59 WeakPolarHBondContact O-CB 3.32Å; I55-V59 VanDerWaalsContact O-CG2 3.31Å; I55-V59 WeakPolarHBondContact O-CG2 3.31Å; I55-V59 PolarHBondContact O-N 2.7Å; V59-I61 VanDerWaalsContact C-N 3.32Å; V59-I61 PolarHBondContact O-N 3.37Å; V59-A62 WeakPolarHBondContact O-CB 3.49Å; V59-A62 PolarHBondContact O-N 3Å; V59-Y63 HydrophobicContact CG1-CD2 3.83Å; V59-Y63 HydrophobicContact CG1-CE2 3.58Å; V59-Y63 WeakPolarHBondContact O-CD2 3.46Å; V59-Y63 PolarHBondContact O-N 3.45Å; V59-V75 HydrophobicContact CG1-CG1 4.3Å
60	A	89.4	Confident	86.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-44.7	173.6	0	0	0	0	0	111.6	W56 A62 Y63 Y64 F72 V75 L76 M100	W56-A60 VanDerWaalsContact O-CB 3.28Å; W56-A60 WeakPolarHBondContact O-CB 3.41Å; W56-A60 PolarHBondContact O-N 3.39Å; A60-A62 PolarHBondContact O-N 3.41Å; A60-Y63 PolarHBondContact O-N 2.91Å; A60-Y64 WeakPolarHBondContact O-CB 3.23Å; A60-Y64 PolarHBondContact O-N 2.97Å; A60-F72 HydrophobicContact CB-CD2 3.82Å; A60-F72 HydrophobicContact CB-CE2 3.97Å; A60-F72 WeakPolarHBondContact O-CD2 3.34Å; A60-V75 HydrophobicContact CB-CG1 4.08Å; A60-L76 HydrophobicContact CB-CD2 3.74Å; A60-L76 HydrophobicContact CB-CG 3.97Å; A60-M100 HydrophobicContact CB-CE 4.39Å
61	I	87.8	Confident	87	Confident	17 Å²	17	45.4 Å²	45.4	9%	0.087	22%	0.222	C	C	.	.	H	α-helix	trans	-59.9	-33.7	175.4	-76.2	167.3	0	0	0	112.1	V5 I57 T58 V59 K65 M100	V5-I61 HydrophobicContact CG1-CG1 4.33Å; V5-I61 HydrophobicContact CG1-CG2 3.82Å; I57-I61 HydrophobicContact CG2-CD1 4.07Å; I57-I61 WeakPolarHBondContact O-CB 3.46Å; I57-I61 WeakPolarHBondContact O-CD1 3.44Å; I57-I61 VanDerWaalsContact O-CG1 3.27Å; I57-I61 WeakPolarHBondContact O-CG1 3.25Å; I57-I61 PolarHBondContact O-N 3.37Å; T58-I61 WeakPolarHBondContact O-CB 3.27Å; T58-I61 PolarHBondContact O-N 3.38Å; V59-I61 VanDerWaalsContact C-N 3.32Å; V59-I61 PolarHBondContact O-N 3.37Å; I61-K65 HydrophobicContact CG2-CD 4.11Å; I61-K65 WeakPolarHBondContact O-CB 3.46Å; I61-K65 VanDerWaalsContact O-CG 3.24Å; I61-K65 WeakPolarHBondContact O-CG 3.5Å; I61-K65 PolarHBondContact O-N 3.02Å; I61-M100 HydrophobicContact CD1-CE 4.37Å; I61-M100 HydrophobicContact CD1-SD 4.47Å; I61-M100 HydrophobicContact CG1-CE 3.84Å
62	A	87.5	Confident	87.4	Confident	7 Å²	7	45.4 Å²	45.4	6%	0.058	22%	0.221	C	C	.	.	H	α-helix	trans	-68.1	-50.6	174.9	0	0	0	0	0	112.1	I18 T33 L36 T58 V59 A60 Y64 K65 K66	I18-A62 HydrophobicContact CD1-CB 4.16Å; T33-A62 HydrophobicContact CG2-CB 4.28Å; L36-A62 HydrophobicContact CD1-CB 4.13Å; L36-A62 HydrophobicContact CD2-CB 3.93Å; T58-A62 PolarHBondContact O-N 3.41Å; V59-A62 WeakPolarHBondContact O-CB 3.49Å; V59-A62 PolarHBondContact O-N 3Å; A60-A62 PolarHBondContact O-N 3.41Å; A62-Y64 VanDerWaalsContact C-N 3.27Å; A62-Y64 PolarHBondContact O-N 2.64Å; A62-K65 WeakPolarHBondContact O-CB 3.35Å; A62-K65 PolarHBondContact O-N 2.97Å; A62-K65 VanDerWaalsContact O-N 3.1Å; A62-K66 PolarHBondContact O-N 2.93Å
63	Y	89.5	Confident	87.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-54.2	-44.8	173.9	-78.4	-70.4	0	0	0	111.6	L36 P37 V42 V59 A60 K65 K66 K67 L68 D71 V75	L36-Y63 HydrophobicContact CB-CD1 4.41Å; L36-Y63 HydrophobicContact CB-CE1 3.92Å; L36-Y63 HydrophobicContact CD1-CD1 3.71Å; L36-Y63 HydrophobicContact CD1-CE1 4.06Å; L36-Y63 HydrophobicContact CD1-CG 3.98Å; L36-Y63 HydrophobicContact CG-CE1 4.46Å; P37-Y63 WeakPolarHBondContact O-CE1 3.46Å; P37-Y63 PolarHBondContact O-OH 3.27Å; V42-Y63 WeakPolarHBondContact CG2-OH 3.12Å; V59-Y63 HydrophobicContact CG1-CD2 3.83Å; V59-Y63 HydrophobicContact CG1-CE2 3.58Å; V59-Y63 WeakPolarHBondContact O-CD2 3.46Å; V59-Y63 PolarHBondContact O-N 3.45Å; A60-Y63 PolarHBondContact O-N 2.91Å; Y63-K65 PolarHBondContact O-N 3.36Å; Y63-K66 CarbonylContact O-C 3.58Å; Y63-K66 PolarHBondContact O-N 3.15Å; Y63-K67 PolarHBondContact O-N 2.94Å; Y63-K67 VanDerWaalsContact O-N 3.14Å; Y63-L68 HydrophobicContact CD1-CB 3.84Å; Y63-L68 HydrophobicContact CD1-CD1 3.72Å; Y63-L68 HydrophobicContact CD1-CG 4.44Å; Y63-L68 HydrophobicContact CE1-CD1 4.09Å; Y63-L68 PolarHBondContact O-N 2.79Å; Y63-D71 HydrophobicContact CD1-CB 3.62Å; Y63-D71 HydrophobicContact CE1-CB 3.81Å; Y63-D71 HydrophobicContact CG-CB 4.06Å; Y63-V75 HydrophobicContact CD2-CG2 4.23Å; Y63-V75 HydrophobicContact CE2-CG2 4.1Å
64	Y	86.4	Confident	87.8	Confident	14 Å²	14	46.7 Å²	46.7	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-60.6	-43.9	176.3	-169.4	-84.5	0	0	0	113	M1 D2 V5 A60 A62 K66 K67 Y69 F72 R107	M1-Y64 HydrophobicContact CB-CE1 4.28Å; M1-Y64 HydrophobicContact CB-CE2 4.18Å; M1-Y64 WeakPolarHBondContact CB-OH 3.44Å; M1-Y64 HydrophobicContact CE-CE2 3.94Å; M1-Y64 HydrophobicContact SD-CD2 4.29Å; M1-Y64 HydrophobicContact SD-CE2 3.82Å; D2-Y64 WeakPolarHBondContact OD1-CE1 3.42Å; D2-Y64 PolarHBondContact OD1-OH 3.18Å; V5-Y64 HydrophobicContact CG1-CD1 4.44Å; V5-Y64 HydrophobicContact CG2-CD1 4.24Å; V5-Y64 HydrophobicContact CG2-CE1 4.27Å; A60-Y64 WeakPolarHBondContact O-CB 3.23Å; A60-Y64 PolarHBondContact O-N 2.97Å; A62-Y64 VanDerWaalsContact C-N 3.27Å; A62-Y64 PolarHBondContact O-N 2.64Å; Y64-K66 VanDerWaalsContact C-N 3.33Å; Y64-K66 PolarHBondContact O-N 3.33Å; Y64-K67 PolarHBondContact O-N 2.85Å; Y64-K67 VanDerWaalsContact O-N 3.11Å; Y64-Y69 HydrophobicContact CD2-CD1 4.31Å; Y64-Y69 HydrophobicContact CD2-CE1 4.3Å; Y64-Y69 HydrophobicContact CE2-CD1 4.39Å; Y64-Y69 HydrophobicContact CE2-CE1 4.19Å; Y64-F72 AromaticContact CD2-CD1 3.88Å; Y64-F72 HydrophobicContact CD2-CD1 3.88Å; Y64-F72 HydrophobicContact CD2-CD2 4.07Å; Y64-F72 AromaticContact CD2-CE1 3.71Å; Y64-F72 HydrophobicContact CD2-CE1 3.71Å; Y64-F72 AromaticContact CD2-CE2 3.88Å; Y64-F72 HydrophobicContact CD2-CE2 3.88Å; Y64-F72 HydrophobicContact CD2-CG 4.04Å; Y64-F72 AromaticContact CD2-CZ 3.68Å; Y64-F72 HydrophobicContact CD2-CZ 3.68Å; Y64-F72 HydrophobicContact CE2-CE1 4.2Å; Y64-F72 HydrophobicContact CE2-CZ 4.32Å; Y64-F72 HydrophobicContact CG-CD2 4.4Å; Y64-F72 HydrophobicContact CG-CE2 4.27Å; Y64-F72 HydrophobicContact CG-CZ 4.46Å; Y64-R107 PolarHBondContact OH-NH1 3.12Å
65	K	84.9	Confident	87.9	Confident	119 Å²	119	40.6 Å²	40.6	52%	0.517	19%	0.192	S	C	.	.	H	α-helix	trans	-61.9	-38.9	176.4	-78.1	167.9	178.1	176.1	0	111.8	I61 A62 Y63 K67	I61-K65 HydrophobicContact CG2-CD 4.11Å; I61-K65 WeakPolarHBondContact O-CB 3.46Å; I61-K65 VanDerWaalsContact O-CG 3.24Å; I61-K65 WeakPolarHBondContact O-CG 3.5Å; I61-K65 PolarHBondContact O-N 3.02Å; A62-K65 WeakPolarHBondContact O-CB 3.35Å; A62-K65 PolarHBondContact O-N 2.97Å; A62-K65 VanDerWaalsContact O-N 3.1Å; Y63-K65 PolarHBondContact O-N 3.36Å; K65-K67 PolarHBondContact O-N 3.31Å
66	K	84.6	Confident	88.1	Confident	88 Å²	88	39.7 Å²	39.7	38%	0.383	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-0.5	175.7	-69.6	-80.5	177	165.1	0	113.9	T33 D34 L36 A62 Y63 Y64 L68	T33-K66 WeakPolarHBondContact O-CE 3.24Å; D34-K66 VanDerWaalsContact CA-NZ 3.32Å; D34-K66 WeakPolarHBondContact O-CE 3.43Å; D34-K66 PolarHBondContact O-NZ 3.28Å; D34-K66 IonicContact OD1-NZ 2.64Å; D34-K66 PolarHBondContact OD1-NZ 3.33Å; L36-K66 HydrophobicContact CD1-CB 4.1Å; L36-K66 HydrophobicContact CD1-CG 3.84Å; A62-K66 PolarHBondContact O-N 2.93Å; Y63-K66 CarbonylContact O-C 3.58Å; Y63-K66 PolarHBondContact O-N 3.15Å; Y64-K66 VanDerWaalsContact C-N 3.33Å; Y64-K66 PolarHBondContact O-N 3.33Å; K66-L68 VanDerWaalsContact C-N 3.27Å; K66-L68 HydrophobicContact CB-CD1 4.33Å; K66-L68 HydrophobicContact CB-CG 4.34Å; K66-L68 PolarHBondContact O-N 3.3Å
67	K	83.6	Confident	88.1	Confident	150 Å²	150	43 Å²	43	65%	0.652	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.4	18.5	-177.3	-48.8	174.1	-176.2	170.6	0	114.5	Y63 Y64 K65 Y69	Y63-K67 PolarHBondContact O-N 2.94Å; Y63-K67 VanDerWaalsContact O-N 3.14Å; Y64-K67 PolarHBondContact O-N 2.85Å; Y64-K67 VanDerWaalsContact O-N 3.11Å; K65-K67 PolarHBondContact O-N 3.31Å; K67-Y69 VanDerWaalsContact C-N 3.31Å; K67-Y69 HydrophobicContact CB-CE2 4.02Å; K67-Y69 WeakPolarHBondContact O-CD2 3.37Å; K67-Y69 PolarHBondContact O-N 2.85Å
68	L	87.8	Confident	88.1	Confident	71 Å²	71	46 Å²	46	37%	0.372	22%	0.217	S	C	.	.			trans	-81.9	79	173.7	-65.2	174.2	0	0	0	108.7	L36 Y63 K66 F72	L36-L68 HydrophobicContact CD1-CD1 4.37Å; Y63-L68 HydrophobicContact CD1-CB 3.84Å; Y63-L68 HydrophobicContact CD1-CD1 3.72Å; Y63-L68 HydrophobicContact CD1-CG 4.44Å; Y63-L68 HydrophobicContact CE1-CD1 4.09Å; Y63-L68 PolarHBondContact O-N 2.79Å; K66-L68 VanDerWaalsContact C-N 3.27Å; K66-L68 HydrophobicContact CB-CD1 4.33Å; K66-L68 HydrophobicContact CB-CG 4.34Å; K66-L68 PolarHBondContact O-N 3.3Å; L68-F72 VanDerWaalsContact O-CB 3.32Å; L68-F72 WeakPolarHBondContact O-CB 3.42Å; L68-F72 PolarHBondContact O-N 3.37Å
69	Y	87.3	Confident	88.1	Confident	75 Å²	75	43.3 Å²	43.3	29%	0.294	20%	0.201	S	C	.	.	H	α-helix	trans	-75.4	-28	-169.7	-60.9	-54.7	0	0	0	114	Y64 K67 E73 Y104	Y64-Y69 HydrophobicContact CD2-CD1 4.31Å; Y64-Y69 HydrophobicContact CD2-CE1 4.3Å; Y64-Y69 HydrophobicContact CE2-CD1 4.39Å; Y64-Y69 HydrophobicContact CE2-CE1 4.19Å; K67-Y69 VanDerWaalsContact C-N 3.31Å; K67-Y69 HydrophobicContact CB-CE2 4.02Å; K67-Y69 WeakPolarHBondContact O-CD2 3.37Å; K67-Y69 PolarHBondContact O-N 2.85Å; Y69-E73 PolarHBondContact O-N 3.31Å; Y69-E73 VanDerWaalsContact O-N 3.12Å; Y69-Y104 PolarHBondContact O-OH 2.86Å
70	D	87.7	Confident	88.1	Confident	111 Å²	111	48.3 Å²	48.3	59%	0.594	22%	0.22	S	C	*	.	H	α-helix	trans	-77.9	-39.6	-179	-58.3	-36.7	0	0	0	110.8	E73 K74	D70-E73 WeakPolarHBondContact O-CB 3.38Å; D70-E73 PolarHBondContact O-N 2.97Å; D70-K74 WeakPolarHBondContact O-CG 3.32Å; D70-K74 PolarHBondContact O-N 3.4Å
71	D	89.1	Confident	88	Confident	29 Å²	29	54.5 Å²	54.5	16%	0.155	25%	0.253	C	S	.	.	H	α-helix	trans	-68.7	-36.4	172.2	-53.7	-70.5	0	0	0	112	G39 Y63 E73 K74 V75	G39-D71 PolarHBondContact N-OD1 3.12Å; Y63-D71 HydrophobicContact CD1-CB 3.62Å; Y63-D71 HydrophobicContact CE1-CB 3.81Å; Y63-D71 HydrophobicContact CG-CB 4.06Å; D71-E73 VanDerWaalsContact C-N 3.26Å; D71-E73 PolarHBondContact O-N 3.44Å; D71-K74 PolarHBondContact O-N 2.94Å; D71-V75 WeakPolarHBondContact O-CB 3.39Å; D71-V75 VanDerWaalsContact O-CG2 3.27Å; D71-V75 WeakPolarHBondContact O-CG2 3.41Å; D71-V75 PolarHBondContact O-N 3.09Å
72	F	90.2	Very high	87.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-57.4	-38.4	169.6	170.7	-103.9	0	0	0	112.8	M1 A60 Y64 L68 L76 M100 Y104	M1-F72 HydrophobicContact CE-CE1 3.92Å; M1-F72 HydrophobicContact CE-CZ 3.97Å; M1-F72 HydrophobicContact SD-CE1 4.28Å; M1-F72 HydrophobicContact SD-CZ 3.74Å; A60-F72 HydrophobicContact CB-CD2 3.82Å; A60-F72 HydrophobicContact CB-CE2 3.97Å; A60-F72 WeakPolarHBondContact O-CD2 3.34Å; Y64-F72 AromaticContact CD2-CD1 3.88Å; Y64-F72 HydrophobicContact CD2-CD1 3.88Å; Y64-F72 HydrophobicContact CD2-CD2 4.07Å; Y64-F72 AromaticContact CD2-CE1 3.71Å; Y64-F72 HydrophobicContact CD2-CE1 3.71Å; Y64-F72 AromaticContact CD2-CE2 3.88Å; Y64-F72 HydrophobicContact CD2-CE2 3.88Å; Y64-F72 HydrophobicContact CD2-CG 4.04Å; Y64-F72 AromaticContact CD2-CZ 3.68Å; Y64-F72 HydrophobicContact CD2-CZ 3.68Å; Y64-F72 HydrophobicContact CE2-CE1 4.2Å; Y64-F72 HydrophobicContact CE2-CZ 4.32Å; Y64-F72 HydrophobicContact CG-CD2 4.4Å; Y64-F72 HydrophobicContact CG-CE2 4.27Å; Y64-F72 HydrophobicContact CG-CZ 4.46Å; L68-F72 VanDerWaalsContact O-CB 3.32Å; L68-F72 WeakPolarHBondContact O-CB 3.42Å; L68-F72 PolarHBondContact O-N 3.37Å; F72-L76 HydrophobicContact CD1-CD1 4.37Å; F72-L76 HydrophobicContact CD2-CD1 4.11Å; F72-L76 HydrophobicContact CE1-CD1 3.78Å; F72-L76 HydrophobicContact CE2-CD1 3.54Å; F72-L76 HydrophobicContact CE2-CG 4.3Å; F72-L76 HydrophobicContact CZ-CD1 3.35Å; F72-L76 WeakPolarHBondContact O-CG 3.21Å; F72-L76 PolarHBondContact O-N 2.78Å; F72-M100 HydrophobicContact CE2-CE 3.81Å; F72-M100 HydrophobicContact CZ-CE 4.2Å; F72-Y104 AromaticContact CD1-CD2 3.72Å; F72-Y104 HydrophobicContact CD1-CD2 3.72Å; F72-Y104 AromaticContact CD1-CE2 3.9Å; F72-Y104 HydrophobicContact CD1-CE2 3.9Å; F72-Y104 HydrophobicContact CD1-CG 4.14Å; F72-Y104 AromaticContact CE1-CD2 3.47Å; F72-Y104 HydrophobicContact CE1-CD2 3.47Å; F72-Y104 VanDerWaalsContact CE1-CD2 3.47Å; F72-Y104 HydrophobicContact CE1-CE2 4.13Å; F72-Y104 AromaticContact CE1-CG 3.74Å; F72-Y104 HydrophobicContact CE1-CG 3.74Å
73	E	90.3	Very high	87.4	Confident	20 Å²	20	56.5 Å²	56.5	9%	0.093	26%	0.264	C	S	.	.	H	α-helix	trans	-68.5	-51.6	175	-173.8	167	-154.8	0	0	110.7	Y69 D70 D71 V75 L76 E77 Y104 Y105 K108	Y69-E73 PolarHBondContact O-N 3.31Å; Y69-E73 VanDerWaalsContact O-N 3.12Å; D70-E73 WeakPolarHBondContact O-CB 3.38Å; D70-E73 PolarHBondContact O-N 2.97Å; D71-E73 VanDerWaalsContact C-N 3.26Å; D71-E73 PolarHBondContact O-N 3.44Å; E73-V75 PolarHBondContact O-N 2.84Å; E73-L76 PolarHBondContact O-N 3.43Å; E73-E77 WeakPolarHBondContact O-CB 3.48Å; E73-E77 WeakPolarHBondContact O-CG 3.43Å; E73-E77 PolarHBondContact O-N 3.46Å; E73-Y104 HydrophobicContact CB-CD1 4.39Å; E73-Y104 HydrophobicContact CB-CE1 3.78Å; E73-Y104 HydrophobicContact CG-CD1 4.27Å; E73-Y104 HydrophobicContact CG-CE1 3.8Å; E73-Y104 WeakPolarHBondContact OE2-CE1 3.47Å; E73-Y104 PolarHBondContact OE2-OH 3.2Å; E73-Y105 HydrophobicContact CG-CE1 4.48Å; E73-Y105 WeakPolarHBondContact OE1-CE1 3.37Å; E73-K108 IonicContact OE1-NZ 3.98Å; E73-K108 PolarHBondContact OE1-NZ 3.35Å; E73-K108 IonicContact OE2-NZ 2.92Å; E73-K108 PolarHBondContact OE2-NZ 2.89Å
74	K	88.9	Confident	86.9	Confident	74 Å²	74	60.3 Å²	60.3	32%	0.322	30%	0.296	S	S	.	.	H	α-helix	trans	-54.1	-49	176.9	-66.9	178.6	-176.8	175.4	0	112.8	E40 L43 D70 D71 L76 E77 E78	E40-K74 IonicContact OE1-NZ 3.58Å; E40-K74 PolarHBondContact OE1-NZ 2.96Å; L43-K74 HydrophobicContact CD1-CB 3.96Å; L43-K74 HydrophobicContact CD1-CD 4.44Å; D70-K74 WeakPolarHBondContact O-CG 3.32Å; D70-K74 PolarHBondContact O-N 3.4Å; D71-K74 PolarHBondContact O-N 2.94Å; K74-L76 VanDerWaalsContact C-N 3.32Å; K74-L76 PolarHBondContact O-N 3.11Å; K74-E77 PolarHBondContact O-N 3.04Å; K74-E78 PolarHBondContact O-N 3.43Å
75	V	89.5	Confident	86.4	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-37.1	-177.5	172.5	0	0	0	0	111.9	L43 W56 V59 A60 Y63 D71 E73 A79	L43-V75 HydrophobicContact CD2-CB 4.44Å; L43-V75 HydrophobicContact CD2-CG2 4Å; L43-V75 HydrophobicContact CG-CG2 4.21Å; W56-V75 HydrophobicContact CE3-CG1 4.12Å; V59-V75 HydrophobicContact CG1-CG1 4.3Å; A60-V75 HydrophobicContact CB-CG1 4.08Å; Y63-V75 HydrophobicContact CD2-CG2 4.23Å; Y63-V75 HydrophobicContact CE2-CG2 4.1Å; D71-V75 WeakPolarHBondContact O-CB 3.39Å; D71-V75 VanDerWaalsContact O-CG2 3.27Å; D71-V75 WeakPolarHBondContact O-CG2 3.41Å; D71-V75 PolarHBondContact O-N 3.09Å; E73-V75 PolarHBondContact O-N 2.84Å; V75-A79 VanDerWaalsContact O-CB 3.24Å; V75-A79 WeakPolarHBondContact O-CB 3.33Å; V75-A79 PolarHBondContact O-N 3.45Å; V75-A79 VanDerWaalsContact O-N 3.16Å
76	L	90.3	Very high	86	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-78.1	-33.2	176	-67.4	178.4	0	0	0	113.1	A60 F72 E73 K74 Y80 L97 M100 L101	A60-L76 HydrophobicContact CB-CD2 3.74Å; A60-L76 HydrophobicContact CB-CG 3.97Å; F72-L76 HydrophobicContact CD1-CD1 4.37Å; F72-L76 HydrophobicContact CD2-CD1 4.11Å; F72-L76 HydrophobicContact CE1-CD1 3.78Å; F72-L76 HydrophobicContact CE2-CD1 3.54Å; F72-L76 HydrophobicContact CE2-CG 4.3Å; F72-L76 HydrophobicContact CZ-CD1 3.35Å; F72-L76 WeakPolarHBondContact O-CG 3.21Å; F72-L76 PolarHBondContact O-N 2.78Å; E73-L76 PolarHBondContact O-N 3.43Å; K74-L76 VanDerWaalsContact C-N 3.32Å; K74-L76 PolarHBondContact O-N 3.11Å; L76-Y80 WeakPolarHBondContact O-CB 3.43Å; L76-Y80 PolarHBondContact O-N 2.96Å; L76-Y80 VanDerWaalsContact O-N 3.09Å; L76-L97 HydrophobicContact CD2-CD1 3.48Å; L76-L97 VanDerWaalsContact CD2-CD1 3.48Å; L76-L97 HydrophobicContact CD2-CG 4.47Å; L76-M100 HydrophobicContact CD1-CB 4.02Å; L76-M100 HydrophobicContact CD1-CE 4.36Å; L76-M100 HydrophobicContact CD2-CE 4.24Å; L76-L101 HydrophobicContact CB-CD1 3.84Å
77	E	90.3	Very high	85.1	Confident	71 Å²	71	61.8 Å²	61.8	33%	0.332	31%	0.31	S	S	.	.	H	α-helix	trans	-66.4	-46.7	174.4	-76.3	-174.4	-168.2	0	0	111.6	E73 K74 Y80 L81 L101 Y105	E73-E77 WeakPolarHBondContact O-CB 3.48Å; E73-E77 WeakPolarHBondContact O-CG 3.43Å; E73-E77 PolarHBondContact O-N 3.46Å; K74-E77 PolarHBondContact O-N 3.04Å; E77-Y80 PolarHBondContact O-N 2.87Å; E77-L81 WeakPolarHBondContact O-CG 3.28Å; E77-L81 PolarHBondContact O-N 3.04Å; E77-L101 HydrophobicContact CG-CD1 4.11Å; E77-Y105 PolarHBondContact OE1-OH 3.31Å
78	E	89.1	Confident	84.5	Confident	63 Å²	63	61 Å²	61	29%	0.294	32%	0.32	S	S	.	.	H	α-helix	trans	-66.6	-41.8	176.2	-75.5	-158.4	-161.2	0	0	112.6	L43 N47 W56 K74 Y80 L81 N82	L43-E78 HydrophobicContact CD2-CB 3.78Å; L43-E78 HydrophobicContact CD2-CG 4.01Å; N47-E78 PolarHBondContact ND2-OE2 3.47Å; W56-E78 HydrophobicContact CH2-CB 4.39Å; W56-E78 HydrophobicContact CZ3-CB 3.97Å; K74-E78 PolarHBondContact O-N 3.43Å; E78-Y80 PolarHBondContact O-N 2.99Å; E78-L81 PolarHBondContact O-N 3.27Å; E78-N82 WeakPolarHBondContact O-CB 3.27Å; E78-N82 PolarHBondContact O-N 3.05Å
79	A	88	Confident	84	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.3	-32.9	173.3	0	0	0	0	0	112.6	L53 W56 V75 A83 L97	L53-A79 HydrophobicContact CD1-CB 4.33Å; W56-A79 HydrophobicContact CB-CB 4.07Å; W56-A79 HydrophobicContact CD2-CB 3.95Å; W56-A79 HydrophobicContact CE3-CB 3.64Å; W56-A79 HydrophobicContact CG-CB 4.18Å; W56-A79 HydrophobicContact CZ3-CB 4.3Å; V75-A79 VanDerWaalsContact O-CB 3.24Å; V75-A79 WeakPolarHBondContact O-CB 3.33Å; V75-A79 PolarHBondContact O-N 3.45Å; V75-A79 VanDerWaalsContact O-N 3.16Å; A79-A83 WeakPolarHBondContact O-CA 3.47Å; A79-A83 WeakPolarHBondContact O-CB 3.44Å; A79-A83 PolarHBondContact O-N 2.98Å; A79-L97 HydrophobicContact CB-CD1 3.68Å; A79-L97 HydrophobicContact CB-CD2 4.15Å
80	Y	87.7	Confident	83.6	Confident	105 Å²	105	63.1 Å²	63.1	41%	0.412	33%	0.329	S	S	.	.	H	α-helix	trans	-76.4	-41.8	176.6	173	-117.2	0	0	0	112.4	L76 E77 E78 A83 L98 L128	L76-Y80 WeakPolarHBondContact O-CB 3.43Å; L76-Y80 PolarHBondContact O-N 2.96Å; L76-Y80 VanDerWaalsContact O-N 3.09Å; E77-Y80 PolarHBondContact O-N 2.87Å; E78-Y80 PolarHBondContact O-N 2.99Å; Y80-A83 WeakPolarHBondContact O-CB 3.43Å; Y80-L98 HydrophobicContact CD2-CD2 3.71Å; Y80-L98 HydrophobicContact CE2-CD2 3.59Å; Y80-L128 HydrophobicContact CE1-CD2 4.32Å; Y80-L128 HydrophobicContact CE2-CD2 4.42Å
81	L	86.9	Confident	83.3	Confident	130 Å²	130	62.9 Å²	62.9	68%	0.681	33%	0.327	S	S	*	.	H	α-helix	trans	-65.1	-43.9	176.5	-71.1	169.3	0	0	0	111.8	E77 E78 A83	E77-L81 WeakPolarHBondContact O-CG 3.28Å; E77-L81 PolarHBondContact O-N 3.04Å; E78-L81 PolarHBondContact O-N 3.27Å; L81-A83 VanDerWaalsContact C-N 3.33Å
82	N	84.1	Confident	83	Confident	53 Å²	53	65.2 Å²	65.2	28%	0.283	35%	0.346	S	S	.	.	S	Bend	trans	-89.6	4.8	-176.5	-62.2	-13.6	0	0	0	112.8	N47 E78 A84 D85 L86	N47-N82 PolarHBondContact OD1-ND2 2.91Å; E78-N82 WeakPolarHBondContact O-CB 3.27Å; E78-N82 PolarHBondContact O-N 3.05Å; N82-A84 PolarHBondContact O-N 3.49Å; N82-A84 VanDerWaalsContact O-N 3.07Å; N82-D85 WeakPolarHBondContact O-CA 3.45Å; N82-D85 WeakPolarHBondContact O-CB 3.09Å; N82-D85 PolarHBondContact O-N 2.98Å; N82-L86 PolarHBondContact O-N 3.32Å
83	A	80.4	Confident	82.7	Confident	12 Å²	12	66.3 Å²	66.3	10%	0.099	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-51.8	-37.1	-175.2	0	0	0	0	0	113.9	A79 Y80 L81 D85 L86 Y89 L94	A79-A83 WeakPolarHBondContact O-CA 3.47Å; A79-A83 WeakPolarHBondContact O-CB 3.44Å; A79-A83 PolarHBondContact O-N 2.98Å; Y80-A83 WeakPolarHBondContact O-CB 3.43Å; L81-A83 VanDerWaalsContact C-N 3.33Å; A83-D85 VanDerWaalsContact C-N 3.27Å; A83-D85 PolarHBondContact O-N 2.76Å; A83-L86 PolarHBondContact O-N 3.47Å; A83-Y89 VanDerWaalsContact O-CE1 3.31Å; A83-Y89 WeakPolarHBondContact O-CE1 3.22Å; A83-L94 HydrophobicContact CB-CD1 4.45Å
84	A	78.2	Confident	82.6	Confident	81 Å²	81	66.3 Å²	66.3	67%	0.669	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-64.4	-30.1	177.2	0	0	0	0	0	113.5	N82	N82-A84 PolarHBondContact O-N 3.49Å; N82-A84 VanDerWaalsContact O-N 3.07Å
85	D	75.9	Confident	82.5	Confident	107 Å²	107	63 Å²	63	57%	0.572	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-86.9	-9.2	-178.4	-103	-55.9	0	0	0	113.7	K50 N82 A83	K50-D85 PolarHBondContact NZ-O 2.85Å; K50-D85 IonicContact NZ-OD1 2.79Å; K50-D85 PolarHBondContact NZ-OD1 2.89Å; N82-D85 WeakPolarHBondContact O-CA 3.45Å; N82-D85 WeakPolarHBondContact O-CB 3.09Å; N82-D85 PolarHBondContact O-N 2.98Å; A83-D85 VanDerWaalsContact C-N 3.27Å; A83-D85 PolarHBondContact O-N 2.76Å
86	L	75.4	Confident	82.4	Confident	11 Å²	11	66.4 Å²	66.4	6%	0.058	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-98	12.1	-178.1	-63	176.5	0	0	0	113.3	L53 W56 N82 A83	L53-L86 HydrophobicContact CD1-CD1 4.24Å; W56-L86 HydrophobicContact CZ2-CD1 4.43Å; W56-L86 HydrophobicContact CZ2-CD2 4.4Å; N82-L86 PolarHBondContact O-N 3.32Å; A83-L86 PolarHBondContact O-N 3.47Å
87	Q	66.6	Low	82.4	Confident	134 Å²	134	66.4 Å²	66.4	63%	0.626	35%	0.351	S	S	*	.			trans	-72.3	142.5	177.4	-69.6	-171.8	-4.3	0	0	112.1	Y89	Q87-Y89 HydrophobicContact CG-CD1 4.03Å; Q87-Y89 HydrophobicContact CG-CE1 3.48Å; Q87-Y89 VanDerWaalsContact CG-CE1 3.48Å
88	P	71.5	Confident	82.4	Confident	132 Å²	132	63.3 Å²	63.3	86%	0.857	34%	0.337	S	S	*	.	S	Bend	cis	-87.5	141.7	3.1	34.1	-34	0	0	0	113.9
89	Y	76.8	Confident	82.4	Confident	54 Å²	54	60.8 Å²	60.8	21%	0.212	33%	0.325	C	S	.	.			trans	-133	168.4	169.6	55.1	-101.4	0	0	0	109.6	L53 A83 Q87 L94	L53-Y89 HydrophobicContact CB-CG 4.46Å; L53-Y89 HydrophobicContact CD2-CD1 4.26Å; L53-Y89 HydrophobicContact CD2-CD2 4.06Å; L53-Y89 HydrophobicContact CD2-CG 3.83Å; A83-Y89 VanDerWaalsContact O-CE1 3.31Å; A83-Y89 WeakPolarHBondContact O-CE1 3.22Å; Q87-Y89 HydrophobicContact CG-CD1 4.03Å; Q87-Y89 HydrophobicContact CG-CE1 3.48Å; Q87-Y89 VanDerWaalsContact CG-CE1 3.48Å; Y89-L94 HydrophobicContact CD2-CB 4.25Å; Y89-L94 HydrophobicContact CE2-CB 3.88Å; Y89-L94 HydrophobicContact CE2-CD2 3.85Å; Y89-L94 HydrophobicContact CE2-CG 4.45Å
90	H	77.7	Confident	82.4	Confident	137 Å²	137	61.7 Å²	61.7	63%	0.634	33%	0.33	S	S	*	.			trans	-86.1	138	170.4	-68	-58.8	0	0	0	111.2	S92 D93 L94	H90-S92 PolarHBondContact O-N 3.22Å; H90-S92 VanDerWaalsContact O-N 3.08Å; H90-D93 WeakPolarHBondContact O-CB 3.37Å; H90-D93 PolarHBondContact O-N 2.9Å; H90-L94 PolarHBondContact O-N 3.39Å
91	D	82.2	Confident	82.5	Confident	106 Å²	106	56.8 Å²	56.8	57%	0.567	31%	0.311	S	S	*	.	H	α-helix	trans	-54.7	-31	179.2	-70.7	-43.2	0	0	0	113.2	D93 L94 V95 I135	D91-D93 VanDerWaalsContact C-N 3.29Å; D91-D93 PolarHBondContact O-N 3.5Å; D91-L94 PolarHBondContact O-N 2.95Å; D91-V95 WeakPolarHBondContact O-CG2 3.39Å; D91-V95 PolarHBondContact O-N 3.27Å; D91-I135 HydrophobicContact CB-CG2 3.7Å
92	S	83.1	Confident	82.7	Confident	78 Å²	78	50.6 Å²	50.6	55%	0.545	28%	0.278	S	S	.	.	H	α-helix	trans	-60.5	-32.6	173.3	52.6	0	0	0	0	114.1	H90 R96	H90-S92 PolarHBondContact O-N 3.22Å; H90-S92 VanDerWaalsContact O-N 3.08Å; S92-R96 VanDerWaalsContact O-CB 3.29Å; S92-R96 WeakPolarHBondContact O-CB 3.37Å; S92-R96 PolarHBondContact O-N 3.26Å
93	D	84.4	Confident	82.9	Confident	23 Å²	23	48.6 Å²	48.6	12%	0.123	27%	0.268	C	S	.	.	H	α-helix	trans	-78.4	-33.6	177.8	-64.7	-46.6	0	0	0	111.1	L53 I57 H90 D91 R96 L97	L53-D93 HydrophobicContact CD2-CB 4.08Å; L53-D93 HydrophobicContact CG-CB 4.39Å; I57-D93 HydrophobicContact CD1-CB 3.99Å; I57-D93 WeakPolarHBondContact CD1-O 3.27Å; H90-D93 WeakPolarHBondContact O-CB 3.37Å; H90-D93 PolarHBondContact O-N 2.9Å; D91-D93 VanDerWaalsContact C-N 3.29Å; D91-D93 PolarHBondContact O-N 3.5Å; D93-R96 PolarHBondContact O-N 3.41Å; D93-L97 WeakPolarHBondContact O-CB 3.09Å; D93-L97 PolarHBondContact O-N 2.95Å
94	L	86.7	Confident	83.4	Confident	21 Å²	21	49 Å²	49	11%	0.11	27%	0.267	C	S	.	.	H	α-helix	trans	-66.9	-41.8	171.5	-178.8	58.2	0	0	0	111.7	L53 A83 Y89 H90 D91 L97 L98 I135	L53-L94 HydrophobicContact CD2-CB 4.35Å; A83-L94 HydrophobicContact CB-CD1 4.45Å; Y89-L94 HydrophobicContact CD2-CB 4.25Å; Y89-L94 HydrophobicContact CE2-CB 3.88Å; Y89-L94 HydrophobicContact CE2-CD2 3.85Å; Y89-L94 HydrophobicContact CE2-CG 4.45Å; H90-L94 PolarHBondContact O-N 3.39Å; D91-L94 PolarHBondContact O-N 2.95Å; L94-L97 HydrophobicContact CD1-CD2 4.29Å; L94-L97 WeakPolarHBondContact O-CB 3.25Å; L94-L97 PolarHBondContact O-N 2.9Å; L94-L98 HydrophobicContact CD1-CD1 4.41Å; L94-L98 HydrophobicContact CD1-CG 4.41Å; L94-L98 HydrophobicContact CG-CD1 4.27Å; L94-L98 VanDerWaalsContact O-CG 3.26Å; L94-L98 WeakPolarHBondContact O-CG 3.36Å; L94-L98 PolarHBondContact O-N 3.48Å; L94-I135 HydrophobicContact CD2-CD1 3.74Å; L94-I135 HydrophobicContact CG-CD1 3.88Å
95	V	88.1	Confident	84	Confident	4 Å²	4	45.9 Å²	45.9	2%	0.024	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-46.9	170.9	171.6	0	0	0	0	110.6	D91 L97 L98 D99 A132 I135 D136 H142	D91-V95 WeakPolarHBondContact O-CG2 3.39Å; D91-V95 PolarHBondContact O-N 3.27Å; V95-L97 VanDerWaalsContact C-N 3.34Å; V95-L97 PolarHBondContact O-N 3.16Å; V95-L98 PolarHBondContact O-N 3.42Å; V95-D99 WeakPolarHBondContact CG1-OD2 3.4Å; V95-D99 WeakPolarHBondContact O-CB 3.28Å; V95-D99 PolarHBondContact O-N 3.41Å; V95-A132 HydrophobicContact CG1-CB 4.45Å; V95-I135 HydrophobicContact CG2-CB 3.67Å; V95-I135 HydrophobicContact CG2-CD1 4.27Å; V95-I135 HydrophobicContact CG2-CG2 3.59Å; V95-D136 HydrophobicContact CG2-CB 4.39Å; V95-H142 HydrophobicContact CG1-CB 4.06Å
96	R	87.2	Confident	84.6	Confident	72 Å²	72	40.9 Å²	40.9	27%	0.272	21%	0.211	S	C	.	.	H	α-helix	trans	-58.8	-41.5	177.1	-177.7	177.9	-175.7	163.9	6.3	112.8	D8 I57 S92 D93 M100	D8-R96 IonicContact OD2-NH2 2.63Å; I57-R96 HydrophobicContact CD1-CB 4.41Å; I57-R96 HydrophobicContact CD1-CG 4.38Å; I57-R96 HydrophobicContact CG2-CG 4.3Å; S92-R96 VanDerWaalsContact O-CB 3.29Å; S92-R96 WeakPolarHBondContact O-CB 3.37Å; S92-R96 PolarHBondContact O-N 3.26Å; D93-R96 PolarHBondContact O-N 3.41Å; R96-M100 HydrophobicContact CG-SD 4.07Å; R96-M100 WeakPolarHBondContact O-CB 3.28Å; R96-M100 VanDerWaalsContact O-CG 3.3Å; R96-M100 WeakPolarHBondContact O-CG 3.46Å; R96-M100 PolarHBondContact O-N 3.34Å
97	L	89.2	Confident	85	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-60.5	-53.5	175.2	-173.9	84.3	0	0	0	110.8	L53 I57 L76 A79 D93 L94 V95 D99 M100 L101	L53-L97 HydrophobicContact CD1-CD1 4.25Å; L53-L97 HydrophobicContact CD1-CD2 4.25Å; I57-L97 HydrophobicContact CD1-CB 4.36Å; I57-L97 HydrophobicContact CG1-CD1 4.07Å; L76-L97 HydrophobicContact CD2-CD1 3.48Å; L76-L97 VanDerWaalsContact CD2-CD1 3.48Å; L76-L97 HydrophobicContact CD2-CG 4.47Å; A79-L97 HydrophobicContact CB-CD1 3.68Å; A79-L97 HydrophobicContact CB-CD2 4.15Å; D93-L97 WeakPolarHBondContact O-CB 3.09Å; D93-L97 PolarHBondContact O-N 2.95Å; L94-L97 HydrophobicContact CD1-CD2 4.29Å; L94-L97 WeakPolarHBondContact O-CB 3.25Å; L94-L97 PolarHBondContact O-N 2.9Å; V95-L97 VanDerWaalsContact C-N 3.34Å; V95-L97 PolarHBondContact O-N 3.16Å; L97-D99 PolarHBondContact O-N 2.99Å; L97-M100 PolarHBondContact O-N 3.35Å; L97-L101 PolarHBondContact O-N 2.94Å
98	L	90.3	Very high	86.1	Confident	5 Å²	5	40 Å²	40	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-59.5	-44.5	-179.9	-69.7	169.8	0	0	0	111.5	Y80 L94 V95 L101 A102 L128 A132 I135	Y80-L98 HydrophobicContact CD2-CD2 3.71Å; Y80-L98 HydrophobicContact CE2-CD2 3.59Å; L94-L98 HydrophobicContact CD1-CD1 4.41Å; L94-L98 HydrophobicContact CD1-CG 4.41Å; L94-L98 HydrophobicContact CG-CD1 4.27Å; L94-L98 VanDerWaalsContact O-CG 3.26Å; L94-L98 WeakPolarHBondContact O-CG 3.36Å; L94-L98 PolarHBondContact O-N 3.48Å; V95-L98 PolarHBondContact O-N 3.42Å; L98-L101 PolarHBondContact O-N 2.91Å; L98-A102 WeakPolarHBondContact O-CB 3.45Å; L98-A102 PolarHBondContact O-N 3.18Å; L98-L128 HydrophobicContact CD2-CD2 3.69Å; L98-A132 HydrophobicContact CB-CB 4.13Å; L98-A132 HydrophobicContact CD1-CB 4.13Å; L98-I135 HydrophobicContact CD1-CD1 3.91Å
99	D	89.2	Confident	86.7	Confident	11 Å²	11	33.9 Å²	33.9	6%	0.059	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-38.4	177.1	-79.2	-37.1	0	0	0	112.9	V95 L97 A102 N103 F129 H142	V95-D99 WeakPolarHBondContact CG1-OD2 3.4Å; V95-D99 WeakPolarHBondContact O-CB 3.28Å; V95-D99 PolarHBondContact O-N 3.41Å; L97-D99 PolarHBondContact O-N 2.99Å; D99-A102 PolarHBondContact O-N 3.36Å; D99-N103 VanDerWaalsContact O-CB 3.26Å; D99-N103 WeakPolarHBondContact O-CB 3.19Å; D99-N103 PolarHBondContact O-N 2.91Å; D99-N103 PolarHBondContact O-ND2 3.45Å; D99-F129 VanDerWaalsContact OD1-CE1 3.29Å; D99-F129 WeakPolarHBondContact OD1-CE1 3.43Å; D99-H142 IonicContact OD1-CE1 3.49Å; D99-H142 IonicContact OD1-CG 3.74Å; D99-H142 IonicContact OD1-ND1 3.3Å; D99-H142 PolarHBondContact OD1-ND1 3.36Å; D99-H142 WeakPolarHBondContact OD2-CA 3.21Å; D99-H142 WeakPolarHBondContact OD2-CB 3.33Å; D99-H142 IonicContact OD2-CG 3.93Å; D99-H142 IonicContact OD2-ND1 2.89Å; D99-H142 PolarHBondContact OD2-ND1 2.9Å
100	M	88.5	Confident	87	Confident	19 Å²	19	38.3 Å²	38.3	9%	0.094	18%	0.181	C	C	.	.	H	α-helix	trans	-65.5	-48	177.2	-79.9	174	51.8	0	0	111.2	M1 I57 A60 I61 F72 L76 R96 L97 A102 Y104	M1-M100 WeakPolarHBondContact CE-O 3.44Å; I57-M100 HydrophobicContact CG2-CE 4.33Å; I57-M100 HydrophobicContact CG2-SD 3.95Å; A60-M100 HydrophobicContact CB-CE 4.39Å; I61-M100 HydrophobicContact CD1-CE 4.37Å; I61-M100 HydrophobicContact CD1-SD 4.47Å; I61-M100 HydrophobicContact CG1-CE 3.84Å; F72-M100 HydrophobicContact CE2-CE 3.81Å; F72-M100 HydrophobicContact CZ-CE 4.2Å; L76-M100 HydrophobicContact CD1-CB 4.02Å; L76-M100 HydrophobicContact CD1-CE 4.36Å; L76-M100 HydrophobicContact CD2-CE 4.24Å; R96-M100 HydrophobicContact CG-SD 4.07Å; R96-M100 WeakPolarHBondContact O-CB 3.28Å; R96-M100 VanDerWaalsContact O-CG 3.3Å; R96-M100 WeakPolarHBondContact O-CG 3.46Å; R96-M100 PolarHBondContact O-N 3.34Å; L97-M100 PolarHBondContact O-N 3.35Å; M100-A102 VanDerWaalsContact C-N 3.34Å; M100-A102 PolarHBondContact O-N 3.46Å; M100-Y104 WeakPolarHBondContact O-CB 3.33Å; M100-Y104 PolarHBondContact O-N 2.88Å
101	L	90.3	Very high	87	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-62.7	-41.1	175.6	-168.7	68.8	0	0	0	111.2	L76 E77 L97 L98 Y104 Y105 L128	L76-L101 HydrophobicContact CB-CD1 3.84Å; E77-L101 HydrophobicContact CG-CD1 4.11Å; L97-L101 PolarHBondContact O-N 2.94Å; L98-L101 PolarHBondContact O-N 2.91Å; L101-Y104 WeakPolarHBondContact O-CB 3.48Å; L101-Y104 PolarHBondContact O-N 2.99Å; L101-Y105 HydrophobicContact CD1-CE1 4.12Å; L101-Y105 HydrophobicContact CD1-CE2 4.35Å; L101-Y105 HydrophobicContact CD2-CE2 4.21Å; L101-Y105 HydrophobicContact CG-CD2 4.47Å; L101-Y105 HydrophobicContact CG-CE2 3.91Å; L101-Y105 PolarHBondContact O-N 2.97Å; L101-L128 HydrophobicContact CB-CD1 4.06Å; L101-L128 HydrophobicContact CD2-CD1 3.69Å; L101-L128 HydrophobicContact CD2-CD2 4.01Å; L101-L128 HydrophobicContact CG-CD1 3.72Å
102	A	91.3	Very high	87.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-70.1	-41	-179.2	0	0	0	0	0	113.5	L98 D99 M100 Y104 G106 A125 L128 F129	L98-A102 WeakPolarHBondContact O-CB 3.45Å; L98-A102 PolarHBondContact O-N 3.18Å; D99-A102 PolarHBondContact O-N 3.36Å; M100-A102 VanDerWaalsContact C-N 3.34Å; M100-A102 PolarHBondContact O-N 3.46Å; A102-Y104 PolarHBondContact O-N 3.22Å; A102-G106 PolarHBondContact O-N 3.29Å; A102-A125 VanDerWaalsContact CA-CB 3.44Å; A102-A125 HydrophobicContact CB-CB 3.66Å; A102-A125 VanDerWaalsContact O-CB 3.24Å; A102-A125 WeakPolarHBondContact O-CB 3.27Å; A102-L128 HydrophobicContact CB-CB 3.71Å; A102-L128 HydrophobicContact CB-CD1 4.15Å; A102-F129 HydrophobicContact CB-CD1 4.19Å; A102-F129 HydrophobicContact CB-CD2 3.73Å; A102-F129 HydrophobicContact CB-CE1 3.93Å; A102-F129 HydrophobicContact CB-CE2 3.4Å; A102-F129 VanDerWaalsContact CB-CE2 3.4Å; A102-F129 HydrophobicContact CB-CG 4.11Å; A102-F129 HydrophobicContact CB-CZ 3.53Å
103	N	88.8	Confident	86.6	Confident	11 Å²	11	38.2 Å²	38.2	6%	0.059	17%	0.165	C	C	.	.	H	α-helix	trans	-65.1	-31.1	170.9	-84.5	-100.2	0	0	0	111.7	M1 D99 R107 G145	M1-N103 HydrophobicContact CE-CB 4.17Å; M1-N103 HydrophobicContact CG-CB 4.28Å; D99-N103 VanDerWaalsContact O-CB 3.26Å; D99-N103 WeakPolarHBondContact O-CB 3.19Å; D99-N103 PolarHBondContact O-N 2.91Å; D99-N103 PolarHBondContact O-ND2 3.45Å; N103-R107 WeakPolarHBondContact O-CB 3.26Å; N103-R107 PolarHBondContact O-N 2.92Å; N103-G145 VanDerWaalsContact ND2-CA 3.34Å; N103-G145 WeakPolarHBondContact ND2-CA 3.42Å; N103-G145 PolarHBondContact OD1-O 3.43Å
104	Y	90.2	Very high	86.4	Confident	21 Å²	21	39 Å²	39	8%	0.082	17%	0.172	C	C	.	.	H	α-helix	trans	-68.5	-53.7	177.6	-175.1	-106.2	0	0	0	111.2	M1 Y69 F72 E73 M100 L101 A102 G106 R107 K108	M1-Y104 HydrophobicContact CE-CD2 4.04Å; M1-Y104 HydrophobicContact CE-CG 4.32Å; Y69-Y104 PolarHBondContact O-OH 2.86Å; F72-Y104 AromaticContact CD1-CD2 3.72Å; F72-Y104 HydrophobicContact CD1-CD2 3.72Å; F72-Y104 AromaticContact CD1-CE2 3.9Å; F72-Y104 HydrophobicContact CD1-CE2 3.9Å; F72-Y104 HydrophobicContact CD1-CG 4.14Å; F72-Y104 AromaticContact CE1-CD2 3.47Å; F72-Y104 HydrophobicContact CE1-CD2 3.47Å; F72-Y104 VanDerWaalsContact CE1-CD2 3.47Å; F72-Y104 HydrophobicContact CE1-CE2 4.13Å; F72-Y104 AromaticContact CE1-CG 3.74Å; F72-Y104 HydrophobicContact CE1-CG 3.74Å; E73-Y104 HydrophobicContact CB-CD1 4.39Å; E73-Y104 HydrophobicContact CB-CE1 3.78Å; E73-Y104 HydrophobicContact CG-CD1 4.27Å; E73-Y104 HydrophobicContact CG-CE1 3.8Å; E73-Y104 WeakPolarHBondContact OE2-CE1 3.47Å; E73-Y104 PolarHBondContact OE2-OH 3.2Å; M100-Y104 WeakPolarHBondContact O-CB 3.33Å; M100-Y104 PolarHBondContact O-N 2.88Å; L101-Y104 WeakPolarHBondContact O-CB 3.48Å; L101-Y104 PolarHBondContact O-N 2.99Å; A102-Y104 PolarHBondContact O-N 3.22Å; Y104-G106 VanDerWaalsContact C-N 3.27Å; Y104-G106 PolarHBondContact O-N 2.98Å; Y104-R107 CarbonylContact O-C 3.48Å; Y104-R107 WeakPolarHBondContact O-CA 3.35Å; Y104-R107 PolarHBondContact O-N 2.77Å; Y104-K108 HydrophobicContact CE1-CD 3.9Å; Y104-K108 WeakPolarHBondContact O-CB 3.43Å; Y104-K108 PolarHBondContact O-N 2.89Å
105	Y	91.2	Very high	86.1	Confident	14 Å²	14	45.1 Å²	45.1	6%	0.055	20%	0.198	C	C	.	.	H	α-helix	trans	-58.4	-37.3	174.3	-67.2	-21.3	0	0	0	112.3	E73 E77 L101 K108 A109 L121 Q124 A125 L128	E73-Y105 HydrophobicContact CG-CE1 4.48Å; E73-Y105 WeakPolarHBondContact OE1-CE1 3.37Å; E77-Y105 PolarHBondContact OE1-OH 3.31Å; L101-Y105 HydrophobicContact CD1-CE1 4.12Å; L101-Y105 HydrophobicContact CD1-CE2 4.35Å; L101-Y105 HydrophobicContact CD2-CE2 4.21Å; L101-Y105 HydrophobicContact CG-CD2 4.47Å; L101-Y105 HydrophobicContact CG-CE2 3.91Å; L101-Y105 PolarHBondContact O-N 2.97Å; Y105-K108 PolarHBondContact O-N 3.46Å; Y105-A109 VanDerWaalsContact O-CB 3.28Å; Y105-A109 WeakPolarHBondContact O-CB 3.47Å; Y105-A109 PolarHBondContact O-N 3.49Å; Y105-L121 HydrophobicContact CD1-CD2 4Å; Y105-L121 HydrophobicContact CG-CD2 4.28Å; Y105-Q124 HydrophobicContact CD2-CB 3.6Å; Y105-Q124 HydrophobicContact CE2-CB 3.8Å; Y105-Q124 HydrophobicContact CG-CB 4.5Å; Y105-A125 HydrophobicContact CD2-CB 4.24Å; Y105-L128 HydrophobicContact CD2-CD1 3.6Å; Y105-L128 HydrophobicContact CE2-CD1 3.55Å
106	G	87.4	Confident	85.9	Confident	2 Å²	2	50.3 Å²	50.3	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-60.3	-43.8	171.3	0	0	0	0	0	113.2	A102 Y104 Y110	A102-G106 PolarHBondContact O-N 3.29Å; Y104-G106 VanDerWaalsContact C-N 3.27Å; Y104-G106 PolarHBondContact O-N 2.98Å; G106-Y110 PolarHBondContact O-N 2.95Å
107	R	85.2	Confident	85.9	Confident	61 Å²	61	52.1 Å²	52.1	23%	0.23	24%	0.235	C	C	.	.	H	α-helix	trans	-69.2	-32.7	174.9	-168.2	-179	-169.2	165.1	11.5	112.5	D2 Y64 N103 Y104 K111	D2-R107 IonicContact OD1-CZ 3.38Å; D2-R107 IonicContact OD1-NH1 3.77Å; D2-R107 PolarHBondContact OD1-NH1 3.38Å; D2-R107 IonicContact OD2-CZ 3.79Å; D2-R107 VanDerWaalsContact OD2-CZ 3.27Å; D2-R107 IonicContact OD2-NH1 3.56Å; D2-R107 PolarHBondContact OD2-NH1 2.83Å; D2-R107 IonicContact OD2-NH2 3.37Å; D2-R107 PolarHBondContact OD2-NH2 2.95Å; Y64-R107 PolarHBondContact OH-NH1 3.12Å; N103-R107 WeakPolarHBondContact O-CB 3.26Å; N103-R107 PolarHBondContact O-N 2.92Å; Y104-R107 CarbonylContact O-C 3.48Å; Y104-R107 WeakPolarHBondContact O-CA 3.35Å; Y104-R107 PolarHBondContact O-N 2.77Å; R107-K111 PolarHBondContact O-N 3.33Å
108	K	88.1	Confident	85.7	Confident	66 Å²	66	54 Å²	54	29%	0.287	24%	0.243	S	C	.	.	H	α-helix	trans	-69	-47.6	176	-163.6	167.8	177.2	173.9	0	110	E73 Y104 Y105 Y110 K111 E112 L121	E73-K108 IonicContact OE1-NZ 3.98Å; E73-K108 PolarHBondContact OE1-NZ 3.35Å; E73-K108 IonicContact OE2-NZ 2.92Å; E73-K108 PolarHBondContact OE2-NZ 2.89Å; Y104-K108 HydrophobicContact CE1-CD 3.9Å; Y104-K108 WeakPolarHBondContact O-CB 3.43Å; Y104-K108 PolarHBondContact O-N 2.89Å; Y105-K108 PolarHBondContact O-N 3.46Å; K108-Y110 VanDerWaalsContact C-N 3.32Å; K108-Y110 PolarHBondContact O-N 3.28Å; K108-K111 PolarHBondContact O-N 3.41Å; K108-E112 WeakPolarHBondContact O-CB 3.26Å; K108-E112 PolarHBondContact O-N 2.98Å; K108-L121 HydrophobicContact CB-CD1 4.22Å; K108-L121 HydrophobicContact CB-CD2 4.48Å; K108-L121 HydrophobicContact CD-CD1 4.48Å; K108-L121 HydrophobicContact CD-CD2 4.1Å; K108-L121 HydrophobicContact CG-CD1 3.93Å; K108-L121 HydrophobicContact CG-CD2 4.34Å
109	A	86.1	Confident	85.6	Confident	3 Å²	3	58.5 Å²	58.5	3%	0.025	27%	0.268	C	S	.	.	H	α-helix	trans	-57.6	-39.6	173.3	0	0	0	0	0	113.1	Y105 K111 E112 K118 L121 I122	Y105-A109 VanDerWaalsContact O-CB 3.28Å; Y105-A109 WeakPolarHBondContact O-CB 3.47Å; Y105-A109 PolarHBondContact O-N 3.49Å; A109-K111 PolarHBondContact O-N 3.06Å; A109-E112 PolarHBondContact O-N 2.95Å; A109-K118 HydrophobicContact CB-CG 4.22Å; A109-K118 WeakPolarHBondContact O-CG 3.35Å; A109-L121 HydrophobicContact CB-CB 3.79Å; A109-L121 HydrophobicContact CB-CD1 4.45Å; A109-I122 HydrophobicContact CB-CD1 4.44Å; A109-I122 HydrophobicContact CB-CG1 3.85Å
110	Y	81.4	Confident	85.7	Confident	148 Å²	148	63.6 Å²	63.6	58%	0.58	29%	0.291	S	S	*	.	H	α-helix	trans	-64.9	-24.5	175.5	-177	-94.8	0	0	0	113.7	G106 K108 Y152	G106-Y110 PolarHBondContact O-N 2.95Å; K108-Y110 VanDerWaalsContact C-N 3.32Å; K108-Y110 PolarHBondContact O-N 3.28Å; Y110-Y152 HydrophobicContact CD2-CD1 4.22Å; Y110-Y152 HydrophobicContact CG-CD1 4.01Å
111	K	79.2	Confident	85.8	Confident	139 Å²	139	63.4 Å²	63.4	60%	0.604	29%	0.29	S	S	*	.	H	α-helix	trans	-93.7	-22.3	175.2	-70.6	179.3	173.4	-176.5	0	113.8	R107 K108 A109	R107-K111 PolarHBondContact O-N 3.33Å; K108-K111 PolarHBondContact O-N 3.41Å; A109-K111 PolarHBondContact O-N 3.06Å
112	E	83.1	Confident	85.8	Confident	49 Å²	49	64.8 Å²	64.8	23%	0.229	30%	0.297	C	S	.	.			trans	-72.7	129.2	-169.9	-179.9	51.1	-120.9	0	0	111.7	K108 A109 S114 K117 K118 L121	K108-E112 WeakPolarHBondContact O-CB 3.26Å; K108-E112 PolarHBondContact O-N 2.98Å; A109-E112 PolarHBondContact O-N 2.95Å; E112-S114 PolarHBondContact OE1-N 3.27Å; E112-K117 HydrophobicContact CG-CB 3.54Å; E112-K117 HydrophobicContact CG-CD 4.32Å; E112-K118 HydrophobicContact CB-CB 4.47Å; E112-K118 HydrophobicContact CG-CB 4.45Å; E112-L121 HydrophobicContact CB-CD1 4.17Å; E112-L121 HydrophobicContact CG-CD1 4.25Å
113	K	73.3	Confident	85.7	Confident	130 Å²	130	66.8 Å²	66.8	57%	0.565	31%	0.314	S	S	*	.			trans	-86.8	-21.5	-174.6	-63.1	-170.3	179.8	-169.7	0	113.4	Y309 N310	K113-Y309 WeakPolarHBondContact CE-O 3.27Å; K113-Y309 PolarHBondContact NZ-O 3.41Å; K113-N310 PolarHBondContact NZ-OD1 2.97Å
114	S	80.8	Confident	85.9	Confident	39 Å²	39	69.7 Å²	69.7	27%	0.273	33%	0.327	S	S	.	.			trans	-83.5	121.9	174.8	167.2	0	0	0	0	110.3	E112 D116 K117 K118	E112-S114 PolarHBondContact OE1-N 3.27Å; S114-D116 PolarHBondContact O-N 2.98Å; S114-D116 PolarHBondContact OG-N 3.36Å; S114-K117 PolarHBondContact O-N 2.69Å; S114-K117 PolarHBondContact OG-N 3.23Å; S114-K118 VanDerWaalsContact O-CB 3.23Å; S114-K118 WeakPolarHBondContact O-CB 3.38Å; S114-K118 PolarHBondContact O-N 3.38Å
115	K	79.5	Confident	85.9	Confident	151 Å²	151	68.7 Å²	68.7	66%	0.657	32%	0.323	S	S	*	.	H	α-helix	trans	-55.1	-40.1	174.5	-71.5	-172	173.2	-171.9	0	112.2	K118 N119	K115-K118 PolarHBondContact O-N 3.01Å; K115-N119 WeakPolarHBondContact O-CB 3.42Å; K115-N119 PolarHBondContact O-N 3.03Å; K115-N119 PolarHBondContact O-ND2 3.45Å; K115-N119 PolarHBondContact O-OD1 2.91Å
116	D	84.6	Confident	85.9	Confident	112 Å²	112	71.1 Å²	71.1	60%	0.599	34%	0.339	S	S	*	.	H	α-helix	trans	-68.4	-45.9	-177.3	-47.3	-61.2	0	0	0	111.3	S114 N119 Q120	S114-D116 PolarHBondContact O-N 2.98Å; S114-D116 PolarHBondContact OG-N 3.36Å; D116-N119 PolarHBondContact O-N 3.5Å; D116-Q120 WeakPolarHBondContact O-CG 3.46Å; D116-Q120 PolarHBondContact O-N 2.72Å
117	K	86.6	Confident	86.1	Confident	110 Å²	110	79.7 Å²	79.7	48%	0.478	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-41.2	173.7	-69.2	-176.5	172.5	-173.1	0	112.3	E112 S114 N119 Q120 L121	E112-K117 HydrophobicContact CG-CB 3.54Å; E112-K117 HydrophobicContact CG-CD 4.32Å; S114-K117 PolarHBondContact O-N 2.69Å; S114-K117 PolarHBondContact OG-N 3.23Å; K117-N119 VanDerWaalsContact C-N 3.33Å; K117-N119 PolarHBondContact O-N 3.49Å; K117-Q120 WeakPolarHBondContact O-CB 3.32Å; K117-Q120 PolarHBondContact O-N 2.69Å; K117-L121 WeakPolarHBondContact O-CB 3.49Å; K117-L121 WeakPolarHBondContact O-CG 3.48Å; K117-L121 PolarHBondContact O-N 3.45Å
118	K	85.6	Confident	86.4	Confident	40 Å²	40	77.2 Å²	77.2	17%	0.174	36%	0.362	C	S	.	.	H	α-helix	trans	-58.2	-46.1	175.3	-179.1	173.2	-173.4	-171.4	0	110.8	A109 E112 S114 K115 L121 I122 E312	A109-K118 HydrophobicContact CB-CG 4.22Å; A109-K118 WeakPolarHBondContact O-CG 3.35Å; E112-K118 HydrophobicContact CB-CB 4.47Å; E112-K118 HydrophobicContact CG-CB 4.45Å; S114-K118 VanDerWaalsContact O-CB 3.23Å; S114-K118 WeakPolarHBondContact O-CB 3.38Å; S114-K118 PolarHBondContact O-N 3.38Å; K115-K118 PolarHBondContact O-N 3.01Å; K118-L121 PolarHBondContact O-N 2.95Å; K118-I122 HydrophobicContact CG-CD1 3.96Å; K118-I122 WeakPolarHBondContact O-CB 3.3Å; K118-I122 VanDerWaalsContact O-CG1 3.23Å; K118-I122 WeakPolarHBondContact O-CG1 3.46Å; K118-I122 PolarHBondContact O-N 3.48Å; K118-E312 IonicContact NZ-OE2 2.65Å; K118-E312 PolarHBondContact NZ-OE2 3.47Å
119	N	87	Confident	86.5	Confident	101 Å²	101	74.4 Å²	74.4	54%	0.54	35%	0.35	S	S	.	.	H	α-helix	trans	-66.5	-36.6	176	-68.6	-9	0	0	0	112.5	K115 D116 K117 A123	K115-N119 WeakPolarHBondContact O-CB 3.42Å; K115-N119 PolarHBondContact O-N 3.03Å; K115-N119 PolarHBondContact O-ND2 3.45Å; K115-N119 PolarHBondContact O-OD1 2.91Å; D116-N119 PolarHBondContact O-N 3.5Å; K117-N119 VanDerWaalsContact C-N 3.33Å; K117-N119 PolarHBondContact O-N 3.49Å; N119-A123 VanDerWaalsContact O-CB 3.31Å; N119-A123 WeakPolarHBondContact O-CB 3.37Å; N119-A123 PolarHBondContact O-N 3.36Å
120	Q	91.6	Very high	86.7	Confident	117 Å²	117	77 Å²	77	55%	0.547	37%	0.366	S	S	.	.	H	α-helix	trans	-63.8	-47.5	173.5	-72.4	162.2	7.9	0	0	111.7	D116 K117 I122 A123 Q124	D116-Q120 WeakPolarHBondContact O-CG 3.46Å; D116-Q120 PolarHBondContact O-N 2.72Å; K117-Q120 WeakPolarHBondContact O-CB 3.32Å; K117-Q120 PolarHBondContact O-N 2.69Å; Q120-I122 PolarHBondContact O-N 3.29Å; Q120-A123 PolarHBondContact O-N 3.02Å; Q120-A123 VanDerWaalsContact O-N 3.15Å; Q120-Q124 WeakPolarHBondContact O-CG 3.48Å; Q120-Q124 PolarHBondContact O-N 3.12Å; Q120-Q124 PolarHBondContact O-OE1 2.98Å
121	L	91	Very high	87.1	Confident	15 Å²	15	71.4 Å²	71.4	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-64.3	-37.5	176.7	-71.7	164.5	0	0	0	112.2	Y105 K108 A109 E112 K117 K118 A125	Y105-L121 HydrophobicContact CD1-CD2 4Å; Y105-L121 HydrophobicContact CG-CD2 4.28Å; K108-L121 HydrophobicContact CB-CD1 4.22Å; K108-L121 HydrophobicContact CB-CD2 4.48Å; K108-L121 HydrophobicContact CD-CD1 4.48Å; K108-L121 HydrophobicContact CD-CD2 4.1Å; K108-L121 HydrophobicContact CG-CD1 3.93Å; K108-L121 HydrophobicContact CG-CD2 4.34Å; A109-L121 HydrophobicContact CB-CB 3.79Å; A109-L121 HydrophobicContact CB-CD1 4.45Å; E112-L121 HydrophobicContact CB-CD1 4.17Å; E112-L121 HydrophobicContact CG-CD1 4.25Å; K117-L121 WeakPolarHBondContact O-CB 3.49Å; K117-L121 WeakPolarHBondContact O-CG 3.48Å; K117-L121 PolarHBondContact O-N 3.45Å; K118-L121 PolarHBondContact O-N 2.95Å; L121-A125 PolarHBondContact O-N 3.35Å
122	I	89.1	Confident	87.5	Confident	32 Å²	32	64.8 Å²	64.8	16%	0.164	32%	0.319	C	S	.	.	H	α-helix	trans	-65.6	-41.3	171.6	-71.1	166.1	0	0	0	110.6	A109 K118 Q120 A125 T126 F149	A109-I122 HydrophobicContact CB-CD1 4.44Å; A109-I122 HydrophobicContact CB-CG1 3.85Å; K118-I122 HydrophobicContact CG-CD1 3.96Å; K118-I122 WeakPolarHBondContact O-CB 3.3Å; K118-I122 VanDerWaalsContact O-CG1 3.23Å; K118-I122 WeakPolarHBondContact O-CG1 3.46Å; K118-I122 PolarHBondContact O-N 3.48Å; Q120-I122 PolarHBondContact O-N 3.29Å; I122-A125 CarbonylContact O-C 3.51Å; I122-A125 WeakPolarHBondContact O-CA 3.22Å; I122-A125 PolarHBondContact O-N 2.93Å; I122-A125 VanDerWaalsContact O-N 3.16Å; I122-T126 PolarHBondContact O-N 3.4Å; I122-T126 PolarHBondContact O-OG1 3.28Å; I122-F149 HydrophobicContact CG2-CZ 4.07Å
123	A	91.2	Very high	87.8	Confident	41 Å²	41	64.2 Å²	64.2	34%	0.339	32%	0.318	S	S	.	.	H	α-helix	trans	-68.3	-36.5	177.6	0	0	0	0	0	113.1	N119 Q120 R127	N119-A123 VanDerWaalsContact O-CB 3.31Å; N119-A123 WeakPolarHBondContact O-CB 3.37Å; N119-A123 PolarHBondContact O-N 3.36Å; Q120-A123 PolarHBondContact O-N 3.02Å; Q120-A123 VanDerWaalsContact O-N 3.15Å; A123-R127 WeakPolarHBondContact O-CD 3.4Å; A123-R127 WeakPolarHBondContact O-CG 3.45Å; A123-R127 PolarHBondContact O-N 3.19Å; A123-R127 VanDerWaalsContact O-N 3.16Å
124	Q	91.1	Very high	88.5	Confident	72 Å²	72	67.8 Å²	67.8	34%	0.336	33%	0.328	S	S	.	.	H	α-helix	trans	-62.8	-45.3	167.1	-69.8	167.6	-66	0	0	110.2	Y105 Q120 R127 L128	Y105-Q124 HydrophobicContact CD2-CB 3.6Å; Y105-Q124 HydrophobicContact CE2-CB 3.8Å; Y105-Q124 HydrophobicContact CG-CB 4.5Å; Q120-Q124 WeakPolarHBondContact O-CG 3.48Å; Q120-Q124 PolarHBondContact O-N 3.12Å; Q120-Q124 PolarHBondContact O-OE1 2.98Å; Q124-R127 PolarHBondContact O-N 3.22Å; Q124-L128 WeakPolarHBondContact O-CG 3.25Å; Q124-L128 PolarHBondContact O-N 2.91Å
125	A	91	Very high	88.7	Confident	0 Å²	0	69 Å²	69	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-36.1	-70.8	165.5	0	0	0	0	0	113.6	A102 Y105 L121 I122 R127 L128 F129 F149	A102-A125 VanDerWaalsContact CA-CB 3.44Å; A102-A125 HydrophobicContact CB-CB 3.66Å; A102-A125 VanDerWaalsContact O-CB 3.24Å; A102-A125 WeakPolarHBondContact O-CB 3.27Å; Y105-A125 HydrophobicContact CD2-CB 4.24Å; L121-A125 PolarHBondContact O-N 3.35Å; I122-A125 CarbonylContact O-C 3.51Å; I122-A125 WeakPolarHBondContact O-CA 3.22Å; I122-A125 PolarHBondContact O-N 2.93Å; I122-A125 VanDerWaalsContact O-N 3.16Å; A125-R127 VanDerWaalsContact C-N 3.3Å; A125-R127 PolarHBondContact O-N 3.26Å; A125-L128 HydrophobicContact CB-CD1 4.42Å; A125-L128 PolarHBondContact O-N 3.39Å; A125-F129 HydrophobicContact CB-CD2 4.41Å; A125-F129 HydrophobicContact CB-CE2 4.33Å; A125-F129 VanDerWaalsContact O-CD2 3.29Å; A125-F129 WeakPolarHBondContact O-CD2 3.46Å; A125-F129 PolarHBondContact O-N 2.81Å; A125-F129 VanDerWaalsContact O-N 3.15Å; A125-F149 HydrophobicContact CB-CD2 4.37Å; A125-F149 HydrophobicContact CB-CE2 3.98Å
126	T	90.4	Very high	88.9	Confident	65 Å²	65	65.3 Å²	65.3	40%	0.399	32%	0.318	S	S	.	.	H	α-helix	trans	-61.8	-36.1	-175.8	-51.4	0	0	0	0	112.2	I122 T130	I122-T126 PolarHBondContact O-N 3.4Å; I122-T126 PolarHBondContact O-OG1 3.28Å; T126-T130 VanDerWaalsContact O-CB 3.26Å; T126-T130 WeakPolarHBondContact O-CB 3.21Å; T126-T130 PolarHBondContact O-N 2.76Å; T126-T130 PolarHBondContact O-OG1 3.35Å
127	R	91.8	Very high	88.8	Confident	183 Å²	183	63.8 Å²	63.8	69%	0.691	31%	0.308	S	S	*	.	H	α-helix	trans	-61.6	-46.4	176	-74.2	169.4	-170.3	-175.7	4.4	112	A123 Q124 A125 T130 S131	A123-R127 WeakPolarHBondContact O-CD 3.4Å; A123-R127 WeakPolarHBondContact O-CG 3.45Å; A123-R127 PolarHBondContact O-N 3.19Å; A123-R127 VanDerWaalsContact O-N 3.16Å; Q124-R127 PolarHBondContact O-N 3.22Å; A125-R127 VanDerWaalsContact C-N 3.3Å; A125-R127 PolarHBondContact O-N 3.26Å; R127-T130 CarbonylContact O-C 3.55Å; R127-T130 WeakPolarHBondContact O-CB 3.41Å; R127-T130 PolarHBondContact O-N 3.09Å; R127-S131 PolarHBondContact O-N 3.19Å; R127-S131 PolarHBondContact O-OG 3.37Å
128	L	91.4	Very high	88.7	Confident	9 Å²	9	65.3 Å²	65.3	5%	0.047	31%	0.312	C	S	.	.	H	α-helix	trans	-66.2	-45.2	-178.6	-70	169.4	0	0	0	112.1	Y80 L98 L101 A102 Y105 Q124 A125 T130 S131 A132	Y80-L128 HydrophobicContact CE1-CD2 4.32Å; Y80-L128 HydrophobicContact CE2-CD2 4.42Å; L98-L128 HydrophobicContact CD2-CD2 3.69Å; L101-L128 HydrophobicContact CB-CD1 4.06Å; L101-L128 HydrophobicContact CD2-CD1 3.69Å; L101-L128 HydrophobicContact CD2-CD2 4.01Å; L101-L128 HydrophobicContact CG-CD1 3.72Å; A102-L128 HydrophobicContact CB-CB 3.71Å; A102-L128 HydrophobicContact CB-CD1 4.15Å; Y105-L128 HydrophobicContact CD2-CD1 3.6Å; Y105-L128 HydrophobicContact CE2-CD1 3.55Å; Q124-L128 WeakPolarHBondContact O-CG 3.25Å; Q124-L128 PolarHBondContact O-N 2.91Å; A125-L128 HydrophobicContact CB-CD1 4.42Å; A125-L128 PolarHBondContact O-N 3.39Å; L128-T130 VanDerWaalsContact C-N 3.27Å; L128-T130 PolarHBondContact O-N 3.15Å; L128-S131 WeakPolarHBondContact CA-OG 3.41Å; L128-S131 PolarHBondContact O-N 3.48Å; L128-S131 VanDerWaalsContact O-N 3.12Å; L128-S131 PolarHBondContact O-OG 2.9Å; L128-A132 PolarHBondContact O-N 3.31Å
129	F	90.6	Very high	88.6	Confident	6 Å²	6	66 Å²	66	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-36.7	171.5	-73.2	-64	0	0	0	111.8	D99 A102 A125 S131 A132 D133 H142 R146 F149	D99-F129 VanDerWaalsContact OD1-CE1 3.29Å; D99-F129 WeakPolarHBondContact OD1-CE1 3.43Å; A102-F129 HydrophobicContact CB-CD1 4.19Å; A102-F129 HydrophobicContact CB-CD2 3.73Å; A102-F129 HydrophobicContact CB-CE1 3.93Å; A102-F129 HydrophobicContact CB-CE2 3.4Å; A102-F129 VanDerWaalsContact CB-CE2 3.4Å; A102-F129 HydrophobicContact CB-CG 4.11Å; A102-F129 HydrophobicContact CB-CZ 3.53Å; A125-F129 HydrophobicContact CB-CD2 4.41Å; A125-F129 HydrophobicContact CB-CE2 4.33Å; A125-F129 VanDerWaalsContact O-CD2 3.29Å; A125-F129 WeakPolarHBondContact O-CD2 3.46Å; A125-F129 PolarHBondContact O-N 2.81Å; A125-F129 VanDerWaalsContact O-N 3.15Å; F129-S131 VanDerWaalsContact C-N 3.3Å; F129-S131 PolarHBondContact O-N 3.12Å; F129-A132 PolarHBondContact O-N 3.17Å; F129-D133 WeakPolarHBondContact O-CB 3.27Å; F129-D133 PolarHBondContact O-N 2.97Å; F129-H142 AromaticContact CD1-CE1 3.84Å; F129-R146 HydrophobicContact CD1-CB 4.25Å; F129-R146 HydrophobicContact CE1-CB 4.27Å; F129-F149 HydrophobicContact CD2-CB 4.23Å; F129-F149 HydrophobicContact CD2-CD1 4.14Å; F129-F149 HydrophobicContact CD2-CD2 4.21Å; F129-F149 AromaticContact CD2-CG 3.93Å; F129-F149 HydrophobicContact CD2-CG 3.93Å; F129-F149 HydrophobicContact CE2-CB 3.38Å; F129-F149 HydrophobicContact CE2-CD1 4.07Å; F129-F149 AromaticContact CE2-CD2 3.61Å; F129-F149 HydrophobicContact CE2-CD2 3.61Å; F129-F149 HydrophobicContact CE2-CE2 4.38Å; F129-F149 AromaticContact CE2-CG 3.41Å; F129-F149 HydrophobicContact CE2-CG 3.41Å; F129-F149 VanDerWaalsContact CE2-CG 3.41Å; F129-F149 HydrophobicContact CZ-CB 3.76Å; F129-F149 HydrophobicContact CZ-CG 4.29Å
130	T	90.7	Very high	88.5	Confident	58 Å²	58	63.8 Å²	63.8	36%	0.356	30%	0.304	S	S	.	.	H	α-helix	trans	-69.2	-23.8	175.8	-55.7	0	0	0	0	113.1	T126 R127 L128 R134	T126-T130 VanDerWaalsContact O-CB 3.26Å; T126-T130 WeakPolarHBondContact O-CB 3.21Å; T126-T130 PolarHBondContact O-N 2.76Å; T126-T130 PolarHBondContact O-OG1 3.35Å; R127-T130 CarbonylContact O-C 3.55Å; R127-T130 WeakPolarHBondContact O-CB 3.41Å; R127-T130 PolarHBondContact O-N 3.09Å; L128-T130 VanDerWaalsContact C-N 3.27Å; L128-T130 PolarHBondContact O-N 3.15Å; T130-R134 WeakPolarHBondContact O-CG 3.38Å; T130-R134 PolarHBondContact O-NE 3.01Å
131	S	88.6	Confident	88.1	Confident	30 Å²	30	63.9 Å²	63.9	21%	0.21	30%	0.303	C	S	.	.	H	α-helix	trans	-79.4	-37.4	168.6	37.9	0	0	0	0	112.7	R127 L128 F129 R134	R127-S131 PolarHBondContact O-N 3.19Å; R127-S131 PolarHBondContact O-OG 3.37Å; L128-S131 WeakPolarHBondContact CA-OG 3.41Å; L128-S131 PolarHBondContact O-N 3.48Å; L128-S131 VanDerWaalsContact O-N 3.12Å; L128-S131 PolarHBondContact O-OG 2.9Å; F129-S131 VanDerWaalsContact C-N 3.3Å; F129-S131 PolarHBondContact O-N 3.12Å; S131-R134 PolarHBondContact O-N 2.66Å
132	A	88.9	Confident	88	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67.1	-40.6	175.4	0	0	0	0	0	112.1	V95 L98 L128 F129 R134 I135 D136 H142	V95-A132 HydrophobicContact CG1-CB 4.45Å; L98-A132 HydrophobicContact CB-CB 4.13Å; L98-A132 HydrophobicContact CD1-CB 4.13Å; L128-A132 PolarHBondContact O-N 3.31Å; F129-A132 PolarHBondContact O-N 3.17Å; A132-R134 PolarHBondContact O-N 2.76Å; A132-I135 PolarHBondContact O-N 3.38Å; A132-D136 PolarHBondContact O-N 2.9Å; A132-D136 VanDerWaalsContact O-N 3.09Å; A132-H142 VanDerWaalsContact CB-CE1 3.49Å; A132-H142 WeakPolarHBondContact CB-CE1 3.42Å
133	D	88.4	Confident	87.9	Confident	37 Å²	37	61.8 Å²	61.8	20%	0.198	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-25.3	171.7	-98.9	-26.5	0	0	0	113.8	F129 M137 H142 R146	F129-D133 WeakPolarHBondContact O-CB 3.27Å; F129-D133 PolarHBondContact O-N 2.97Å; D133-M137 WeakPolarHBondContact OD1-CG 3.37Å; D133-H142 IonicContact OD1-NE2 3.3Å; D133-H142 PolarHBondContact OD1-NE2 3.47Å; D133-R146 IonicContact OD1-CZ 3.93Å; D133-R146 IonicContact OD1-NH1 2.73Å; D133-R146 PolarHBondContact OD1-NH1 3.28Å; D133-R146 IonicContact OD1-NH2 2.83Å; D133-R146 IonicContact OD2-CZ 2.7Å; D133-R146 IonicContact OD2-NH1 2.71Å; D133-R146 PolarHBondContact OD2-NH1 2.95Å; D133-R146 IonicContact OD2-NH2 3.25Å; D133-R146 PolarHBondContact OD2-NH2 2.99Å
134	R	88.6	Confident	87.8	Confident	205 Å²	205	60.6 Å²	60.6	77%	0.774	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-11.9	-179.8	-64.7	170.4	-173.6	-164.7	-1.4	113.7	T130 S131 A132	T130-R134 WeakPolarHBondContact O-CG 3.38Å; T130-R134 PolarHBondContact O-NE 3.01Å; S131-R134 PolarHBondContact O-N 2.66Å; A132-R134 PolarHBondContact O-N 2.76Å
135	I	85	Confident	87.6	Confident	64 Å²	64	57.5 Å²	57.5	33%	0.328	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-61.1	-176.9	-55.9	164.6	0	0	0	108.4	D91 L94 V95 L98 A132	D91-I135 HydrophobicContact CB-CG2 3.7Å; L94-I135 HydrophobicContact CD2-CD1 3.74Å; L94-I135 HydrophobicContact CG-CD1 3.88Å; V95-I135 HydrophobicContact CG2-CB 3.67Å; V95-I135 HydrophobicContact CG2-CD1 4.27Å; V95-I135 HydrophobicContact CG2-CG2 3.59Å; L98-I135 HydrophobicContact CD1-CD1 3.91Å; A132-I135 PolarHBondContact O-N 3.38Å
136	D	83.1	Confident	87.4	Confident	74 Å²	74	59.8 Å²	59.8	40%	0.396	28%	0.276	S	S	.	.			trans	-144.4	109.9	168.4	-170.3	-12.1	0	0	0	110.6	V95 A132 Y138 D139 H142	V95-D136 HydrophobicContact CG2-CB 4.39Å; A132-D136 PolarHBondContact O-N 2.9Å; A132-D136 VanDerWaalsContact O-N 3.09Å; D136-Y138 PolarHBondContact OD1-N 3.44Å; D136-D139 PolarHBondContact OD1-N 3.22Å; D136-D139 VanDerWaalsContact OD1-N 3.15Å; D136-H142 PolarHBondContact O-CD2 3.02Å
137	M	83.6	Confident	87.4	Confident	80 Å²	80	56.7 Å²	56.7	39%	0.394	26%	0.257	S	S	.	.	S	Bend	trans	-80.8	-17.7	177.7	177.9	173.8	55	0	0	113.3	D133 L143	D133-M137 WeakPolarHBondContact OD1-CG 3.37Å; M137-L143 VanDerWaalsContact O-CD2 3.31Å; M137-L143 WeakPolarHBondContact O-CD2 3.39Å
138	Y	83.5	Confident	87.2	Confident	143 Å²	143	49.5 Å²	49.5	56%	0.561	23%	0.231	S	C	*	.	S	Bend	trans	-113.2	-3.5	-168.5	-70.8	-54.3	0	0	0	115.2	D136 L143 Q170	D136-Y138 PolarHBondContact OD1-N 3.44Å; Y138-L143 WeakPolarHBondContact O-CD1 3.18Å; Y138-Q170 PolarHBondContact O-NE2 3.22Å
139	D	84.3	Confident	87	Confident	54 Å²	54	49.4 Å²	49.4	29%	0.289	23%	0.23	S	C	.	.			trans	-54	141.6	171.2	170.9	56.4	0	0	0	112.5	D136 K141 H142 L143	D136-D139 PolarHBondContact OD1-N 3.22Å; D136-D139 VanDerWaalsContact OD1-N 3.15Å; D139-K141 VanDerWaalsContact C-N 3.33Å; D139-K141 PolarHBondContact O-N 3.42Å; D139-K141 VanDerWaalsContact OD2-CA 3.28Å; D139-K141 WeakPolarHBondContact OD2-CA 3.44Å; D139-K141 WeakPolarHBondContact OD2-CB 3.23Å; D139-K141 PolarHBondContact OD2-N 3.28Å; D139-H142 HydrophobicContact CB-CB 4.14Å; D139-H142 PolarHBondContact O-N 2.97Å; D139-H142 PolarHBondContact OD2-N 3.39Å; D139-L143 WeakPolarHBondContact O-CB 3.29Å; D139-L143 VanDerWaalsContact O-CG 3.32Å; D139-L143 WeakPolarHBondContact O-CG 3.32Å; D139-L143 PolarHBondContact O-N 3.24Å
140	Q	84.5	Confident	86.9	Confident	54 Å²	54	49.9 Å²	49.9	25%	0.252	23%	0.232	S	C	.	.	H	α-helix	trans	-67.4	-31.4	-176.7	-163	-176.5	36.7	0	0	112.5	L144 V167 A172	Q140-L144 WeakPolarHBondContact O-CB 3.31Å; Q140-L144 PolarHBondContact O-N 2.92Å; Q140-V167 HydrophobicContact CG-CB 4.43Å; Q140-V167 HydrophobicContact CG-CG1 3.81Å; Q140-V167 HydrophobicContact CG-CG2 4.36Å; Q140-V167 PolarHBondContact NE2-O 3.41Å; Q140-A172 PolarHBondContact NE2-O 3.04Å
141	K	83.5	Confident	86.7	Confident	119 Å²	119	48 Å²	48	52%	0.517	22%	0.22	S	C	.	.	H	α-helix	trans	-77.5	-40	177.9	-54.3	171.6	179.3	173.9	0	110.2	D139 L144 G145	D139-K141 VanDerWaalsContact C-N 3.33Å; D139-K141 PolarHBondContact O-N 3.42Å; D139-K141 VanDerWaalsContact OD2-CA 3.28Å; D139-K141 WeakPolarHBondContact OD2-CA 3.44Å; D139-K141 WeakPolarHBondContact OD2-CB 3.23Å; D139-K141 PolarHBondContact OD2-N 3.28Å; K141-L144 PolarHBondContact O-N 3.01Å; K141-G145 PolarHBondContact O-N 3.43Å
142	H	88.1	Confident	86.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-55.5	174.6	-179.5	62.3	0	0	0	112.8	V95 D99 F129 A132 D133 D136 D139 L144 G145 R146	V95-H142 HydrophobicContact CG1-CB 4.06Å; D99-H142 IonicContact OD1-CE1 3.49Å; D99-H142 IonicContact OD1-CG 3.74Å; D99-H142 IonicContact OD1-ND1 3.3Å; D99-H142 PolarHBondContact OD1-ND1 3.36Å; D99-H142 WeakPolarHBondContact OD2-CA 3.21Å; D99-H142 WeakPolarHBondContact OD2-CB 3.33Å; D99-H142 IonicContact OD2-CG 3.93Å; D99-H142 IonicContact OD2-ND1 2.89Å; D99-H142 PolarHBondContact OD2-ND1 2.9Å; F129-H142 AromaticContact CD1-CE1 3.84Å; A132-H142 VanDerWaalsContact CB-CE1 3.49Å; A132-H142 WeakPolarHBondContact CB-CE1 3.42Å; D133-H142 IonicContact OD1-NE2 3.3Å; D133-H142 PolarHBondContact OD1-NE2 3.47Å; D136-H142 PolarHBondContact O-CD2 3.02Å; D139-H142 HydrophobicContact CB-CB 4.14Å; D139-H142 PolarHBondContact O-N 2.97Å; D139-H142 PolarHBondContact OD2-N 3.39Å; H142-L144 PolarHBondContact O-N 3.08Å; H142-G145 PolarHBondContact O-N 2.92Å; H142-R146 WeakPolarHBondContact O-CB 2.98Å; H142-R146 PolarHBondContact O-N 3.4Å
143	L	88.5	Confident	86.1	Confident	4 Å²	4	51.7 Å²	51.7	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-56.4	-36.9	177.4	-69.4	171.8	0	0	0	112.2	M137 Y138 D139 A147 F166 V167	M137-L143 VanDerWaalsContact O-CD2 3.31Å; M137-L143 WeakPolarHBondContact O-CD2 3.39Å; Y138-L143 WeakPolarHBondContact O-CD1 3.18Å; D139-L143 WeakPolarHBondContact O-CB 3.29Å; D139-L143 VanDerWaalsContact O-CG 3.32Å; D139-L143 WeakPolarHBondContact O-CG 3.32Å; D139-L143 PolarHBondContact O-N 3.24Å; L143-A147 WeakPolarHBondContact O-CB 3.41Å; L143-A147 PolarHBondContact O-N 3.43Å; L143-F166 HydrophobicContact CD1-CB 4.23Å; L143-V167 HydrophobicContact CB-CG2 3.46Å; L143-V167 VanDerWaalsContact CB-CG2 3.46Å; L143-V167 HydrophobicContact CD1-CG2 4.33Å
144	L	87.8	Confident	85.6	Confident	16 Å²	16	51.3 Å²	51.3	8%	0.084	24%	0.237	C	C	.	.	H	α-helix	trans	-69.5	-42.7	175.6	-179.1	73.5	0	0	0	112.4	Q140 K141 H142 A147 F148 L164 V167 P176 A177	Q140-L144 WeakPolarHBondContact O-CB 3.31Å; Q140-L144 PolarHBondContact O-N 2.92Å; K141-L144 PolarHBondContact O-N 3.01Å; H142-L144 PolarHBondContact O-N 3.08Å; L144-A147 WeakPolarHBondContact O-CB 3.38Å; L144-A147 PolarHBondContact O-N 3.37Å; L144-F148 HydrophobicContact CD1-CD2 4.23Å; L144-F148 HydrophobicContact CD1-CE2 3.71Å; L144-F148 HydrophobicContact CD2-CE2 4.48Å; L144-F148 HydrophobicContact CG-CD2 4.11Å; L144-F148 HydrophobicContact CG-CE2 3.91Å; L144-F148 VanDerWaalsContact O-CD2 3.28Å; L144-F148 WeakPolarHBondContact O-CD2 3.47Å; L144-F148 PolarHBondContact O-N 3.49Å; L144-F148 VanDerWaalsContact O-N 3.07Å; L144-L164 HydrophobicContact CD1-CD2 3.88Å; L144-V167 HydrophobicContact CB-CG2 4.38Å; L144-P176 HydrophobicContact CD1-CB 3.8Å; L144-P176 HydrophobicContact CD2-CB 3.61Å; L144-P176 HydrophobicContact CD2-CG 4.12Å; L144-P176 HydrophobicContact CG-CB 4.22Å; L144-A177 HydrophobicContact CD1-CB 4.12Å
145	G	86.4	Confident	85.1	Confident	7 Å²	7	49 Å²	49	7%	0.072	24%	0.235	C	C	.	.	H	α-helix	trans	-61.1	-48.3	176.2	0	0	0	0	0	111.6	N103 K141 H142 A147 F148 F149	N103-G145 VanDerWaalsContact ND2-CA 3.34Å; N103-G145 WeakPolarHBondContact ND2-CA 3.42Å; N103-G145 PolarHBondContact OD1-O 3.43Å; K141-G145 PolarHBondContact O-N 3.43Å; H142-G145 PolarHBondContact O-N 2.92Å; G145-A147 VanDerWaalsContact C-N 3.31Å; G145-A147 PolarHBondContact O-N 2.89Å; G145-F148 PolarHBondContact O-N 3.34Å; G145-F148 VanDerWaalsContact O-N 3.15Å; G145-F149 PolarHBondContact O-N 2.97Å
146	R	88.9	Confident	85.1	Confident	48 Å²	48	48 Å²	48	18%	0.181	23%	0.23	C	C	.	.	H	α-helix	trans	-58.5	-40.4	174.3	-169.4	-176.1	-167.3	149.4	18	112.5	F129 D133 H142 F149 F150	F129-R146 HydrophobicContact CD1-CB 4.25Å; F129-R146 HydrophobicContact CE1-CB 4.27Å; D133-R146 IonicContact OD1-CZ 3.93Å; D133-R146 IonicContact OD1-NH1 2.73Å; D133-R146 PolarHBondContact OD1-NH1 3.28Å; D133-R146 IonicContact OD1-NH2 2.83Å; D133-R146 IonicContact OD2-CZ 2.7Å; D133-R146 IonicContact OD2-NH1 2.71Å; D133-R146 PolarHBondContact OD2-NH1 2.95Å; D133-R146 IonicContact OD2-NH2 3.25Å; D133-R146 PolarHBondContact OD2-NH2 2.99Å; H142-R146 WeakPolarHBondContact O-CB 2.98Å; H142-R146 PolarHBondContact O-N 3.4Å; R146-F149 WeakPolarHBondContact O-CB 3.4Å; R146-F149 PolarHBondContact O-N 2.87Å; R146-F150 HydrophobicContact CG-CD2 4.32Å; R146-F150 HydrophobicContact CG-CE2 3.76Å; R146-F150 HydrophobicContact CG-CZ 4.25Å; R146-F150 VanDerWaalsContact O-CD2 3.28Å; R146-F150 WeakPolarHBondContact O-CD2 3.44Å; R146-F150 PolarHBondContact O-N 2.89Å; R146-F150 VanDerWaalsContact O-N 3.11Å
147	A	88.7	Confident	85.2	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.5	-39.5	175.1	0	0	0	0	0	113.2	L143 L144 G145 I151 Q163 L164	L143-A147 WeakPolarHBondContact O-CB 3.41Å; L143-A147 PolarHBondContact O-N 3.43Å; L144-A147 WeakPolarHBondContact O-CB 3.38Å; L144-A147 PolarHBondContact O-N 3.37Å; G145-A147 VanDerWaalsContact C-N 3.31Å; G145-A147 PolarHBondContact O-N 2.89Å; A147-I151 WeakPolarHBondContact O-CG1 3.48Å; A147-I151 PolarHBondContact O-N 3.43Å; A147-Q163 HydrophobicContact CB-CB 4.01Å; A147-L164 HydrophobicContact CB-CD1 4.37Å; A147-L164 HydrophobicContact CB-CD2 3.65Å; A147-L164 HydrophobicContact CB-CG 3.68Å
148	F	88	Confident	85.5	Confident	32 Å²	32	47.9 Å²	47.9	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-70.1	-34.4	174.7	-80.3	-64.9	0	0	0	112.6	L144 G145 I151 Y152 P176	L144-F148 HydrophobicContact CD1-CD2 4.23Å; L144-F148 HydrophobicContact CD1-CE2 3.71Å; L144-F148 HydrophobicContact CD2-CE2 4.48Å; L144-F148 HydrophobicContact CG-CD2 4.11Å; L144-F148 HydrophobicContact CG-CE2 3.91Å; L144-F148 VanDerWaalsContact O-CD2 3.28Å; L144-F148 WeakPolarHBondContact O-CD2 3.47Å; L144-F148 PolarHBondContact O-N 3.49Å; L144-F148 VanDerWaalsContact O-N 3.07Å; G145-F148 PolarHBondContact O-N 3.34Å; G145-F148 VanDerWaalsContact O-N 3.15Å; F148-I151 HydrophobicContact CD1-CD1 4.22Å; F148-I151 WeakPolarHBondContact O-CB 3.43Å; F148-I151 PolarHBondContact O-N 2.93Å; F148-I151 VanDerWaalsContact O-N 3.13Å; F148-Y152 HydrophobicContact CB-CE2 4.21Å; F148-Y152 WeakPolarHBondContact O-CD2 3.29Å; F148-Y152 PolarHBondContact O-N 3.42Å; F148-P176 HydrophobicContact CE2-CB 3.98Å; F148-P176 HydrophobicContact CZ-CB 4.24Å
149	F	88.4	Confident	85.7	Confident	6 Å²	6	45 Å²	45	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-57.8	-49.2	171.4	174.9	-100	0	0	0	112.2	I122 A125 F129 G145 R146 I151 Y152 E153	I122-F149 HydrophobicContact CG2-CZ 4.07Å; A125-F149 HydrophobicContact CB-CD2 4.37Å; A125-F149 HydrophobicContact CB-CE2 3.98Å; F129-F149 HydrophobicContact CD2-CB 4.23Å; F129-F149 HydrophobicContact CD2-CD1 4.14Å; F129-F149 HydrophobicContact CD2-CD2 4.21Å; F129-F149 AromaticContact CD2-CG 3.93Å; F129-F149 HydrophobicContact CD2-CG 3.93Å; F129-F149 HydrophobicContact CE2-CB 3.38Å; F129-F149 HydrophobicContact CE2-CD1 4.07Å; F129-F149 AromaticContact CE2-CD2 3.61Å; F129-F149 HydrophobicContact CE2-CD2 3.61Å; F129-F149 HydrophobicContact CE2-CE2 4.38Å; F129-F149 AromaticContact CE2-CG 3.41Å; F129-F149 HydrophobicContact CE2-CG 3.41Å; F129-F149 VanDerWaalsContact CE2-CG 3.41Å; F129-F149 HydrophobicContact CZ-CB 3.76Å; F129-F149 HydrophobicContact CZ-CG 4.29Å; G145-F149 PolarHBondContact O-N 2.97Å; R146-F149 WeakPolarHBondContact O-CB 3.4Å; R146-F149 PolarHBondContact O-N 2.87Å; F149-I151 PolarHBondContact O-N 3.29Å; F149-Y152 PolarHBondContact O-N 3.32Å; F149-E153 PolarHBondContact O-N 2.9Å
150	F	88.1	Confident	85.9	Confident	16 Å²	16	42.4 Å²	42.4	7%	0.07	21%	0.21	C	C	.	.	H	α-helix	trans	-61.2	-27.9	174.5	-66.6	-48.3	0	0	0	113.5	R146 G154 N156 Q159 A160 Q163	R146-F150 HydrophobicContact CG-CD2 4.32Å; R146-F150 HydrophobicContact CG-CE2 3.76Å; R146-F150 HydrophobicContact CG-CZ 4.25Å; R146-F150 VanDerWaalsContact O-CD2 3.28Å; R146-F150 WeakPolarHBondContact O-CD2 3.44Å; R146-F150 PolarHBondContact O-N 2.89Å; R146-F150 VanDerWaalsContact O-N 3.11Å; F150-G154 PolarHBondContact O-N 3.49Å; F150-G154 VanDerWaalsContact O-N 3.16Å; F150-N156 HydrophobicContact CB-CB 4.3Å; F150-N156 HydrophobicContact CD1-CB 3.76Å; F150-N156 HydrophobicContact CE1-CB 4.34Å; F150-N156 HydrophobicContact CG-CB 4.21Å; F150-Q159 HydrophobicContact CD2-CB 3.93Å; F150-Q159 HydrophobicContact CE1-CB 4.49Å; F150-Q159 HydrophobicContact CE2-CB 3.77Å; F150-Q159 HydrophobicContact CG-CB 4.37Å; F150-Q159 HydrophobicContact CZ-CB 4.06Å; F150-A160 HydrophobicContact CB-CB 3.76Å; F150-Q163 HydrophobicContact CE2-CG 4.2Å
151	I	86	Confident	86.2	Confident	20 Å²	20	41.8 Å²	41.8	10%	0.103	21%	0.209	C	C	.	.	H	α-helix	trans	-74	-34.1	173.3	-70.2	168.7	0	0	0	111.7	A147 F148 F149 W157 A160 L164 I184	A147-I151 WeakPolarHBondContact O-CG1 3.48Å; A147-I151 PolarHBondContact O-N 3.43Å; F148-I151 HydrophobicContact CD1-CD1 4.22Å; F148-I151 WeakPolarHBondContact O-CB 3.43Å; F148-I151 PolarHBondContact O-N 2.93Å; F148-I151 VanDerWaalsContact O-N 3.13Å; F149-I151 PolarHBondContact O-N 3.29Å; I151-W157 HydrophobicContact CB-CZ3 4.39Å; I151-W157 HydrophobicContact CG1-CZ3 4.2Å; I151-W157 HydrophobicContact CG2-CZ3 4.22Å; I151-A160 HydrophobicContact CG1-CB 4Å; I151-L164 HydrophobicContact CD1-CD1 4.42Å; I151-I184 HydrophobicContact CD1-CD1 4.24Å; I151-I184 HydrophobicContact CD1-CG1 4.14Å; I151-I184 HydrophobicContact CG1-CD1 4.48Å; I151-I184 HydrophobicContact CG1-CG1 4.23Å
152	Y	83.5	Confident	86.5	Confident	58 Å²	58	38.3 Å²	38.3	23%	0.227	20%	0.2	C	C	.	.	H	α-helix	trans	-75.3	-34.7	174.9	-67.5	-51.2	0	0	0	112.9	Y110 F148 F149	Y110-Y152 HydrophobicContact CD2-CD1 4.22Å; Y110-Y152 HydrophobicContact CG-CD1 4.01Å; F148-Y152 HydrophobicContact CB-CE2 4.21Å; F148-Y152 WeakPolarHBondContact O-CD2 3.29Å; F148-Y152 PolarHBondContact O-N 3.42Å; F149-Y152 PolarHBondContact O-N 3.32Å
153	E	82.1	Confident	86.5	Confident	48 Å²	48	39.6 Å²	39.6	22%	0.224	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-42.7	172	-176.5	-174.3	-126.8	0	0	111.2	F149 E155 N156	F149-E153 PolarHBondContact O-N 2.9Å; E153-E155 PolarHBondContact O-N 3.41Å; E153-N156 WeakPolarHBondContact OE2-CB 3.32Å; E153-N156 PolarHBondContact OE2-ND2 3.31Å
154	G	77.9	Confident	86.6	Confident	30 Å²	30	39.5 Å²	39.5	31%	0.309	21%	0.205	S	C	.	.	S	Bend	trans	83.8	4.2	169	0	0	0	0	0	115.7	F150 W157	F150-G154 PolarHBondContact O-N 3.49Å; F150-G154 VanDerWaalsContact O-N 3.16Å; G154-W157 VanDerWaalsContact O-CZ2 3.24Å; G154-W157 WeakPolarHBondContact O-CZ2 3.34Å; G154-W157 PolarHBondContact O-NE1 3.24Å
155	E	78.3	Confident	86.7	Confident	156 Å²	156	41.4 Å²	41.4	73%	0.729	22%	0.215	S	C	*	.	S	Bend	trans	-106.7	-49	176	-60.7	-171.3	173.9	0	0	111.6	E153 W157	E153-E155 PolarHBondContact O-N 3.41Å; E155-W157 VanDerWaalsContact O-CD1 3.23Å; E155-W157 PolarHBondContact O-N 3.33Å
156	N	83.5	Confident	86.8	Confident	43 Å²	43	46.2 Å²	46.2	23%	0.23	23%	0.234	C	C	.	.			trans	-81.2	46.3	-169.9	-76.5	-61.6	0	0	0	115.3	F150 E153 S158 Q159 A160	F150-N156 HydrophobicContact CB-CB 4.3Å; F150-N156 HydrophobicContact CD1-CB 3.76Å; F150-N156 HydrophobicContact CE1-CB 4.34Å; F150-N156 HydrophobicContact CG-CB 4.21Å; E153-N156 WeakPolarHBondContact OE2-CB 3.32Å; E153-N156 PolarHBondContact OE2-ND2 3.31Å; N156-S158 PolarHBondContact O-N 2.76Å; N156-S158 VanDerWaalsContact O-N 3.1Å; N156-Q159 HydrophobicContact CB-CB 4.21Å; N156-Q159 HydrophobicContact CB-CG 4.13Å; N156-Q159 PolarHBondContact O-N 3.46Å; N156-Q159 PolarHBondContact OD1-NE2 3.2Å; N156-A160 PolarHBondContact O-N 2.92Å
157	W	86.4	Confident	86.7	Confident	67 Å²	67	43.9 Å²	43.9	25%	0.254	23%	0.226	S	C	.	.	H	α-helix	trans	-56	-28	-179.1	-57.8	105.3	0	0	0	115.1	I151 G154 E155 D161 I184 N187	I151-W157 HydrophobicContact CB-CZ3 4.39Å; I151-W157 HydrophobicContact CG1-CZ3 4.2Å; I151-W157 HydrophobicContact CG2-CZ3 4.22Å; G154-W157 VanDerWaalsContact O-CZ2 3.24Å; G154-W157 WeakPolarHBondContact O-CZ2 3.34Å; G154-W157 PolarHBondContact O-NE1 3.24Å; E155-W157 VanDerWaalsContact O-CD1 3.23Å; E155-W157 PolarHBondContact O-N 3.33Å; W157-D161 PolarHBondContact O-N 3.14Å; W157-I184 HydrophobicContact CE3-CG1 4.12Å; W157-N187 WeakPolarHBondContact CH2-ND2 3.29Å; W157-N187 VanDerWaalsContact CZ3-ND2 3.33Å; W157-N187 WeakPolarHBondContact CZ3-ND2 3.31Å
158	S	88.6	Confident	86.6	Confident	85 Å²	85	45.2 Å²	45.2	59%	0.594	23%	0.232	S	C	*	.	H	α-helix	trans	-74	-41.8	176	49.7	0	0	0	0	112.1	N156 D161 S162	N156-S158 PolarHBondContact O-N 2.76Å; N156-S158 VanDerWaalsContact O-N 3.1Å; S158-D161 PolarHBondContact O-N 3.21Å; S158-S162 PolarHBondContact O-N 2.91Å
159	Q	87.3	Confident	86.6	Confident	81 Å²	81	49.8 Å²	49.8	38%	0.379	26%	0.258	S	S	.	.	H	α-helix	trans	-69.5	-41.9	175.4	-50.3	-166.9	35.6	0	0	110.6	F150 N156 D161 S162 Q163	F150-Q159 HydrophobicContact CD2-CB 3.93Å; F150-Q159 HydrophobicContact CE1-CB 4.49Å; F150-Q159 HydrophobicContact CE2-CB 3.77Å; F150-Q159 HydrophobicContact CG-CB 4.37Å; F150-Q159 HydrophobicContact CZ-CB 4.06Å; N156-Q159 HydrophobicContact CB-CB 4.21Å; N156-Q159 HydrophobicContact CB-CG 4.13Å; N156-Q159 PolarHBondContact O-N 3.46Å; N156-Q159 PolarHBondContact OD1-NE2 3.2Å; Q159-D161 VanDerWaalsContact C-N 3.32Å; Q159-D161 PolarHBondContact O-N 2.94Å; Q159-S162 PolarHBondContact O-N 3.06Å; Q159-S162 PolarHBondContact O-OG 3.13Å; Q159-Q163 WeakPolarHBondContact O-CG 3.35Å; Q159-Q163 PolarHBondContact O-N 3.14Å
160	A	89.3	Confident	86.3	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-54.1	-47.8	173	0	0	0	0	0	111.8	F150 I151 N156 L164 I184	F150-A160 HydrophobicContact CB-CB 3.76Å; I151-A160 HydrophobicContact CG1-CB 4Å; N156-A160 PolarHBondContact O-N 2.92Å; A160-L164 VanDerWaalsContact O-CG 3.26Å; A160-L164 WeakPolarHBondContact O-CG 3.42Å; A160-L164 PolarHBondContact O-N 3.08Å; A160-L164 VanDerWaalsContact O-N 3.15Å; A160-I184 HydrophobicContact CB-CD1 3.7Å; A160-I184 HydrophobicContact CB-CG1 4.46Å
161	D	90.3	Very high	85.5	Confident	41 Å²	41	55.9 Å²	55.9	22%	0.219	30%	0.303	C	S	.	.	H	α-helix	trans	-69.8	-36.1	178.5	-166.5	56.4	0	0	0	112.2	W157 S158 Q159 L164 N165 K181 I184	W157-D161 PolarHBondContact O-N 3.14Å; S158-D161 PolarHBondContact O-N 3.21Å; Q159-D161 VanDerWaalsContact C-N 3.32Å; Q159-D161 PolarHBondContact O-N 2.94Å; D161-L164 CarbonylContact O-C 3.19Å; D161-L164 PolarHBondContact O-N 3.2Å; D161-N165 WeakPolarHBondContact O-CB 3.46Å; D161-N165 PolarHBondContact O-N 3.44Å; D161-N165 PolarHBondContact O-ND2 3.46Å; D161-N165 PolarHBondContact OD2-ND2 2.96Å; D161-K181 VanDerWaalsContact OD1-CE 3.3Å; D161-K181 WeakPolarHBondContact OD1-CE 3.5Å; D161-I184 HydrophobicContact CB-CD1 3.96Å; D161-I184 HydrophobicContact CB-CG2 4.46Å
162	S	90.1	Very high	84.9	Confident	47 Å²	47	56.9 Å²	56.9	33%	0.329	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-44.1	177.5	71.3	0	0	0	0	112.1	S158 Q159 L164 N165 F166	S158-S162 PolarHBondContact O-N 2.91Å; Q159-S162 PolarHBondContact O-N 3.06Å; Q159-S162 PolarHBondContact O-OG 3.13Å; S162-L164 VanDerWaalsContact C-N 3.35Å; S162-L164 PolarHBondContact O-N 3.13Å; S162-N165 WeakPolarHBondContact O-CA 3.34Å; S162-N165 WeakPolarHBondContact O-CB 3.41Å; S162-N165 PolarHBondContact O-N 3.44Å; S162-N165 VanDerWaalsContact O-N 3.08Å; S162-F166 VanDerWaalsContact O-CD2 3.23Å; S162-F166 WeakPolarHBondContact O-CD2 3.38Å; S162-F166 PolarHBondContact O-N 3.38Å
163	Q	88.2	Confident	84.7	Confident	27 Å²	27	58 Å²	58	13%	0.126	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-39.9	174.8	-55.3	-52.2	-0.6	0	0	111.9	A147 F150 Q159 N165 F166 V167	A147-Q163 HydrophobicContact CB-CB 4.01Å; F150-Q163 HydrophobicContact CE2-CG 4.2Å; Q159-Q163 WeakPolarHBondContact O-CG 3.35Å; Q159-Q163 PolarHBondContact O-N 3.14Å; Q163-N165 VanDerWaalsContact C-N 3.28Å; Q163-N165 PolarHBondContact O-N 2.91Å; Q163-F166 PolarHBondContact O-N 3.49Å; Q163-V167 WeakPolarHBondContact O-CG2 3.49Å; Q163-V167 PolarHBondContact O-N 2.89Å
164	L	90.5	Very high	84.8	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-70.5	-20.9	173.9	-64.1	170.9	0	0	0	113.7	L144 A147 I151 A160 D161 S162 L168 A177 K181 I184	L144-L164 HydrophobicContact CD1-CD2 3.88Å; A147-L164 HydrophobicContact CB-CD1 4.37Å; A147-L164 HydrophobicContact CB-CD2 3.65Å; A147-L164 HydrophobicContact CB-CG 3.68Å; I151-L164 HydrophobicContact CD1-CD1 4.42Å; A160-L164 VanDerWaalsContact O-CG 3.26Å; A160-L164 WeakPolarHBondContact O-CG 3.42Å; A160-L164 PolarHBondContact O-N 3.08Å; A160-L164 VanDerWaalsContact O-N 3.15Å; D161-L164 CarbonylContact O-C 3.19Å; D161-L164 PolarHBondContact O-N 3.2Å; S162-L164 VanDerWaalsContact C-N 3.35Å; S162-L164 PolarHBondContact O-N 3.13Å; L164-L168 WeakPolarHBondContact O-CB 3.4Å; L164-L168 WeakPolarHBondContact O-CD1 3.3Å; L164-L168 WeakPolarHBondContact O-CG 3.33Å; L164-L168 PolarHBondContact O-N 2.88Å; L164-A177 HydrophobicContact CD2-CB 3.92Å; L164-K181 HydrophobicContact CB-CD 4.41Å; L164-K181 HydrophobicContact CB-CG 3.92Å; L164-K181 HydrophobicContact CD1-CG 3.96Å; L164-K181 WeakPolarHBondContact O-CE 3.45Å; L164-I184 HydrophobicContact CD1-CD1 3.7Å
165	N	89.7	Confident	85.3	Confident	57 Å²	57	56.3 Å²	56.3	31%	0.305	32%	0.317	S	S	.	.	H	α-helix	trans	-71.9	-46.3	167.9	-77.9	-63	0	0	0	110.1	D161 S162 Q163 L168 N169 K181	D161-N165 WeakPolarHBondContact O-CB 3.46Å; D161-N165 PolarHBondContact O-N 3.44Å; D161-N165 PolarHBondContact O-ND2 3.46Å; D161-N165 PolarHBondContact OD2-ND2 2.96Å; S162-N165 WeakPolarHBondContact O-CA 3.34Å; S162-N165 WeakPolarHBondContact O-CB 3.41Å; S162-N165 PolarHBondContact O-N 3.44Å; S162-N165 VanDerWaalsContact O-N 3.08Å; Q163-N165 VanDerWaalsContact C-N 3.28Å; Q163-N165 PolarHBondContact O-N 2.91Å; N165-L168 PolarHBondContact O-N 2.98Å; N165-N169 VanDerWaalsContact O-CB 3.32Å; N165-N169 WeakPolarHBondContact O-CB 3.28Å; N165-N169 PolarHBondContact O-N 2.98Å; N165-N169 PolarHBondContact O-ND2 2.97Å; N165-N169 PolarHBondContact O-OD1 3.09Å; N165-K181 VanDerWaalsContact CG-NZ 3.3Å; N165-K181 PolarHBondContact OD1-NZ 3.13Å
166	F	88	Confident	85.7	Confident	107 Å²	107	49.6 Å²	49.6	47%	0.469	29%	0.287	S	S	.	.	H	α-helix	trans	-57.9	-50.8	174.9	-76.2	-69.8	0	0	0	112.6	L143 S162 Q163 L168 N169 Q170	L143-F166 HydrophobicContact CD1-CB 4.23Å; S162-F166 VanDerWaalsContact O-CD2 3.23Å; S162-F166 WeakPolarHBondContact O-CD2 3.38Å; S162-F166 PolarHBondContact O-N 3.38Å; Q163-F166 PolarHBondContact O-N 3.49Å; F166-L168 PolarHBondContact O-N 3.38Å; F166-L168 VanDerWaalsContact O-N 3.13Å; F166-N169 PolarHBondContact O-N 3.42Å; F166-Q170 WeakPolarHBondContact O-CG 3.32Å; F166-Q170 PolarHBondContact O-N 3.15Å
167	V	87.4	Confident	86	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.2	-31.8	178	166.2	0	0	0	0	113.4	Q140 L143 L144 Q163 A177	Q140-V167 HydrophobicContact CG-CB 4.43Å; Q140-V167 HydrophobicContact CG-CG1 3.81Å; Q140-V167 HydrophobicContact CG-CG2 4.36Å; Q140-V167 PolarHBondContact NE2-O 3.41Å; L143-V167 HydrophobicContact CB-CG2 3.46Å; L143-V167 VanDerWaalsContact CB-CG2 3.46Å; L143-V167 HydrophobicContact CD1-CG2 4.33Å; L144-V167 HydrophobicContact CB-CG2 4.38Å; Q163-V167 WeakPolarHBondContact O-CG2 3.49Å; Q163-V167 PolarHBondContact O-N 2.89Å; V167-A177 HydrophobicContact CG1-CB 3.68Å
168	L	87.2	Confident	86.3	Confident	27 Å²	27	46.3 Å²	46.3	14%	0.141	27%	0.272	C	S	.	.	H	α-helix	trans	-91.5	-23.7	178.3	-72.2	170.7	0	0	0	113.2	L164 N165 F166 G171 A177 Y178 K181	L164-L168 WeakPolarHBondContact O-CB 3.4Å; L164-L168 WeakPolarHBondContact O-CD1 3.3Å; L164-L168 WeakPolarHBondContact O-CG 3.33Å; L164-L168 PolarHBondContact O-N 2.88Å; N165-L168 PolarHBondContact O-N 2.98Å; F166-L168 PolarHBondContact O-N 3.38Å; F166-L168 VanDerWaalsContact O-N 3.13Å; L168-G171 PolarHBondContact O-N 3Å; L168-A177 HydrophobicContact CD1-CB 4.21Å; L168-A177 HydrophobicContact CD2-CB 4.03Å; L168-A177 HydrophobicContact CG-CB 3.92Å; L168-Y178 HydrophobicContact CD1-CD1 4.25Å; L168-Y178 HydrophobicContact CD1-CE1 3.99Å; L168-Y178 HydrophobicContact CD2-CD2 4.19Å; L168-Y178 HydrophobicContact CD2-CE1 4.27Å; L168-Y178 HydrophobicContact CD2-CE2 3.7Å; L168-K181 HydrophobicContact CD1-CD 3.85Å
169	N	86.8	Confident	86.4	Confident	128 Å²	128	43.1 Å²	43.1	68%	0.684	25%	0.248	S	C	*	.	H	α-helix	trans	-77.2	-22	174.7	-70.7	-10.1	0	0	0	112.4	N165 F166 G171	N165-N169 VanDerWaalsContact O-CB 3.32Å; N165-N169 WeakPolarHBondContact O-CB 3.28Å; N165-N169 PolarHBondContact O-N 2.98Å; N165-N169 PolarHBondContact O-ND2 2.97Å; N165-N169 PolarHBondContact O-OD1 3.09Å; F166-N169 PolarHBondContact O-N 3.42Å; N169-G171 PolarHBondContact O-N 3Å; N169-G171 VanDerWaalsContact O-N 3.08Å
170	Q	83	Confident	86.5	Confident	89 Å²	89	39.2 Å²	39.2	42%	0.416	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-0.4	168.6	-73.3	171.5	-25.1	0	0	113.9	Y138 F166 A172	Y138-Q170 PolarHBondContact O-NE2 3.22Å; F166-Q170 WeakPolarHBondContact O-CG 3.32Å; F166-Q170 PolarHBondContact O-N 3.15Å; Q170-A172 VanDerWaalsContact C-N 3.27Å; Q170-A172 PolarHBondContact O-N 3.43Å; Q170-A172 VanDerWaalsContact O-N 3.16Å
171	G	71.5	Confident	86.6	Confident	61 Å²	61	40 Å²	40	63%	0.629	23%	0.233	S	C	*	.	S	Bend	trans	85.2	-26	170.8	0	0	0	0	0	115.5	L168 N169 P173	L168-G171 PolarHBondContact O-N 3Å; N169-G171 PolarHBondContact O-N 3Å; N169-G171 VanDerWaalsContact O-N 3.08Å; G171-P173 WeakPolarHBondContact O-CD 3.28Å
172	A	72.5	Confident	86.7	Confident	41 Å²	41	38 Å²	38	34%	0.339	22%	0.222	S	C	.	.			trans	-75.9	120	177.5	0	0	0	0	0	112.1	Q140 Q170 S174	Q140-A172 PolarHBondContact NE2-O 3.04Å; Q170-A172 VanDerWaalsContact C-N 3.27Å; Q170-A172 PolarHBondContact O-N 3.43Å; Q170-A172 VanDerWaalsContact O-N 3.16Å; A172-S174 PolarHBondContact O-N 3.02Å
173	P	80.3	Confident	86.7	Confident	83 Å²	83	37.7 Å²	37.7	54%	0.539	22%	0.219	S	C	.	.			trans	-77.7	87.5	-171.9	31.3	-36.1	0	0	0	113.2	G171 V175 L204	G171-P173 WeakPolarHBondContact O-CD 3.28Å; P173-V175 PolarHBondContact O-N 3.41Å; P173-L204 HydrophobicContact CB-CD1 3.99Å; P173-L204 HydrophobicContact CB-CD2 3.84Å; P173-L204 HydrophobicContact CG-CD2 4.18Å
174	S	84.4	Confident	86.8	Confident	17 Å²	17	36.5 Å²	36.5	12%	0.119	21%	0.214	C	C	.	.			trans	-76.9	116.7	-179.3	175.3	0	0	0	0	113.8	A172 P176 A177 Y178	A172-S174 PolarHBondContact O-N 3.02Å; S174-P176 WeakPolarHBondContact OG-CD 3.25Å; S174-A177 PolarHBondContact O-N 2.96Å; S174-A177 PolarHBondContact OG-N 3.3Å; S174-Y178 VanDerWaalsContact O-CD2 3.24Å; S174-Y178 WeakPolarHBondContact O-CD2 3.49Å; S174-Y178 PolarHBondContact O-N 3.1Å
175	V	88.2	Confident	86.9	Confident	24 Å²	24	36.7 Å²	36.7	15%	0.145	22%	0.215	C	C	.	.	H	α-helix	trans	-59.2	-48.9	171.3	165.8	0	0	0	0	112.1	P173 A177 Y178 L179 A201 L204 Q205	P173-V175 PolarHBondContact O-N 3.41Å; V175-A177 VanDerWaalsContact C-N 3.28Å; V175-A177 PolarHBondContact O-N 3.4Å; V175-Y178 PolarHBondContact O-N 3.47Å; V175-L179 HydrophobicContact CG1-CD1 3.92Å; V175-L179 WeakPolarHBondContact O-CG 3.46Å; V175-L179 PolarHBondContact O-N 3.47Å; V175-L179 VanDerWaalsContact O-N 3.09Å; V175-A201 HydrophobicContact CG1-CB 4.31Å; V175-L204 HydrophobicContact CG2-CB 3.52Å; V175-L204 HydrophobicContact CG2-CD1 4.02Å; V175-L204 HydrophobicContact CG2-CG 4.44Å; V175-Q205 HydrophobicContact CG2-CB 4.04Å
176	P	86.9	Confident	87	Confident	16 Å²	16	36.4 Å²	36.4	10%	0.104	21%	0.212	C	C	.	.	H	α-helix	trans	-51	-43	171.3	-30.2	35.5	0	0	0	114	I3 L144 F148 S174 Y178 L179 G180	I3-P176 HydrophobicContact CB-CG 4.31Å; I3-P176 HydrophobicContact CG2-CG 3.92Å; L144-P176 HydrophobicContact CD1-CB 3.8Å; L144-P176 HydrophobicContact CD2-CB 3.61Å; L144-P176 HydrophobicContact CD2-CG 4.12Å; L144-P176 HydrophobicContact CG-CB 4.22Å; F148-P176 HydrophobicContact CE2-CB 3.98Å; F148-P176 HydrophobicContact CZ-CB 4.24Å; S174-P176 WeakPolarHBondContact OG-CD 3.25Å; P176-Y178 PolarHBondContact O-N 3Å; P176-L179 PolarHBondContact O-N 2.63Å; P176-L179 VanDerWaalsContact O-N 3.12Å; P176-G180 PolarHBondContact O-N 2.88Å
177	A	89.7	Confident	86.9	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-39.6	-178.8	0	0	0	0	0	112.7	L144 L164 V167 L168 S174 V175 L179 G180 K181	L144-A177 HydrophobicContact CD1-CB 4.12Å; L164-A177 HydrophobicContact CD2-CB 3.92Å; V167-A177 HydrophobicContact CG1-CB 3.68Å; L168-A177 HydrophobicContact CD1-CB 4.21Å; L168-A177 HydrophobicContact CD2-CB 4.03Å; L168-A177 HydrophobicContact CG-CB 3.92Å; S174-A177 PolarHBondContact O-N 2.96Å; S174-A177 PolarHBondContact OG-N 3.3Å; V175-A177 VanDerWaalsContact C-N 3.28Å; V175-A177 PolarHBondContact O-N 3.4Å; A177-L179 VanDerWaalsContact C-N 3.31Å; A177-L179 PolarHBondContact O-N 2.94Å; A177-G180 PolarHBondContact O-N 2.69Å; A177-K181 PolarHBondContact O-N 3.31Å
178	Y	91.8	Very high	86.9	Confident	41 Å²	41	39.5 Å²	39.5	16%	0.161	23%	0.228	C	C	.	.	H	α-helix	trans	-64.8	-34	172.3	-76.7	-61.1	0	0	0	112.9	L168 S174 V175 P176 A182 F197 K200 L204	L168-Y178 HydrophobicContact CD1-CD1 4.25Å; L168-Y178 HydrophobicContact CD1-CE1 3.99Å; L168-Y178 HydrophobicContact CD2-CD2 4.19Å; L168-Y178 HydrophobicContact CD2-CE1 4.27Å; L168-Y178 HydrophobicContact CD2-CE2 3.7Å; S174-Y178 VanDerWaalsContact O-CD2 3.24Å; S174-Y178 WeakPolarHBondContact O-CD2 3.49Å; S174-Y178 PolarHBondContact O-N 3.1Å; V175-Y178 PolarHBondContact O-N 3.47Å; P176-Y178 PolarHBondContact O-N 3Å; Y178-A182 WeakPolarHBondContact O-CB 3.5Å; Y178-A182 PolarHBondContact O-N 2.78Å; Y178-F197 AromaticContact CD1-CD1 3.96Å; Y178-F197 HydrophobicContact CD1-CD1 3.96Å; Y178-F197 HydrophobicContact CE1-CD1 4.39Å; Y178-F197 WeakPolarHBondContact O-CB 3.39Å; Y178-K200 HydrophobicContact CD1-CB 3.89Å; Y178-K200 HydrophobicContact CD1-CD 3.88Å; Y178-K200 HydrophobicContact CD2-CB 4.31Å; Y178-K200 HydrophobicContact CE1-CB 4.03Å; Y178-K200 HydrophobicContact CE1-CD 3.34Å; Y178-K200 HydrophobicContact CE1-CG 4.32Å; Y178-K200 HydrophobicContact CE2-CB 4.44Å; Y178-K200 HydrophobicContact CG-CB 4.04Å; Y178-L204 HydrophobicContact CD2-CD1 3.66Å; Y178-L204 HydrophobicContact CE2-CD1 3.66Å
179	L	91.1	Very high	87	Confident	17 Å²	17	45.6 Å²	45.6	9%	0.089	25%	0.254	C	S	.	.	H	α-helix	trans	-73.5	-37	177	-65.1	172.2	0	0	0	112.2	I3 V175 P176 A177 A182 C183 Y198 A201 V212	I3-L179 HydrophobicContact CD1-CD1 3.78Å; I3-L179 HydrophobicContact CG2-CD1 4.47Å; V175-L179 HydrophobicContact CG1-CD1 3.92Å; V175-L179 WeakPolarHBondContact O-CG 3.46Å; V175-L179 PolarHBondContact O-N 3.47Å; V175-L179 VanDerWaalsContact O-N 3.09Å; P176-L179 PolarHBondContact O-N 2.63Å; P176-L179 VanDerWaalsContact O-N 3.12Å; A177-L179 VanDerWaalsContact C-N 3.31Å; A177-L179 PolarHBondContact O-N 2.94Å; L179-A182 PolarHBondContact O-N 2.81Å; L179-C183 PolarHBondContact O-N 3.15Å; L179-Y198 HydrophobicContact CD2-CD1 3.69Å; L179-Y198 HydrophobicContact CD2-CE1 3.93Å; L179-A201 HydrophobicContact CD2-CB 3.69Å; L179-A201 HydrophobicContact CG-CB 3.95Å; L179-V212 HydrophobicContact CD1-CG2 3.81Å; L179-V212 HydrophobicContact CD2-CB 4.34Å; L179-V212 HydrophobicContact CD2-CG1 3.79Å; L179-V212 HydrophobicContact CD2-CG2 3.76Å; L179-V212 HydrophobicContact CG-CG2 4.47Å
180	G	89.4	Confident	87.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.8	-51.3	168.8	0	0	0	0	0	111.6	P176 A177 A182 C183 I184	P176-G180 PolarHBondContact O-N 2.88Å; A177-G180 PolarHBondContact O-N 2.69Å; G180-A182 VanDerWaalsContact C-N 3.3Å; G180-A182 PolarHBondContact O-N 3.09Å; G180-C183 WeakPolarHBondContact O-CB 3.43Å; G180-C183 PolarHBondContact O-N 2.89Å; G180-C183 VanDerWaalsContact O-N 3.09Å; G180-I184 WeakPolarHBondContact O-CG1 3.49Å; G180-I184 PolarHBondContact O-N 3.33Å
181	K	91.8	Very high	87.8	Confident	16 Å²	16	41.4 Å²	41.4	7%	0.07	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-34.9	176.3	-73.8	-166.9	169.2	179.4	0	113.4	D161 L164 N165 L168 A177 C183 I184 A185 F197	D161-K181 VanDerWaalsContact OD1-CE 3.3Å; D161-K181 WeakPolarHBondContact OD1-CE 3.5Å; L164-K181 HydrophobicContact CB-CD 4.41Å; L164-K181 HydrophobicContact CB-CG 3.92Å; L164-K181 HydrophobicContact CD1-CG 3.96Å; L164-K181 WeakPolarHBondContact O-CE 3.45Å; N165-K181 VanDerWaalsContact CG-NZ 3.3Å; N165-K181 PolarHBondContact OD1-NZ 3.13Å; L168-K181 HydrophobicContact CD1-CD 3.85Å; A177-K181 PolarHBondContact O-N 3.31Å; K181-C183 VanDerWaalsContact C-N 3.34Å; K181-I184 PolarHBondContact O-N 2.86Å; K181-A185 VanDerWaalsContact O-CB 3.24Å; K181-A185 WeakPolarHBondContact O-CB 3.33Å; K181-A185 PolarHBondContact O-N 3.28Å; K181-F197 HydrophobicContact CB-CD1 4.23Å; K181-F197 HydrophobicContact CB-CD2 3.91Å; K181-F197 HydrophobicContact CB-CE1 4.37Å; K181-F197 HydrophobicContact CB-CE2 4.07Å; K181-F197 HydrophobicContact CB-CG 4Å; K181-F197 HydrophobicContact CB-CZ 4.3Å; K181-F197 HydrophobicContact CD-CE1 4.18Å; K181-F197 HydrophobicContact CD-CZ 4.27Å
182	A	92.4	Very high	88.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-39.3	174.4	0	0	0	0	0	112.2	Y178 L179 G180 F186 A194 F197 Y198	Y178-A182 WeakPolarHBondContact O-CB 3.5Å; Y178-A182 PolarHBondContact O-N 2.78Å; L179-A182 PolarHBondContact O-N 2.81Å; G180-A182 VanDerWaalsContact C-N 3.3Å; G180-A182 PolarHBondContact O-N 3.09Å; A182-F186 WeakPolarHBondContact O-CB 3.49Å; A182-F186 PolarHBondContact O-N 2.89Å; A182-A194 WeakPolarHBondContact O-CB 3.47Å; A182-F197 HydrophobicContact CB-CB 3.79Å; A182-Y198 HydrophobicContact CB-CD1 3.68Å; A182-Y198 HydrophobicContact CB-CD2 3.9Å; A182-Y198 HydrophobicContact CB-CE1 3.52Å; A182-Y198 HydrophobicContact CB-CE2 3.75Å; A182-Y198 HydrophobicContact CB-CG 3.85Å
183	C	89.8	Confident	89.9	Confident	39 Å²	39	50.3 Å²	50.3	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-65.7	-49.1	174.4	-176.4	0	0	0	0	112	L179 G180 K181 A185 F186 N187	L179-C183 PolarHBondContact O-N 3.15Å; G180-C183 WeakPolarHBondContact O-CB 3.43Å; G180-C183 PolarHBondContact O-N 2.89Å; G180-C183 VanDerWaalsContact O-N 3.09Å; K181-C183 VanDerWaalsContact C-N 3.34Å; C183-A185 PolarHBondContact O-N 3.45Å; C183-F186 WeakPolarHBondContact O-CB 3.48Å; C183-F186 PolarHBondContact O-N 2.82Å; C183-F186 VanDerWaalsContact O-N 3.14Å; C183-N187 PolarHBondContact O-N 3.29Å
184	I	90.8	Very high	90.6	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.015	22%	0.215	C	C	.	.	H	α-helix	trans	-58.8	-46.9	177.7	-60.4	170.1	0	0	0	110.6	I151 W157 A160 D161 L164 G180 K181 F186 N187 K188	I151-I184 HydrophobicContact CD1-CD1 4.24Å; I151-I184 HydrophobicContact CD1-CG1 4.14Å; I151-I184 HydrophobicContact CG1-CD1 4.48Å; I151-I184 HydrophobicContact CG1-CG1 4.23Å; W157-I184 HydrophobicContact CE3-CG1 4.12Å; A160-I184 HydrophobicContact CB-CD1 3.7Å; A160-I184 HydrophobicContact CB-CG1 4.46Å; D161-I184 HydrophobicContact CB-CD1 3.96Å; D161-I184 HydrophobicContact CB-CG2 4.46Å; L164-I184 HydrophobicContact CD1-CD1 3.7Å; G180-I184 WeakPolarHBondContact O-CG1 3.49Å; G180-I184 PolarHBondContact O-N 3.33Å; K181-I184 PolarHBondContact O-N 2.86Å; I184-F186 VanDerWaalsContact C-N 3.32Å; I184-F186 PolarHBondContact O-N 3.24Å; I184-N187 PolarHBondContact O-N 3.01Å; I184-K188 HydrophobicContact CG2-CD 4.08Å; I184-K188 WeakPolarHBondContact O-CG 3.43Å; I184-K188 PolarHBondContact O-N 2.99Å
185	A	92.5	Very high	91	Very high	4 Å²	4	46 Å²	46	3%	0.033	21%	0.212	C	C	.	.	H	α-helix	trans	-63.3	-36	177.2	0	0	0	0	0	112.5	K181 C183 K189 E190 N193 A194 F197	K181-A185 VanDerWaalsContact O-CB 3.24Å; K181-A185 WeakPolarHBondContact O-CB 3.33Å; K181-A185 PolarHBondContact O-N 3.28Å; C183-A185 PolarHBondContact O-N 3.45Å; A185-K189 PolarHBondContact O-N 3.35Å; A185-E190 HydrophobicContact CB-CB 4.28Å; A185-E190 WeakPolarHBondContact O-CA 3.5Å; A185-E190 WeakPolarHBondContact O-CB 3.44Å; A185-E190 PolarHBondContact O-N 2.85Å; A185-N193 HydrophobicContact CB-CB 4.27Å; A185-A194 HydrophobicContact CB-CB 3.97Å; A185-F197 HydrophobicContact CB-CD2 4.15Å; A185-F197 HydrophobicContact CB-CE2 4.17Å
186	F	91.2	Very high	91.3	Very high	52 Å²	52	46.3 Å²	46.3	23%	0.228	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-44.4	174.9	-174.4	-94.7	0	0	0	111.8	A182 C183 I184 K189 Y191 A194 H218 R222	A182-F186 WeakPolarHBondContact O-CB 3.49Å; A182-F186 PolarHBondContact O-N 2.89Å; C183-F186 WeakPolarHBondContact O-CB 3.48Å; C183-F186 PolarHBondContact O-N 2.82Å; C183-F186 VanDerWaalsContact O-N 3.14Å; I184-F186 VanDerWaalsContact C-N 3.32Å; I184-F186 PolarHBondContact O-N 3.24Å; F186-K189 WeakPolarHBondContact O-CA 3.05Å; F186-K189 PolarHBondContact O-N 3.31Å; F186-Y191 AromaticContact CD2-CD1 3.69Å; F186-Y191 HydrophobicContact CD2-CD1 3.69Å; F186-Y191 HydrophobicContact CD2-CE1 4.01Å; F186-Y191 AromaticContact CE2-CD1 3.84Å; F186-Y191 HydrophobicContact CE2-CD1 3.84Å; F186-Y191 AromaticContact CE2-CE1 3.93Å; F186-Y191 HydrophobicContact CE2-CE1 3.93Å; F186-Y191 HydrophobicContact CG-CD1 4.46Å; F186-Y191 HydrophobicContact CZ-CE1 4.39Å; F186-A194 HydrophobicContact CB-CB 4.26Å; F186-H218 HydrophobicContact CE2-CB 4.01Å; F186-H218 HydrophobicContact CZ-CB 4.1Å; F186-R222 HydrophobicContact CE2-CG 4.25Å; F186-R222 HydrophobicContact CZ-CG 4.36Å
187	N	85.5	Confident	91.6	Very high	76 Å²	76	47.9 Å²	47.9	41%	0.406	23%	0.225	S	C	.	.	H	α-helix	trans	-69	-34.7	179.5	-66.7	-9	0	0	0	112.1	W157 C183 I184 K189	W157-N187 WeakPolarHBondContact CH2-ND2 3.29Å; W157-N187 VanDerWaalsContact CZ3-ND2 3.33Å; W157-N187 WeakPolarHBondContact CZ3-ND2 3.31Å; C183-N187 PolarHBondContact O-N 3.29Å; I184-N187 PolarHBondContact O-N 3.01Å; N187-K189 PolarHBondContact O-N 3.36Å; N187-K189 VanDerWaalsContact O-N 3.14Å
188	K	88.4	Confident	91.7	Very high	95 Å²	95	49.1 Å²	49.1	41%	0.413	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	1.7	167.8	-69	178.2	-178.8	175.8	0	114.1	I184 E190	I184-K188 HydrophobicContact CG2-CD 4.08Å; I184-K188 WeakPolarHBondContact O-CG 3.43Å; I184-K188 PolarHBondContact O-N 2.99Å; K188-E190 HydrophobicContact CB-CG 4.01Å; K188-E190 WeakPolarHBondContact CD-OE1 3.39Å; K188-E190 PolarHBondContact O-N 3.4Å
189	K	88.6	Confident	91.8	Very high	155 Å²	155	53.6 Å²	53.6	67%	0.674	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.1	13.2	-175.8	-51.1	173.8	-175.1	172	0	114.3	A185 F186 N187 Y191	A185-K189 PolarHBondContact O-N 3.35Å; F186-K189 WeakPolarHBondContact O-CA 3.05Å; F186-K189 PolarHBondContact O-N 3.31Å; N187-K189 PolarHBondContact O-N 3.36Å; N187-K189 VanDerWaalsContact O-N 3.14Å; K189-Y191 HydrophobicContact CB-CE2 4.24Å; K189-Y191 WeakPolarHBondContact O-CD2 3.44Å; K189-Y191 WeakPolarHBondContact O-CE2 3.41Å; K189-Y191 PolarHBondContact O-N 3.4Å
190	E	92.9	Very high	91.8	Very high	78 Å²	78	57.3 Å²	57.3	36%	0.364	26%	0.262	S	S	.	.			trans	-81.9	54.2	178.6	-58.7	176	-145.7	0	0	111.9	A185 K188 R192 N193 A194	A185-E190 HydrophobicContact CB-CB 4.28Å; A185-E190 WeakPolarHBondContact O-CA 3.5Å; A185-E190 WeakPolarHBondContact O-CB 3.44Å; A185-E190 PolarHBondContact O-N 2.85Å; K188-E190 HydrophobicContact CB-CG 4.01Å; K188-E190 WeakPolarHBondContact CD-OE1 3.39Å; K188-E190 PolarHBondContact O-N 3.4Å; E190-R192 PolarHBondContact O-N 3.36Å; E190-N193 HydrophobicContact CB-CB 4.05Å; E190-N193 WeakPolarHBondContact O-CA 3.25Å; E190-N193 PolarHBondContact O-N 3.34Å; E190-N193 PolarHBondContact OE2-ND2 3.3Å; E190-A194 PolarHBondContact O-N 3.39Å
191	Y	94.4	Very high	91.8	Very high	52 Å²	52	57.3 Å²	57.3	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-56.3	-26	-170.2	-46.9	-60.5	0	0	0	114.6	F186 K189 L195 R222 L223	F186-Y191 AromaticContact CD2-CD1 3.69Å; F186-Y191 HydrophobicContact CD2-CD1 3.69Å; F186-Y191 HydrophobicContact CD2-CE1 4.01Å; F186-Y191 AromaticContact CE2-CD1 3.84Å; F186-Y191 HydrophobicContact CE2-CD1 3.84Å; F186-Y191 AromaticContact CE2-CE1 3.93Å; F186-Y191 HydrophobicContact CE2-CE1 3.93Å; F186-Y191 HydrophobicContact CG-CD1 4.46Å; F186-Y191 HydrophobicContact CZ-CE1 4.39Å; K189-Y191 HydrophobicContact CB-CE2 4.24Å; K189-Y191 WeakPolarHBondContact O-CD2 3.44Å; K189-Y191 WeakPolarHBondContact O-CE2 3.41Å; K189-Y191 PolarHBondContact O-N 3.4Å; Y191-L195 WeakPolarHBondContact O-CG 3.48Å; Y191-L195 PolarHBondContact O-N 3.27Å; Y191-L195 VanDerWaalsContact O-N 3.09Å; Y191-R222 HydrophobicContact CD1-CB 3.87Å; Y191-R222 HydrophobicContact CD1-CG 4.23Å; Y191-R222 HydrophobicContact CD2-CB 3.76Å; Y191-R222 HydrophobicContact CE1-CB 3.85Å; Y191-R222 HydrophobicContact CE1-CG 3.85Å; Y191-R222 HydrophobicContact CE2-CB 3.75Å; Y191-R222 HydrophobicContact CE2-CG 4.41Å; Y191-R222 HydrophobicContact CG-CB 3.82Å; Y191-L223 HydrophobicContact CD2-CD2 4.5Å
192	R	94.7	Very high	91.6	Very high	202 Å²	202	58.2 Å²	58.2	76%	0.762	27%	0.267	S	S	*	.	H	α-helix	trans	-69.1	-42.2	173.3	-66.1	-175.4	179.9	-179.3	0.8	112.2	E190 G196 L223	E190-R192 PolarHBondContact O-N 3.36Å; R192-G196 PolarHBondContact O-N 2.82Å; R192-G196 VanDerWaalsContact O-N 3.08Å; R192-L223 HydrophobicContact CG-CD1 4.25Å; R192-L223 HydrophobicContact CG-CD2 4Å
193	N	93.4	Very high	91.5	Very high	86 Å²	86	68.2 Å²	68.2	46%	0.46	31%	0.305	S	S	.	.	H	α-helix	trans	-71.6	-40.9	178.1	-65.4	-10.6	0	0	0	110.2	A185 E190 L195 G196 F197	A185-N193 HydrophobicContact CB-CB 4.27Å; E190-N193 HydrophobicContact CB-CB 4.05Å; E190-N193 WeakPolarHBondContact O-CA 3.25Å; E190-N193 PolarHBondContact O-N 3.34Å; E190-N193 PolarHBondContact OE2-ND2 3.3Å; N193-L195 PolarHBondContact O-N 3.1Å; N193-G196 CarbonylContact O-C 3.55Å; N193-G196 WeakPolarHBondContact O-CA 3.5Å; N193-G196 PolarHBondContact O-N 3.4Å; N193-F197 HydrophobicContact CB-CE2 4.29Å; N193-F197 WeakPolarHBondContact O-CD2 3.32Å; N193-F197 PolarHBondContact O-N 2.87Å
194	A	94.5	Very high	91.4	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-55.4	-47.8	171.8	0	0	0	0	0	112.3	A182 A185 F186 E190 G196 F197 Y198	A182-A194 WeakPolarHBondContact O-CB 3.47Å; A185-A194 HydrophobicContact CB-CB 3.97Å; F186-A194 HydrophobicContact CB-CB 4.26Å; E190-A194 PolarHBondContact O-N 3.39Å; A194-G196 VanDerWaalsContact C-N 3.28Å; A194-G196 PolarHBondContact O-N 2.93Å; A194-F197 PolarHBondContact O-N 3.12Å; A194-Y198 HydrophobicContact CB-CE2 4.39Å; A194-Y198 WeakPolarHBondContact O-CD2 3.37Å; A194-Y198 PolarHBondContact O-N 3.44Å
195	L	93.6	Very high	91.2	Very high	11 Å²	11	73.2 Å²	73.2	6%	0.058	33%	0.326	C	S	.	.	H	α-helix	trans	-59.7	-36.8	171.6	-79.9	177.6	0	0	0	113	Y191 N193 R199 M216 C219 F220 L223	Y191-L195 WeakPolarHBondContact O-CG 3.48Å; Y191-L195 PolarHBondContact O-N 3.27Å; Y191-L195 VanDerWaalsContact O-N 3.09Å; N193-L195 PolarHBondContact O-N 3.1Å; L195-R199 VanDerWaalsContact O-CB 3.28Å; L195-R199 WeakPolarHBondContact O-CB 3.39Å; L195-R199 WeakPolarHBondContact O-CD 3.36Å; L195-R199 WeakPolarHBondContact O-CG 3.4Å; L195-R199 PolarHBondContact O-N 2.91Å; L195-M216 HydrophobicContact CD2-CB 4.02Å; L195-M216 HydrophobicContact CD2-CE 4.16Å; L195-M216 HydrophobicContact CD2-CG 4.05Å; L195-C219 HydrophobicContact CD1-CB 4.23Å; L195-C219 HydrophobicContact CD2-CB 3.65Å; L195-C219 HydrophobicContact CG-CB 3.56Å; L195-F220 HydrophobicContact CD1-CD1 3.77Å; L195-F220 HydrophobicContact CD1-CE1 3.61Å; L195-F220 HydrophobicContact CD1-CZ 4.29Å; L195-F220 HydrophobicContact CD2-CD1 4.38Å; L195-F220 HydrophobicContact CD2-CD2 4.41Å; L195-F220 HydrophobicContact CD2-CE1 4.11Å; L195-F220 HydrophobicContact CD2-CE2 4.15Å; L195-F220 HydrophobicContact CD2-CZ 3.99Å; L195-L223 HydrophobicContact CD1-CD1 3.55Å
196	G	93.2	Very high	90.8	Very high	30 Å²	30	76.6 Å²	76.6	31%	0.309	35%	0.348	S	S	.	.	H	α-helix	trans	-58.8	-46.6	173.8	0	0	0	0	0	112.1	R192 N193 A194 R199 K200	R192-G196 PolarHBondContact O-N 2.82Å; R192-G196 VanDerWaalsContact O-N 3.08Å; N193-G196 CarbonylContact O-C 3.55Å; N193-G196 WeakPolarHBondContact O-CA 3.5Å; N193-G196 PolarHBondContact O-N 3.4Å; A194-G196 VanDerWaalsContact C-N 3.28Å; A194-G196 PolarHBondContact O-N 2.93Å; G196-R199 PolarHBondContact O-N 3.45Å; G196-K200 WeakPolarHBondContact O-CG 3.41Å; G196-K200 PolarHBondContact O-N 3.32Å; G196-K200 VanDerWaalsContact O-N 3.1Å
197	F	93.1	Very high	90.4	Very high	48 Å²	48	81 Å²	81	21%	0.211	37%	0.374	C	S	.	.	H	α-helix	trans	-71.1	-43.5	178.7	-62.2	-53.6	0	0	0	113	Y178 K181 A182 A185 N193 A194 R199 K200 A201	Y178-F197 AromaticContact CD1-CD1 3.96Å; Y178-F197 HydrophobicContact CD1-CD1 3.96Å; Y178-F197 HydrophobicContact CE1-CD1 4.39Å; Y178-F197 WeakPolarHBondContact O-CB 3.39Å; K181-F197 HydrophobicContact CB-CD1 4.23Å; K181-F197 HydrophobicContact CB-CD2 3.91Å; K181-F197 HydrophobicContact CB-CE1 4.37Å; K181-F197 HydrophobicContact CB-CE2 4.07Å; K181-F197 HydrophobicContact CB-CG 4Å; K181-F197 HydrophobicContact CB-CZ 4.3Å; K181-F197 HydrophobicContact CD-CE1 4.18Å; K181-F197 HydrophobicContact CD-CZ 4.27Å; A182-F197 HydrophobicContact CB-CB 3.79Å; A185-F197 HydrophobicContact CB-CD2 4.15Å; A185-F197 HydrophobicContact CB-CE2 4.17Å; N193-F197 HydrophobicContact CB-CE2 4.29Å; N193-F197 WeakPolarHBondContact O-CD2 3.32Å; N193-F197 PolarHBondContact O-N 2.87Å; A194-F197 PolarHBondContact O-N 3.12Å; F197-R199 VanDerWaalsContact C-N 3.27Å; F197-R199 PolarHBondContact O-N 3.48Å; F197-K200 WeakPolarHBondContact O-CB 3.47Å; F197-K200 PolarHBondContact O-N 3.35Å; F197-A201 PolarHBondContact O-N 2.91Å
198	Y	93.5	Very high	90.1	Very high	27 Å²	27	77.9 Å²	77.9	11%	0.106	36%	0.358	C	S	.	.	H	α-helix	trans	-58.8	-38	172.6	-72.4	-56.5	0	0	0	112.4	L179 A182 A194 A201 L202 V212 M216	L179-Y198 HydrophobicContact CD2-CD1 3.69Å; L179-Y198 HydrophobicContact CD2-CE1 3.93Å; A182-Y198 HydrophobicContact CB-CD1 3.68Å; A182-Y198 HydrophobicContact CB-CD2 3.9Å; A182-Y198 HydrophobicContact CB-CE1 3.52Å; A182-Y198 HydrophobicContact CB-CE2 3.75Å; A182-Y198 HydrophobicContact CB-CG 3.85Å; A194-Y198 HydrophobicContact CB-CE2 4.39Å; A194-Y198 WeakPolarHBondContact O-CD2 3.37Å; A194-Y198 PolarHBondContact O-N 3.44Å; Y198-A201 PolarHBondContact O-N 2.86Å; Y198-L202 PolarHBondContact O-N 3.4Å; Y198-V212 HydrophobicContact CD1-CG1 4.19Å; Y198-M216 VanDerWaalsContact CB-CG 3.46Å; Y198-M216 HydrophobicContact CD2-CG 4.09Å; Y198-M216 HydrophobicContact CG-CG 3.89Å
199	R	92.4	Very high	89.9	Confident	134 Å²	134	76.4 Å²	76.4	51%	0.506	36%	0.358	S	S	.	.	H	α-helix	trans	-66.8	-32.7	173.6	-76	168.2	172.5	-173.8	-3.7	113	L195 G196 F197 R203 M216	L195-R199 VanDerWaalsContact O-CB 3.28Å; L195-R199 WeakPolarHBondContact O-CB 3.39Å; L195-R199 WeakPolarHBondContact O-CD 3.36Å; L195-R199 WeakPolarHBondContact O-CG 3.4Å; L195-R199 PolarHBondContact O-N 2.91Å; G196-R199 PolarHBondContact O-N 3.45Å; F197-R199 VanDerWaalsContact C-N 3.27Å; F197-R199 PolarHBondContact O-N 3.48Å; R199-R203 VanDerWaalsContact O-CG 3.24Å; R199-R203 WeakPolarHBondContact O-CG 3.45Å; R199-R203 PolarHBondContact O-N 3.02Å; R199-M216 HydrophobicContact CG-CE 4.13Å
200	K	90.8	Very high	89.8	Confident	96 Å²	96	69.3 Å²	69.3	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-68.4	-46.5	172.8	-72.6	-178.6	-179.5	-173	0	110.8	Y178 G196 F197 L202 R203 L204	Y178-K200 HydrophobicContact CD1-CB 3.89Å; Y178-K200 HydrophobicContact CD1-CD 3.88Å; Y178-K200 HydrophobicContact CD2-CB 4.31Å; Y178-K200 HydrophobicContact CE1-CB 4.03Å; Y178-K200 HydrophobicContact CE1-CD 3.34Å; Y178-K200 HydrophobicContact CE1-CG 4.32Å; Y178-K200 HydrophobicContact CE2-CB 4.44Å; Y178-K200 HydrophobicContact CG-CB 4.04Å; G196-K200 WeakPolarHBondContact O-CG 3.41Å; G196-K200 PolarHBondContact O-N 3.32Å; G196-K200 VanDerWaalsContact O-N 3.1Å; F197-K200 WeakPolarHBondContact O-CB 3.47Å; F197-K200 PolarHBondContact O-N 3.35Å; K200-L202 PolarHBondContact O-N 3.46Å; K200-R203 PolarHBondContact O-N 2.86Å; K200-R203 VanDerWaalsContact O-N 3.17Å; K200-L204 PolarHBondContact O-N 2.79Å
201	A	89.5	Confident	89.5	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-55.7	-48.8	175.6	0	0	0	0	0	112.5	V175 L179 F197 Y198 R203 L204 Q205	V175-A201 HydrophobicContact CG1-CB 4.31Å; L179-A201 HydrophobicContact CD2-CB 3.69Å; L179-A201 HydrophobicContact CG-CB 3.95Å; F197-A201 PolarHBondContact O-N 2.91Å; Y198-A201 PolarHBondContact O-N 2.86Å; A201-R203 VanDerWaalsContact C-N 3.3Å; A201-R203 PolarHBondContact O-N 2.97Å; A201-L204 PolarHBondContact O-N 2.78Å; A201-Q205 PolarHBondContact O-N 3.44Å
202	L	89.1	Confident	89.3	Confident	34 Å²	34	67.2 Å²	67.2	18%	0.178	33%	0.326	C	S	.	.	H	α-helix	trans	-69.8	-19.9	178.7	-73.5	175.5	0	0	0	115.1	Y198 K200 C208 V212 R213 M216	Y198-L202 PolarHBondContact O-N 3.4Å; K200-L202 PolarHBondContact O-N 3.46Å; L202-C208 HydrophobicContact CD2-CB 3.7Å; L202-V212 HydrophobicContact CD1-CG1 4.31Å; L202-V212 HydrophobicContact CD2-CG1 3.87Å; L202-V212 HydrophobicContact CG-CG1 3.81Å; L202-R213 HydrophobicContact CD1-CG 4.31Å; L202-M216 HydrophobicContact CD1-SD 3.39Å; L202-M216 WeakPolarHBondContact CD1-SD 3.47Å
203	R	90.3	Very high	89.2	Confident	210 Å²	210	59.6 Å²	59.6	79%	0.792	30%	0.297	S	S	*	.	H	α-helix	trans	-78	-32.2	172.6	-80.5	172.5	177	-170.7	-1.9	112.3	R199 K200 A201	R199-R203 VanDerWaalsContact O-CG 3.24Å; R199-R203 WeakPolarHBondContact O-CG 3.45Å; R199-R203 PolarHBondContact O-N 3.02Å; K200-R203 PolarHBondContact O-N 2.86Å; K200-R203 VanDerWaalsContact O-N 3.17Å; A201-R203 VanDerWaalsContact C-N 3.3Å; A201-R203 PolarHBondContact O-N 2.97Å
204	L	87.9	Confident	89.1	Confident	72 Å²	72	56.8 Å²	56.8	38%	0.377	28%	0.282	S	S	.	.	H	α-helix	trans	-77.4	-45.8	176.9	-67.9	168.6	0	0	0	111.1	P173 V175 Y178 K200 A201	P173-L204 HydrophobicContact CB-CD1 3.99Å; P173-L204 HydrophobicContact CB-CD2 3.84Å; P173-L204 HydrophobicContact CG-CD2 4.18Å; V175-L204 HydrophobicContact CG2-CB 3.52Å; V175-L204 HydrophobicContact CG2-CD1 4.02Å; V175-L204 HydrophobicContact CG2-CG 4.44Å; Y178-L204 HydrophobicContact CD2-CD1 3.66Å; Y178-L204 HydrophobicContact CE2-CD1 3.66Å; K200-L204 PolarHBondContact O-N 2.79Å; A201-L204 PolarHBondContact O-N 2.78Å
205	Q	85	Confident	89	Confident	76 Å²	76	57.1 Å²	57.1	36%	0.355	29%	0.286	S	S	.	.			trans	-129	97.4	177	-172.8	67	-26.6	0	0	111	V175 A201 N207 C208	V175-Q205 HydrophobicContact CG2-CB 4.04Å; A201-Q205 PolarHBondContact O-N 3.44Å; Q205-N207 PolarHBondContact O-N 2.8Å; Q205-C208 PolarHBondContact O-N 3.22Å; Q205-C208 PolarHBondContact O-SG 2.83Å
206	P	83.9	Confident	89	Confident	75 Å²	75	57.8 Å²	57.8	49%	0.487	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-35.2	176	-26.5	35.8	0	0	0	112.6	C208 R213	P206-C208 PolarHBondContact O-N 3.4Å; P206-C208 VanDerWaalsContact O-N 3.11Å; P206-R213 PolarHBondContact O-NH2 2.94Å
207	N	84.5	Confident	89	Confident	145 Å²	145	56.3 Å²	56.3	78%	0.775	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	33.3	179.8	-66.3	-4	0	0	0	113.1	Q205	Q205-N207 PolarHBondContact O-N 2.8Å
208	C	78.6	Confident	89	Confident	9 Å²	9	57.1 Å²	57.1	6%	0.061	28%	0.278	C	S	.	.			trans	-61.3	149.3	168	-79.6	0	0	0	0	112	L202 Q205 P206 V212 R213	L202-C208 HydrophobicContact CD2-CB 3.7Å; Q205-C208 PolarHBondContact O-N 3.22Å; Q205-C208 PolarHBondContact O-SG 2.83Å; P206-C208 PolarHBondContact O-N 3.4Å; P206-C208 VanDerWaalsContact O-N 3.11Å; C208-V212 HydrophobicContact CB-CB 4.01Å; C208-V212 HydrophobicContact CB-CG1 4.3Å; C208-V212 HydrophobicContact CB-CG2 3.81Å; C208-R213 PolarHBondContact O-NH1 3.18Å
209	P	84.2	Confident	89	Confident	65 Å²	65	55.9 Å²	55.9	42%	0.422	27%	0.273	S	S	.	.			trans	-62.1	162	175	26.5	-35.1	0	0	0	113.1	T211 V212	P209-T211 PolarHBondContact O-N 2.82Å; P209-T211 VanDerWaalsContact O-N 3.13Å; P209-V212 HydrophobicContact CG-CG2 4.41Å; P209-V212 PolarHBondContact O-N 3.39Å; P209-V212 VanDerWaalsContact O-N 3.12Å
210	A	87.2	Confident	89.1	Confident	5 Å²	5	50.6 Å²	50.6	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-56	-31.6	-176.4	0	0	0	0	0	113.9	V212 R213 L214 A236 L239 D240	A210-V212 PolarHBondContact O-N 2.73Å; A210-R213 PolarHBondContact O-N 2.79Å; A210-L214 PolarHBondContact O-N 3.27Å; A210-A236 HydrophobicContact CB-CB 4.22Å; A210-A236 WeakPolarHBondContact CB-O 3.25Å; A210-L239 HydrophobicContact CB-CB 4.27Å; A210-D240 HydrophobicContact CB-CB 3.46Å; A210-D240 VanDerWaalsContact CB-CB 3.46Å
211	T	86.5	Confident	89.3	Confident	83 Å²	83	48.1 Å²	48.1	51%	0.509	24%	0.243	S	C	.	.	H	α-helix	trans	-54.8	-32	176.9	52.7	0	0	0	0	113.8	P209 L214 G215	P209-T211 PolarHBondContact O-N 2.82Å; P209-T211 VanDerWaalsContact O-N 3.13Å; T211-L214 WeakPolarHBondContact O-CB 3.21Å; T211-G215 PolarHBondContact O-N 3.09Å
212	V	89.9	Confident	89.3	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.018	27%	0.27	C	S	.	.	H	α-helix	trans	-68.6	-37.8	176.3	178.6	0	0	0	0	111.4	L179 Y198 L202 C208 P209 A210 M216	L179-V212 HydrophobicContact CD1-CG2 3.81Å; L179-V212 HydrophobicContact CD2-CB 4.34Å; L179-V212 HydrophobicContact CD2-CG1 3.79Å; L179-V212 HydrophobicContact CD2-CG2 3.76Å; L179-V212 HydrophobicContact CG-CG2 4.47Å; Y198-V212 HydrophobicContact CD1-CG1 4.19Å; L202-V212 HydrophobicContact CD1-CG1 4.31Å; L202-V212 HydrophobicContact CD2-CG1 3.87Å; L202-V212 HydrophobicContact CG-CG1 3.81Å; C208-V212 HydrophobicContact CB-CB 4.01Å; C208-V212 HydrophobicContact CB-CG1 4.3Å; C208-V212 HydrophobicContact CB-CG2 3.81Å; P209-V212 HydrophobicContact CG-CG2 4.41Å; P209-V212 PolarHBondContact O-N 3.39Å; P209-V212 VanDerWaalsContact O-N 3.12Å; A210-V212 PolarHBondContact O-N 2.73Å; V212-M216 PolarHBondContact O-N 2.8Å
213	R	91.5	Very high	89.5	Confident	42 Å²	42	56.1 Å²	56.1	16%	0.158	28%	0.275	C	S	.	.	H	α-helix	trans	-78.9	-32.3	178.3	-65.4	178.5	-179.9	79.4	-2.5	111.7	L202 P206 C208 A210 M216 G217 A236	L202-R213 HydrophobicContact CD1-CG 4.31Å; P206-R213 PolarHBondContact O-NH2 2.94Å; C208-R213 PolarHBondContact O-NH1 3.18Å; A210-R213 PolarHBondContact O-N 2.79Å; R213-M216 PolarHBondContact O-N 3.25Å; R213-G217 PolarHBondContact O-N 2.95Å; R213-A236 HydrophobicContact CB-CB 4.35Å
214	L	92.7	Very high	89.5	Confident	27 Å²	27	48.5 Å²	48.5	14%	0.141	26%	0.262	C	S	.	.	H	α-helix	trans	-56	-48.8	167.5	177.9	65.1	0	0	0	111.4	A210 T211 M216 G217 H218 F233 G245 A246	A210-L214 PolarHBondContact O-N 3.27Å; T211-L214 WeakPolarHBondContact O-CB 3.21Å; L214-M216 VanDerWaalsContact C-N 3.34Å; L214-M216 PolarHBondContact O-N 2.97Å; L214-G217 WeakPolarHBondContact O-CA 3.44Å; L214-G217 PolarHBondContact O-N 3.43Å; L214-H218 VanDerWaalsContact CD1-NE2 3.34Å; L214-H218 WeakPolarHBondContact CD1-NE2 3.44Å; L214-H218 PolarHBondContact O-CD2 2.85Å; L214-H218 PolarHBondContact O-N 3Å; L214-F233 HydrophobicContact CD1-CD1 3.85Å; L214-F233 HydrophobicContact CD1-CE1 3.85Å; L214-G245 VanDerWaalsContact CD1-C 3.4Å; L214-A246 HydrophobicContact CD1-CB 4.11Å
215	G	90.9	Very high	89.8	Confident	8 Å²	8	48.1 Å²	48.1	8%	0.082	26%	0.26	C	S	.	.	H	α-helix	trans	-57.1	-42.5	175.5	0	0	0	0	0	113.4	T211 G217 H218 C219	T211-G215 PolarHBondContact O-N 3.09Å; G215-G217 PolarHBondContact O-N 2.83Å; G215-H218 PolarHBondContact O-N 3.35Å; G215-C219 PolarHBondContact O-N 2.85Å; G215-C219 VanDerWaalsContact O-N 3.08Å; G215-C219 PolarHBondContact O-SG 3.3Å
216	M	93.8	Very high	90.1	Very high	24 Å²	24	48.5 Å²	48.5	12%	0.118	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-39.9	171.9	-70	-175.2	63.4	0	0	112.9	L195 Y198 R199 L202 V212 R213 L214 C219 F220	L195-M216 HydrophobicContact CD2-CB 4.02Å; L195-M216 HydrophobicContact CD2-CE 4.16Å; L195-M216 HydrophobicContact CD2-CG 4.05Å; Y198-M216 VanDerWaalsContact CB-CG 3.46Å; Y198-M216 HydrophobicContact CD2-CG 4.09Å; Y198-M216 HydrophobicContact CG-CG 3.89Å; R199-M216 HydrophobicContact CG-CE 4.13Å; L202-M216 HydrophobicContact CD1-SD 3.39Å; L202-M216 WeakPolarHBondContact CD1-SD 3.47Å; V212-M216 PolarHBondContact O-N 2.8Å; R213-M216 PolarHBondContact O-N 3.25Å; L214-M216 VanDerWaalsContact C-N 3.34Å; L214-M216 PolarHBondContact O-N 2.97Å; M216-C219 PolarHBondContact O-N 3.3Å; M216-F220 HydrophobicContact CB-CE2 4.31Å; M216-F220 HydrophobicContact CE-CE2 3.95Å; M216-F220 HydrophobicContact CE-CZ 4.12Å; M216-F220 WeakPolarHBondContact O-CD2 3.28Å; M216-F220 PolarHBondContact O-N 3.47Å
217	G	93.8	Very high	90.6	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.8	-45.6	176.2	0	0	0	0	0	112.5	R213 L214 G215 C219 F220 F221 A229	R213-G217 PolarHBondContact O-N 2.95Å; L214-G217 WeakPolarHBondContact O-CA 3.44Å; L214-G217 PolarHBondContact O-N 3.43Å; G215-G217 PolarHBondContact O-N 2.83Å; G217-C219 PolarHBondContact O-N 3.48Å; G217-F220 PolarHBondContact O-N 3.38Å; G217-F221 WeakPolarHBondContact O-CB 3.32Å; G217-F221 PolarHBondContact O-N 2.96Å; G217-A229 WeakPolarHBondContact O-CB 3.27Å
218	H	92.9	Very high	91	Very high	65 Å²	65	50.1 Å²	50.1	30%	0.301	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-39.9	174.2	-65.9	-61.5	0	0	0	112.5	F186 L214 G215 F221 R222 F233	F186-H218 HydrophobicContact CE2-CB 4.01Å; F186-H218 HydrophobicContact CZ-CB 4.1Å; L214-H218 VanDerWaalsContact CD1-NE2 3.34Å; L214-H218 WeakPolarHBondContact CD1-NE2 3.44Å; L214-H218 PolarHBondContact O-CD2 2.85Å; L214-H218 PolarHBondContact O-N 3Å; G215-H218 PolarHBondContact O-N 3.35Å; H218-F221 PolarHBondContact O-N 3.41Å; H218-R222 WeakPolarHBondContact O-CG 3.42Å; H218-R222 PolarHBondContact O-N 2.86Å; H218-F233 AromaticContact ND1-CZ 3.97Å
219	C	94.2	Very high	91.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.5	-42.1	174.8	-62	0	0	0	0	112.4	L195 G215 M216 G217 F221 R222 L223	L195-C219 HydrophobicContact CD1-CB 4.23Å; L195-C219 HydrophobicContact CD2-CB 3.65Å; L195-C219 HydrophobicContact CG-CB 3.56Å; G215-C219 PolarHBondContact O-N 2.85Å; G215-C219 VanDerWaalsContact O-N 3.08Å; G215-C219 PolarHBondContact O-SG 3.3Å; M216-C219 PolarHBondContact O-N 3.3Å; G217-C219 PolarHBondContact O-N 3.48Å; C219-F221 VanDerWaalsContact C-N 3.34Å; C219-R222 PolarHBondContact O-N 2.81Å; C219-L223 WeakPolarHBondContact O-CB 3.32Å; C219-L223 VanDerWaalsContact O-CG 3.29Å; C219-L223 WeakPolarHBondContact O-CG 3.43Å; C219-L223 PolarHBondContact O-N 2.84Å
220	F	95.2	Very high	92.3	Very high	23 Å²	23	48.8 Å²	48.8	10%	0.101	24%	0.243	C	C	.	.	H	α-helix	trans	-63.8	-39.4	175.5	-73.3	-53.1	0	0	0	112	L195 M216 G217 L223 G224 N225 K228 A229 A232	L195-F220 HydrophobicContact CD1-CD1 3.77Å; L195-F220 HydrophobicContact CD1-CE1 3.61Å; L195-F220 HydrophobicContact CD1-CZ 4.29Å; L195-F220 HydrophobicContact CD2-CD1 4.38Å; L195-F220 HydrophobicContact CD2-CD2 4.41Å; L195-F220 HydrophobicContact CD2-CE1 4.11Å; L195-F220 HydrophobicContact CD2-CE2 4.15Å; L195-F220 HydrophobicContact CD2-CZ 3.99Å; M216-F220 HydrophobicContact CB-CE2 4.31Å; M216-F220 HydrophobicContact CE-CE2 3.95Å; M216-F220 HydrophobicContact CE-CZ 4.12Å; M216-F220 WeakPolarHBondContact O-CD2 3.28Å; M216-F220 PolarHBondContact O-N 3.47Å; G217-F220 PolarHBondContact O-N 3.38Å; F220-L223 CarbonylContact O-C 3.54Å; F220-L223 PolarHBondContact O-N 3.42Å; F220-G224 PolarHBondContact O-N 3.2Å; F220-N225 HydrophobicContact CB-CB 4.27Å; F220-N225 HydrophobicContact CD1-CB 4.21Å; F220-N225 PolarHBondContact O-N 2.83Å; F220-K228 HydrophobicContact CB-CB 4.22Å; F220-K228 HydrophobicContact CD1-CB 3.81Å; F220-K228 HydrophobicContact CD1-CD 4.37Å; F220-K228 HydrophobicContact CD2-CB 3.87Å; F220-K228 HydrophobicContact CE1-CB 4.07Å; F220-K228 HydrophobicContact CE1-CD 4.15Å; F220-K228 HydrophobicContact CE2-CB 4.12Å; F220-K228 HydrophobicContact CG-CB 3.72Å; F220-K228 HydrophobicContact CZ-CB 4.22Å; F220-A229 HydrophobicContact CB-CB 3.9Å; F220-A232 HydrophobicContact CD2-CB 4.23Å
221	F	93	Very high	92.7	Very high	44 Å²	44	54.2 Å²	54.2	19%	0.193	27%	0.271	C	S	.	.	H	α-helix	trans	-62	-48.3	175.4	-176.1	-95	0	0	0	111.7	G217 H218 C219 L223 G224 M226 A229 V252 L253	G217-F221 WeakPolarHBondContact O-CB 3.32Å; G217-F221 PolarHBondContact O-N 2.96Å; H218-F221 PolarHBondContact O-N 3.41Å; C219-F221 VanDerWaalsContact C-N 3.34Å; F221-L223 PolarHBondContact O-N 3.14Å; F221-G224 PolarHBondContact O-N 2.82Å; F221-M226 HydrophobicContact CD2-CE 4.28Å; F221-M226 HydrophobicContact CD2-SD 3.65Å; F221-M226 HydrophobicContact CE2-CE 4.15Å; F221-M226 HydrophobicContact CE2-SD 3.93Å; F221-M226 HydrophobicContact CG-SD 4.49Å; F221-A229 HydrophobicContact CB-CB 4.1Å; F221-V252 HydrophobicContact CE2-CG1 4.16Å; F221-V252 HydrophobicContact CZ-CG1 3.93Å; F221-L253 HydrophobicContact CD2-CD2 3.93Å; F221-L253 HydrophobicContact CD2-CG 4.41Å; F221-L253 HydrophobicContact CE2-CD2 4.05Å; F221-L253 HydrophobicContact CE2-CG 4.49Å
222	R	90.9	Very high	93	Very high	148 Å²	148	51 Å²	51	56%	0.558	25%	0.252	S	S	*	.	H	α-helix	trans	-65.9	-19.9	175.2	-66.2	-63.6	-173.7	-144	-0.2	113.7	F186 Y191 H218 C219	F186-R222 HydrophobicContact CE2-CG 4.25Å; F186-R222 HydrophobicContact CZ-CG 4.36Å; Y191-R222 HydrophobicContact CD1-CB 3.87Å; Y191-R222 HydrophobicContact CD1-CG 4.23Å; Y191-R222 HydrophobicContact CD2-CB 3.76Å; Y191-R222 HydrophobicContact CE1-CB 3.85Å; Y191-R222 HydrophobicContact CE1-CG 3.85Å; Y191-R222 HydrophobicContact CE2-CB 3.75Å; Y191-R222 HydrophobicContact CE2-CG 4.41Å; Y191-R222 HydrophobicContact CG-CB 3.82Å; H218-R222 WeakPolarHBondContact O-CG 3.42Å; H218-R222 PolarHBondContact O-N 2.86Å; C219-R222 PolarHBondContact O-N 2.81Å
223	L	92.6	Very high	93.3	Very high	54 Å²	54	50.9 Å²	50.9	28%	0.283	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	14.4	171.4	-68.9	169	0	0	0	113.4	Y191 R192 L195 C219 F220 F221 N225	Y191-L223 HydrophobicContact CD2-CD2 4.5Å; R192-L223 HydrophobicContact CG-CD1 4.25Å; R192-L223 HydrophobicContact CG-CD2 4Å; L195-L223 HydrophobicContact CD1-CD1 3.55Å; C219-L223 WeakPolarHBondContact O-CB 3.32Å; C219-L223 VanDerWaalsContact O-CG 3.29Å; C219-L223 WeakPolarHBondContact O-CG 3.43Å; C219-L223 PolarHBondContact O-N 2.84Å; F220-L223 CarbonylContact O-C 3.54Å; F220-L223 PolarHBondContact O-N 3.42Å; F221-L223 PolarHBondContact O-N 3.14Å; L223-N225 PolarHBondContact O-N 2.85Å; L223-N225 PolarHBondContact O-ND2 2.81Å
224	G	90.9	Very high	93.4	Very high	50 Å²	50	54.1 Å²	54.1	52%	0.515	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	3.7	178.2	0	0	0	0	0	115.7	F220 F221 M226	F220-G224 PolarHBondContact O-N 3.2Å; F221-G224 PolarHBondContact O-N 2.82Å; G224-M226 PolarHBondContact O-N 3.2Å
225	N	93.6	Very high	93.5	Very high	64 Å²	64	58.8 Å²	58.8	34%	0.342	28%	0.283	S	S	.	.			trans	-83.8	64.6	-176.9	-83	-109.2	0	0	0	110.4	F220 L223 E227 K228 A229	F220-N225 HydrophobicContact CB-CB 4.27Å; F220-N225 HydrophobicContact CD1-CB 4.21Å; F220-N225 PolarHBondContact O-N 2.83Å; L223-N225 PolarHBondContact O-N 2.85Å; L223-N225 PolarHBondContact O-ND2 2.81Å; N225-E227 VanDerWaalsContact C-N 3.3Å; N225-E227 PolarHBondContact O-N 3.24Å; N225-K228 HydrophobicContact CB-CB 4.29Å; N225-K228 HydrophobicContact CB-CD 4.31Å; N225-K228 PolarHBondContact O-N 3.29Å; N225-K228 PolarHBondContact OD1-NZ 3.29Å; N225-A229 PolarHBondContact O-N 3.49Å
226	M	92.3	Very high	93.6	Very high	84 Å²	84	58.4 Å²	58.4	41%	0.414	28%	0.279	S	S	.	.	H	α-helix	trans	-55.4	-39.3	-170.6	-59.1	-51.2	-177	0	0	113.7	F221 G224 K228 A229 R230 L253	F221-M226 HydrophobicContact CD2-CE 4.28Å; F221-M226 HydrophobicContact CD2-SD 3.65Å; F221-M226 HydrophobicContact CE2-CE 4.15Å; F221-M226 HydrophobicContact CE2-SD 3.93Å; F221-M226 HydrophobicContact CG-SD 4.49Å; G224-M226 PolarHBondContact O-N 3.2Å; M226-K228 PolarHBondContact O-N 2.91Å; M226-A229 PolarHBondContact O-N 2.94Å; M226-R230 WeakPolarHBondContact O-CB 3.45Å; M226-R230 PolarHBondContact O-N 3.06Å; M226-L253 HydrophobicContact CB-CD2 3.93Å; M226-L253 HydrophobicContact CG-CD2 4.21Å; M226-L253 HydrophobicContact SD-CD2 3.66Å
227	E	93.1	Very high	93.5	Very high	156 Å²	156	58.6 Å²	58.6	73%	0.729	28%	0.28	S	S	*	.	H	α-helix	trans	-59.9	-44.4	175.4	-60.4	176.4	162.2	0	0	112.5	N225 R230 L231	N225-E227 VanDerWaalsContact C-N 3.3Å; N225-E227 PolarHBondContact O-N 3.24Å; E227-R230 WeakPolarHBondContact O-CB 3.23Å; E227-R230 PolarHBondContact O-N 3.41Å; E227-L231 WeakPolarHBondContact O-CG 3.47Å; E227-L231 PolarHBondContact O-N 3.4Å
228	K	94	Very high	93.4	Very high	98 Å²	98	63.4 Å²	63.4	43%	0.426	31%	0.306	S	S	.	.	H	α-helix	trans	-75.3	-30.9	-178.6	-64.2	170.5	-168.6	146.7	0	111.3	F220 N225 M226 A232	F220-K228 HydrophobicContact CB-CB 4.22Å; F220-K228 HydrophobicContact CD1-CB 3.81Å; F220-K228 HydrophobicContact CD1-CD 4.37Å; F220-K228 HydrophobicContact CD2-CB 3.87Å; F220-K228 HydrophobicContact CE1-CB 4.07Å; F220-K228 HydrophobicContact CE1-CD 4.15Å; F220-K228 HydrophobicContact CE2-CB 4.12Å; F220-K228 HydrophobicContact CG-CB 3.72Å; F220-K228 HydrophobicContact CZ-CB 4.22Å; N225-K228 HydrophobicContact CB-CB 4.29Å; N225-K228 HydrophobicContact CB-CD 4.31Å; N225-K228 PolarHBondContact O-N 3.29Å; N225-K228 PolarHBondContact OD1-NZ 3.29Å; M226-K228 PolarHBondContact O-N 2.91Å; K228-A232 VanDerWaalsContact O-CB 3.28Å; K228-A232 WeakPolarHBondContact O-CB 3.47Å; K228-A232 PolarHBondContact O-N 2.86Å
229	A	95	Very high	93.3	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.7	-49	167.4	0	0	0	0	0	110.8	G217 F220 F221 N225 M226 L231 A232 F233 L253	G217-A229 WeakPolarHBondContact O-CB 3.27Å; F220-A229 HydrophobicContact CB-CB 3.9Å; F221-A229 HydrophobicContact CB-CB 4.1Å; N225-A229 PolarHBondContact O-N 3.49Å; M226-A229 PolarHBondContact O-N 2.94Å; A229-L231 VanDerWaalsContact C-N 3.34Å; A229-L231 PolarHBondContact O-N 3.45Å; A229-A232 PolarHBondContact O-N 2.83Å; A229-A232 VanDerWaalsContact O-N 3.15Å; A229-F233 HydrophobicContact CB-CD2 4.4Å; A229-F233 HydrophobicContact CB-CE2 3.96Å; A229-F233 WeakPolarHBondContact O-CD2 3.25Å; A229-F233 WeakPolarHBondContact O-CG 3.25Å; A229-F233 PolarHBondContact O-N 2.99Å; A229-L253 HydrophobicContact CB-CD1 4.22Å
230	R	94.9	Very high	93	Very high	47 Å²	47	66.6 Å²	66.6	18%	0.177	33%	0.325	C	S	.	.	H	α-helix	trans	-57	-43.2	176.8	-170.4	175.2	-81.7	-69.7	15.6	112.1	M226 E227 K234 L250 L253 D254 E257	M226-R230 WeakPolarHBondContact O-CB 3.45Å; M226-R230 PolarHBondContact O-N 3.06Å; E227-R230 WeakPolarHBondContact O-CB 3.23Å; E227-R230 PolarHBondContact O-N 3.41Å; R230-K234 WeakPolarHBondContact O-CB 3.49Å; R230-K234 WeakPolarHBondContact O-CG 3.21Å; R230-K234 PolarHBondContact O-N 3.35Å; R230-L250 HydrophobicContact CB-CD2 4.49Å; R230-L250 HydrophobicContact CG-CD2 3.94Å; R230-L253 HydrophobicContact CB-CD1 3.93Å; R230-D254 IonicContact CZ-OD1 3.94Å; R230-D254 IonicContact NH1-OD1 3.2Å; R230-D254 PolarHBondContact NH1-OD1 3.45Å; R230-D254 IonicContact NH2-OD1 2.68Å; R230-D254 PolarHBondContact NH2-OD1 3.31Å; R230-E257 IonicContact CZ-OE1 2.73Å; R230-E257 IonicContact NE-OE1 3.04Å; R230-E257 IonicContact NH2-OE1 3.84Å; R230-E257 PolarHBondContact NH2-OE1 3.49Å; R230-E257 IonicContact NH2-OE2 3.59Å; R230-E257 PolarHBondContact NH2-OE2 2.81Å
231	L	94.9	Very high	92.8	Very high	118 Å²	118	69.1 Å²	69.1	62%	0.618	34%	0.343	S	S	*	.	H	α-helix	trans	-66.5	-42.7	174.6	-71.7	171.9	0	0	0	112.7	E227 A229 R235	E227-L231 WeakPolarHBondContact O-CG 3.47Å; E227-L231 PolarHBondContact O-N 3.4Å; A229-L231 VanDerWaalsContact C-N 3.34Å; A229-L231 PolarHBondContact O-N 3.45Å; L231-R235 WeakPolarHBondContact O-CB 3.33Å; L231-R235 PolarHBondContact O-N 2.81Å
232	A	93.7	Very high	92.7	Very high	15 Å²	15	73.6 Å²	73.6	12%	0.124	37%	0.365	C	S	.	.	H	α-helix	trans	-66.5	-41.8	179.3	0	0	0	0	0	112.7	F220 K228 A229 R235 A236	F220-A232 HydrophobicContact CD2-CB 4.23Å; K228-A232 VanDerWaalsContact O-CB 3.28Å; K228-A232 WeakPolarHBondContact O-CB 3.47Å; K228-A232 PolarHBondContact O-N 2.86Å; A229-A232 PolarHBondContact O-N 2.83Å; A229-A232 VanDerWaalsContact O-N 3.15Å; A232-R235 PolarHBondContact O-N 3.09Å; A232-A236 PolarHBondContact O-N 3.39Å
233	F	95.4	Very high	92.6	Very high	2 Å²	2	67 Å²	67	1%	0.009	34%	0.342	C	S	.	.	H	α-helix	trans	-69.3	-41.1	175.5	-60	-45.8	0	0	0	112.1	L214 H218 A229 R235 A236 L237 A246 L250 L253	L214-F233 HydrophobicContact CD1-CD1 3.85Å; L214-F233 HydrophobicContact CD1-CE1 3.85Å; H218-F233 AromaticContact ND1-CZ 3.97Å; A229-F233 HydrophobicContact CB-CD2 4.4Å; A229-F233 HydrophobicContact CB-CE2 3.96Å; A229-F233 WeakPolarHBondContact O-CD2 3.25Å; A229-F233 WeakPolarHBondContact O-CG 3.25Å; A229-F233 PolarHBondContact O-N 2.99Å; F233-R235 VanDerWaalsContact C-N 3.34Å; F233-R235 PolarHBondContact O-N 2.82Å; F233-A236 WeakPolarHBondContact O-CB 3.35Å; F233-A236 PolarHBondContact O-N 2.99Å; F233-L237 PolarHBondContact O-N 3.22Å; F233-L237 VanDerWaalsContact O-N 3.11Å; F233-A246 HydrophobicContact CB-CB 4.38Å; F233-L250 HydrophobicContact CB-CD2 3.8Å; F233-L250 HydrophobicContact CB-CG 3.78Å; F233-L250 HydrophobicContact CD2-CD2 4.39Å; F233-L253 HydrophobicContact CD2-CD1 3.75Å; F233-L253 HydrophobicContact CE2-CD1 3.9Å
234	K	94.8	Very high	92.6	Very high	110 Å²	110	65.5 Å²	65.5	48%	0.478	33%	0.334	S	S	.	.	H	α-helix	trans	-54.8	-50.7	169.4	-80.9	-177.3	175.3	-171.2	0	110.7	R230 A236 L237 D238 L250	R230-K234 WeakPolarHBondContact O-CB 3.49Å; R230-K234 WeakPolarHBondContact O-CG 3.21Å; R230-K234 PolarHBondContact O-N 3.35Å; K234-A236 PolarHBondContact O-N 3.42Å; K234-L237 WeakPolarHBondContact O-CA 3.37Å; K234-L237 PolarHBondContact O-N 3.43Å; K234-D238 PolarHBondContact O-N 3.15Å; K234-L250 HydrophobicContact CG-CD1 4.06Å; K234-L250 HydrophobicContact CG-CD2 4.3Å
235	R	92.8	Very high	92.6	Very high	124 Å²	124	64.3 Å²	64.3	47%	0.468	32%	0.322	S	S	.	.	H	α-helix	trans	-69.3	-15.3	-178.7	-166.4	54.3	-173.9	159.7	8.5	114.4	L231 A232 F233 D238 L239	L231-R235 WeakPolarHBondContact O-CB 3.33Å; L231-R235 PolarHBondContact O-N 2.81Å; A232-R235 PolarHBondContact O-N 3.09Å; F233-R235 VanDerWaalsContact C-N 3.34Å; F233-R235 PolarHBondContact O-N 2.82Å; R235-D238 WeakPolarHBondContact CD-OD2 3.5Å; R235-D238 IonicContact CZ-OD2 2.8Å; R235-D238 IonicContact NE-OD2 3.86Å; R235-D238 IonicContact NH1-OD2 2.73Å; R235-D238 PolarHBondContact NH1-OD2 3.29Å; R235-L239 WeakPolarHBondContact O-CD1 3.45Å; R235-L239 WeakPolarHBondContact O-CG 3.49Å
236	A	92.9	Very high	92.6	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-75.3	-43.7	166.3	0	0	0	0	0	110.9	A210 R213 A232 F233 K234 L239 D240 A246	A210-A236 HydrophobicContact CB-CB 4.22Å; A210-A236 WeakPolarHBondContact CB-O 3.25Å; R213-A236 HydrophobicContact CB-CB 4.35Å; A232-A236 PolarHBondContact O-N 3.39Å; F233-A236 WeakPolarHBondContact O-CB 3.35Å; F233-A236 PolarHBondContact O-N 2.99Å; K234-A236 PolarHBondContact O-N 3.42Å; A236-L239 PolarHBondContact O-N 2.86Å; A236-D240 PolarHBondContact O-N 2.79Å; A236-A246 HydrophobicContact CB-CB 3.8Å
237	L	92.6	Very high	92.7	Very high	28 Å²	28	57.5 Å²	57.5	15%	0.147	29%	0.287	C	S	.	.	H	α-helix	trans	-68.9	-29.5	176.8	-64.8	171.8	0	0	0	114.1	F233 K234 L239 D240 C243 A246 L247 L250	F233-L237 PolarHBondContact O-N 3.22Å; F233-L237 VanDerWaalsContact O-N 3.11Å; K234-L237 WeakPolarHBondContact O-CA 3.37Å; K234-L237 PolarHBondContact O-N 3.43Å; L237-L239 PolarHBondContact O-N 2.99Å; L237-D240 WeakPolarHBondContact CA-O 3.32Å; L237-D240 CarbonylContact O-C 3.56Å; L237-C243 HydrophobicContact CD2-CB 4.17Å; L237-A246 HydrophobicContact CD1-CB 4.41Å; L237-A246 HydrophobicContact CD2-CB 3.81Å; L237-A246 HydrophobicContact CG-CB 3.73Å; L237-L247 HydrophobicContact CD1-CD2 3.82Å; L237-L247 HydrophobicContact CD1-CG 4.37Å; L237-L247 HydrophobicContact CD2-CD2 3.96Å; L237-L247 HydrophobicContact CD2-CG 3.8Å; L237-L250 HydrophobicContact CD1-CD1 3.59Å
238	D	92.4	Very high	92.7	Very high	101 Å²	101	50.2 Å²	50.2	54%	0.54	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-20.8	172.3	-58.7	-15	0	0	0	113	K234 R235	K234-D238 PolarHBondContact O-N 3.15Å; R235-D238 WeakPolarHBondContact CD-OD2 3.5Å; R235-D238 IonicContact CZ-OD2 2.8Å; R235-D238 IonicContact NE-OD2 3.86Å; R235-D238 IonicContact NH1-OD2 2.73Å; R235-D238 PolarHBondContact NH1-OD2 3.29Å
239	L	90.6	Very high	92.6	Very high	77 Å²	77	45.9 Å²	45.9	40%	0.403	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-31.7	-178.2	-65.9	171.5	0	0	0	112	A210 R235 A236 L237	A210-L239 HydrophobicContact CB-CB 4.27Å; R235-L239 WeakPolarHBondContact O-CD1 3.45Å; R235-L239 WeakPolarHBondContact O-CG 3.49Å; A236-L239 PolarHBondContact O-N 2.86Å; L237-L239 PolarHBondContact O-N 2.99Å
240	D	88.5	Confident	92.5	Very high	56 Å²	56	46.3 Å²	46.3	30%	0.299	24%	0.239	S	C	.	.			trans	-141.5	94.5	179.4	175	2.9	0	0	0	108.8	A210 A236 L237 E242 C243	A210-D240 HydrophobicContact CB-CB 3.46Å; A210-D240 VanDerWaalsContact CB-CB 3.46Å; A236-D240 PolarHBondContact O-N 2.79Å; L237-D240 WeakPolarHBondContact CA-O 3.32Å; L237-D240 CarbonylContact O-C 3.56Å; D240-E242 PolarHBondContact O-N 3.31Å; D240-E242 VanDerWaalsContact O-N 3.14Å; D240-E242 WeakPolarHBondContact OD1-CA 3.33Å; D240-E242 WeakPolarHBondContact OD1-CB 3.28Å; D240-E242 PolarHBondContact OD1-N 3.28Å; D240-C243 HydrophobicContact CB-CB 3.99Å; D240-C243 VanDerWaalsContact O-CB 3.25Å; D240-C243 WeakPolarHBondContact O-CB 3.23Å; D240-C243 PolarHBondContact O-N 3.44Å; D240-C243 VanDerWaalsContact O-N 3.16Å; D240-C243 PolarHBondContact OD1-N 2.99Å; D240-C243 VanDerWaalsContact OD1-N 3.16Å; D240-C243 WeakPolarHBondContact OD2-CB 3.47Å
241	P	90	Very high	92.4	Very high	75 Å²	75	44.1 Å²	44.1	49%	0.487	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-13.5	177.3	-24.4	35.7	0	0	0	114.4	R272	P241-R272 PolarHBondContact O-NH2 3.36Å
242	E	89.8	Confident	92.3	Very high	138 Å²	138	39.5 Å²	39.5	65%	0.645	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	-1.9	-179.6	-57.1	-171.6	162.1	0	0	112.2	D240 V244 L276	D240-E242 PolarHBondContact O-N 3.31Å; D240-E242 VanDerWaalsContact O-N 3.14Å; D240-E242 WeakPolarHBondContact OD1-CA 3.33Å; D240-E242 WeakPolarHBondContact OD1-CB 3.28Å; D240-E242 PolarHBondContact OD1-N 3.28Å; E242-V244 WeakPolarHBondContact O-CG2 3.19Å; E242-V244 PolarHBondContact O-N 3.05Å; E242-L276 HydrophobicContact CB-CD2 4.16Å; E242-L276 HydrophobicContact CG-CD2 4.09Å
243	C	90.3	Very high	92.2	Very high	10 Å²	10	39.1 Å²	39.1	7%	0.068	20%	0.204	C	C	.	.			trans	-64.2	84.9	-179.1	-172.7	0	0	0	0	113.2	L237 D240 G245 A246 L247	L237-C243 HydrophobicContact CD2-CB 4.17Å; D240-C243 HydrophobicContact CB-CB 3.99Å; D240-C243 VanDerWaalsContact O-CB 3.25Å; D240-C243 WeakPolarHBondContact O-CB 3.23Å; D240-C243 PolarHBondContact O-N 3.44Å; D240-C243 VanDerWaalsContact O-N 3.16Å; D240-C243 PolarHBondContact OD1-N 2.99Å; D240-C243 VanDerWaalsContact OD1-N 3.16Å; D240-C243 WeakPolarHBondContact OD2-CB 3.47Å; C243-G245 VanDerWaalsContact C-N 3.27Å; C243-G245 PolarHBondContact O-N 3.44Å; C243-A246 HydrophobicContact CB-CB 4.19Å; C243-A246 PolarHBondContact O-N 3.22Å; C243-L247 PolarHBondContact O-N 3.3Å; C243-L247 VanDerWaalsContact O-N 3.15Å
244	V	92.2	Very high	92.1	Very high	22 Å²	22	39.1 Å²	39.1	13%	0.133	20%	0.203	C	C	.	.	H	α-helix	trans	-49.1	-45.2	179.4	-177.7	0	0	0	0	111.9	E242 A246 L247 V248 A273 L276 D277 V283	E242-V244 WeakPolarHBondContact O-CG2 3.19Å; E242-V244 PolarHBondContact O-N 3.05Å; V244-A246 VanDerWaalsContact C-N 3.27Å; V244-A246 PolarHBondContact O-N 2.96Å; V244-L247 WeakPolarHBondContact O-CB 3.35Å; V244-L247 PolarHBondContact O-N 2.71Å; V244-V248 HydrophobicContact CG1-CG2 4.44Å; V244-V248 WeakPolarHBondContact O-CG2 3.4Å; V244-V248 PolarHBondContact O-N 3.06Å; V244-A273 HydrophobicContact CG1-CB 4.1Å; V244-L276 HydrophobicContact CG2-CB 3.81Å; V244-D277 HydrophobicContact CG1-CB 4.18Å; V244-D277 HydrophobicContact CG2-CB 3.84Å; V244-V283 HydrophobicContact CG1-CG2 4.04Å
245	G	90.4	Very high	91.9	Very high	25 Å²	25	36.2 Å²	36.2	26%	0.258	19%	0.193	S	C	.	.	H	α-helix	trans	-60.3	-33.9	179.2	0	0	0	0	0	113.7	L214 C243 G249	L214-G245 VanDerWaalsContact CD1-C 3.4Å; C243-G245 VanDerWaalsContact C-N 3.27Å; C243-G245 PolarHBondContact O-N 3.44Å; G245-G249 PolarHBondContact O-N 3.15Å
246	A	93.3	Very high	91.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-79.7	-32.2	177.5	0	0	0	0	0	112.3	L214 F233 A236 L237 C243 V244 L250	L214-A246 HydrophobicContact CD1-CB 4.11Å; F233-A246 HydrophobicContact CB-CB 4.38Å; A236-A246 HydrophobicContact CB-CB 3.8Å; L237-A246 HydrophobicContact CD1-CB 4.41Å; L237-A246 HydrophobicContact CD2-CB 3.81Å; L237-A246 HydrophobicContact CG-CB 3.73Å; C243-A246 HydrophobicContact CB-CB 4.19Å; C243-A246 PolarHBondContact O-N 3.22Å; V244-A246 VanDerWaalsContact C-N 3.27Å; V244-A246 PolarHBondContact O-N 2.96Å; A246-L250 WeakPolarHBondContact O-CG 3.16Å; A246-L250 PolarHBondContact O-N 3.03Å
247	L	94.4	Very high	91.5	Very high	5 Å²	5	39.7 Å²	39.7	3%	0.026	22%	0.217	C	C	.	.	H	α-helix	trans	-61.8	-46.8	168.6	-71.1	173	0	0	0	111.3	L237 C243 V244 L250 A251 R272 A273 L276	L237-L247 HydrophobicContact CD1-CD2 3.82Å; L237-L247 HydrophobicContact CD1-CG 4.37Å; L237-L247 HydrophobicContact CD2-CD2 3.96Å; L237-L247 HydrophobicContact CD2-CG 3.8Å; C243-L247 PolarHBondContact O-N 3.3Å; C243-L247 VanDerWaalsContact O-N 3.15Å; V244-L247 WeakPolarHBondContact O-CB 3.35Å; V244-L247 PolarHBondContact O-N 2.71Å; L247-L250 PolarHBondContact O-N 2.81Å; L247-A251 WeakPolarHBondContact O-CB 3.34Å; L247-A251 PolarHBondContact O-N 3.32Å; L247-R272 HydrophobicContact CD1-CB 4.22Å; L247-R272 HydrophobicContact CD1-CG 3.72Å; L247-A273 HydrophobicContact CB-CB 4.03Å; L247-A273 HydrophobicContact CD1-CB 4.18Å; L247-L276 HydrophobicContact CD1-CD1 3.57Å
248	V	93.4	Very high	91.1	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-44.1	176.7	175.7	0	0	0	0	111	V244 L250 A251 V252 A273 M282 V283	V244-V248 HydrophobicContact CG1-CG2 4.44Å; V244-V248 WeakPolarHBondContact O-CG2 3.4Å; V244-V248 PolarHBondContact O-N 3.06Å; V248-L250 VanDerWaalsContact C-N 3.3Å; V248-L250 PolarHBondContact O-N 2.93Å; V248-A251 PolarHBondContact O-N 3.09Å; V248-A251 VanDerWaalsContact O-N 3.1Å; V248-V252 HydrophobicContact CG1-CG2 4.27Å; V248-V252 WeakPolarHBondContact O-CG2 3.47Å; V248-V252 PolarHBondContact O-N 2.91Å; V248-A273 HydrophobicContact CG2-CB 4.17Å; V248-M282 HydrophobicContact CG1-CE 4.11Å; V248-M282 HydrophobicContact CG1-CG 3.87Å; V248-M282 HydrophobicContact CG1-SD 3.69Å; V248-V283 HydrophobicContact CG2-CG2 3.43Å; V248-V283 VanDerWaalsContact CG2-CG2 3.43Å
249	G	91.7	Very high	90.9	Very high	7 Å²	7	45.3 Å²	45.3	7%	0.072	24%	0.242	C	C	.	.	H	α-helix	trans	-57.2	-39.4	175.7	0	0	0	0	0	113.4	G245 L253	G245-G249 PolarHBondContact O-N 3.15Å; G249-L253 WeakPolarHBondContact O-CD1 3.46Å; G249-L253 WeakPolarHBondContact O-CG 3.19Å; G249-L253 PolarHBondContact O-N 3.23Å
250	L	93.9	Very high	90.7	Very high	9 Å²	9	49.4 Å²	49.4	5%	0.047	26%	0.259	C	S	.	.	H	α-helix	trans	-72.8	-40.6	171.6	-71	-177.2	0	0	0	113.1	R230 F233 K234 L237 A246 L247 V248 V252 L253 D254 K269	R230-L250 HydrophobicContact CB-CD2 4.49Å; R230-L250 HydrophobicContact CG-CD2 3.94Å; F233-L250 HydrophobicContact CB-CD2 3.8Å; F233-L250 HydrophobicContact CB-CG 3.78Å; F233-L250 HydrophobicContact CD2-CD2 4.39Å; K234-L250 HydrophobicContact CG-CD1 4.06Å; K234-L250 HydrophobicContact CG-CD2 4.3Å; L237-L250 HydrophobicContact CD1-CD1 3.59Å; A246-L250 WeakPolarHBondContact O-CG 3.16Å; A246-L250 PolarHBondContact O-N 3.03Å; L247-L250 PolarHBondContact O-N 2.81Å; V248-L250 VanDerWaalsContact C-N 3.3Å; V248-L250 PolarHBondContact O-N 2.93Å; L250-V252 PolarHBondContact O-N 3.16Å; L250-L253 HydrophobicContact CD2-CD1 4.39Å; L250-L253 WeakPolarHBondContact O-CB 3.37Å; L250-L253 PolarHBondContact O-N 2.99Å; L250-D254 PolarHBondContact O-N 3.14Å; L250-K269 HydrophobicContact CB-CD 4.16Å
251	A	92.9	Very high	90.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-42.3	-179.6	0	0	0	0	0	112.5	L247 V248 L253 D254 L255 G266 K269 L270	L247-A251 WeakPolarHBondContact O-CB 3.34Å; L247-A251 PolarHBondContact O-N 3.32Å; V248-A251 PolarHBondContact O-N 3.09Å; V248-A251 VanDerWaalsContact O-N 3.1Å; A251-L253 VanDerWaalsContact C-N 3.33Å; A251-L253 PolarHBondContact O-N 2.87Å; A251-D254 PolarHBondContact O-N 2.75Å; A251-L255 WeakPolarHBondContact O-CB 3.41Å; A251-L255 VanDerWaalsContact O-CG 3.28Å; A251-L255 WeakPolarHBondContact O-CG 3.49Å; A251-L255 PolarHBondContact O-N 3.42Å; A251-G266 WeakPolarHBondContact CB-O 3.34Å; A251-K269 HydrophobicContact CB-CB 3.96Å; A251-L270 HydrophobicContact CB-CD2 4.01Å; A251-L270 HydrophobicContact CB-CG 3.8Å
252	V	92.2	Very high	90.7	Very high	21 Å²	21	50.5 Å²	50.5	13%	0.127	26%	0.257	C	S	.	.	H	α-helix	trans	-63.5	-38.9	175	172.8	0	0	0	0	111.2	F221 V248 L250 N256 M282 H286	F221-V252 HydrophobicContact CE2-CG1 4.16Å; F221-V252 HydrophobicContact CZ-CG1 3.93Å; V248-V252 HydrophobicContact CG1-CG2 4.27Å; V248-V252 WeakPolarHBondContact O-CG2 3.47Å; V248-V252 PolarHBondContact O-N 2.91Å; L250-V252 PolarHBondContact O-N 3.16Å; V252-N256 WeakPolarHBondContact O-CB 3.22Å; V252-N256 PolarHBondContact O-N 2.87Å; V252-N256 PolarHBondContact O-ND2 2.82Å; V252-M282 HydrophobicContact CG2-CE 4.26Å; V252-H286 VanDerWaalsContact CG2-NE2 3.33Å; V252-H286 WeakPolarHBondContact CG2-NE2 3.47Å
253	L	92.5	Very high	90.7	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-63.2	-42.9	174	-75.6	167.4	0	0	0	112.2	F221 M226 A229 R230 F233 G249 L250 A251 N256 E257	F221-L253 HydrophobicContact CD2-CD2 3.93Å; F221-L253 HydrophobicContact CD2-CG 4.41Å; F221-L253 HydrophobicContact CE2-CD2 4.05Å; F221-L253 HydrophobicContact CE2-CG 4.49Å; M226-L253 HydrophobicContact CB-CD2 3.93Å; M226-L253 HydrophobicContact CG-CD2 4.21Å; M226-L253 HydrophobicContact SD-CD2 3.66Å; A229-L253 HydrophobicContact CB-CD1 4.22Å; R230-L253 HydrophobicContact CB-CD1 3.93Å; F233-L253 HydrophobicContact CD2-CD1 3.75Å; F233-L253 HydrophobicContact CE2-CD1 3.9Å; G249-L253 WeakPolarHBondContact O-CD1 3.46Å; G249-L253 WeakPolarHBondContact O-CG 3.19Å; G249-L253 PolarHBondContact O-N 3.23Å; L250-L253 HydrophobicContact CD2-CD1 4.39Å; L250-L253 WeakPolarHBondContact O-CB 3.37Å; L250-L253 PolarHBondContact O-N 2.99Å; A251-L253 VanDerWaalsContact C-N 3.33Å; A251-L253 PolarHBondContact O-N 2.87Å; L253-N256 PolarHBondContact O-N 3.28Å; L253-E257 PolarHBondContact O-N 3.47Å
254	D	92.3	Very high	90.7	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-70.5	-38	178.8	-51.6	-32.3	0	0	0	112.6	R230 L250 A251 N256 E257 S262 K269	R230-D254 IonicContact CZ-OD1 3.94Å; R230-D254 IonicContact NH1-OD1 3.2Å; R230-D254 PolarHBondContact NH1-OD1 3.45Å; R230-D254 IonicContact NH2-OD1 2.68Å; R230-D254 PolarHBondContact NH2-OD1 3.31Å; L250-D254 PolarHBondContact O-N 3.14Å; A251-D254 PolarHBondContact O-N 2.75Å; D254-N256 VanDerWaalsContact C-N 3.31Å; D254-N256 PolarHBondContact O-N 3.48Å; D254-E257 WeakPolarHBondContact O-CB 3.38Å; D254-E257 PolarHBondContact O-N 3.36Å; D254-S262 VanDerWaalsContact CB-O 3.29Å; D254-S262 WeakPolarHBondContact CB-O 3.42Å; D254-S262 WeakPolarHBondContact O-CB 3.38Å; D254-S262 PolarHBondContact O-OG 3.07Å; D254-K269 IonicContact OD1-NZ 3.25Å; D254-K269 WeakPolarHBondContact OD2-CD 3.4Å; D254-K269 WeakPolarHBondContact OD2-CE 3.27Å; D254-K269 IonicContact OD2-NZ 2.71Å; D254-K269 PolarHBondContact OD2-NZ 3.1Å
255	L	90	Very high	90.6	Very high	49 Å²	49	56 Å²	56	26%	0.257	28%	0.279	S	S	.	.	H	α-helix	trans	-64.1	-38.2	175.3	-73	167.8	0	0	0	111.3	A251 E257 K258 I263 L270	A251-L255 WeakPolarHBondContact O-CB 3.41Å; A251-L255 VanDerWaalsContact O-CG 3.28Å; A251-L255 WeakPolarHBondContact O-CG 3.49Å; A251-L255 PolarHBondContact O-N 3.42Å; L255-E257 PolarHBondContact O-N 3.35Å; L255-K258 PolarHBondContact O-N 3.12Å; L255-K258 VanDerWaalsContact O-N 3.11Å; L255-I263 HydrophobicContact CD2-CB 4.49Å; L255-I263 HydrophobicContact CD2-CG1 4.4Å; L255-I263 HydrophobicContact CD2-CG2 4.22Å; L255-L270 HydrophobicContact CD1-CD1 4.03Å
256	N	88.2	Confident	90.7	Very high	95 Å²	95	54.8 Å²	54.8	51%	0.508	27%	0.266	S	S	.	.	H	α-helix	trans	-66.3	-20.8	176.3	-76.3	-28.5	0	0	0	114	V252 L253 D254 K258	V252-N256 WeakPolarHBondContact O-CB 3.22Å; V252-N256 PolarHBondContact O-N 2.87Å; V252-N256 PolarHBondContact O-ND2 2.82Å; L253-N256 PolarHBondContact O-N 3.28Å; D254-N256 VanDerWaalsContact C-N 3.31Å; D254-N256 PolarHBondContact O-N 3.48Å; N256-K258 VanDerWaalsContact C-N 3.26Å; N256-K258 PolarHBondContact O-N 3.29Å
257	E	88.7	Confident	90.6	Very high	102 Å²	102	56 Å²	56	48%	0.477	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-14.5	173.7	-73.5	166	-179.2	0	0	112.9	R230 L253 D254 L255 T259 S262	R230-E257 IonicContact CZ-OE1 2.73Å; R230-E257 IonicContact NE-OE1 3.04Å; R230-E257 IonicContact NH2-OE1 3.84Å; R230-E257 PolarHBondContact NH2-OE1 3.49Å; R230-E257 IonicContact NH2-OE2 3.59Å; R230-E257 PolarHBondContact NH2-OE2 2.81Å; L253-E257 PolarHBondContact O-N 3.47Å; D254-E257 WeakPolarHBondContact O-CB 3.38Å; D254-E257 PolarHBondContact O-N 3.36Å; L255-E257 PolarHBondContact O-N 3.35Å; E257-T259 PolarHBondContact O-N 2.84Å; E257-S262 WeakPolarHBondContact CB-OG 3.2Å; E257-S262 WeakPolarHBondContact OE2-CB 3.23Å
258	K	84.6	Confident	90.5	Very high	174 Å²	174	61 Å²	61	76%	0.757	30%	0.297	S	S	*	.			trans	55.7	10.9	172.8	-60.3	-179.7	-178	-177.1	0	116.7	L255 N256	L255-K258 PolarHBondContact O-N 3.12Å; L255-K258 VanDerWaalsContact O-N 3.11Å; N256-K258 VanDerWaalsContact C-N 3.26Å; N256-K258 PolarHBondContact O-N 3.29Å
259	T	89.1	Confident	90.4	Very high	74 Å²	74	62.9 Å²	62.9	45%	0.454	31%	0.305	S	S	.	.			trans	-83.2	152.3	174.4	74	0	0	0	0	110.7	E257 E261 S262 I263	E257-T259 PolarHBondContact O-N 2.84Å; T259-E261 PolarHBondContact O-N 3.02Å; T259-S262 PolarHBondContact N-OG 3.02Å; T259-S262 VanDerWaalsContact N-OG 3.15Å; T259-S262 PolarHBondContact O-N 2.94Å; T259-S262 PolarHBondContact O-OG 3.47Å; T259-S262 WeakPolarHBondContact OG1-CB 3.23Å; T259-S262 PolarHBondContact OG1-N 2.89Å; T259-S262 PolarHBondContact OG1-OG 3.3Å; T259-I263 WeakPolarHBondContact O-CB 3.36Å; T259-I263 WeakPolarHBondContact O-CD1 3.12Å; T259-I263 VanDerWaalsContact O-CG1 3.24Å; T259-I263 WeakPolarHBondContact O-CG1 3.38Å; T259-I263 PolarHBondContact O-N 3.35Å
260	Q	86.4	Confident	90.5	Very high	162 Å²	162	62.6 Å²	62.6	76%	0.757	30%	0.302	S	S	*	.	H	α-helix	trans	-58.8	-33.9	179.2	-167.5	66.2	13.6	0	0	112.6	K264	Q260-K264 WeakPolarHBondContact O-CB 3.17Å; Q260-K264 PolarHBondContact O-N 3.42Å
261	E	89.4	Confident	90.4	Very high	151 Å²	151	64.8 Å²	64.8	71%	0.706	32%	0.318	S	S	*	.	H	α-helix	trans	-75.7	-43.9	177.7	-66.3	-178.9	-165.9	0	0	112.1	T259 K264 Q265	T259-E261 PolarHBondContact O-N 3.02Å; E261-K264 PolarHBondContact O-N 2.9Å; E261-Q265 WeakPolarHBondContact O-CG 3.25Å; E261-Q265 PolarHBondContact O-N 2.88Å
262	S	89.4	Confident	90.5	Very high	4 Å²	4	70.5 Å²	70.5	3%	0.028	34%	0.339	C	S	.	.	H	α-helix	trans	-66.6	-38.7	177.9	74.2	0	0	0	0	111.3	D254 E257 T259 K264 Q265 G266	D254-S262 VanDerWaalsContact CB-O 3.29Å; D254-S262 WeakPolarHBondContact CB-O 3.42Å; D254-S262 WeakPolarHBondContact O-CB 3.38Å; D254-S262 PolarHBondContact O-OG 3.07Å; E257-S262 WeakPolarHBondContact CB-OG 3.2Å; E257-S262 WeakPolarHBondContact OE2-CB 3.23Å; T259-S262 PolarHBondContact N-OG 3.02Å; T259-S262 VanDerWaalsContact N-OG 3.15Å; T259-S262 PolarHBondContact O-N 2.94Å; T259-S262 PolarHBondContact O-OG 3.47Å; T259-S262 WeakPolarHBondContact OG1-CB 3.23Å; T259-S262 PolarHBondContact OG1-N 2.89Å; T259-S262 PolarHBondContact OG1-OG 3.3Å; S262-K264 PolarHBondContact O-N 3.36Å; S262-Q265 PolarHBondContact O-N 3.21Å; S262-G266 PolarHBondContact O-N 3.4Å
263	I	89	Confident	90.5	Very high	56 Å²	56	69.5 Å²	69.5	29%	0.287	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-46.1	171.5	-66.7	163.5	0	0	0	110.7	L255 T259 Q265 G266 V267	L255-I263 HydrophobicContact CD2-CB 4.49Å; L255-I263 HydrophobicContact CD2-CG1 4.4Å; L255-I263 HydrophobicContact CD2-CG2 4.22Å; T259-I263 WeakPolarHBondContact O-CB 3.36Å; T259-I263 WeakPolarHBondContact O-CD1 3.12Å; T259-I263 VanDerWaalsContact O-CG1 3.24Å; T259-I263 WeakPolarHBondContact O-CG1 3.38Å; T259-I263 PolarHBondContact O-N 3.35Å; I263-Q265 PolarHBondContact O-N 3.34Å; I263-G266 PolarHBondContact O-N 3.09Å; I263-V267 HydrophobicContact CG2-CG2 4.48Å; I263-V267 VanDerWaalsContact O-CG2 3.32Å; I263-V267 WeakPolarHBondContact O-CG2 3.33Å; I263-V267 PolarHBondContact O-N 2.95Å
264	K	90.4	Very high	90.5	Very high	140 Å²	140	73.2 Å²	73.2	61%	0.609	35%	0.347	S	S	*	.	H	α-helix	trans	-61.1	-43	176.6	-175.1	178.5	178	-177.5	0	112.1	Q260 E261 S262 Q268	Q260-K264 WeakPolarHBondContact O-CB 3.17Å; Q260-K264 PolarHBondContact O-N 3.42Å; E261-K264 PolarHBondContact O-N 2.9Å; S262-K264 PolarHBondContact O-N 3.36Å; K264-Q268 VanDerWaalsContact O-CG 3.31Å; K264-Q268 WeakPolarHBondContact O-CG 3.48Å; K264-Q268 PolarHBondContact O-N 2.73Å
265	Q	91.3	Very high	90.6	Very high	88 Å²	88	79.6 Å²	79.6	41%	0.411	38%	0.381	S	S	.	.	H	α-helix	trans	-66.3	-40.4	176.5	-71.5	-174	41.4	0	0	112.7	E261 S262 I263 Q268 K269	E261-Q265 WeakPolarHBondContact O-CG 3.25Å; E261-Q265 PolarHBondContact O-N 2.88Å; S262-Q265 PolarHBondContact O-N 3.21Å; I263-Q265 PolarHBondContact O-N 3.34Å; Q265-Q268 PolarHBondContact O-N 2.84Å; Q265-K269 WeakPolarHBondContact O-CD 3.5Å; Q265-K269 WeakPolarHBondContact O-CG 3.4Å; Q265-K269 PolarHBondContact O-N 3.11Å
266	G	91	Very high	90.7	Very high	0 Å²	0	80.8 Å²	80.8	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-63.4	-45.9	176.9	0	0	0	0	0	111.7	A251 S262 I263 Q268 K269 L270	A251-G266 WeakPolarHBondContact CB-O 3.34Å; S262-G266 PolarHBondContact O-N 3.4Å; I263-G266 PolarHBondContact O-N 3.09Å; G266-Q268 PolarHBondContact O-N 2.72Å; G266-K269 PolarHBondContact O-N 3.28Å; G266-K269 VanDerWaalsContact O-N 3.16Å; G266-L270 WeakPolarHBondContact O-CG 3.46Å; G266-L270 PolarHBondContact O-N 3.16Å
267	V	90.9	Very high	90.7	Very high	26 Å²	26	78.3 Å²	78.3	16%	0.158	37%	0.374	C	S	.	.	H	α-helix	trans	-62.7	-39.7	174.9	173.6	0	0	0	0	111.8	I263 K269 L270 S271 H290	I263-V267 HydrophobicContact CG2-CG2 4.48Å; I263-V267 VanDerWaalsContact O-CG2 3.32Å; I263-V267 WeakPolarHBondContact O-CG2 3.33Å; I263-V267 PolarHBondContact O-N 2.95Å; V267-K269 VanDerWaalsContact C-N 3.32Å; V267-K269 PolarHBondContact O-N 3.48Å; V267-L270 PolarHBondContact O-N 3.11Å; V267-S271 PolarHBondContact O-N 2.98Å; V267-S271 PolarHBondContact O-OG 2.91Å; V267-H290 HydrophobicContact CG2-CB 4.4Å
268	Q	92.4	Very high	90.8	Very high	110 Å²	110	76.2 Å²	76.2	51%	0.514	37%	0.371	S	S	.	.	H	α-helix	trans	-62.1	-37.7	173.6	-77.1	176	-30.1	0	0	112.8	K264 Q265 G266 S271 R272	K264-Q268 VanDerWaalsContact O-CG 3.31Å; K264-Q268 WeakPolarHBondContact O-CG 3.48Å; K264-Q268 PolarHBondContact O-N 2.73Å; Q265-Q268 PolarHBondContact O-N 2.84Å; G266-Q268 PolarHBondContact O-N 2.72Å; Q268-S271 WeakPolarHBondContact CA-OG 3.16Å; Q268-S271 PolarHBondContact O-OG 3.34Å; Q268-R272 PolarHBondContact O-N 3.2Å
269	K	93.1	Very high	91	Very high	44 Å²	44	71.3 Å²	71.3	19%	0.191	36%	0.356	C	S	.	.	H	α-helix	trans	-71.5	-36	175.8	-70.9	158.5	-164.8	163.5	0	111.6	L250 A251 D254 Q265 G266 V267 R272 A273	L250-K269 HydrophobicContact CB-CD 4.16Å; A251-K269 HydrophobicContact CB-CB 3.96Å; D254-K269 IonicContact OD1-NZ 3.25Å; D254-K269 WeakPolarHBondContact OD2-CD 3.4Å; D254-K269 WeakPolarHBondContact OD2-CE 3.27Å; D254-K269 IonicContact OD2-NZ 2.71Å; D254-K269 PolarHBondContact OD2-NZ 3.1Å; Q265-K269 WeakPolarHBondContact O-CD 3.5Å; Q265-K269 WeakPolarHBondContact O-CG 3.4Å; Q265-K269 PolarHBondContact O-N 3.11Å; G266-K269 PolarHBondContact O-N 3.28Å; G266-K269 VanDerWaalsContact O-N 3.16Å; V267-K269 VanDerWaalsContact C-N 3.32Å; V267-K269 PolarHBondContact O-N 3.48Å; K269-R272 PolarHBondContact O-N 2.98Å; K269-A273 WeakPolarHBondContact O-CB 3.3Å; K269-A273 PolarHBondContact O-N 2.57Å
270	L	93.1	Very high	91	Very high	1 Å²	1	69.5 Å²	69.5	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-65.7	-41.3	170.8	-70.3	169.9	0	0	0	112.6	A251 L255 G266 V267 R272 A273 Y274 V283 H286 L287	A251-L270 HydrophobicContact CB-CD2 4.01Å; A251-L270 HydrophobicContact CB-CG 3.8Å; L255-L270 HydrophobicContact CD1-CD1 4.03Å; G266-L270 WeakPolarHBondContact O-CG 3.46Å; G266-L270 PolarHBondContact O-N 3.16Å; V267-L270 PolarHBondContact O-N 3.11Å; L270-R272 VanDerWaalsContact C-N 3.33Å; L270-R272 PolarHBondContact O-N 3.24Å; L270-A273 PolarHBondContact O-N 3.04Å; L270-Y274 WeakPolarHBondContact O-CB 3.22Å; L270-Y274 PolarHBondContact O-N 2.9Å; L270-V283 HydrophobicContact CD2-CG1 4.4Å; L270-H286 HydrophobicContact CD1-CB 3.64Å; L270-H286 HydrophobicContact CD2-CB 3.86Å; L270-H286 HydrophobicContact CG-CB 4.42Å; L270-L287 HydrophobicContact CB-CD2 3.8Å; L270-L287 HydrophobicContact CB-CG 4.21Å; L270-L287 HydrophobicContact CD1-CD2 4.46Å
271	S	92.6	Very high	91.3	Very high	54 Å²	54	62.8 Å²	62.8	38%	0.378	31%	0.314	S	S	.	.	H	α-helix	trans	-65.9	-36.3	175.7	56.8	0	0	0	0	112.1	V267 Q268 N275	V267-S271 PolarHBondContact O-N 2.98Å; V267-S271 PolarHBondContact O-OG 2.91Å; Q268-S271 WeakPolarHBondContact CA-OG 3.16Å; Q268-S271 PolarHBondContact O-OG 3.34Å; S271-N275 PolarHBondContact O-N 2.73Å; S271-N275 VanDerWaalsContact O-N 3.09Å; S271-N275 PolarHBondContact O-OD1 3.04Å
272	R	93.4	Very high	91.4	Very high	120 Å²	120	59 Å²	59	45%	0.453	30%	0.297	S	S	.	.	H	α-helix	trans	-65.4	-42.8	171.1	-178	179.5	165.9	163.5	-4.3	111.4	P241 L247 Q268 K269 L270 Y274 N275 L276	P241-R272 PolarHBondContact O-NH2 3.36Å; L247-R272 HydrophobicContact CD1-CB 4.22Å; L247-R272 HydrophobicContact CD1-CG 3.72Å; Q268-R272 PolarHBondContact O-N 3.2Å; K269-R272 PolarHBondContact O-N 2.98Å; L270-R272 VanDerWaalsContact C-N 3.33Å; L270-R272 PolarHBondContact O-N 3.24Å; R272-Y274 VanDerWaalsContact C-N 3.35Å; R272-Y274 PolarHBondContact O-N 2.83Å; R272-N275 PolarHBondContact O-N 3.19Å; R272-L276 HydrophobicContact CG-CD1 4.22Å; R272-L276 WeakPolarHBondContact O-CG 3.22Å; R272-L276 PolarHBondContact O-N 2.97Å
273	A	93.6	Very high	91.6	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-62.1	-41	177.4	0	0	0	0	0	112.1	V244 L247 V248 K269 L270 L276 D277 V283	V244-A273 HydrophobicContact CG1-CB 4.1Å; L247-A273 HydrophobicContact CB-CB 4.03Å; L247-A273 HydrophobicContact CD1-CB 4.18Å; V248-A273 HydrophobicContact CG2-CB 4.17Å; K269-A273 WeakPolarHBondContact O-CB 3.3Å; K269-A273 PolarHBondContact O-N 2.57Å; L270-A273 PolarHBondContact O-N 3.04Å; A273-L276 PolarHBondContact O-N 3.08Å; A273-D277 PolarHBondContact O-N 3.3Å; A273-V283 HydrophobicContact CB-CG1 4.21Å; A273-V283 HydrophobicContact CB-CG2 3.73Å
274	Y	92.9	Very high	91.8	Very high	87 Å²	87	56.2 Å²	56.2	34%	0.341	28%	0.282	S	S	.	.	H	α-helix	trans	-67.5	-35.5	177.3	178.9	-100.5	0	0	0	113.2	L270 R272 L276 D277 S278 V283 L284 L287 L303	L270-Y274 WeakPolarHBondContact O-CB 3.22Å; L270-Y274 PolarHBondContact O-N 2.9Å; R272-Y274 VanDerWaalsContact C-N 3.35Å; R272-Y274 PolarHBondContact O-N 2.83Å; Y274-L276 PolarHBondContact O-N 3.26Å; Y274-D277 CarbonylContact O-C 3.52Å; Y274-S278 WeakPolarHBondContact O-CA 3.49Å; Y274-S278 PolarHBondContact O-N 2.83Å; Y274-V283 HydrophobicContact CD2-CG1 4.5Å; Y274-L284 HydrophobicContact CD2-CD2 4.19Å; Y274-L284 HydrophobicContact CE2-CD2 3.84Å; Y274-L287 HydrophobicContact CD2-CD1 3.94Å; Y274-L287 HydrophobicContact CG-CD1 3.88Å; Y274-L303 HydrophobicContact CE2-CD2 4.45Å
275	N	93.2	Very high	92	Very high	134 Å²	134	49.7 Å²	49.7	72%	0.717	25%	0.254	S	S	*	.	H	α-helix	trans	-71	-19.4	175.2	-68.8	1.9	0	0	0	112.9	S271 R272	S271-N275 PolarHBondContact O-N 2.73Å; S271-N275 VanDerWaalsContact O-N 3.09Å; S271-N275 PolarHBondContact O-OD1 3.04Å; R272-N275 PolarHBondContact O-N 3.19Å
276	L	91.8	Very high	92	Very high	74 Å²	74	47.4 Å²	47.4	39%	0.387	24%	0.243	S	C	.	.	H	α-helix	trans	-92.3	-42.2	175.1	-70.1	164.7	0	0	0	111.8	E242 V244 L247 R272 A273 Y274	E242-L276 HydrophobicContact CB-CD2 4.16Å; E242-L276 HydrophobicContact CG-CD2 4.09Å; V244-L276 HydrophobicContact CG2-CB 3.81Å; L247-L276 HydrophobicContact CD1-CD1 3.57Å; R272-L276 HydrophobicContact CG-CD1 4.22Å; R272-L276 WeakPolarHBondContact O-CG 3.22Å; R272-L276 PolarHBondContact O-N 2.97Å; A273-L276 PolarHBondContact O-N 3.08Å; Y274-L276 PolarHBondContact O-N 3.26Å
277	D	88.3	Confident	92.1	Very high	43 Å²	43	48 Å²	48	23%	0.23	25%	0.246	C	C	.	.			trans	-140.3	98.7	175.8	176.3	6.7	0	0	0	110.1	V244 A273 Y274 T279 N280	V244-D277 HydrophobicContact CG1-CB 4.18Å; V244-D277 HydrophobicContact CG2-CB 3.84Å; A273-D277 PolarHBondContact O-N 3.3Å; Y274-D277 CarbonylContact O-C 3.52Å; D277-T279 VanDerWaalsContact C-N 3.26Å; D277-T279 PolarHBondContact O-N 3.21Å; D277-T279 WeakPolarHBondContact OD1-CA 3.41Å; D277-T279 WeakPolarHBondContact OD1-CB 3.2Å; D277-T279 PolarHBondContact OD1-N 2.87Å; D277-T279 PolarHBondContact OD1-OG1 2.79Å; D277-N280 HydrophobicContact CB-CB 4.24Å; D277-N280 PolarHBondContact OD1-N 3.39Å; D277-N280 WeakPolarHBondContact OD2-CB 3.14Å; D277-N280 PolarHBondContact OD2-ND2 3.5Å
278	S	90.5	Very high	92.3	Very high	58 Å²	58	46.7 Å²	46.7	41%	0.406	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-7.6	177.4	60.7	0	0	0	0	113.6	Y274 H306	Y274-S278 WeakPolarHBondContact O-CA 3.49Å; Y274-S278 PolarHBondContact O-N 2.83Å; S278-H306 PolarHBondContact O-CE1 3.18Å; S278-H306 PolarHBondContact O-ND1 3.32Å
279	T	89.1	Confident	92.2	Very high	72 Å²	72	43.8 Å²	43.8	44%	0.442	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-18.1	177.7	71.1	0	0	0	0	112.6	D277 P281 L284 N310	D277-T279 VanDerWaalsContact C-N 3.26Å; D277-T279 PolarHBondContact O-N 3.21Å; D277-T279 WeakPolarHBondContact OD1-CA 3.41Å; D277-T279 WeakPolarHBondContact OD1-CB 3.2Å; D277-T279 PolarHBondContact OD1-N 2.87Å; D277-T279 PolarHBondContact OD1-OG1 2.79Å; T279-P281 WeakPolarHBondContact O-CD 3.48Å; T279-L284 WeakPolarHBondContact O-CD1 3.35Å; T279-N310 WeakPolarHBondContact O-CB 3.21Å; T279-N310 PolarHBondContact O-ND2 3.44Å; T279-N310 VanDerWaalsContact O-ND2 3.1Å
280	N	90.3	Very high	92.1	Very high	36 Å²	36	44.6 Å²	44.6	19%	0.193	23%	0.231	C	C	.	.			trans	-57.7	112.8	-171.6	-155.1	-78.5	0	0	0	113.3	D277 M282 V283 L284	D277-N280 HydrophobicContact CB-CB 4.24Å; D277-N280 PolarHBondContact OD1-N 3.39Å; D277-N280 WeakPolarHBondContact OD2-CB 3.14Å; D277-N280 PolarHBondContact OD2-ND2 3.5Å; N280-M282 VanDerWaalsContact C-N 3.26Å; N280-M282 PolarHBondContact O-N 3.35Å; N280-M282 PolarHBondContact OD1-N 2.8Å; N280-V283 HydrophobicContact CB-CB 3.94Å; N280-V283 HydrophobicContact CB-CG2 3.63Å; N280-V283 PolarHBondContact O-N 3.35Å; N280-V283 PolarHBondContact OD1-N 2.96Å; N280-L284 WeakPolarHBondContact O-CB 3.38Å; N280-L284 WeakPolarHBondContact O-CD1 3.47Å; N280-L284 WeakPolarHBondContact O-CG 3.3Å; N280-L284 PolarHBondContact O-N 3.02Å
281	P	91.5	Very high	92.1	Very high	20 Å²	20	46.4 Å²	46.4	13%	0.13	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-27.9	-172.5	29.8	-38	0	0	0	112.6	T279 N285 A307 T311 I316	T279-P281 WeakPolarHBondContact O-CD 3.48Å; P281-N285 WeakPolarHBondContact O-CB 3.4Å; P281-N285 PolarHBondContact O-N 2.82Å; P281-A307 HydrophobicContact CB-CB 4Å; P281-T311 HydrophobicContact CB-CG2 4.39Å; P281-I316 HydrophobicContact CB-CG2 3.91Å; P281-I316 HydrophobicContact CG-CG2 4.35Å
282	M	91	Very high	92.1	Very high	72 Å²	72	44.9 Å²	44.9	36%	0.355	23%	0.225	S	C	.	.	H	α-helix	trans	-75.8	-39.9	178.1	-163.5	173.9	-173.8	0	0	112	V248 V252 N280 H286	V248-M282 HydrophobicContact CG1-CE 4.11Å; V248-M282 HydrophobicContact CG1-CG 3.87Å; V248-M282 HydrophobicContact CG1-SD 3.69Å; V252-M282 HydrophobicContact CG2-CE 4.26Å; N280-M282 VanDerWaalsContact C-N 3.26Å; N280-M282 PolarHBondContact O-N 3.35Å; N280-M282 PolarHBondContact OD1-N 2.8Å; M282-H286 PolarHBondContact O-CD2 2.91Å; M282-H286 PolarHBondContact O-N 2.81Å; M282-H286 VanDerWaalsContact O-N 3.15Å
283	V	93.6	Very high	91.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.1	-46.3	171.7	-178	0	0	0	0	110.2	V244 V248 L270 A273 Y274 N280 H286 L287	V244-V283 HydrophobicContact CG1-CG2 4.04Å; V248-V283 HydrophobicContact CG2-CG2 3.43Å; V248-V283 VanDerWaalsContact CG2-CG2 3.43Å; L270-V283 HydrophobicContact CD2-CG1 4.4Å; A273-V283 HydrophobicContact CB-CG1 4.21Å; A273-V283 HydrophobicContact CB-CG2 3.73Å; Y274-V283 HydrophobicContact CD2-CG1 4.5Å; N280-V283 HydrophobicContact CB-CB 3.94Å; N280-V283 HydrophobicContact CB-CG2 3.63Å; N280-V283 PolarHBondContact O-N 3.35Å; N280-V283 PolarHBondContact OD1-N 2.96Å; V283-H286 PolarHBondContact O-N 3.16Å; V283-L287 HydrophobicContact CG1-CD1 3.92Å; V283-L287 HydrophobicContact CG1-CG 4.33Å; V283-L287 WeakPolarHBondContact O-CB 3.28Å; V283-L287 WeakPolarHBondContact O-CG 3.35Å; V283-L287 PolarHBondContact O-N 3.08Å
284	L	94.5	Very high	91.8	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-61.5	-45	-179.8	-69.5	167.9	0	0	0	112.1	Y274 T279 N280 L287 A288 L303 H306 A307	Y274-L284 HydrophobicContact CD2-CD2 4.19Å; Y274-L284 HydrophobicContact CE2-CD2 3.84Å; T279-L284 WeakPolarHBondContact O-CD1 3.35Å; N280-L284 WeakPolarHBondContact O-CB 3.38Å; N280-L284 WeakPolarHBondContact O-CD1 3.47Å; N280-L284 WeakPolarHBondContact O-CG 3.3Å; N280-L284 PolarHBondContact O-N 3.02Å; L284-L287 PolarHBondContact O-N 3.31Å; L284-A288 WeakPolarHBondContact O-CB 3.38Å; L284-A288 PolarHBondContact O-N 3.33Å; L284-L303 HydrophobicContact CD2-CB 4.38Å; L284-L303 HydrophobicContact CD2-CD2 3.52Å; L284-H306 HydrophobicContact CD1-CB 4.13Å; L284-H306 VanDerWaalsContact CD1-ND1 3.34Å; L284-H306 WeakPolarHBondContact CD1-ND1 3.44Å; L284-A307 HydrophobicContact CB-CB 3.78Å; L284-A307 HydrophobicContact CD1-CB 4.27Å
285	N	93.5	Very high	91.7	Very high	3 Å²	3	55.6 Å²	55.6	2%	0.016	27%	0.274	C	S	.	.	H	α-helix	trans	-62.9	-42.8	175.7	-82.6	-5.2	0	0	0	112.9	P281 A288 D289 A307 I316 E319 S320	P281-N285 WeakPolarHBondContact O-CB 3.4Å; P281-N285 PolarHBondContact O-N 2.82Å; N285-A288 WeakPolarHBondContact O-CB 3.26Å; N285-A288 PolarHBondContact O-N 3.43Å; N285-D289 PolarHBondContact O-N 2.93Å; N285-A307 WeakPolarHBondContact OD1-CB 3.3Å; N285-I316 PolarHBondContact ND2-O 3.35Å; N285-E319 WeakPolarHBondContact ND2-CB 3.46Å; N285-S320 PolarHBondContact ND2-OG 2.94Å; N285-S320 VanDerWaalsContact ND2-OG 3.13Å; N285-S320 WeakPolarHBondContact OD1-CA 3.17Å; N285-S320 PolarHBondContact OD1-OG 2.97Å
286	H	92.5	Very high	91.7	Very high	40 Å²	40	51.6 Å²	51.6	19%	0.185	25%	0.251	C	S	.	.	H	α-helix	trans	-72.2	-32.3	178.5	-67.9	-48.6	0	0	0	112.9	V252 L270 M282 V283 D289 H290	V252-H286 VanDerWaalsContact CG2-NE2 3.33Å; V252-H286 WeakPolarHBondContact CG2-NE2 3.47Å; L270-H286 HydrophobicContact CD1-CB 3.64Å; L270-H286 HydrophobicContact CD2-CB 3.86Å; L270-H286 HydrophobicContact CG-CB 4.42Å; M282-H286 PolarHBondContact O-CD2 2.91Å; M282-H286 PolarHBondContact O-N 2.81Å; M282-H286 VanDerWaalsContact O-N 3.15Å; V283-H286 PolarHBondContact O-N 3.16Å; H286-D289 PolarHBondContact O-N 3.37Å; H286-H290 PolarHBondContact O-N 2.86Å; H286-H290 VanDerWaalsContact O-N 3.1Å
287	L	92.8	Very high	91.8	Very high	12 Å²	12	50.2 Å²	50.2	6%	0.063	24%	0.241	C	C	.	.	H	α-helix	trans	-68.8	-37.9	169.8	-73.7	178.1	0	0	0	111.7	L270 Y274 V283 L284 D289 H290 F291 L303	L270-L287 HydrophobicContact CB-CD2 3.8Å; L270-L287 HydrophobicContact CB-CG 4.21Å; L270-L287 HydrophobicContact CD1-CD2 4.46Å; Y274-L287 HydrophobicContact CD2-CD1 3.94Å; Y274-L287 HydrophobicContact CG-CD1 3.88Å; V283-L287 HydrophobicContact CG1-CD1 3.92Å; V283-L287 HydrophobicContact CG1-CG 4.33Å; V283-L287 WeakPolarHBondContact O-CB 3.28Å; V283-L287 WeakPolarHBondContact O-CG 3.35Å; V283-L287 PolarHBondContact O-N 3.08Å; L284-L287 PolarHBondContact O-N 3.31Å; L287-D289 VanDerWaalsContact C-N 3.33Å; L287-D289 PolarHBondContact O-N 3.23Å; L287-H290 PolarHBondContact O-N 3.23Å; L287-F291 HydrophobicContact CB-CD2 4.44Å; L287-F291 HydrophobicContact CB-CE2 4.38Å; L287-F291 WeakPolarHBondContact O-CD2 3.32Å; L287-F291 PolarHBondContact O-N 3.47Å; L287-L303 HydrophobicContact CB-CD1 4.08Å
288	A	93.7	Very high	92	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.4	-43.3	173.2	0	0	0	0	0	111.4	L284 N285 H290 F291 F292 V300 L303 A304 Q323	L284-A288 WeakPolarHBondContact O-CB 3.38Å; L284-A288 PolarHBondContact O-N 3.33Å; N285-A288 WeakPolarHBondContact O-CB 3.26Å; N285-A288 PolarHBondContact O-N 3.43Å; A288-H290 PolarHBondContact O-N 3.45Å; A288-F291 PolarHBondContact O-N 3.35Å; A288-F292 WeakPolarHBondContact O-CB 3.29Å; A288-F292 PolarHBondContact O-N 2.94Å; A288-V300 HydrophobicContact CB-CG1 4.05Å; A288-V300 WeakPolarHBondContact O-CG2 3.49Å; A288-L303 HydrophobicContact CB-CB 4.15Å; A288-A304 HydrophobicContact CB-CB 4.34Å; A288-Q323 HydrophobicContact CB-CB 4.46Å
289	D	92.1	Very high	92.1	Very high	48 Å²	48	53 Å²	53	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-60	-44	173.3	-162.2	62.2	0	0	0	112.3	N285 H286 L287 F292 Y293 Q323 R326	N285-D289 PolarHBondContact O-N 2.93Å; H286-D289 PolarHBondContact O-N 3.37Å; L287-D289 VanDerWaalsContact C-N 3.33Å; L287-D289 PolarHBondContact O-N 3.23Å; D289-F292 WeakPolarHBondContact O-CB 3.5Å; D289-F292 PolarHBondContact O-N 3.47Å; D289-Y293 VanDerWaalsContact O-CD2 3.23Å; D289-Y293 WeakPolarHBondContact O-CD2 3.16Å; D289-Y293 PolarHBondContact O-N 3.19Å; D289-Q323 PolarHBondContact OD1-NE2 2.79Å; D289-R326 IonicContact OD1-CZ 2.84Å; D289-R326 IonicContact OD1-NH1 3.75Å; D289-R326 PolarHBondContact OD1-NH1 3.21Å; D289-R326 IonicContact OD1-NH2 2.68Å
290	H	90.4	Very high	92.4	Very high	62 Å²	62	49.6 Å²	49.6	29%	0.287	24%	0.235	S	C	.	.	H	α-helix	trans	-62.2	-45.9	175.8	177.5	59.4	0	0	0	112.7	V267 H286 L287 A288 F292 Y293 K294	V267-H290 HydrophobicContact CG2-CB 4.4Å; H286-H290 PolarHBondContact O-N 2.86Å; H286-H290 VanDerWaalsContact O-N 3.1Å; L287-H290 PolarHBondContact O-N 3.23Å; A288-H290 PolarHBondContact O-N 3.45Å; H290-F292 VanDerWaalsContact C-N 3.27Å; H290-F292 PolarHBondContact O-N 3.08Å; H290-Y293 PolarHBondContact O-N 2.95Å; H290-K294 PolarHBondContact O-N 3.48Å; H290-K294 VanDerWaalsContact O-N 3.1Å
291	F	92.3	Very high	92.5	Very high	39 Å²	39	49.3 Å²	49.3	17%	0.171	23%	0.232	C	C	.	.	H	α-helix	trans	-68	-26.1	177.8	-75.2	-63.5	0	0	0	112.9	L287 A288 K294 K295 E296 K299 V300 L303	L287-F291 HydrophobicContact CB-CD2 4.44Å; L287-F291 HydrophobicContact CB-CE2 4.38Å; L287-F291 WeakPolarHBondContact O-CD2 3.32Å; L287-F291 PolarHBondContact O-N 3.47Å; A288-F291 PolarHBondContact O-N 3.35Å; F291-K294 HydrophobicContact CD1-CD 4.37Å; F291-K294 CarbonylContact O-C 3.56Å; F291-K294 PolarHBondContact O-N 2.97Å; F291-K295 PolarHBondContact O-N 3.48Å; F291-K295 VanDerWaalsContact O-N 3.14Å; F291-E296 HydrophobicContact CB-CB 4.31Å; F291-E296 HydrophobicContact CD1-CB 4.04Å; F291-E296 HydrophobicContact CD1-CG 4.47Å; F291-E296 VanDerWaalsContact CD1-OE2 3.29Å; F291-E296 WeakPolarHBondContact CD1-OE2 3.35Å; F291-E296 WeakPolarHBondContact CE1-OE2 3.33Å; F291-E296 PolarHBondContact O-N 2.87Å; F291-K299 HydrophobicContact CB-CB 4.38Å; F291-K299 HydrophobicContact CD1-CD 4.02Å; F291-K299 HydrophobicContact CD2-CB 4.32Å; F291-K299 HydrophobicContact CE1-CD 3.89Å; F291-K299 HydrophobicContact CE2-CD 4.5Å; F291-K299 HydrophobicContact CG-CB 4.18Å; F291-K299 HydrophobicContact CG-CD 4.4Å; F291-K299 HydrophobicContact CZ-CD 4.15Å; F291-V300 HydrophobicContact CB-CG2 3.92Å; F291-L303 HydrophobicContact CD2-CD1 3.43Å; F291-L303 VanDerWaalsContact CD2-CD1 3.43Å; F291-L303 HydrophobicContact CE2-CD1 3.75Å
292	F	93.4	Very high	92.6	Very high	22 Å²	22	57.7 Å²	57.7	10%	0.096	26%	0.261	C	S	.	.	H	α-helix	trans	-63.3	-49.6	172.4	177	-88.4	0	0	0	111.3	A288 D289 H290 K294 K295 Y297 V300 R326 I330	A288-F292 WeakPolarHBondContact O-CB 3.29Å; A288-F292 PolarHBondContact O-N 2.94Å; D289-F292 WeakPolarHBondContact O-CB 3.5Å; D289-F292 PolarHBondContact O-N 3.47Å; H290-F292 VanDerWaalsContact C-N 3.27Å; H290-F292 PolarHBondContact O-N 3.08Å; F292-K294 PolarHBondContact O-N 3.35Å; F292-K295 WeakPolarHBondContact O-CA 3.24Å; F292-K295 PolarHBondContact O-N 2.85Å; F292-Y297 HydrophobicContact CD2-CD1 4.18Å; F292-Y297 HydrophobicContact CD2-CE1 4.04Å; F292-Y297 HydrophobicContact CE2-CE1 4.17Å; F292-V300 HydrophobicContact CB-CG1 4.44Å; F292-V300 HydrophobicContact CB-CG2 3.96Å; F292-R326 HydrophobicContact CD2-CB 4.2Å; F292-R326 HydrophobicContact CE2-CB 3.59Å; F292-R326 HydrophobicContact CZ-CB 4.04Å; F292-I330 HydrophobicContact CE1-CD1 4.24Å; F292-I330 HydrophobicContact CE2-CD1 3.73Å; F292-I330 HydrophobicContact CE2-CG1 4.31Å; F292-I330 HydrophobicContact CZ-CD1 3.34Å; F292-I330 HydrophobicContact CZ-CG1 4.22Å
293	Y	89.3	Confident	92.8	Very high	160 Å²	160	55.2 Å²	55.2	63%	0.627	25%	0.25	S	C	*	.	H	α-helix	trans	-64.9	-27.8	173.9	-71	-70.7	0	0	0	112.9	D289 H290 K295	D289-Y293 VanDerWaalsContact O-CD2 3.23Å; D289-Y293 WeakPolarHBondContact O-CD2 3.16Å; D289-Y293 PolarHBondContact O-N 3.19Å; H290-Y293 PolarHBondContact O-N 2.95Å; Y293-K295 PolarHBondContact O-N 3.37Å
294	K	90.2	Very high	92.8	Very high	118 Å²	118	55.2 Å²	55.2	51%	0.513	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	0.2	171.8	-149	-168.6	171.8	-155.9	0	114	H290 F291 F292 E296	H290-K294 PolarHBondContact O-N 3.48Å; H290-K294 VanDerWaalsContact O-N 3.1Å; F291-K294 HydrophobicContact CD1-CD 4.37Å; F291-K294 CarbonylContact O-C 3.56Å; F291-K294 PolarHBondContact O-N 2.97Å; F292-K294 PolarHBondContact O-N 3.35Å; K294-E296 HydrophobicContact CB-CG 4.5Å; K294-E296 HydrophobicContact CD-CG 4.28Å; K294-E296 WeakPolarHBondContact CD-OE1 3.43Å; K294-E296 VanDerWaalsContact CE-OE1 3.27Å; K294-E296 WeakPolarHBondContact CE-OE1 3.41Å; K294-E296 IonicContact NZ-OE1 2.74Å; K294-E296 PolarHBondContact NZ-OE1 2.98Å; K294-E296 PolarHBondContact O-N 3.3Å
295	K	91.8	Very high	92.7	Very high	153 Å²	153	58.4 Å²	58.4	67%	0.665	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	19.4	-175	-49.7	-167.4	177.1	-173.3	0	115.3	F291 F292 Y293 Y297	F291-K295 PolarHBondContact O-N 3.48Å; F291-K295 VanDerWaalsContact O-N 3.14Å; F292-K295 WeakPolarHBondContact O-CA 3.24Å; F292-K295 PolarHBondContact O-N 2.85Å; Y293-K295 PolarHBondContact O-N 3.37Å; K295-Y297 VanDerWaalsContact C-N 3.28Å; K295-Y297 HydrophobicContact CB-CE2 3.88Å; K295-Y297 WeakPolarHBondContact CG-OH 3.23Å; K295-Y297 VanDerWaalsContact O-CD2 3.29Å; K295-Y297 WeakPolarHBondContact O-CD2 3.47Å; K295-Y297 WeakPolarHBondContact O-CE2 3.45Å; K295-Y297 PolarHBondContact O-N 2.95Å; K295-Y297 VanDerWaalsContact O-N 3.13Å
296	E	93.5	Very high	92.7	Very high	51 Å²	51	62 Å²	62	24%	0.238	28%	0.282	C	S	.	.			trans	-89.6	54.8	179.4	-68	-172	-169.8	0	0	111.7	F291 K294 A298 K299 V300	F291-E296 HydrophobicContact CB-CB 4.31Å; F291-E296 HydrophobicContact CD1-CB 4.04Å; F291-E296 HydrophobicContact CD1-CG 4.47Å; F291-E296 VanDerWaalsContact CD1-OE2 3.29Å; F291-E296 WeakPolarHBondContact CD1-OE2 3.35Å; F291-E296 WeakPolarHBondContact CE1-OE2 3.33Å; F291-E296 PolarHBondContact O-N 2.87Å; K294-E296 HydrophobicContact CB-CG 4.5Å; K294-E296 HydrophobicContact CD-CG 4.28Å; K294-E296 WeakPolarHBondContact CD-OE1 3.43Å; K294-E296 VanDerWaalsContact CE-OE1 3.27Å; K294-E296 WeakPolarHBondContact CE-OE1 3.41Å; K294-E296 IonicContact NZ-OE1 2.74Å; K294-E296 PolarHBondContact NZ-OE1 2.98Å; K294-E296 PolarHBondContact O-N 3.3Å; E296-A298 PolarHBondContact O-N 2.95Å; E296-K299 WeakPolarHBondContact O-CB 3.41Å; E296-K299 PolarHBondContact O-N 3.04Å; E296-K299 VanDerWaalsContact OE2-CD 3.27Å; E296-K299 WeakPolarHBondContact OE2-CD 3.34Å; E296-K299 WeakPolarHBondContact OE2-CE 3.19Å; E296-K299 IonicContact OE2-NZ 3.05Å; E296-K299 PolarHBondContact OE2-NZ 3.1Å; E296-V300 PolarHBondContact O-N 2.97Å
297	Y	93.2	Very high	92.7	Very high	44 Å²	44	60 Å²	60	17%	0.173	27%	0.274	C	S	.	.	H	α-helix	trans	-53.5	-32	-169	-51.2	-65.8	0	0	0	114.9	F292 K295 K299 V300 H301 I330	F292-Y297 HydrophobicContact CD2-CD1 4.18Å; F292-Y297 HydrophobicContact CD2-CE1 4.04Å; F292-Y297 HydrophobicContact CE2-CE1 4.17Å; K295-Y297 VanDerWaalsContact C-N 3.28Å; K295-Y297 HydrophobicContact CB-CE2 3.88Å; K295-Y297 WeakPolarHBondContact CG-OH 3.23Å; K295-Y297 VanDerWaalsContact O-CD2 3.29Å; K295-Y297 WeakPolarHBondContact O-CD2 3.47Å; K295-Y297 WeakPolarHBondContact O-CE2 3.45Å; K295-Y297 PolarHBondContact O-N 2.95Å; K295-Y297 VanDerWaalsContact O-N 3.13Å; Y297-K299 VanDerWaalsContact C-N 3.26Å; Y297-K299 PolarHBondContact O-N 3.43Å; Y297-V300 WeakPolarHBondContact O-CB 3.32Å; Y297-V300 PolarHBondContact O-N 2.88Å; Y297-H301 PolarHBondContact O-N 3.24Å; Y297-H301 VanDerWaalsContact O-N 3.13Å; Y297-H301 PolarHBondContact O-ND1 3.2Å; Y297-I330 HydrophobicContact CE1-CB 4.41Å; Y297-I330 HydrophobicContact CE1-CD1 4.41Å; Y297-I330 HydrophobicContact CE1-CG2 4.06Å; Y297-I330 HydrophobicContact CE2-CG2 4.15Å
298	A	92.7	Very high	92.7	Very high	66 Å²	66	61.8 Å²	61.8	55%	0.545	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-28.4	175.9	0	0	0	0	0	113.3	E296 R302	E296-A298 PolarHBondContact O-N 2.95Å; A298-R302 WeakPolarHBondContact O-CG 3.36Å; A298-R302 PolarHBondContact O-N 2.87Å
299	K	92.6	Very high	92.5	Very high	95 Å²	95	68.9 Å²	68.9	41%	0.413	31%	0.309	S	S	.	.	H	α-helix	trans	-80.1	-37.4	172.5	-64.9	-174.9	-170.4	164.4	0	111.8	F291 E296 Y297 H301 R302 L303	F291-K299 HydrophobicContact CB-CB 4.38Å; F291-K299 HydrophobicContact CD1-CD 4.02Å; F291-K299 HydrophobicContact CD2-CB 4.32Å; F291-K299 HydrophobicContact CE1-CD 3.89Å; F291-K299 HydrophobicContact CE2-CD 4.5Å; F291-K299 HydrophobicContact CG-CB 4.18Å; F291-K299 HydrophobicContact CG-CD 4.4Å; F291-K299 HydrophobicContact CZ-CD 4.15Å; E296-K299 WeakPolarHBondContact O-CB 3.41Å; E296-K299 PolarHBondContact O-N 3.04Å; E296-K299 VanDerWaalsContact OE2-CD 3.27Å; E296-K299 WeakPolarHBondContact OE2-CD 3.34Å; E296-K299 WeakPolarHBondContact OE2-CE 3.19Å; E296-K299 IonicContact OE2-NZ 3.05Å; E296-K299 PolarHBondContact OE2-NZ 3.1Å; Y297-K299 VanDerWaalsContact C-N 3.26Å; Y297-K299 PolarHBondContact O-N 3.43Å; K299-H301 VanDerWaalsContact C-N 3.32Å; K299-H301 PolarHBondContact O-N 2.81Å; K299-R302 PolarHBondContact O-N 2.9Å; K299-L303 HydrophobicContact CB-CD1 4.42Å; K299-L303 WeakPolarHBondContact O-CB 3.49Å; K299-L303 VanDerWaalsContact O-CG 3.24Å; K299-L303 WeakPolarHBondContact O-CG 3.4Å; K299-L303 PolarHBondContact O-N 3.3Å
300	V	94.7	Very high	92.2	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-52.8	-51.8	175.1	-173.4	0	0	0	0	110.2	A288 F291 F292 E296 Y297 L303 A304 Q323 A327	A288-V300 HydrophobicContact CB-CG1 4.05Å; A288-V300 WeakPolarHBondContact O-CG2 3.49Å; F291-V300 HydrophobicContact CB-CG2 3.92Å; F292-V300 HydrophobicContact CB-CG1 4.44Å; F292-V300 HydrophobicContact CB-CG2 3.96Å; E296-V300 PolarHBondContact O-N 2.97Å; Y297-V300 WeakPolarHBondContact O-CB 3.32Å; Y297-V300 PolarHBondContact O-N 2.88Å; V300-L303 PolarHBondContact O-N 3.26Å; V300-A304 VanDerWaalsContact O-CB 3.24Å; V300-A304 WeakPolarHBondContact O-CB 3.33Å; V300-A304 PolarHBondContact O-N 2.75Å; V300-Q323 HydrophobicContact CG1-CB 4.4Å; V300-A327 HydrophobicContact CB-CB 4.29Å; V300-A327 HydrophobicContact CG1-CB 4.01Å
301	H	93.2	Very high	92	Very high	30 Å²	30	66.4 Å²	66.4	14%	0.139	30%	0.298	C	S	.	.	H	α-helix	trans	-58.5	-50	176.5	-69.9	99.4	0	0	0	112.8	Y297 K299 L303 L305 A327 F328 Q331	Y297-H301 PolarHBondContact O-N 3.24Å; Y297-H301 VanDerWaalsContact O-N 3.13Å; Y297-H301 PolarHBondContact O-ND1 3.2Å; K299-H301 VanDerWaalsContact C-N 3.32Å; K299-H301 PolarHBondContact O-N 2.81Å; H301-L303 PolarHBondContact O-N 3.09Å; H301-L305 WeakPolarHBondContact O-CB 3.41Å; H301-L305 PolarHBondContact O-N 2.76Å; H301-A327 WeakPolarHBondContact CE1-CB 3.37Å; H301-F328 AromaticContact CD2-CE2 3.48Å; H301-F328 VanDerWaalsContact CD2-CE2 3.48Å; H301-F328 WeakPolarHBondContact CD2-CE2 3.26Å; H301-F328 AromaticContact CD2-CZ 3.56Å; H301-F328 AromaticContact NE2-CD1 3.62Å; H301-F328 AromaticContact NE2-CD2 3.42Å; H301-F328 WeakPolarHBondContact NE2-CD2 3.45Å; H301-F328 AromaticContact NE2-CE1 3.56Å; H301-F328 AromaticContact NE2-CE2 3.34Å; H301-F328 VanDerWaalsContact NE2-CE2 3.34Å; H301-F328 WeakPolarHBondContact NE2-CE2 3.24Å; H301-F328 AromaticContact NE2-CG 3.56Å; H301-F328 AromaticContact NE2-CZ 3.42Å; H301-F328 WeakPolarHBondContact NE2-CZ 3.21Å; H301-Q331 PolarHBondContact CE1-OE1 3.43Å; H301-Q331 VanDerWaalsContact CE1-OE1 3.23Å
302	R	93.6	Very high	91.4	Very high	195 Å²	195	68.1 Å²	68.1	74%	0.736	31%	0.306	S	S	*	.	H	α-helix	trans	-61.1	-43.4	-179	-71.6	175.6	-175.6	-173.9	1.7	112.5	A298 K299 H306	A298-R302 WeakPolarHBondContact O-CG 3.36Å; A298-R302 PolarHBondContact O-N 2.87Å; K299-R302 PolarHBondContact O-N 2.9Å; R302-H306 WeakPolarHBondContact O-CB 3.13Å; R302-H306 PolarHBondContact O-N 3.48Å; R302-H306 VanDerWaalsContact O-N 3.1Å
303	L	94.2	Very high	90.9	Very high	21 Å²	21	70.5 Å²	70.5	11%	0.11	32%	0.323	C	S	.	.	H	α-helix	trans	-71.4	-46	-178.5	-65.1	167.7	0	0	0	111.5	Y274 L284 L287 A288 F291 K299 V300 H301 H306 A307	Y274-L303 HydrophobicContact CE2-CD2 4.45Å; L284-L303 HydrophobicContact CD2-CB 4.38Å; L284-L303 HydrophobicContact CD2-CD2 3.52Å; L287-L303 HydrophobicContact CB-CD1 4.08Å; A288-L303 HydrophobicContact CB-CB 4.15Å; F291-L303 HydrophobicContact CD2-CD1 3.43Å; F291-L303 VanDerWaalsContact CD2-CD1 3.43Å; F291-L303 HydrophobicContact CE2-CD1 3.75Å; K299-L303 HydrophobicContact CB-CD1 4.42Å; K299-L303 WeakPolarHBondContact O-CB 3.49Å; K299-L303 VanDerWaalsContact O-CG 3.24Å; K299-L303 WeakPolarHBondContact O-CG 3.4Å; K299-L303 PolarHBondContact O-N 3.3Å; V300-L303 PolarHBondContact O-N 3.26Å; H301-L303 PolarHBondContact O-N 3.09Å; L303-H306 PolarHBondContact O-N 2.92Å; L303-A307 WeakPolarHBondContact O-CB 3.47Å; L303-A307 PolarHBondContact O-N 3.31Å
304	A	94.4	Very high	90.8	Very high	0 Å²	0	69 Å²	69	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-67.5	-36.6	178.9	0	0	0	0	0	112.5	A288 V300 A307 F308 S320 Q323 M324	A288-A304 HydrophobicContact CB-CB 4.34Å; V300-A304 VanDerWaalsContact O-CB 3.24Å; V300-A304 WeakPolarHBondContact O-CB 3.33Å; V300-A304 PolarHBondContact O-N 2.75Å; A304-A307 WeakPolarHBondContact O-CB 3.26Å; A304-A307 PolarHBondContact O-N 3.5Å; A304-F308 WeakPolarHBondContact O-CB 3.37Å; A304-F308 PolarHBondContact O-N 3.37Å; A304-S320 WeakPolarHBondContact O-CB 3.49Å; A304-Q323 HydrophobicContact CB-CB 4.14Å; A304-M324 HydrophobicContact CB-CG 3.65Å; A304-M324 HydrophobicContact CB-SD 4.39Å
305	L	93.5	Very high	90.7	Very high	67 Å²	67	65.8 Å²	65.8	35%	0.351	31%	0.314	S	S	.	.	H	α-helix	trans	-66.2	-40.4	173.7	-170.2	68.2	0	0	0	111.5	H301 F308 Y309 M324	H301-L305 WeakPolarHBondContact O-CB 3.41Å; H301-L305 PolarHBondContact O-N 2.76Å; L305-F308 PolarHBondContact O-N 3.41Å; L305-Y309 HydrophobicContact CD1-CD2 4.14Å; L305-Y309 HydrophobicContact CD1-CE2 3.51Å; L305-Y309 HydrophobicContact CD2-CE2 4.35Å; L305-Y309 HydrophobicContact CG-CD2 4.01Å; L305-Y309 HydrophobicContact CG-CE2 3.7Å; L305-Y309 VanDerWaalsContact O-CD2 3.24Å; L305-Y309 WeakPolarHBondContact O-CD2 3.22Å; L305-Y309 PolarHBondContact O-N 2.96Å; L305-M324 HydrophobicContact CB-SD 4.11Å; L305-M324 HydrophobicContact CD1-SD 4.07Å
306	H	92.3	Very high	90.6	Very high	78 Å²	78	60.1 Å²	60.1	36%	0.361	29%	0.291	S	S	.	.	H	α-helix	trans	-65.7	-39.2	174.5	-167.3	-132	0	0	0	111.7	S278 L284 R302 L303 N310	S278-H306 PolarHBondContact O-CE1 3.18Å; S278-H306 PolarHBondContact O-ND1 3.32Å; L284-H306 HydrophobicContact CD1-CB 4.13Å; L284-H306 VanDerWaalsContact CD1-ND1 3.34Å; L284-H306 WeakPolarHBondContact CD1-ND1 3.44Å; R302-H306 WeakPolarHBondContact O-CB 3.13Å; R302-H306 PolarHBondContact O-N 3.48Å; R302-H306 VanDerWaalsContact O-N 3.1Å; L303-H306 PolarHBondContact O-N 2.92Å; H306-N310 PolarHBondContact CD2-ND2 3.33Å; H306-N310 PolarHBondContact CE1-ND2 3.13Å; H306-N310 PolarHBondContact NE2-ND2 2.99Å; H306-N310 VanDerWaalsContact NE2-ND2 3.12Å; H306-N310 VanDerWaalsContact O-CB 3.3Å; H306-N310 WeakPolarHBondContact O-CB 3.33Å; H306-N310 PolarHBondContact O-N 3.05Å; H306-N310 VanDerWaalsContact O-N 3.15Å; H306-N310 PolarHBondContact O-ND2 2.91Å
307	A	92.8	Very high	90.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-47.6	173.5	0	0	0	0	0	112.1	P281 L284 N285 L303 A304 Y309 N310 T311 S320	P281-A307 HydrophobicContact CB-CB 4Å; L284-A307 HydrophobicContact CB-CB 3.78Å; L284-A307 HydrophobicContact CD1-CB 4.27Å; N285-A307 WeakPolarHBondContact OD1-CB 3.3Å; L303-A307 WeakPolarHBondContact O-CB 3.47Å; L303-A307 PolarHBondContact O-N 3.31Å; A304-A307 WeakPolarHBondContact O-CB 3.26Å; A304-A307 PolarHBondContact O-N 3.5Å; A307-Y309 PolarHBondContact O-N 3.05Å; A307-N310 PolarHBondContact O-N 3.32Å; A307-N310 VanDerWaalsContact O-N 3.13Å; A307-T311 PolarHBondContact O-N 3.39Å; A307-S320 WeakPolarHBondContact CB-OG 3.42Å
308	F	91.8	Very high	90.5	Very high	48 Å²	48	59 Å²	59	21%	0.211	28%	0.284	C	S	.	.	H	α-helix	trans	-57.4	-44.9	179.8	-178.2	-92.9	0	0	0	112.5	A304 L305 N310 R317 C321 L347	A304-F308 WeakPolarHBondContact O-CB 3.37Å; A304-F308 PolarHBondContact O-N 3.37Å; L305-F308 PolarHBondContact O-N 3.41Å; F308-N310 VanDerWaalsContact C-N 3.35Å; F308-R317 HydrophobicContact CD2-CB 3.79Å; F308-R317 HydrophobicContact CD2-CG 3.97Å; F308-R317 HydrophobicContact CE2-CB 3.83Å; F308-R317 HydrophobicContact CE2-CG 4.09Å; F308-C321 VanDerWaalsContact CE2-SG 3.53Å; F308-L347 HydrophobicContact CE2-CD1 4.26Å
309	Y	89.7	Confident	90.6	Very high	150 Å²	150	59.1 Å²	59.1	59%	0.588	27%	0.273	S	S	*	.	H	α-helix	trans	-80.2	-8	178.4	-68.5	-55.9	0	0	0	114.9	K113 L305 A307	K113-Y309 WeakPolarHBondContact CE-O 3.27Å; K113-Y309 PolarHBondContact NZ-O 3.41Å; L305-Y309 HydrophobicContact CD1-CD2 4.14Å; L305-Y309 HydrophobicContact CD1-CE2 3.51Å; L305-Y309 HydrophobicContact CD2-CE2 4.35Å; L305-Y309 HydrophobicContact CG-CD2 4.01Å; L305-Y309 HydrophobicContact CG-CE2 3.7Å; L305-Y309 VanDerWaalsContact O-CD2 3.24Å; L305-Y309 WeakPolarHBondContact O-CD2 3.22Å; L305-Y309 PolarHBondContact O-N 2.96Å; A307-Y309 PolarHBondContact O-N 3.05Å
310	N	87.5	Confident	90.6	Very high	42 Å²	42	54.6 Å²	54.6	23%	0.225	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	3.2	177.9	-72.6	-17	0	0	0	113.9	K113 T279 H306 A307 F308	K113-N310 PolarHBondContact NZ-OD1 2.97Å; T279-N310 WeakPolarHBondContact O-CB 3.21Å; T279-N310 PolarHBondContact O-ND2 3.44Å; T279-N310 VanDerWaalsContact O-ND2 3.1Å; H306-N310 PolarHBondContact CD2-ND2 3.33Å; H306-N310 PolarHBondContact CE1-ND2 3.13Å; H306-N310 PolarHBondContact NE2-ND2 2.99Å; H306-N310 VanDerWaalsContact NE2-ND2 3.12Å; H306-N310 VanDerWaalsContact O-CB 3.3Å; H306-N310 WeakPolarHBondContact O-CB 3.33Å; H306-N310 PolarHBondContact O-N 3.05Å; H306-N310 VanDerWaalsContact O-N 3.15Å; H306-N310 PolarHBondContact O-ND2 2.91Å; A307-N310 PolarHBondContact O-N 3.32Å; A307-N310 VanDerWaalsContact O-N 3.13Å; F308-N310 VanDerWaalsContact C-N 3.35Å
311	T	85	Confident	90.6	Very high	16 Å²	16	54.6 Å²	54.6	10%	0.098	25%	0.253	C	S	.	.			trans	-130	148.6	176.2	-164.4	0	0	0	0	111.9	P281 A307 T313 I316 R317	P281-T311 HydrophobicContact CB-CG2 4.39Å; A307-T311 PolarHBondContact O-N 3.39Å; T311-T313 PolarHBondContact OG1-N 3.18Å; T311-T313 VanDerWaalsContact OG1-N 3.15Å; T311-I316 HydrophobicContact CG2-CB 4.01Å; T311-I316 HydrophobicContact CG2-CG2 4.04Å; T311-R317 HydrophobicContact CG2-CG 3.61Å; T311-R317 PolarHBondContact O-NE 3.14Å; T311-R317 PolarHBondContact O-NH2 3.05Å
312	E	79.5	Confident	90.8	Very high	74 Å²	74	54.8 Å²	54.8	35%	0.346	25%	0.253	S	S	.	.			trans	-93.9	-17.5	162.5	-64.9	-147	109	0	0	112.7	K118 E314	K118-E312 IonicContact NZ-OE2 2.65Å; K118-E312 PolarHBondContact NZ-OE2 3.47Å; E312-E314 PolarHBondContact O-N 2.84Å
313	T	83.4	Confident	90.8	Very high	73 Å²	73	46.3 Å²	46.3	45%	0.448	22%	0.222	S	C	.	.			trans	-71.5	112.8	-171	-48.3	0	0	0	0	111.4	T311 S315 I316 R317	T311-T313 PolarHBondContact OG1-N 3.18Å; T311-T313 VanDerWaalsContact OG1-N 3.15Å; T313-S315 VanDerWaalsContact C-N 3.3Å; T313-S315 PolarHBondContact O-N 2.66Å; T313-I316 HydrophobicContact CG2-CD1 4.28Å; T313-I316 HydrophobicContact CG2-CG1 4.16Å; T313-I316 PolarHBondContact O-N 3.04Å; T313-R317 PolarHBondContact O-N 3.19Å
314	E	87.1	Confident	90.8	Very high	129 Å²	129	45.5 Å²	45.5	60%	0.603	22%	0.218	S	C	*	.	H	α-helix	trans	-52.7	-43	-174.2	-60.8	179.2	142.7	0	0	113.1	E312 I316 R317 A318 L347	E312-E314 PolarHBondContact O-N 2.84Å; E314-I316 VanDerWaalsContact C-N 3.29Å; E314-I316 PolarHBondContact O-N 3.26Å; E314-R317 CarbonylContact O-C 3.37Å; E314-R317 WeakPolarHBondContact O-CB 3.48Å; E314-R317 PolarHBondContact O-N 3.01Å; E314-R317 VanDerWaalsContact O-N 3.15Å; E314-A318 WeakPolarHBondContact O-CB 3.41Å; E314-A318 PolarHBondContact O-N 2.9Å; E314-L347 CarbonylContact C-O 3.43Å; E314-L347 HydrophobicContact CB-CD2 4.32Å; E314-L347 HydrophobicContact CG-CD2 4.29Å
315	S	87.3	Confident	90.9	Very high	49 Å²	49	45.5 Å²	45.5	34%	0.343	22%	0.218	S	C	.	.	H	α-helix	trans	-61.5	-35.1	178.1	64.9	0	0	0	0	113.5	T313 E319	T313-S315 VanDerWaalsContact C-N 3.3Å; T313-S315 PolarHBondContact O-N 2.66Å; S315-E319 PolarHBondContact O-N 3.45Å; S315-E319 VanDerWaalsContact O-N 3.16Å
316	I	89.7	Confident	90.9	Very high	35 Å²	35	43.6 Å²	43.6	18%	0.179	21%	0.206	C	C	.	.	H	α-helix	trans	-77.3	-36.5	178.2	-53.2	179.1	0	0	0	109.6	P281 N285 T311 T313 E314 A318 E319 S320	P281-I316 HydrophobicContact CB-CG2 3.91Å; P281-I316 HydrophobicContact CG-CG2 4.35Å; N285-I316 PolarHBondContact ND2-O 3.35Å; T311-I316 HydrophobicContact CG2-CB 4.01Å; T311-I316 HydrophobicContact CG2-CG2 4.04Å; T313-I316 HydrophobicContact CG2-CD1 4.28Å; T313-I316 HydrophobicContact CG2-CG1 4.16Å; T313-I316 PolarHBondContact O-N 3.04Å; E314-I316 VanDerWaalsContact C-N 3.29Å; E314-I316 PolarHBondContact O-N 3.26Å; I316-A318 VanDerWaalsContact C-N 3.34Å; I316-E319 PolarHBondContact O-N 3.33Å; I316-S320 PolarHBondContact O-N 2.99Å; I316-S320 PolarHBondContact O-OG 2.75Å
317	R	92.4	Very high	91.1	Very high	71 Å²	71	39.9 Å²	39.9	27%	0.268	19%	0.189	S	C	.	.	H	α-helix	trans	-61.6	-40.1	170.1	-65.6	-172.2	171	159	-4.5	111.9	F308 T311 T313 E314 S320 C321 L347	F308-R317 HydrophobicContact CD2-CB 3.79Å; F308-R317 HydrophobicContact CD2-CG 3.97Å; F308-R317 HydrophobicContact CE2-CB 3.83Å; F308-R317 HydrophobicContact CE2-CG 4.09Å; T311-R317 HydrophobicContact CG2-CG 3.61Å; T311-R317 PolarHBondContact O-NE 3.14Å; T311-R317 PolarHBondContact O-NH2 3.05Å; T313-R317 PolarHBondContact O-N 3.19Å; E314-R317 CarbonylContact O-C 3.37Å; E314-R317 WeakPolarHBondContact O-CB 3.48Å; E314-R317 PolarHBondContact O-N 3.01Å; E314-R317 VanDerWaalsContact O-N 3.15Å; R317-S320 WeakPolarHBondContact O-CB 3.48Å; R317-S320 PolarHBondContact O-N 3.11Å; R317-C321 WeakPolarHBondContact O-CB 3.3Å; R317-C321 PolarHBondContact O-N 2.94Å; R317-C321 PolarHBondContact O-SG 3.21Å; R317-C321 VanDerWaalsContact O-SG 3.36Å; R317-L347 HydrophobicContact CB-CD1 3.89Å
318	A	93.9	Very high	91.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-43.8	176.4	0	0	0	0	0	112.1	E314 I316 C321 Y322 L347 F352	E314-A318 WeakPolarHBondContact O-CB 3.41Å; E314-A318 PolarHBondContact O-N 2.9Å; I316-A318 VanDerWaalsContact C-N 3.34Å; A318-C321 PolarHBondContact O-N 2.84Å; A318-Y322 VanDerWaalsContact O-CB 3.28Å; A318-Y322 WeakPolarHBondContact O-CB 3.38Å; A318-Y322 PolarHBondContact O-N 3.22Å; A318-L347 HydrophobicContact CB-CB 3.85Å; A318-F352 HydrophobicContact CB-CD1 4.07Å; A318-F352 HydrophobicContact CB-CE1 4.16Å
319	E	93.1	Very high	91.3	Very high	68 Å²	68	41 Å²	41	32%	0.318	19%	0.194	S	C	.	.	H	α-helix	trans	-60.2	-43.8	171.8	-74.9	176.5	-174.8	0	0	111.8	N285 S315 I316 Y322 Q323 F352	N285-E319 WeakPolarHBondContact ND2-CB 3.46Å; S315-E319 PolarHBondContact O-N 3.45Å; S315-E319 VanDerWaalsContact O-N 3.16Å; I316-E319 PolarHBondContact O-N 3.33Å; E319-Y322 PolarHBondContact O-N 3.1Å; E319-Q323 WeakPolarHBondContact O-CG 3.34Å; E319-Q323 PolarHBondContact O-N 3.03Å; E319-F352 HydrophobicContact CG-CE1 4.5Å; E319-F352 HydrophobicContact CG-CE2 4.36Å; E319-F352 HydrophobicContact CG-CZ 4.13Å
320	S	94.1	Very high	91.5	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-46.8	177.7	-58.1	0	0	0	0	112	N285 A304 A307 I316 R317 Y322 Q323 M324	N285-S320 PolarHBondContact ND2-OG 2.94Å; N285-S320 VanDerWaalsContact ND2-OG 3.13Å; N285-S320 WeakPolarHBondContact OD1-CA 3.17Å; N285-S320 PolarHBondContact OD1-OG 2.97Å; A304-S320 WeakPolarHBondContact O-CB 3.49Å; A307-S320 WeakPolarHBondContact CB-OG 3.42Å; I316-S320 PolarHBondContact O-N 2.99Å; I316-S320 PolarHBondContact O-OG 2.75Å; R317-S320 WeakPolarHBondContact O-CB 3.48Å; R317-S320 PolarHBondContact O-N 3.11Å; S320-Y322 VanDerWaalsContact C-N 3.35Å; S320-Y322 PolarHBondContact O-N 2.92Å; S320-Q323 PolarHBondContact O-N 2.77Å; S320-M324 WeakPolarHBondContact O-CG 3.22Å; S320-M324 PolarHBondContact O-N 3.06Å
321	C	95.1	Very high	91.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-43.1	173.2	-71.9	0	0	0	0	111.6	F308 R317 A318 Q323 M324 A325 Y340 A344	F308-C321 VanDerWaalsContact CE2-SG 3.53Å; R317-C321 WeakPolarHBondContact O-CB 3.3Å; R317-C321 PolarHBondContact O-N 2.94Å; R317-C321 PolarHBondContact O-SG 3.21Å; R317-C321 VanDerWaalsContact O-SG 3.36Å; A318-C321 PolarHBondContact O-N 2.84Å; C321-Q323 PolarHBondContact O-N 2.79Å; C321-M324 PolarHBondContact O-N 3.41Å; C321-A325 WeakPolarHBondContact O-CB 3.42Å; C321-A325 PolarHBondContact O-N 3.33Å; C321-Y340 HydrophobicContact CB-CD1 4.43Å; C321-A344 HydrophobicContact CB-CB 3.8Å
322	Y	95.7	Very high	92.1	Very high	34 Å²	34	46.6 Å²	46.6	13%	0.133	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-39.5	176.3	173.7	-107.2	0	0	0	112.8	A318 E319 S320 A325 R326 Y341 F352 L354 P355	A318-Y322 VanDerWaalsContact O-CB 3.28Å; A318-Y322 WeakPolarHBondContact O-CB 3.38Å; A318-Y322 PolarHBondContact O-N 3.22Å; E319-Y322 PolarHBondContact O-N 3.1Å; S320-Y322 VanDerWaalsContact C-N 3.35Å; S320-Y322 PolarHBondContact O-N 2.92Å; Y322-A325 PolarHBondContact O-N 2.93Å; Y322-R326 HydrophobicContact CE1-CG 4.41Å; Y322-R326 HydrophobicContact CE2-CG 4.15Å; Y322-R326 VanDerWaalsContact O-CG 3.31Å; Y322-R326 WeakPolarHBondContact O-CG 3.29Å; Y322-R326 PolarHBondContact O-N 3.37Å; Y322-Y341 HydrophobicContact CD2-CD1 4.26Å; Y322-Y341 AromaticContact CD2-CE1 3.89Å; Y322-Y341 HydrophobicContact CD2-CE1 3.89Å; Y322-Y341 HydrophobicContact CE2-CE1 4.05Å; Y322-F352 HydrophobicContact CD1-CE2 4.45Å; Y322-F352 AromaticContact CD1-CZ 3.73Å; Y322-F352 HydrophobicContact CD1-CZ 3.73Å; Y322-F352 HydrophobicContact CD2-CZ 4.39Å; Y322-F352 HydrophobicContact CE1-CZ 4.42Å; Y322-F352 HydrophobicContact CG-CE1 4.26Å; Y322-F352 AromaticContact CG-CZ 3.71Å; Y322-F352 HydrophobicContact CG-CZ 3.71Å; Y322-L354 HydrophobicContact CD2-CB 4.3Å; Y322-L354 HydrophobicContact CE1-CB 4.22Å; Y322-L354 HydrophobicContact CE1-CD1 4.02Å; Y322-L354 HydrophobicContact CE2-CB 3.56Å; Y322-P355 HydrophobicContact CD2-CG 4.07Å; Y322-P355 HydrophobicContact CG-CG 4.49Å
323	Q	95	Very high	92.7	Very high	17 Å²	17	46 Å²	46	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-68.3	-37.9	175.5	-66.1	-63.7	2.2	0	0	112.7	A288 D289 V300 A304 E319 S320 C321 A327	A288-Q323 HydrophobicContact CB-CB 4.46Å; D289-Q323 PolarHBondContact OD1-NE2 2.79Å; V300-Q323 HydrophobicContact CG1-CB 4.4Å; A304-Q323 HydrophobicContact CB-CB 4.14Å; E319-Q323 WeakPolarHBondContact O-CG 3.34Å; E319-Q323 PolarHBondContact O-N 3.03Å; S320-Q323 PolarHBondContact O-N 2.77Å; C321-Q323 PolarHBondContact O-N 2.79Å; Q323-A327 WeakPolarHBondContact O-CB 3.49Å; Q323-A327 PolarHBondContact O-N 2.82Å
324	M	94.4	Very high	93.2	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.02	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-45.7	171.6	-67	-174.6	-72.6	0	0	111.2	A304 L305 S320 C321 R326 A327 F328 Y340	A304-M324 HydrophobicContact CB-CG 3.65Å; A304-M324 HydrophobicContact CB-SD 4.39Å; L305-M324 HydrophobicContact CB-SD 4.11Å; L305-M324 HydrophobicContact CD1-SD 4.07Å; S320-M324 WeakPolarHBondContact O-CG 3.22Å; S320-M324 PolarHBondContact O-N 3.06Å; C321-M324 PolarHBondContact O-N 3.41Å; M324-R326 PolarHBondContact O-N 3.19Å; M324-A327 PolarHBondContact O-N 3.03Å; M324-A327 VanDerWaalsContact O-N 3.1Å; M324-F328 HydrophobicContact CB-CE2 4.47Å; M324-F328 VanDerWaalsContact O-CD2 3.25Å; M324-F328 WeakPolarHBondContact O-CD2 3.43Å; M324-F328 PolarHBondContact O-N 3.23Å; M324-Y340 HydrophobicContact CB-CD1 4.24Å; M324-Y340 HydrophobicContact CB-CD2 4.33Å; M324-Y340 HydrophobicContact CB-CG 4.12Å; M324-Y340 HydrophobicContact CE-CD1 3.85Å; M324-Y340 HydrophobicContact CE-CE1 3.61Å; M324-Y340 HydrophobicContact SD-CE1 4.08Å
325	A	95.4	Very high	93.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.1	-46.5	179.5	0	0	0	0	0	112.5	C321 Y322 A327 F328 H329 Y341	C321-A325 WeakPolarHBondContact O-CB 3.42Å; C321-A325 PolarHBondContact O-N 3.33Å; Y322-A325 PolarHBondContact O-N 2.93Å; A325-A327 VanDerWaalsContact C-N 3.32Å; A325-A327 PolarHBondContact O-N 3.27Å; A325-F328 PolarHBondContact O-N 3.46Å; A325-H329 VanDerWaalsContact O-CB 3.26Å; A325-H329 WeakPolarHBondContact O-CB 3.46Å; A325-H329 PolarHBondContact O-N 3.46Å; A325-Y341 HydrophobicContact CB-CD1 3.48Å; A325-Y341 VanDerWaalsContact CB-CD1 3.48Å; A325-Y341 HydrophobicContact CB-CD2 3.8Å; A325-Y341 HydrophobicContact CB-CE1 3.58Å; A325-Y341 HydrophobicContact CB-CE2 3.9Å; A325-Y341 HydrophobicContact CB-CG 3.58Å
326	R	94.8	Very high	93.8	Very high	27 Å²	27	44 Å²	44	10%	0.102	21%	0.206	C	C	.	.	H	α-helix	trans	-59.1	-41.1	174.2	-71.4	169.1	76	-169.3	14.6	112.6	D289 F292 Y322 M324 H329 I330	D289-R326 IonicContact OD1-CZ 2.84Å; D289-R326 IonicContact OD1-NH1 3.75Å; D289-R326 PolarHBondContact OD1-NH1 3.21Å; D289-R326 IonicContact OD1-NH2 2.68Å; F292-R326 HydrophobicContact CD2-CB 4.2Å; F292-R326 HydrophobicContact CE2-CB 3.59Å; F292-R326 HydrophobicContact CZ-CB 4.04Å; Y322-R326 HydrophobicContact CE1-CG 4.41Å; Y322-R326 HydrophobicContact CE2-CG 4.15Å; Y322-R326 VanDerWaalsContact O-CG 3.31Å; Y322-R326 WeakPolarHBondContact O-CG 3.29Å; Y322-R326 PolarHBondContact O-N 3.37Å; M324-R326 PolarHBondContact O-N 3.19Å; R326-H329 PolarHBondContact O-N 2.83Å; R326-I330 PolarHBondContact O-N 3.03Å; R326-I330 VanDerWaalsContact O-N 3.11Å
327	A	94.8	Very high	94	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-69.9	-40.2	-177.9	0	0	0	0	0	111.4	V300 H301 Q323 M324 A325 Q331	V300-A327 HydrophobicContact CB-CB 4.29Å; V300-A327 HydrophobicContact CG1-CB 4.01Å; H301-A327 WeakPolarHBondContact CE1-CB 3.37Å; Q323-A327 WeakPolarHBondContact O-CB 3.49Å; Q323-A327 PolarHBondContact O-N 2.82Å; M324-A327 PolarHBondContact O-N 3.03Å; M324-A327 VanDerWaalsContact O-N 3.1Å; A325-A327 VanDerWaalsContact C-N 3.32Å; A325-A327 PolarHBondContact O-N 3.27Å; A327-Q331 WeakPolarHBondContact O-CB 3.26Å; A327-Q331 VanDerWaalsContact O-CG 3.24Å; A327-Q331 WeakPolarHBondContact O-CG 3.41Å; A327-Q331 PolarHBondContact O-N 3.47Å
328	F	94.8	Very high	94.1	Very high	32 Å²	32	40.4 Å²	40.4	14%	0.14	19%	0.192	C	C	.	.	H	α-helix	trans	-66.3	-37.2	170.3	-75.2	-61.2	0	0	0	113	H301 M324 A325 Q331 E332 N333 N336 A337 Y340	H301-F328 AromaticContact CD2-CE2 3.48Å; H301-F328 VanDerWaalsContact CD2-CE2 3.48Å; H301-F328 WeakPolarHBondContact CD2-CE2 3.26Å; H301-F328 AromaticContact CD2-CZ 3.56Å; H301-F328 AromaticContact NE2-CD1 3.62Å; H301-F328 AromaticContact NE2-CD2 3.42Å; H301-F328 WeakPolarHBondContact NE2-CD2 3.45Å; H301-F328 AromaticContact NE2-CE1 3.56Å; H301-F328 AromaticContact NE2-CE2 3.34Å; H301-F328 VanDerWaalsContact NE2-CE2 3.34Å; H301-F328 WeakPolarHBondContact NE2-CE2 3.24Å; H301-F328 AromaticContact NE2-CG 3.56Å; H301-F328 AromaticContact NE2-CZ 3.42Å; H301-F328 WeakPolarHBondContact NE2-CZ 3.21Å; M324-F328 HydrophobicContact CB-CE2 4.47Å; M324-F328 VanDerWaalsContact O-CD2 3.25Å; M324-F328 WeakPolarHBondContact O-CD2 3.43Å; M324-F328 PolarHBondContact O-N 3.23Å; A325-F328 PolarHBondContact O-N 3.46Å; F328-Q331 CarbonylContact O-C 3.55Å; F328-Q331 WeakPolarHBondContact O-CA 3.11Å; F328-Q331 PolarHBondContact O-N 2.98Å; F328-Q331 VanDerWaalsContact O-N 3.08Å; F328-E332 PolarHBondContact O-N 3Å; F328-N333 HydrophobicContact CB-CB 4.27Å; F328-N333 HydrophobicContact CD1-CB 3.99Å; F328-N333 PolarHBondContact O-N 3.38Å; F328-N336 HydrophobicContact CB-CB 4.23Å; F328-N336 HydrophobicContact CD1-CB 3.85Å; F328-N336 HydrophobicContact CD2-CB 3.84Å; F328-N336 HydrophobicContact CE1-CB 4.11Å; F328-N336 HydrophobicContact CE2-CB 4.12Å; F328-N336 HydrophobicContact CG-CB 3.7Å; F328-N336 HydrophobicContact CZ-CB 4.24Å; F328-A337 HydrophobicContact CB-CB 3.94Å; F328-Y340 AromaticContact CD2-CD2 3.65Å; F328-Y340 HydrophobicContact CD2-CD2 3.65Å; F328-Y340 AromaticContact CD2-CE2 3.91Å; F328-Y340 HydrophobicContact CD2-CE2 3.91Å; F328-Y340 AromaticContact CE2-CD2 3.61Å; F328-Y340 HydrophobicContact CE2-CD2 3.61Å; F328-Y340 AromaticContact CE2-CE2 3.34Å; F328-Y340 HydrophobicContact CE2-CE2 3.34Å; F328-Y340 HydrophobicContact CZ-CE2 4.24Å
329	H	95	Very high	94.2	Very high	41 Å²	41	45.3 Å²	45.3	19%	0.19	22%	0.215	C	C	.	.	H	α-helix	trans	-61.8	-46.3	178.6	-170.9	171.2	0	0	0	111.6	A325 R326 Q331 E332 Y334 A337 Y341 Q361 M362	A325-H329 VanDerWaalsContact O-CB 3.26Å; A325-H329 WeakPolarHBondContact O-CB 3.46Å; A325-H329 PolarHBondContact O-N 3.46Å; R326-H329 PolarHBondContact O-N 2.83Å; H329-Q331 PolarHBondContact O-N 3.29Å; H329-E332 PolarHBondContact O-N 2.67Å; H329-E332 VanDerWaalsContact O-N 3.13Å; H329-Y334 AromaticContact CD2-CE1 3.85Å; H329-A337 HydrophobicContact CB-CB 4.06Å; H329-Y341 HydrophobicContact CB-CE2 4.25Å; H329-Y341 AromaticContact ND1-CE2 3.67Å; H329-Y341 AromaticContact ND1-CZ 3.83Å; H329-Y341 PolarHBondContact ND1-OH 3.47Å; H329-Y341 VanDerWaalsContact ND1-OH 3.11Å; H329-Q361 PolarHBondContact CE1-OE1 3.19Å; H329-M362 VanDerWaalsContact CE1-CE 3.43Å; H329-M362 WeakPolarHBondContact CE1-CE 3.48Å; H329-M362 WeakPolarHBondContact NE2-CE 3.06Å
330	I	93.2	Very high	94.3	Very high	87 Å²	87	45 Å²	45	45%	0.446	21%	0.211	S	C	.	.	H	α-helix	trans	-69.2	-21	174.2	-67.8	-169.5	0	0	0	112.5	F292 Y297 R326 E332	F292-I330 HydrophobicContact CE1-CD1 4.24Å; F292-I330 HydrophobicContact CE2-CD1 3.73Å; F292-I330 HydrophobicContact CE2-CG1 4.31Å; F292-I330 HydrophobicContact CZ-CD1 3.34Å; F292-I330 HydrophobicContact CZ-CG1 4.22Å; Y297-I330 HydrophobicContact CE1-CB 4.41Å; Y297-I330 HydrophobicContact CE1-CD1 4.41Å; Y297-I330 HydrophobicContact CE1-CG2 4.06Å; Y297-I330 HydrophobicContact CE2-CG2 4.15Å; R326-I330 PolarHBondContact O-N 3.03Å; R326-I330 VanDerWaalsContact O-N 3.11Å; I330-E332 VanDerWaalsContact C-N 3.26Å; I330-E332 PolarHBondContact O-N 3.28Å
331	Q	92.3	Very high	94.4	Very high	91 Å²	91	45.4 Å²	45.4	43%	0.425	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	12.7	172.8	-69.7	177.7	-28.1	0	0	113.3	H301 A327 F328 H329 N333	H301-Q331 PolarHBondContact CE1-OE1 3.43Å; H301-Q331 VanDerWaalsContact CE1-OE1 3.23Å; A327-Q331 WeakPolarHBondContact O-CB 3.26Å; A327-Q331 VanDerWaalsContact O-CG 3.24Å; A327-Q331 WeakPolarHBondContact O-CG 3.41Å; A327-Q331 PolarHBondContact O-N 3.47Å; F328-Q331 CarbonylContact O-C 3.55Å; F328-Q331 WeakPolarHBondContact O-CA 3.11Å; F328-Q331 PolarHBondContact O-N 2.98Å; F328-Q331 VanDerWaalsContact O-N 3.08Å; H329-Q331 PolarHBondContact O-N 3.29Å; Q331-N333 PolarHBondContact O-N 3.41Å
332	E	92.2	Very high	94.3	Very high	147 Å²	147	50.2 Å²	50.2	69%	0.687	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	15.6	-179.1	-55.5	-177.7	163.3	0	0	114	F328 H329 I330 Y334	F328-E332 PolarHBondContact O-N 3Å; H329-E332 PolarHBondContact O-N 2.67Å; H329-E332 VanDerWaalsContact O-N 3.13Å; I330-E332 VanDerWaalsContact C-N 3.26Å; I330-E332 PolarHBondContact O-N 3.28Å; E332-Y334 VanDerWaalsContact C-N 3.29Å; E332-Y334 HydrophobicContact CB-CE2 3.97Å; E332-Y334 WeakPolarHBondContact O-CD2 3.46Å; E332-Y334 WeakPolarHBondContact O-CE2 3.26Å; E332-Y334 PolarHBondContact O-N 3.47Å; E332-Y334 VanDerWaalsContact O-N 3.08Å
333	N	93.5	Very high	94.2	Very high	62 Å²	62	51.8 Å²	51.8	33%	0.332	24%	0.242	S	C	.	.			trans	-89.5	69.8	177.9	-168.2	-34.7	0	0	0	109.5	F328 Q331 D335 N336 A337	F328-N333 HydrophobicContact CB-CB 4.27Å; F328-N333 HydrophobicContact CD1-CB 3.99Å; F328-N333 PolarHBondContact O-N 3.38Å; Q331-N333 PolarHBondContact O-N 3.41Å; N333-D335 VanDerWaalsContact C-N 3.27Å; N333-D335 PolarHBondContact O-N 2.97Å; N333-N336 PolarHBondContact ND2-ND2 3.27Å; N333-N336 PolarHBondContact O-N 2.88Å; N333-N336 VanDerWaalsContact OD1-CB 3.3Å; N333-N336 WeakPolarHBondContact OD1-CB 3.09Å; N333-N336 PolarHBondContact OD1-N 2.88Å; N333-N336 PolarHBondContact OD1-ND2 3.37Å; N333-A337 WeakPolarHBondContact O-CB 3.06Å; N333-A337 PolarHBondContact O-N 3.48Å
334	Y	93.5	Very high	94.1	Very high	64 Å²	64	51 Å²	51	25%	0.251	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-28	-171.6	-58.9	-67.9	0	0	0	113.9	H329 E332 F338 M362 H365	H329-Y334 AromaticContact CD2-CE1 3.85Å; E332-Y334 VanDerWaalsContact C-N 3.29Å; E332-Y334 HydrophobicContact CB-CE2 3.97Å; E332-Y334 WeakPolarHBondContact O-CD2 3.46Å; E332-Y334 WeakPolarHBondContact O-CE2 3.26Å; E332-Y334 PolarHBondContact O-N 3.47Å; E332-Y334 VanDerWaalsContact O-N 3.08Å; Y334-F338 VanDerWaalsContact O-CB 3.25Å; Y334-F338 WeakPolarHBondContact O-CB 3.5Å; Y334-F338 PolarHBondContact O-N 2.87Å; Y334-M362 HydrophobicContact CD1-CE 3.75Å; Y334-M362 HydrophobicContact CD1-SD 3.97Å; Y334-M362 HydrophobicContact CE1-CE 4.3Å; Y334-H365 AromaticContact CD2-CD2 3.83Å; Y334-H365 AromaticContact CD2-CE1 3.47Å; Y334-H365 VanDerWaalsContact CD2-CE1 3.47Å; Y334-H365 WeakPolarHBondContact CD2-CE1 3.45Å; Y334-H365 AromaticContact CD2-ND1 3.96Å; Y334-H365 AromaticContact CD2-NE2 3.37Å; Y334-H365 WeakPolarHBondContact CD2-NE2 3.26Å; Y334-H365 AromaticContact CE2-CD2 3.72Å; Y334-H365 AromaticContact CE2-CE1 3.9Å; Y334-H365 AromaticContact CE2-NE2 3.3Å; Y334-H365 VanDerWaalsContact CE2-NE2 3.3Å; Y334-H365 WeakPolarHBondContact CE2-NE2 3.35Å; Y334-H365 AromaticContact CG-CE1 3.96Å; Y334-H365 AromaticContact CG-ND1 3.99Å; Y334-H365 AromaticContact CZ-CD2 3.83Å; Y334-H365 AromaticContact CZ-NE2 3.89Å
335	D	93	Very high	94	Very high	93 Å²	93	51.9 Å²	51.9	50%	0.497	24%	0.244	S	C	.	.	H	α-helix	trans	-74.1	-42.2	179.2	-69.5	-51.7	0	0	0	112.9	N333 Q339 R366	N333-D335 VanDerWaalsContact C-N 3.27Å; N333-D335 PolarHBondContact O-N 2.97Å; D335-Q339 WeakPolarHBondContact O-CG 3.47Å; D335-Q339 PolarHBondContact O-N 3.1Å; D335-Q339 VanDerWaalsContact O-N 3.09Å; D335-Q339 PolarHBondContact O-NE2 3.47Å; D335-R366 IonicContact OD1-CZ 3.44Å; D335-R366 IonicContact OD1-NE 3.24Å; D335-R366 IonicContact OD1-NH2 3.2Å; D335-R366 PolarHBondContact OD1-NH2 2.78Å
336	N	93.3	Very high	93.8	Very high	50 Å²	50	57.3 Å²	57.3	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-68	-41.5	170.7	-71.6	-16.6	0	0	0	110.5	F328 N333 F338 Q339 Y340	F328-N336 HydrophobicContact CB-CB 4.23Å; F328-N336 HydrophobicContact CD1-CB 3.85Å; F328-N336 HydrophobicContact CD2-CB 3.84Å; F328-N336 HydrophobicContact CE1-CB 4.11Å; F328-N336 HydrophobicContact CE2-CB 4.12Å; F328-N336 HydrophobicContact CG-CB 3.7Å; F328-N336 HydrophobicContact CZ-CB 4.24Å; N333-N336 PolarHBondContact ND2-ND2 3.27Å; N333-N336 PolarHBondContact O-N 2.88Å; N333-N336 VanDerWaalsContact OD1-CB 3.3Å; N333-N336 WeakPolarHBondContact OD1-CB 3.09Å; N333-N336 PolarHBondContact OD1-N 2.88Å; N333-N336 PolarHBondContact OD1-ND2 3.37Å; N336-F338 VanDerWaalsContact C-N 3.35Å; N336-F338 PolarHBondContact O-N 3.5Å; N336-Q339 PolarHBondContact O-N 3.35Å; N336-Y340 HydrophobicContact CB-CD2 4.5Å; N336-Y340 WeakPolarHBondContact O-CD2 3.48Å; N336-Y340 PolarHBondContact O-N 2.94Å
337	A	95.1	Very high	93.5	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.9	-46	176.1	0	0	0	0	0	111.6	F328 H329 N333 Y340 Y341 M362	F328-A337 HydrophobicContact CB-CB 3.94Å; H329-A337 HydrophobicContact CB-CB 4.06Å; N333-A337 WeakPolarHBondContact O-CB 3.06Å; N333-A337 PolarHBondContact O-N 3.48Å; A337-Y340 PolarHBondContact O-N 3.26Å; A337-Y341 HydrophobicContact CB-CD2 4.34Å; A337-Y341 HydrophobicContact CB-CE2 4.23Å; A337-Y341 WeakPolarHBondContact O-CB 3.41Å; A337-Y341 WeakPolarHBondContact O-CD2 3.28Å; A337-Y341 PolarHBondContact O-N 2.81Å; A337-M362 HydrophobicContact CB-SD 3.7Å
338	F	94.6	Very high	92.5	Very high	32 Å²	32	58.9 Å²	58.9	14%	0.14	28%	0.283	C	S	.	.	H	α-helix	trans	-57.7	-49.7	173.8	177.6	-87.9	0	0	0	112	Y334 N336 Y340 Y341 Y342 L359 M362 Y363 R366	Y334-F338 VanDerWaalsContact O-CB 3.25Å; Y334-F338 WeakPolarHBondContact O-CB 3.5Å; Y334-F338 PolarHBondContact O-N 2.87Å; N336-F338 VanDerWaalsContact C-N 3.35Å; N336-F338 PolarHBondContact O-N 3.5Å; F338-Y340 VanDerWaalsContact C-N 3.34Å; F338-Y340 PolarHBondContact O-N 3.12Å; F338-Y341 PolarHBondContact O-N 3.2Å; F338-Y342 WeakPolarHBondContact O-CB 3.22Å; F338-Y342 PolarHBondContact O-N 3.46Å; F338-L359 HydrophobicContact CD2-CD1 3.85Å; F338-L359 HydrophobicContact CE2-CD1 3.75Å; F338-L359 HydrophobicContact CZ-CD1 4.4Å; F338-M362 HydrophobicContact CB-CB 4.19Å; F338-M362 HydrophobicContact CB-CG 4.19Å; F338-M362 HydrophobicContact CD2-CB 3.79Å; F338-M362 HydrophobicContact CG-CB 4.5Å; F338-Y363 HydrophobicContact CE2-CD1 4.11Å; F338-Y363 AromaticContact CE2-CE1 3.63Å; F338-Y363 HydrophobicContact CE2-CE1 3.63Å; F338-Y363 AromaticContact CE2-CZ 3.94Å; F338-Y363 HydrophobicContact CZ-CE1 4.12Å; F338-R366 VanDerWaalsContact CD2-NH1 3.31Å; F338-R366 VanDerWaalsContact CE1-NH1 3.26Å
339	Q	94.6	Very high	91.5	Very high	103 Å²	103	59.7 Å²	59.7	48%	0.481	29%	0.293	S	S	.	.	H	α-helix	trans	-58.2	-46.3	179.4	-72.8	173.6	49.2	0	0	111.5	D335 N336 Y342 L343	D335-Q339 WeakPolarHBondContact O-CG 3.47Å; D335-Q339 PolarHBondContact O-N 3.1Å; D335-Q339 VanDerWaalsContact O-N 3.09Å; D335-Q339 PolarHBondContact O-NE2 3.47Å; N336-Q339 PolarHBondContact O-N 3.35Å; Q339-Y342 PolarHBondContact O-N 3.27Å; Q339-L343 WeakPolarHBondContact O-CB 3.43Å; Q339-L343 VanDerWaalsContact O-CG 3.26Å; Q339-L343 WeakPolarHBondContact O-CG 3.02Å; Q339-L343 PolarHBondContact O-N 2.99Å
340	Y	95.1	Very high	90.6	Very high	61 Å²	61	62.4 Å²	62.4	24%	0.239	32%	0.316	C	S	.	.	H	α-helix	trans	-73.5	-32.9	179.9	-74	-67.4	0	0	0	113.6	C321 M324 F328 N336 A337 F338 L343 A344	C321-Y340 HydrophobicContact CB-CD1 4.43Å; M324-Y340 HydrophobicContact CB-CD1 4.24Å; M324-Y340 HydrophobicContact CB-CD2 4.33Å; M324-Y340 HydrophobicContact CB-CG 4.12Å; M324-Y340 HydrophobicContact CE-CD1 3.85Å; M324-Y340 HydrophobicContact CE-CE1 3.61Å; M324-Y340 HydrophobicContact SD-CE1 4.08Å; F328-Y340 AromaticContact CD2-CD2 3.65Å; F328-Y340 HydrophobicContact CD2-CD2 3.65Å; F328-Y340 AromaticContact CD2-CE2 3.91Å; F328-Y340 HydrophobicContact CD2-CE2 3.91Å; F328-Y340 AromaticContact CE2-CD2 3.61Å; F328-Y340 HydrophobicContact CE2-CD2 3.61Å; F328-Y340 AromaticContact CE2-CE2 3.34Å; F328-Y340 HydrophobicContact CE2-CE2 3.34Å; F328-Y340 HydrophobicContact CZ-CE2 4.24Å; N336-Y340 HydrophobicContact CB-CD2 4.5Å; N336-Y340 WeakPolarHBondContact O-CD2 3.48Å; N336-Y340 PolarHBondContact O-N 2.94Å; A337-Y340 PolarHBondContact O-N 3.26Å; F338-Y340 VanDerWaalsContact C-N 3.34Å; F338-Y340 PolarHBondContact O-N 3.12Å; Y340-L343 HydrophobicContact CD1-CD1 4.44Å; Y340-A344 WeakPolarHBondContact O-CB 3.47Å; Y340-A344 PolarHBondContact O-N 3.21Å
341	Y	96	Very high	90	Very high	8 Å²	8	63.6 Å²	63.6	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-66.2	-41.6	170.1	-77.5	-55.3	0	0	0	111.4	Y322 A325 H329 A337 F338 A344 T345 M362	Y322-Y341 HydrophobicContact CD2-CD1 4.26Å; Y322-Y341 AromaticContact CD2-CE1 3.89Å; Y322-Y341 HydrophobicContact CD2-CE1 3.89Å; Y322-Y341 HydrophobicContact CE2-CE1 4.05Å; A325-Y341 HydrophobicContact CB-CD1 3.48Å; A325-Y341 VanDerWaalsContact CB-CD1 3.48Å; A325-Y341 HydrophobicContact CB-CD2 3.8Å; A325-Y341 HydrophobicContact CB-CE1 3.58Å; A325-Y341 HydrophobicContact CB-CE2 3.9Å; A325-Y341 HydrophobicContact CB-CG 3.58Å; H329-Y341 HydrophobicContact CB-CE2 4.25Å; H329-Y341 AromaticContact ND1-CE2 3.67Å; H329-Y341 AromaticContact ND1-CZ 3.83Å; H329-Y341 PolarHBondContact ND1-OH 3.47Å; H329-Y341 VanDerWaalsContact ND1-OH 3.11Å; A337-Y341 HydrophobicContact CB-CD2 4.34Å; A337-Y341 HydrophobicContact CB-CE2 4.23Å; A337-Y341 WeakPolarHBondContact O-CB 3.41Å; A337-Y341 WeakPolarHBondContact O-CD2 3.28Å; A337-Y341 PolarHBondContact O-N 2.81Å; F338-Y341 PolarHBondContact O-N 3.2Å; Y341-A344 CarbonylContact O-C 3.6Å; Y341-A344 WeakPolarHBondContact O-CB 3.45Å; Y341-A344 PolarHBondContact O-N 2.92Å; Y341-T345 PolarHBondContact O-N 3.49Å; Y341-M362 HydrophobicContact CD2-CG 3.68Å; Y341-M362 HydrophobicContact CD2-SD 4.31Å; Y341-M362 HydrophobicContact CE2-CG 4.15Å; Y341-M362 HydrophobicContact CE2-SD 4.33Å
342	Y	93.8	Very high	89.7	Confident	101 Å²	101	60.9 Å²	60.9	40%	0.396	32%	0.315	S	S	.	.	H	α-helix	trans	-65.1	-48.9	178.8	-176.5	-106.3	0	0	0	111.3	F338 Q339 A344 T345 Q346 L359	F338-Y342 WeakPolarHBondContact O-CB 3.22Å; F338-Y342 PolarHBondContact O-N 3.46Å; Q339-Y342 PolarHBondContact O-N 3.27Å; Y342-A344 VanDerWaalsContact C-N 3.28Å; Y342-A344 PolarHBondContact O-N 3.14Å; Y342-T345 PolarHBondContact O-N 2.93Å; Y342-T345 PolarHBondContact O-OG1 3.36Å; Y342-Q346 HydrophobicContact CE1-CG 4.33Å; Y342-Q346 PolarHBondContact O-N 3.44Å; Y342-Q346 PolarHBondContact OH-NE2 2.94Å; Y342-L359 HydrophobicContact CD2-CD2 4.41Å
343	L	93.6	Very high	89.6	Confident	67 Å²	67	55.2 Å²	55.2	35%	0.351	29%	0.289	S	S	.	.	H	α-helix	trans	-58.4	-39	171.4	-71.8	169.5	0	0	0	111.9	Q339 Y340 Q346 L347	Q339-L343 WeakPolarHBondContact O-CB 3.43Å; Q339-L343 VanDerWaalsContact O-CG 3.26Å; Q339-L343 WeakPolarHBondContact O-CG 3.02Å; Q339-L343 PolarHBondContact O-N 2.99Å; Y340-L343 HydrophobicContact CD1-CD1 4.44Å; L343-Q346 PolarHBondContact O-N 3.25Å; L343-L347 WeakPolarHBondContact O-CB 3.3Å; L343-L347 WeakPolarHBondContact O-CG 3.28Å; L343-L347 PolarHBondContact O-N 3.47Å
344	A	93.6	Very high	89.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-37.4	174	0	0	0	0	0	112.3	C321 Y340 Y341 Y342 A348 P355	C321-A344 HydrophobicContact CB-CB 3.8Å; Y340-A344 WeakPolarHBondContact O-CB 3.47Å; Y340-A344 PolarHBondContact O-N 3.21Å; Y341-A344 CarbonylContact O-C 3.6Å; Y341-A344 WeakPolarHBondContact O-CB 3.45Å; Y341-A344 PolarHBondContact O-N 2.92Å; Y342-A344 VanDerWaalsContact C-N 3.28Å; Y342-A344 PolarHBondContact O-N 3.14Å; A344-A348 WeakPolarHBondContact O-CA 3.41Å; A344-A348 WeakPolarHBondContact O-CB 3.37Å; A344-A348 PolarHBondContact O-N 2.89Å; A344-P355 HydrophobicContact CB-CB 3.84Å; A344-P355 HydrophobicContact CB-CG 3.83Å
345	T	91.1	Very high	89.5	Confident	23 Å²	23	53.7 Å²	53.7	14%	0.141	28%	0.284	C	S	.	.	H	α-helix	trans	-69.8	-32.8	173.4	55	0	0	0	0	113.6	Y341 Y342 P355 F356 L359	Y341-T345 PolarHBondContact O-N 3.49Å; Y342-T345 PolarHBondContact O-N 2.93Å; Y342-T345 PolarHBondContact O-OG1 3.36Å; T345-P355 HydrophobicContact CG2-CB 3.64Å; T345-F356 HydrophobicContact CG2-CD1 3.75Å; T345-F356 HydrophobicContact CG2-CD2 4.15Å; T345-F356 HydrophobicContact CG2-CE1 3.76Å; T345-F356 HydrophobicContact CG2-CE2 4.16Å; T345-F356 HydrophobicContact CG2-CG 3.95Å; T345-F356 HydrophobicContact CG2-CZ 3.96Å; T345-L359 HydrophobicContact CG2-CD2 4.09Å
346	Q	91.3	Very high	89.5	Confident	114 Å²	114	51.7 Å²	51.7	53%	0.533	27%	0.271	S	S	.	.	H	α-helix	trans	-69	-36.1	175	-71.4	-174.9	-23	0	0	112.6	Y342 L343	Y342-Q346 HydrophobicContact CE1-CG 4.33Å; Y342-Q346 PolarHBondContact O-N 3.44Å; Y342-Q346 PolarHBondContact OH-NE2 2.94Å; L343-Q346 PolarHBondContact O-N 3.25Å
347	L	88.3	Confident	89.5	Confident	35 Å²	35	51.9 Å²	51.9	18%	0.183	27%	0.268	C	S	.	.	S	Bend	trans	-91.8	-4.8	-179.7	-62.7	168.3	0	0	0	113.2	F308 E314 R317 A318 L343 S349	F308-L347 HydrophobicContact CE2-CD1 4.26Å; E314-L347 CarbonylContact C-O 3.43Å; E314-L347 HydrophobicContact CB-CD2 4.32Å; E314-L347 HydrophobicContact CG-CD2 4.29Å; R317-L347 HydrophobicContact CB-CD1 3.89Å; A318-L347 HydrophobicContact CB-CB 3.85Å; L343-L347 WeakPolarHBondContact O-CB 3.3Å; L343-L347 WeakPolarHBondContact O-CG 3.28Å; L343-L347 PolarHBondContact O-N 3.47Å; L347-S349 PolarHBondContact O-N 3.35Å
348	A	75.6	Confident	89.4	Confident	25 Å²	25	52 Å²	52	21%	0.207	27%	0.269	C	S	.	.			trans	-68.9	131.1	-174.8	0	0	0	0	0	111.7	A344 F352	A344-A348 WeakPolarHBondContact O-CA 3.41Å; A344-A348 WeakPolarHBondContact O-CB 3.37Å; A344-A348 PolarHBondContact O-N 2.89Å; A348-F352 HydrophobicContact CB-CB 4.28Å; A348-F352 HydrophobicContact CB-CD1 4.24Å
349	S	73.7	Confident	89.3	Confident	50 Å²	50	50.8 Å²	50.8	35%	0.35	27%	0.265	S	S	.	.			trans	-62.8	151.1	156.8	64.5	0	0	0	0	109.4	L347 T351 F352	L347-S349 PolarHBondContact O-N 3.35Å; S349-T351 PolarHBondContact O-N 2.88Å; S349-T351 PolarHBondContact OG-OG1 3.17Å; S349-T351 VanDerWaalsContact OG-OG1 3.1Å; S349-F352 PolarHBondContact O-N 3.04Å
350	S	75.9	Confident	89.3	Confident	97 Å²	97	45.9 Å²	45.9	68%	0.678	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-9.6	-177.4	69	0	0	0	0	115.2
351	T	79.4	Confident	89.2	Confident	112 Å²	112	45.9 Å²	45.9	69%	0.687	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-10.6	175.9	50.1	0	0	0	0	113.9	S349 I353	S349-T351 PolarHBondContact O-N 2.88Å; S349-T351 PolarHBondContact OG-OG1 3.17Å; S349-T351 VanDerWaalsContact OG-OG1 3.1Å; T351-I353 PolarHBondContact O-N 3.28Å
352	F	86.5	Confident	89.1	Confident	35 Å²	35	45.6 Å²	45.6	15%	0.154	24%	0.243	C	C	.	.			trans	-97.6	85.3	-175.1	-170.4	-130.3	0	0	0	110.9	A318 E319 Y322 A348 S349 L354 P355	A318-F352 HydrophobicContact CB-CD1 4.07Å; A318-F352 HydrophobicContact CB-CE1 4.16Å; E319-F352 HydrophobicContact CG-CE1 4.5Å; E319-F352 HydrophobicContact CG-CE2 4.36Å; E319-F352 HydrophobicContact CG-CZ 4.13Å; Y322-F352 HydrophobicContact CD1-CE2 4.45Å; Y322-F352 AromaticContact CD1-CZ 3.73Å; Y322-F352 HydrophobicContact CD1-CZ 3.73Å; Y322-F352 HydrophobicContact CD2-CZ 4.39Å; Y322-F352 HydrophobicContact CE1-CZ 4.42Å; Y322-F352 HydrophobicContact CG-CE1 4.26Å; Y322-F352 AromaticContact CG-CZ 3.71Å; Y322-F352 HydrophobicContact CG-CZ 3.71Å; A348-F352 HydrophobicContact CB-CB 4.28Å; A348-F352 HydrophobicContact CB-CD1 4.24Å; S349-F352 PolarHBondContact O-N 3.04Å; F352-L354 HydrophobicContact CE2-CB 4.37Å; F352-L354 HydrophobicContact CE2-CD1 4.23Å; F352-P355 HydrophobicContact CD1-CG 3.48Å; F352-P355 VanDerWaalsContact CD1-CG 3.48Å; F352-P355 HydrophobicContact CE1-CG 3.26Å; F352-P355 HydrophobicContact CG-CG 4.36Å; F352-P355 HydrophobicContact CZ-CG 3.99Å; F352-P355 WeakPolarHBondContact O-CD 3.46Å
353	I	90	Very high	89.1	Confident	28 Å²	28	42.2 Å²	42.2	14%	0.144	23%	0.229	C	C	.	.			trans	-84.2	-24.6	-168.4	-59.8	141.3	0	0	0	112.6	T351 P355 F356 V379 D382	T351-I353 PolarHBondContact O-N 3.28Å; I353-P355 VanDerWaalsContact C-CD 3.48Å; I353-F356 WeakPolarHBondContact O-CB 3.36Å; I353-F356 PolarHBondContact O-N 2.94Å; I353-V379 HydrophobicContact CG2-CB 4.08Å; I353-V379 HydrophobicContact CG2-CG1 4.05Å; I353-V379 HydrophobicContact CG2-CG2 3.86Å; I353-D382 HydrophobicContact CD1-CB 3.4Å; I353-D382 VanDerWaalsContact CD1-CB 3.4Å; I353-D382 HydrophobicContact CG1-CB 3.88Å
354	L	91.5	Very high	89	Confident	93 Å²	93	41.9 Å²	41.9	49%	0.487	23%	0.228	S	C	.	.	H	α-helix	trans	-58.2	-35.5	-172.4	-59.4	173.8	0	0	0	115.1	Y322 F352 F356 Y357 G358	Y322-L354 HydrophobicContact CD2-CB 4.3Å; Y322-L354 HydrophobicContact CE1-CB 4.22Å; Y322-L354 HydrophobicContact CE1-CD1 4.02Å; Y322-L354 HydrophobicContact CE2-CB 3.56Å; F352-L354 HydrophobicContact CE2-CB 4.37Å; F352-L354 HydrophobicContact CE2-CD1 4.23Å; L354-F356 VanDerWaalsContact C-N 3.31Å; L354-F356 PolarHBondContact O-N 3.49Å; L354-Y357 PolarHBondContact O-N 3.36Å; L354-G358 PolarHBondContact O-N 2.98Å
355	P	93.1	Very high	88.9	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61	-33.8	172.7	-26.6	37.2	0	0	0	114.2	Y322 A344 T345 F352 I353 G358 L359	Y322-P355 HydrophobicContact CD2-CG 4.07Å; Y322-P355 HydrophobicContact CG-CG 4.49Å; A344-P355 HydrophobicContact CB-CB 3.84Å; A344-P355 HydrophobicContact CB-CG 3.83Å; T345-P355 HydrophobicContact CG2-CB 3.64Å; F352-P355 HydrophobicContact CD1-CG 3.48Å; F352-P355 VanDerWaalsContact CD1-CG 3.48Å; F352-P355 HydrophobicContact CE1-CG 3.26Å; F352-P355 HydrophobicContact CG-CG 4.36Å; F352-P355 HydrophobicContact CZ-CG 3.99Å; F352-P355 WeakPolarHBondContact O-CD 3.46Å; I353-P355 VanDerWaalsContact C-CD 3.48Å; P355-G358 PolarHBondContact O-N 3.43Å; P355-L359 VanDerWaalsContact O-CB 3.26Å; P355-L359 WeakPolarHBondContact O-CB 3.06Å; P355-L359 PolarHBondContact O-N 2.95Å
356	F	93	Very high	88.8	Confident	52 Å²	52	51.3 Å²	51.3	23%	0.228	27%	0.266	C	S	.	.	H	α-helix	trans	-67.7	-36.6	178.8	-65.9	-84.5	0	0	0	112	T345 I353 L354 L359 G360 R378 V379	T345-F356 HydrophobicContact CG2-CD1 3.75Å; T345-F356 HydrophobicContact CG2-CD2 4.15Å; T345-F356 HydrophobicContact CG2-CE1 3.76Å; T345-F356 HydrophobicContact CG2-CE2 4.16Å; T345-F356 HydrophobicContact CG2-CG 3.95Å; T345-F356 HydrophobicContact CG2-CZ 3.96Å; I353-F356 WeakPolarHBondContact O-CB 3.36Å; I353-F356 PolarHBondContact O-N 2.94Å; L354-F356 VanDerWaalsContact C-N 3.31Å; L354-F356 PolarHBondContact O-N 3.49Å; F356-L359 PolarHBondContact O-N 2.71Å; F356-G360 PolarHBondContact O-N 2.77Å; F356-R378 HydrophobicContact CD1-CB 4.3Å; F356-R378 HydrophobicContact CD1-CG 3.97Å; F356-R378 HydrophobicContact CD2-CG 4.33Å; F356-R378 HydrophobicContact CE1-CG 4.18Å; F356-R378 HydrophobicContact CG-CB 4.46Å; F356-R378 HydrophobicContact CG-CG 4.06Å; F356-R378 HydrophobicContact CZ-CG 4.45Å; F356-V379 HydrophobicContact CB-CG2 3.99Å
357	Y	93.5	Very high	88.7	Confident	53 Å²	53	51.9 Å²	51.9	21%	0.208	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-47.7	173.7	-175.3	-94.7	0	0	0	111.3	L354 L359 G360 Q361 F376 E388 I392	L354-Y357 PolarHBondContact O-N 3.36Å; Y357-L359 PolarHBondContact O-N 2.97Å; Y357-G360 PolarHBondContact O-N 3.13Å; Y357-Q361 VanDerWaalsContact CE1-CD 3.49Å; Y357-Q361 HydrophobicContact CE1-CG 4.23Å; Y357-Q361 WeakPolarHBondContact O-CG 3.28Å; Y357-Q361 PolarHBondContact O-N 3.45Å; Y357-Q361 VanDerWaalsContact O-N 3.09Å; Y357-F376 HydrophobicContact CD2-CD1 4.08Å; Y357-F376 AromaticContact CD2-CE1 3.8Å; Y357-F376 HydrophobicContact CD2-CE1 3.8Å; Y357-F376 HydrophobicContact CE2-CD1 4.4Å; Y357-F376 AromaticContact CE2-CE1 3.95Å; Y357-F376 HydrophobicContact CE2-CE1 3.95Å; Y357-F376 HydrophobicContact CG-CE1 4.43Å; Y357-E388 HydrophobicContact CE2-CB 4.33Å; Y357-I392 HydrophobicContact CE2-CD1 4.43Å
358	G	92.6	Very high	88.9	Confident	2 Å²	2	52.7 Å²	52.7	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-62.6	-41.4	176.2	0	0	0	0	0	113.1	L354 P355 Q361 M362	L354-G358 PolarHBondContact O-N 2.98Å; P355-G358 PolarHBondContact O-N 3.43Å; G358-Q361 WeakPolarHBondContact O-CB 3.45Å; G358-Q361 PolarHBondContact O-N 2.82Å; G358-M362 WeakPolarHBondContact O-CG 3.42Å; G358-M362 PolarHBondContact O-N 3.42Å
359	L	93.9	Very high	89.6	Confident	7 Å²	7	54.4 Å²	54.4	4%	0.037	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-40	175.8	-167.4	70.3	0	0	0	111.7	F338 Y342 T345 P355 F356 Y357 Q361 M362 Y363	F338-L359 HydrophobicContact CD2-CD1 3.85Å; F338-L359 HydrophobicContact CE2-CD1 3.75Å; F338-L359 HydrophobicContact CZ-CD1 4.4Å; Y342-L359 HydrophobicContact CD2-CD2 4.41Å; T345-L359 HydrophobicContact CG2-CD2 4.09Å; P355-L359 VanDerWaalsContact O-CB 3.26Å; P355-L359 WeakPolarHBondContact O-CB 3.06Å; P355-L359 PolarHBondContact O-N 2.95Å; F356-L359 PolarHBondContact O-N 2.71Å; Y357-L359 PolarHBondContact O-N 2.97Å; L359-Q361 VanDerWaalsContact C-N 3.32Å; L359-Q361 PolarHBondContact O-N 3.27Å; L359-M362 PolarHBondContact O-N 2.88Å; L359-M362 VanDerWaalsContact O-N 3.1Å; L359-Y363 HydrophobicContact CD1-CE2 4.28Å; L359-Y363 HydrophobicContact CD2-CE2 3.67Å; L359-Y363 HydrophobicContact CG-CD2 4.01Å; L359-Y363 HydrophobicContact CG-CE2 3.51Å; L359-Y363 VanDerWaalsContact O-CD2 3.24Å; L359-Y363 WeakPolarHBondContact O-CD2 3.36Å; L359-Y363 PolarHBondContact O-N 3.45Å
360	G	93.5	Very high	90.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.1	-42	171.8	0	0	0	0	0	112.7	F356 Y357 M362 Y363 L364	F356-G360 PolarHBondContact O-N 2.77Å; Y357-G360 PolarHBondContact O-N 3.13Å; G360-M362 VanDerWaalsContact C-N 3.33Å; G360-M362 PolarHBondContact O-N 3.41Å; G360-Y363 PolarHBondContact O-N 2.68Å; G360-L364 WeakPolarHBondContact O-CG 3.12Å; G360-L364 PolarHBondContact O-N 2.93Å
361	Q	93.3	Very high	91.1	Very high	61 Å²	61	57.1 Å²	57.1	29%	0.285	28%	0.278	S	S	.	.	H	α-helix	trans	-64.7	-34.2	173.7	-65.8	179.3	-56	0	0	112.7	H329 Y357 G358 L359 H365 F376	H329-Q361 PolarHBondContact CE1-OE1 3.19Å; Y357-Q361 VanDerWaalsContact CE1-CD 3.49Å; Y357-Q361 HydrophobicContact CE1-CG 4.23Å; Y357-Q361 WeakPolarHBondContact O-CG 3.28Å; Y357-Q361 PolarHBondContact O-N 3.45Å; Y357-Q361 VanDerWaalsContact O-N 3.09Å; G358-Q361 WeakPolarHBondContact O-CB 3.45Å; G358-Q361 PolarHBondContact O-N 2.82Å; L359-Q361 VanDerWaalsContact C-N 3.32Å; L359-Q361 PolarHBondContact O-N 3.27Å; Q361-H365 PolarHBondContact O-N 2.88Å; Q361-H365 VanDerWaalsContact O-N 3.1Å; Q361-F376 HydrophobicContact CG-CZ 4.28Å
362	M	93.8	Very high	91.7	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-72.2	-36.7	174.4	-59.5	-62.4	88.3	0	0	112.9	H329 Y334 A337 F338 Y341 G358 L359 G360 H365 R366	H329-M362 VanDerWaalsContact CE1-CE 3.43Å; H329-M362 WeakPolarHBondContact CE1-CE 3.48Å; H329-M362 WeakPolarHBondContact NE2-CE 3.06Å; Y334-M362 HydrophobicContact CD1-CE 3.75Å; Y334-M362 HydrophobicContact CD1-SD 3.97Å; Y334-M362 HydrophobicContact CE1-CE 4.3Å; A337-M362 HydrophobicContact CB-SD 3.7Å; F338-M362 HydrophobicContact CB-CB 4.19Å; F338-M362 HydrophobicContact CB-CG 4.19Å; F338-M362 HydrophobicContact CD2-CB 3.79Å; F338-M362 HydrophobicContact CG-CB 4.5Å; Y341-M362 HydrophobicContact CD2-CG 3.68Å; Y341-M362 HydrophobicContact CD2-SD 4.31Å; Y341-M362 HydrophobicContact CE2-CG 4.15Å; Y341-M362 HydrophobicContact CE2-SD 4.33Å; G358-M362 WeakPolarHBondContact O-CG 3.42Å; G358-M362 PolarHBondContact O-N 3.42Å; L359-M362 PolarHBondContact O-N 2.88Å; L359-M362 VanDerWaalsContact O-N 3.1Å; G360-M362 VanDerWaalsContact C-N 3.33Å; G360-M362 PolarHBondContact O-N 3.41Å; M362-H365 PolarHBondContact O-N 3.34Å; M362-R366 PolarHBondContact O-N 3.48Å; M362-R366 VanDerWaalsContact O-N 3.08Å
363	Y	94.4	Very high	92	Very high	30 Å²	30	50.3 Å²	50.3	12%	0.118	24%	0.24	C	C	.	.	H	α-helix	trans	-64.6	-40.5	172.7	-74.1	-56.1	0	0	0	111.5	F338 L359 G360 H365 R366 N367 D368 H371	F338-Y363 HydrophobicContact CE2-CD1 4.11Å; F338-Y363 AromaticContact CE2-CE1 3.63Å; F338-Y363 HydrophobicContact CE2-CE1 3.63Å; F338-Y363 AromaticContact CE2-CZ 3.94Å; F338-Y363 HydrophobicContact CZ-CE1 4.12Å; L359-Y363 HydrophobicContact CD1-CE2 4.28Å; L359-Y363 HydrophobicContact CD2-CE2 3.67Å; L359-Y363 HydrophobicContact CG-CD2 4.01Å; L359-Y363 HydrophobicContact CG-CE2 3.51Å; L359-Y363 VanDerWaalsContact O-CD2 3.24Å; L359-Y363 WeakPolarHBondContact O-CD2 3.36Å; L359-Y363 PolarHBondContact O-N 3.45Å; G360-Y363 PolarHBondContact O-N 2.68Å; Y363-H365 PolarHBondContact O-N 3.09Å; Y363-R366 CarbonylContact O-C 3.4Å; Y363-R366 PolarHBondContact O-N 2.81Å; Y363-R366 VanDerWaalsContact O-N 3.12Å; Y363-N367 PolarHBondContact O-N 2.75Å; Y363-N367 VanDerWaalsContact O-N 3.09Å; Y363-D368 HydrophobicContact CD1-CB 3.95Å; Y363-D368 PolarHBondContact O-N 2.71Å; Y363-H371 HydrophobicContact CD1-CB 3.7Å; Y363-H371 HydrophobicContact CD2-CB 3.76Å; Y363-H371 HydrophobicContact CE1-CB 3.65Å; Y363-H371 HydrophobicContact CE2-CB 3.69Å; Y363-H371 HydrophobicContact CG-CB 3.78Å
364	L	91.6	Very high	92.1	Very high	61 Å²	61	54.7 Å²	54.7	32%	0.319	26%	0.261	S	S	.	.	H	α-helix	trans	-56.5	-47.7	170.4	-74.1	175.1	0	0	0	112.2	G360 R366 N367 L369 A372 F376 I392 L396	G360-L364 WeakPolarHBondContact O-CG 3.12Å; G360-L364 PolarHBondContact O-N 2.93Å; L364-R366 PolarHBondContact O-N 2.92Å; L364-N367 PolarHBondContact O-N 2.97Å; L364-L369 HydrophobicContact CD2-CD2 4.41Å; L364-A372 HydrophobicContact CD2-CB 4.08Å; L364-A372 HydrophobicContact CG-CB 4.09Å; L364-F376 HydrophobicContact CD1-CE2 3.79Å; L364-F376 HydrophobicContact CD1-CZ 3.94Å; L364-F376 HydrophobicContact CG-CE2 4.09Å; L364-I392 HydrophobicContact CD1-CG2 3.85Å; L364-L396 HydrophobicContact CD2-CD1 4.18Å; L364-L396 HydrophobicContact CD2-CD2 3.75Å; L364-L396 HydrophobicContact CD2-CG 4.21Å
365	H	90.3	Very high	92.1	Very high	112 Å²	112	50.8 Å²	50.8	52%	0.519	24%	0.241	S	C	.	.	H	α-helix	trans	-61.4	-29.5	177.5	-172.6	-79.8	0	0	0	112.7	Y334 Q361 M362 Y363	Y334-H365 AromaticContact CD2-CD2 3.83Å; Y334-H365 AromaticContact CD2-CE1 3.47Å; Y334-H365 VanDerWaalsContact CD2-CE1 3.47Å; Y334-H365 WeakPolarHBondContact CD2-CE1 3.45Å; Y334-H365 AromaticContact CD2-ND1 3.96Å; Y334-H365 AromaticContact CD2-NE2 3.37Å; Y334-H365 WeakPolarHBondContact CD2-NE2 3.26Å; Y334-H365 AromaticContact CE2-CD2 3.72Å; Y334-H365 AromaticContact CE2-CE1 3.9Å; Y334-H365 AromaticContact CE2-NE2 3.3Å; Y334-H365 VanDerWaalsContact CE2-NE2 3.3Å; Y334-H365 WeakPolarHBondContact CE2-NE2 3.35Å; Y334-H365 AromaticContact CG-CE1 3.96Å; Y334-H365 AromaticContact CG-ND1 3.99Å; Y334-H365 AromaticContact CZ-CD2 3.83Å; Y334-H365 AromaticContact CZ-NE2 3.89Å; Q361-H365 PolarHBondContact O-N 2.88Å; Q361-H365 VanDerWaalsContact O-N 3.1Å; M362-H365 PolarHBondContact O-N 3.34Å; Y363-H365 PolarHBondContact O-N 3.09Å
366	R	90.8	Very high	92.1	Very high	109 Å²	109	50.8 Å²	50.8	41%	0.411	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	6.1	175.7	-70.3	179.3	170.1	177.6	-1.6	114.2	D335 F338 M362 Y363 L364 D368	D335-R366 IonicContact OD1-CZ 3.44Å; D335-R366 IonicContact OD1-NE 3.24Å; D335-R366 IonicContact OD1-NH2 3.2Å; D335-R366 PolarHBondContact OD1-NH2 2.78Å; F338-R366 VanDerWaalsContact CD2-NH1 3.31Å; F338-R366 VanDerWaalsContact CE1-NH1 3.26Å; M362-R366 PolarHBondContact O-N 3.48Å; M362-R366 VanDerWaalsContact O-N 3.08Å; Y363-R366 CarbonylContact O-C 3.4Å; Y363-R366 PolarHBondContact O-N 2.81Å; Y363-R366 VanDerWaalsContact O-N 3.12Å; L364-R366 PolarHBondContact O-N 2.92Å; R366-D368 PolarHBondContact O-N 2.73Å
367	N	89.1	Confident	92.1	Very high	125 Å²	125	51.2 Å²	51.2	67%	0.668	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	23.3	-175.4	-159.2	34.1	0	0	0	114.5	Y363 L364 L369	Y363-N367 PolarHBondContact O-N 2.75Å; Y363-N367 VanDerWaalsContact O-N 3.09Å; L364-N367 PolarHBondContact O-N 2.97Å; N367-L369 PolarHBondContact O-N 3.05Å
368	D	91.4	Very high	92	Very high	53 Å²	53	53.6 Å²	53.6	28%	0.283	25%	0.253	S	S	.	.			trans	-89.4	79.3	175.8	-170.7	-25	0	0	0	109.8	Y363 R366 E370 H371 A372	Y363-D368 HydrophobicContact CD1-CB 3.95Å; Y363-D368 PolarHBondContact O-N 2.71Å; R366-D368 PolarHBondContact O-N 2.73Å; D368-E370 VanDerWaalsContact C-N 3.27Å; D368-E370 PolarHBondContact O-N 2.62Å; D368-H371 WeakPolarHBondContact OD1-CB 3.47Å; D368-H371 IonicContact OD1-CG 3.27Å; D368-H371 PolarHBondContact OD1-N 3.13Å; D368-H371 IonicContact OD1-ND1 2.91Å; D368-H371 PolarHBondContact OD1-ND1 3.48Å; D368-H371 IonicContact OD2-CE1 2.63Å; D368-H371 IonicContact OD2-CG 2.83Å; D368-H371 IonicContact OD2-ND1 2.67Å; D368-H371 PolarHBondContact OD2-ND1 3.27Å; D368-A372 VanDerWaalsContact O-CB 3.22Å; D368-A372 WeakPolarHBondContact O-CB 3.36Å; D368-A372 PolarHBondContact O-N 2.92Å
369	L	90.6	Very high	92	Very high	60 Å²	60	53.7 Å²	53.7	31%	0.314	25%	0.253	S	S	.	.	H	α-helix	trans	-68.1	-24.7	-171.6	-52	-174	0	0	0	113.1	L364 N367 A373 L396	L364-L369 HydrophobicContact CD2-CD2 4.41Å; N367-L369 PolarHBondContact O-N 3.05Å; L369-A373 WeakPolarHBondContact O-CB 3.32Å; L369-A373 PolarHBondContact O-N 2.88Å; L369-A373 VanDerWaalsContact O-N 3.14Å; L369-L396 HydrophobicContact CB-CD2 3.92Å; L369-L396 HydrophobicContact CD2-CD2 3.75Å; L369-L396 HydrophobicContact CG-CD2 4.28Å
370	E	89.3	Confident	91.8	Very high	114 Å²	114	54.6 Å²	54.6	53%	0.533	26%	0.258	S	S	.	.	H	α-helix	trans	-80.7	-45.8	-179.3	-60.7	-149.2	127.8	0	0	111.7	D368 A372 A373 M374 K402	D368-E370 VanDerWaalsContact C-N 3.27Å; D368-E370 PolarHBondContact O-N 2.62Å; E370-A372 VanDerWaalsContact C-N 3.33Å; E370-A373 PolarHBondContact O-N 2.89Å; E370-M374 WeakPolarHBondContact O-CG 3.28Å; E370-M374 PolarHBondContact O-N 3.17Å; E370-K402 IonicContact OE1-NZ 2.76Å
371	H	90.8	Very high	91.6	Very high	90 Å²	90	61 Å²	61	42%	0.417	29%	0.285	S	S	.	.	H	α-helix	trans	-71.5	-28.4	174.1	-63.4	103.3	0	0	0	112.7	Y363 D368 S375	Y363-H371 HydrophobicContact CD1-CB 3.7Å; Y363-H371 HydrophobicContact CD2-CB 3.76Å; Y363-H371 HydrophobicContact CE1-CB 3.65Å; Y363-H371 HydrophobicContact CE2-CB 3.69Å; Y363-H371 HydrophobicContact CG-CB 3.78Å; D368-H371 WeakPolarHBondContact OD1-CB 3.47Å; D368-H371 IonicContact OD1-CG 3.27Å; D368-H371 PolarHBondContact OD1-N 3.13Å; D368-H371 IonicContact OD1-ND1 2.91Å; D368-H371 PolarHBondContact OD1-ND1 3.48Å; D368-H371 IonicContact OD2-CE1 2.63Å; D368-H371 IonicContact OD2-CG 2.83Å; D368-H371 IonicContact OD2-ND1 2.67Å; D368-H371 PolarHBondContact OD2-ND1 3.27Å; H371-S375 WeakPolarHBondContact O-CB 3.42Å; H371-S375 PolarHBondContact O-N 3.19Å; H371-S375 PolarHBondContact O-OG 3.05Å
372	A	93.4	Very high	91.3	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-58.3	-54	167.5	0	0	0	0	0	110.9	L364 D368 E370 M374 S375 F376 L396	L364-A372 HydrophobicContact CD2-CB 4.08Å; L364-A372 HydrophobicContact CG-CB 4.09Å; D368-A372 VanDerWaalsContact O-CB 3.22Å; D368-A372 WeakPolarHBondContact O-CB 3.36Å; D368-A372 PolarHBondContact O-N 2.92Å; E370-A372 VanDerWaalsContact C-N 3.33Å; A372-M374 PolarHBondContact O-N 3.05Å; A372-S375 WeakPolarHBondContact O-CB 3.4Å; A372-S375 PolarHBondContact O-N 2.92Å; A372-S375 VanDerWaalsContact O-N 3.12Å; A372-F376 HydrophobicContact CB-CD2 4.45Å; A372-F376 HydrophobicContact CB-CE2 4.2Å; A372-F376 WeakPolarHBondContact O-CD2 3.33Å; A372-F376 PolarHBondContact O-N 3.23Å; A372-L396 HydrophobicContact CB-CD1 4.11Å
373	A	92	Very high	91	Very high	4 Å²	4	65.1 Å²	65.1	3%	0.033	31%	0.309	C	S	.	.	H	α-helix	trans	-57.6	-46.1	179	0	0	0	0	0	112.5	L369 E370 S375 F376 E377 L393 L396 Y397	L369-A373 WeakPolarHBondContact O-CB 3.32Å; L369-A373 PolarHBondContact O-N 2.88Å; L369-A373 VanDerWaalsContact O-N 3.14Å; E370-A373 PolarHBondContact O-N 2.89Å; A373-S375 VanDerWaalsContact C-N 3.28Å; A373-S375 PolarHBondContact O-N 3.48Å; A373-F376 PolarHBondContact O-N 2.94Å; A373-E377 WeakPolarHBondContact O-CB 3.28Å; A373-E377 PolarHBondContact O-N 2.93Å; A373-L393 HydrophobicContact CB-CD1 3.84Å; A373-L396 HydrophobicContact CB-CD1 4.37Å; A373-Y397 HydrophobicContact CB-CE1 4.04Å
374	M	92.2	Very high	90.6	Very high	121 Å²	121	67.5 Å²	67.5	60%	0.596	33%	0.329	S	S	*	.	H	α-helix	trans	-60	-36.6	176.3	-70.5	176.2	65.5	0	0	113	E370 A372 R378	E370-M374 WeakPolarHBondContact O-CG 3.28Å; E370-M374 PolarHBondContact O-N 3.17Å; A372-M374 PolarHBondContact O-N 3.05Å; M374-R378 PolarHBondContact O-N 3.39Å
375	S	91.7	Very high	90.4	Very high	10 Å²	10	71.7 Å²	71.7	7%	0.07	35%	0.351	C	S	.	.	H	α-helix	trans	-69.2	-42.3	177.7	-57.7	0	0	0	0	111.5	H371 A372 A373 R378 V379	H371-S375 WeakPolarHBondContact O-CB 3.42Å; H371-S375 PolarHBondContact O-N 3.19Å; H371-S375 PolarHBondContact O-OG 3.05Å; A372-S375 WeakPolarHBondContact O-CB 3.4Å; A372-S375 PolarHBondContact O-N 2.92Å; A372-S375 VanDerWaalsContact O-N 3.12Å; A373-S375 VanDerWaalsContact C-N 3.28Å; A373-S375 PolarHBondContact O-N 3.48Å; S375-R378 WeakPolarHBondContact O-CB 3.42Å; S375-R378 PolarHBondContact O-N 3.45Å; S375-V379 PolarHBondContact O-N 3.42Å
376	F	94	Very high	90.4	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-71.9	-37.4	176.9	-67.6	-53.2	0	0	0	112.9	Y357 Q361 L364 A372 A373 R378 V379 L380 T389 I392 L393 L396	Y357-F376 HydrophobicContact CD2-CD1 4.08Å; Y357-F376 AromaticContact CD2-CE1 3.8Å; Y357-F376 HydrophobicContact CD2-CE1 3.8Å; Y357-F376 HydrophobicContact CE2-CD1 4.4Å; Y357-F376 AromaticContact CE2-CE1 3.95Å; Y357-F376 HydrophobicContact CE2-CE1 3.95Å; Y357-F376 HydrophobicContact CG-CE1 4.43Å; Q361-F376 HydrophobicContact CG-CZ 4.28Å; L364-F376 HydrophobicContact CD1-CE2 3.79Å; L364-F376 HydrophobicContact CD1-CZ 3.94Å; L364-F376 HydrophobicContact CG-CE2 4.09Å; A372-F376 HydrophobicContact CB-CD2 4.45Å; A372-F376 HydrophobicContact CB-CE2 4.2Å; A372-F376 WeakPolarHBondContact O-CD2 3.33Å; A372-F376 PolarHBondContact O-N 3.23Å; A373-F376 PolarHBondContact O-N 2.94Å; F376-R378 PolarHBondContact O-N 2.94Å; F376-V379 WeakPolarHBondContact O-CB 3.43Å; F376-V379 PolarHBondContact O-N 3.29Å; F376-V379 VanDerWaalsContact O-N 3.08Å; F376-L380 PolarHBondContact O-N 3.16Å; F376-T389 HydrophobicContact CB-CG2 3.68Å; F376-T389 HydrophobicContact CD1-CG2 3.95Å; F376-T389 HydrophobicContact CG-CG2 4.2Å; F376-T389 WeakPolarHBondContact O-CG2 3.18Å; F376-I392 HydrophobicContact CD2-CG2 3.67Å; F376-I392 HydrophobicContact CE1-CD1 4.43Å; F376-I392 HydrophobicContact CE1-CG2 4.39Å; F376-I392 HydrophobicContact CE2-CG2 3.39Å; F376-I392 HydrophobicContact CG-CG2 4.31Å; F376-I392 HydrophobicContact CZ-CD1 4.33Å; F376-I392 HydrophobicContact CZ-CG2 3.77Å; F376-L393 HydrophobicContact CB-CD1 4.41Å; F376-L396 HydrophobicContact CD2-CD1 3.99Å; F376-L396 HydrophobicContact CE2-CD1 4.33Å
377	E	92.3	Very high	90.3	Very high	62 Å²	62	66.2 Å²	66.2	29%	0.29	33%	0.33	S	S	.	.	H	α-helix	trans	-54.8	-39.8	167.9	-84.7	-169.4	-153.4	0	0	112.2	A373 V379 L380 K381 L393 Y397	A373-E377 WeakPolarHBondContact O-CB 3.28Å; A373-E377 PolarHBondContact O-N 2.93Å; E377-V379 VanDerWaalsContact C-N 3.3Å; E377-V379 PolarHBondContact O-N 3.01Å; E377-L380 PolarHBondContact O-N 2.83Å; E377-K381 WeakPolarHBondContact O-CD 3.19Å; E377-K381 VanDerWaalsContact O-CG 3.3Å; E377-K381 WeakPolarHBondContact O-CG 3.41Å; E377-K381 PolarHBondContact O-N 3.42Å; E377-K381 IonicContact OE2-NZ 2.75Å; E377-K381 PolarHBondContact OE2-NZ 3.18Å; E377-L393 HydrophobicContact CG-CD2 4.24Å; E377-Y397 PolarHBondContact OE1-OH 2.67Å; E377-Y397 VanDerWaalsContact OE1-OH 3.06Å
378	R	90.6	Very high	90.2	Very high	103 Å²	103	64.6 Å²	64.6	39%	0.389	32%	0.319	S	S	.	.	H	α-helix	trans	-64.7	-36.8	177.9	-172.4	69.2	-147.6	-152.8	4.6	111.4	F356 M374 S375 F376 D382	F356-R378 HydrophobicContact CD1-CB 4.3Å; F356-R378 HydrophobicContact CD1-CG 3.97Å; F356-R378 HydrophobicContact CD2-CG 4.33Å; F356-R378 HydrophobicContact CE1-CG 4.18Å; F356-R378 HydrophobicContact CG-CB 4.46Å; F356-R378 HydrophobicContact CG-CG 4.06Å; F356-R378 HydrophobicContact CZ-CG 4.45Å; M374-R378 PolarHBondContact O-N 3.39Å; S375-R378 WeakPolarHBondContact O-CB 3.42Å; S375-R378 PolarHBondContact O-N 3.45Å; F376-R378 PolarHBondContact O-N 2.94Å; R378-D382 IonicContact NE-OD2 2.98Å; R378-D382 IonicContact NH2-OD2 3.88Å
379	V	92.1	Very high	90.3	Very high	3 Å²	3	62.1 Å²	62.1	2%	0.018	31%	0.305	C	S	.	.	H	α-helix	trans	-66	-42.5	174.7	176.3	0	0	0	0	111.4	I353 F356 S375 F376 E377 K381 D382 N383 N386 T389	I353-V379 HydrophobicContact CG2-CB 4.08Å; I353-V379 HydrophobicContact CG2-CG1 4.05Å; I353-V379 HydrophobicContact CG2-CG2 3.86Å; F356-V379 HydrophobicContact CB-CG2 3.99Å; S375-V379 PolarHBondContact O-N 3.42Å; F376-V379 WeakPolarHBondContact O-CB 3.43Å; F376-V379 PolarHBondContact O-N 3.29Å; F376-V379 VanDerWaalsContact O-N 3.08Å; E377-V379 VanDerWaalsContact C-N 3.3Å; E377-V379 PolarHBondContact O-N 3.01Å; V379-K381 PolarHBondContact O-N 2.94Å; V379-D382 PolarHBondContact O-N 2.96Å; V379-N383 PolarHBondContact O-N 3.36Å; V379-N386 WeakPolarHBondContact CG1-ND2 3.44Å; V379-T389 HydrophobicContact CB-CG2 4.05Å; V379-T389 HydrophobicContact CG1-CG2 4.11Å
380	L	89.8	Confident	90.3	Very high	26 Å²	26	59.8 Å²	59.8	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-69.3	-29.3	178.8	-65.2	178.3	0	0	0	113.8	F376 E377 D382 N383 P384 N386 T389 L390 L393	F376-L380 PolarHBondContact O-N 3.16Å; E377-L380 PolarHBondContact O-N 2.83Å; L380-D382 VanDerWaalsContact C-N 3.25Å; L380-D382 PolarHBondContact O-N 3.48Å; L380-N383 CarbonylContact O-C 3.37Å; L380-P384 WeakPolarHBondContact O-CA 3.28Å; L380-P384 VanDerWaalsContact O-N 3.12Å; L380-N386 HydrophobicContact CD2-CB 4.36Å; L380-T389 HydrophobicContact CD1-CG2 4.23Å; L380-T389 HydrophobicContact CD2-CG2 3.69Å; L380-T389 HydrophobicContact CG-CG2 3.6Å; L380-L390 HydrophobicContact CD1-CD2 3.84Å; L380-L390 HydrophobicContact CD2-CD2 3.72Å; L380-L390 HydrophobicContact CD2-CG 3.93Å; L380-L390 HydrophobicContact CG-CD2 4.45Å; L380-L393 HydrophobicContact CD1-CD2 3.58Å
381	K	90.4	Very high	90.4	Very high	134 Å²	134	56 Å²	56	58%	0.583	28%	0.275	S	S	*	.	H	α-helix	trans	-62.3	-32.6	177.9	-77.5	160.3	-168.9	161.9	0	112.7	E377 V379	E377-K381 WeakPolarHBondContact O-CD 3.19Å; E377-K381 VanDerWaalsContact O-CG 3.3Å; E377-K381 WeakPolarHBondContact O-CG 3.41Å; E377-K381 PolarHBondContact O-N 3.42Å; E377-K381 IonicContact OE2-NZ 2.75Å; E377-K381 PolarHBondContact OE2-NZ 3.18Å; V379-K381 PolarHBondContact O-N 2.94Å
382	D	85.8	Confident	90.4	Very high	70 Å²	70	53.1 Å²	53.1	37%	0.374	26%	0.263	S	S	.	.	H	α-helix	trans	-100.8	-29	177.3	-63.8	-54.8	0	0	0	112.8	I353 R378 V379 L380	I353-D382 HydrophobicContact CD1-CB 3.4Å; I353-D382 VanDerWaalsContact CD1-CB 3.4Å; I353-D382 HydrophobicContact CG1-CB 3.88Å; R378-D382 IonicContact NE-OD2 2.98Å; R378-D382 IonicContact NH2-OD2 3.88Å; V379-D382 PolarHBondContact O-N 2.96Å; L380-D382 VanDerWaalsContact C-N 3.25Å; L380-D382 PolarHBondContact O-N 3.48Å
383	N	87.4	Confident	90.4	Very high	80 Å²	80	53.4 Å²	53.4	43%	0.428	26%	0.264	S	S	.	.			trans	-129.6	79.1	176.4	-69.4	-61.8	0	0	0	111.5	V379 L380 N385 N386	V379-N383 PolarHBondContact O-N 3.36Å; L380-N383 CarbonylContact O-C 3.37Å; N383-N385 VanDerWaalsContact C-N 3.3Å; N383-N385 PolarHBondContact O-N 3.08Å; N383-N386 HydrophobicContact CB-CB 4.35Å; N383-N386 WeakPolarHBondContact O-CB 3.5Å; N383-N386 PolarHBondContact O-N 2.93Å
384	P	87.8	Confident	90.3	Very high	80 Å²	80	53.2 Å²	53.2	52%	0.519	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-30.8	-171.7	22.9	-34	0	0	0	114.1	L380 N386	L380-P384 WeakPolarHBondContact O-CA 3.28Å; L380-P384 VanDerWaalsContact O-N 3.12Å; P384-N386 VanDerWaalsContact C-N 3.27Å; P384-N386 PolarHBondContact O-N 3.02Å
385	N	86.6	Confident	90.2	Very high	149 Å²	149	48.4 Å²	48.4	80%	0.797	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	23.4	-176.8	-60.6	21.9	0	0	0	112.8	N383 Y387	N383-N385 VanDerWaalsContact C-N 3.3Å; N383-N385 PolarHBondContact O-N 3.08Å; N385-Y387 PolarHBondContact O-N 3.06Å
386	N	89.3	Confident	90.1	Very high	50 Å²	50	48.6 Å²	48.6	27%	0.267	24%	0.241	S	C	.	.			trans	-79.9	87.7	-179.7	-170.5	3.4	0	0	0	111.2	V379 L380 N383 P384 E388 T389 L390	V379-N386 WeakPolarHBondContact CG1-ND2 3.44Å; L380-N386 HydrophobicContact CD2-CB 4.36Å; N383-N386 HydrophobicContact CB-CB 4.35Å; N383-N386 WeakPolarHBondContact O-CB 3.5Å; N383-N386 PolarHBondContact O-N 2.93Å; P384-N386 VanDerWaalsContact C-N 3.27Å; P384-N386 PolarHBondContact O-N 3.02Å; N386-E388 VanDerWaalsContact C-N 3.32Å; N386-E388 PolarHBondContact O-N 3.26Å; N386-E388 VanDerWaalsContact O-N 3.17Å; N386-T389 PolarHBondContact ND2-OG1 3.44Å; N386-T389 WeakPolarHBondContact O-CA 3.42Å; N386-T389 WeakPolarHBondContact O-CB 3.39Å; N386-T389 PolarHBondContact O-N 2.85Å; N386-L390 PolarHBondContact O-N 3.3Å
387	Y	89.4	Confident	90	Very high	56 Å²	56	49.1 Å²	49.1	22%	0.22	24%	0.243	C	C	.	.	H	α-helix	trans	-37.5	-52.8	179.6	163.7	-96.6	0	0	0	114.3	N385 T389 L390 K391 V416 Q420 D423	N385-Y387 PolarHBondContact O-N 3.06Å; Y387-T389 VanDerWaalsContact C-N 3.27Å; Y387-T389 PolarHBondContact O-N 2.97Å; Y387-L390 PolarHBondContact O-N 3.24Å; Y387-L390 VanDerWaalsContact O-N 3.14Å; Y387-K391 PolarHBondContact O-N 3.1Å; Y387-V416 HydrophobicContact CD2-CG1 3.97Å; Y387-V416 HydrophobicContact CE2-CG1 3.67Å; Y387-Q420 HydrophobicContact CD2-CB 4.01Å; Y387-Q420 HydrophobicContact CE2-CB 3.68Å; Y387-Q420 HydrophobicContact CE2-CG 4.19Å; Y387-D423 PolarHBondContact OH-OD2 3.45Å; Y387-D423 VanDerWaalsContact OH-OD2 3.13Å
388	E	88.3	Confident	89.7	Confident	92 Å²	92	46.7 Å²	46.7	43%	0.43	23%	0.233	S	C	.	.	H	α-helix	trans	-58.8	-40.6	-179.7	-60.3	-60.3	157	0	0	112	Y357 N386 I392	Y357-E388 HydrophobicContact CE2-CB 4.33Å; N386-E388 VanDerWaalsContact C-N 3.32Å; N386-E388 PolarHBondContact O-N 3.26Å; N386-E388 VanDerWaalsContact O-N 3.17Å; E388-I392 WeakPolarHBondContact O-CB 3.49Å; E388-I392 WeakPolarHBondContact O-CD1 3.39Å; E388-I392 WeakPolarHBondContact O-CG1 3.44Å; E388-I392 PolarHBondContact O-N 3.09Å
389	T	91.5	Very high	89.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-74.4	-34.4	179.8	-54.7	0	0	0	0	111.7	F376 V379 L380 N386 Y387 L393	F376-T389 HydrophobicContact CB-CG2 3.68Å; F376-T389 HydrophobicContact CD1-CG2 3.95Å; F376-T389 HydrophobicContact CG-CG2 4.2Å; F376-T389 WeakPolarHBondContact O-CG2 3.18Å; V379-T389 HydrophobicContact CB-CG2 4.05Å; V379-T389 HydrophobicContact CG1-CG2 4.11Å; L380-T389 HydrophobicContact CD1-CG2 4.23Å; L380-T389 HydrophobicContact CD2-CG2 3.69Å; L380-T389 HydrophobicContact CG-CG2 3.6Å; N386-T389 PolarHBondContact ND2-OG1 3.44Å; N386-T389 WeakPolarHBondContact O-CA 3.42Å; N386-T389 WeakPolarHBondContact O-CB 3.39Å; N386-T389 PolarHBondContact O-N 2.85Å; Y387-T389 VanDerWaalsContact C-N 3.27Å; Y387-T389 PolarHBondContact O-N 2.97Å; T389-L393 WeakPolarHBondContact O-CB 3.29Å; T389-L393 PolarHBondContact O-N 3.08Å
390	L	92.1	Very high	89.2	Confident	11 Å²	11	47.8 Å²	47.8	6%	0.058	25%	0.245	C	C	.	.	H	α-helix	trans	-65.1	-45	173.5	-65.8	170.2	0	0	0	111.3	L380 N386 Y387 G394 L412 V416	L380-L390 HydrophobicContact CD1-CD2 3.84Å; L380-L390 HydrophobicContact CD2-CD2 3.72Å; L380-L390 HydrophobicContact CD2-CG 3.93Å; L380-L390 HydrophobicContact CG-CD2 4.45Å; N386-L390 PolarHBondContact O-N 3.3Å; Y387-L390 PolarHBondContact O-N 3.24Å; Y387-L390 VanDerWaalsContact O-N 3.14Å; L390-G394 PolarHBondContact O-N 3.37Å; L390-L412 HydrophobicContact CD2-CD2 3.73Å; L390-V416 HydrophobicContact CB-CG2 3.58Å
391	K	91.1	Very high	88.6	Confident	35 Å²	35	53.9 Å²	53.9	15%	0.152	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-44.5	178	-175.7	170.5	176.1	172	0	112.2	Y387 S395 V416 D423 E425	Y387-K391 PolarHBondContact O-N 3.1Å; K391-S395 PolarHBondContact O-N 2.8Å; K391-S395 VanDerWaalsContact O-N 3.09Å; K391-S395 PolarHBondContact O-OG 3.34Å; K391-S395 VanDerWaalsContact O-OG 3.11Å; K391-V416 HydrophobicContact CB-CG1 4.38Å; K391-V416 HydrophobicContact CB-CG2 4.28Å; K391-D423 WeakPolarHBondContact CD-OD2 3.44Å; K391-D423 VanDerWaalsContact CE-OD2 3.28Å; K391-D423 WeakPolarHBondContact CE-OD2 3.44Å; K391-D423 IonicContact NZ-OD1 2.75Å; K391-D423 PolarHBondContact NZ-OD1 3.42Å; K391-D423 IonicContact NZ-OD2 3.9Å; K391-D423 PolarHBondContact NZ-OD2 3.23Å; K391-E425 VanDerWaalsContact CE-OE2 3.32Å; K391-E425 WeakPolarHBondContact CE-OE2 3.43Å; K391-E425 IonicContact NZ-OE2 2.63Å; K391-E425 PolarHBondContact NZ-OE2 3.47Å
392	I	91.5	Very high	88.3	Confident	30 Å²	30	53 Å²	53	15%	0.154	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-45.7	175.9	-67.9	167.2	0	0	0	111.5	Y357 L364 F376 E388 G394 S395 L396	Y357-I392 HydrophobicContact CE2-CD1 4.43Å; L364-I392 HydrophobicContact CD1-CG2 3.85Å; F376-I392 HydrophobicContact CD2-CG2 3.67Å; F376-I392 HydrophobicContact CE1-CD1 4.43Å; F376-I392 HydrophobicContact CE1-CG2 4.39Å; F376-I392 HydrophobicContact CE2-CG2 3.39Å; F376-I392 HydrophobicContact CG-CG2 4.31Å; F376-I392 HydrophobicContact CZ-CD1 4.33Å; F376-I392 HydrophobicContact CZ-CG2 3.77Å; E388-I392 WeakPolarHBondContact O-CB 3.49Å; E388-I392 WeakPolarHBondContact O-CD1 3.39Å; E388-I392 WeakPolarHBondContact O-CG1 3.44Å; E388-I392 PolarHBondContact O-N 3.09Å; I392-G394 VanDerWaalsContact C-N 3.34Å; I392-G394 PolarHBondContact O-N 3.37Å; I392-S395 PolarHBondContact O-N 3.5Å; I392-S395 PolarHBondContact O-OG 2.98Å; I392-L396 HydrophobicContact CG2-CD1 4.13Å; I392-L396 WeakPolarHBondContact O-CG 3.45Å; I392-L396 PolarHBondContact O-N 3.37Å; I392-L396 VanDerWaalsContact O-N 3.08Å
393	L	92	Very high	88	Confident	6 Å²	6	54 Å²	54	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-68.5	-34.8	179.8	-170.1	65.1	0	0	0	112	A373 F376 E377 L380 T389 Y397 L412	A373-L393 HydrophobicContact CB-CD1 3.84Å; F376-L393 HydrophobicContact CB-CD1 4.41Å; E377-L393 HydrophobicContact CG-CD2 4.24Å; L380-L393 HydrophobicContact CD1-CD2 3.58Å; T389-L393 WeakPolarHBondContact O-CB 3.29Å; T389-L393 PolarHBondContact O-N 3.08Å; L393-Y397 HydrophobicContact CD1-CD1 4.16Å; L393-Y397 HydrophobicContact CD1-CE1 3.6Å; L393-Y397 HydrophobicContact CD1-CE2 4.34Å; L393-Y397 HydrophobicContact CD2-CE2 4.31Å; L393-Y397 HydrophobicContact CG-CD2 4.42Å; L393-Y397 HydrophobicContact CG-CE1 4.18Å; L393-Y397 HydrophobicContact CG-CE2 4.09Å; L393-Y397 WeakPolarHBondContact O-CB 3.05Å; L393-Y397 PolarHBondContact O-N 2.88Å; L393-L412 HydrophobicContact CB-CD1 4.14Å; L393-L412 HydrophobicContact CD2-CD1 4.03Å; L393-L412 HydrophobicContact CG-CD1 3.87Å
394	G	90.9	Very high	87.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57	-58.6	171	0	0	0	0	0	111.6	L390 I392 L396 Y397 A398 S409	L390-G394 PolarHBondContact O-N 3.37Å; I392-G394 VanDerWaalsContact C-N 3.34Å; I392-G394 PolarHBondContact O-N 3.37Å; G394-L396 VanDerWaalsContact C-N 3.3Å; G394-L396 PolarHBondContact O-N 3.22Å; G394-Y397 CarbonylContact O-C 3.56Å; G394-Y397 WeakPolarHBondContact O-CA 3.46Å; G394-Y397 PolarHBondContact O-N 3.36Å; G394-A398 PolarHBondContact O-N 3.23Å; G394-S409 PolarHBondContact O-OG 3.33Å
395	S	89.5	Confident	87.8	Confident	20 Å²	20	53.8 Å²	53.8	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-58.2	-38.8	179.7	51.6	0	0	0	0	113.2	K391 I392 Y397 A398 Q399	K391-S395 PolarHBondContact O-N 2.8Å; K391-S395 VanDerWaalsContact O-N 3.09Å; K391-S395 PolarHBondContact O-OG 3.34Å; K391-S395 VanDerWaalsContact O-OG 3.11Å; I392-S395 PolarHBondContact O-N 3.5Å; I392-S395 PolarHBondContact O-OG 2.98Å; S395-Y397 VanDerWaalsContact C-N 3.28Å; S395-Y397 PolarHBondContact O-N 3.32Å; S395-A398 PolarHBondContact O-N 2.81Å; S395-Q399 WeakPolarHBondContact O-CG 3.47Å; S395-Q399 PolarHBondContact O-N 3.47Å
396	L	90.2	Very high	87.8	Confident	13 Å²	13	52 Å²	52	7%	0.068	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-34.5	171.5	-79	172.2	0	0	0	113.6	L364 L369 A372 A373 F376 I392 G394	L364-L396 HydrophobicContact CD2-CD1 4.18Å; L364-L396 HydrophobicContact CD2-CD2 3.75Å; L364-L396 HydrophobicContact CD2-CG 4.21Å; L369-L396 HydrophobicContact CB-CD2 3.92Å; L369-L396 HydrophobicContact CD2-CD2 3.75Å; L369-L396 HydrophobicContact CG-CD2 4.28Å; A372-L396 HydrophobicContact CB-CD1 4.11Å; A373-L396 HydrophobicContact CB-CD1 4.37Å; F376-L396 HydrophobicContact CD2-CD1 3.99Å; F376-L396 HydrophobicContact CE2-CD1 4.33Å; I392-L396 HydrophobicContact CG2-CD1 4.13Å; I392-L396 WeakPolarHBondContact O-CG 3.45Å; I392-L396 PolarHBondContact O-N 3.37Å; I392-L396 VanDerWaalsContact O-N 3.08Å; G394-L396 VanDerWaalsContact C-N 3.3Å; G394-L396 PolarHBondContact O-N 3.22Å
397	Y	90.7	Very high	87.7	Confident	12 Å²	12	53.1 Å²	53.1	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-84.7	-27	179.4	-76.7	7.2	0	0	0	112.8	A373 E377 L393 G394 S395 S400 K405 Q408 L412	A373-Y397 HydrophobicContact CB-CE1 4.04Å; E377-Y397 PolarHBondContact OE1-OH 2.67Å; E377-Y397 VanDerWaalsContact OE1-OH 3.06Å; L393-Y397 HydrophobicContact CD1-CD1 4.16Å; L393-Y397 HydrophobicContact CD1-CE1 3.6Å; L393-Y397 HydrophobicContact CD1-CE2 4.34Å; L393-Y397 HydrophobicContact CD2-CE2 4.31Å; L393-Y397 HydrophobicContact CG-CD2 4.42Å; L393-Y397 HydrophobicContact CG-CE1 4.18Å; L393-Y397 HydrophobicContact CG-CE2 4.09Å; L393-Y397 WeakPolarHBondContact O-CB 3.05Å; L393-Y397 PolarHBondContact O-N 2.88Å; G394-Y397 CarbonylContact O-C 3.56Å; G394-Y397 WeakPolarHBondContact O-CA 3.46Å; G394-Y397 PolarHBondContact O-N 3.36Å; S395-Y397 VanDerWaalsContact C-N 3.28Å; S395-Y397 PolarHBondContact O-N 3.32Å; Y397-S400 WeakPolarHBondContact O-CB 3.31Å; Y397-S400 PolarHBondContact O-N 3.37Å; Y397-K405 WeakPolarHBondContact CB-O 3.42Å; Y397-K405 HydrophobicContact CD1-CD 4.02Å; Y397-K405 HydrophobicContact CD1-CG 4.28Å; Y397-K405 HydrophobicContact CE1-CD 4.18Å; Y397-K405 HydrophobicContact CE1-CG 4.5Å; Y397-K405 HydrophobicContact CG-CB 4.29Å; Y397-K405 HydrophobicContact CG-CG 4.37Å; Y397-Q408 HydrophobicContact CD2-CB 3.83Å; Y397-Q408 HydrophobicContact CE2-CB 4.14Å; Y397-Q408 VanDerWaalsContact CE2-OE1 3.31Å; Y397-L412 HydrophobicContact CD2-CD1 3.79Å; Y397-L412 HydrophobicContact CE2-CD1 4.15Å
398	A	87.8	Confident	87.7	Confident	11 Å²	11	54.5 Å²	54.5	9%	0.091	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-43.6	171.5	0	0	0	0	0	112.3	G394 S395 S400 R406 S409 L433	G394-A398 PolarHBondContact O-N 3.23Å; S395-A398 PolarHBondContact O-N 2.81Å; A398-S400 PolarHBondContact O-N 2.73Å; A398-R406 PolarHBondContact O-NE 2.83Å; A398-R406 VanDerWaalsContact O-NE 3.16Å; A398-S409 PolarHBondContact N-OG 3.09Å; A398-L433 HydrophobicContact CB-CD1 4.25Å; A398-L433 HydrophobicContact CB-CD2 3.81Å; A398-L433 HydrophobicContact CB-CG 4.27Å
399	Q	85.6	Confident	87.9	Confident	107 Å²	107	50.1 Å²	50.1	50%	0.5	26%	0.255	S	S	.	.	S	Bend	trans	-68	-12.3	176.9	-68.3	171.2	13	0	0	113.4	S395	S395-Q399 WeakPolarHBondContact O-CG 3.47Å; S395-Q399 PolarHBondContact O-N 3.47Å
400	S	85.1	Confident	87.8	Confident	22 Å²	22	53 Å²	53	15%	0.154	27%	0.268	C	S	.	.			trans	-79.1	126.6	177.8	-171	0	0	0	0	112.2	Y397 A398 K402 K405	Y397-S400 WeakPolarHBondContact O-CB 3.31Å; Y397-S400 PolarHBondContact O-N 3.37Å; A398-S400 PolarHBondContact O-N 2.73Å; S400-K402 PolarHBondContact O-N 2.76Å; S400-K402 VanDerWaalsContact O-N 3.11Å; S400-K402 PolarHBondContact OG-N 2.85Å; S400-K405 WeakPolarHBondContact OG-CD 3.48Å
401	N	77.8	Confident	87.7	Confident	153 Å²	153	58.5 Å²	58.5	82%	0.818	29%	0.293	S	S	*	.	S	Bend	trans	-65.8	-7.2	172	-68.9	-8.7	0	0	0	114.2
402	K	83.6	Confident	87.7	Confident	116 Å²	116	57.9 Å²	57.9	50%	0.504	29%	0.292	S	S	.	.			trans	-80.7	122.5	178.8	-64.7	174.5	-178.4	168.8	0	109.3	E370 S400 D404 K405 R406	E370-K402 IonicContact OE1-NZ 2.76Å; S400-K402 PolarHBondContact O-N 2.76Å; S400-K402 VanDerWaalsContact O-N 3.11Å; S400-K402 PolarHBondContact OG-N 2.85Å; K402-D404 VanDerWaalsContact C-N 3.27Å; K402-D404 PolarHBondContact O-N 3.44Å; K402-K405 HydrophobicContact CB-CB 4.45Å; K402-K405 PolarHBondContact O-N 3.03Å; K402-K405 VanDerWaalsContact O-N 3.1Å; K402-R406 PolarHBondContact O-N 3.27Å
403	P	80.6	Confident	87.8	Confident	90 Å²	90	56.6 Å²	56.6	58%	0.584	29%	0.285	S	S	*	.	H	α-helix	trans	-61.2	-34.8	-174.5	24.4	-34	0	0	0	112.7	K405 R406 T407	P403-K405 VanDerWaalsContact C-N 3.33Å; P403-K405 PolarHBondContact O-N 3.49Å; P403-R406 CarbonylContact O-C 3.48Å; P403-R406 PolarHBondContact O-N 2.83Å; P403-R406 VanDerWaalsContact O-N 3.11Å; P403-T407 PolarHBondContact O-N 3.32Å
404	D	85.2	Confident	87.7	Confident	113 Å²	113	61 Å²	61	60%	0.604	30%	0.304	S	S	*	.	H	α-helix	trans	-63.4	-36.9	178	-45.2	-47.4	0	0	0	112.4	K402 T407 Q408	K402-D404 VanDerWaalsContact C-N 3.27Å; K402-D404 PolarHBondContact O-N 3.44Å; D404-T407 PolarHBondContact O-N 3.35Å; D404-T407 PolarHBondContact O-OG1 3.24Å; D404-Q408 VanDerWaalsContact O-CG 3.3Å; D404-Q408 WeakPolarHBondContact O-CG 3.47Å; D404-Q408 PolarHBondContact O-N 3.16Å
405	K	86.2	Confident	87.7	Confident	44 Å²	44	65.6 Å²	65.6	19%	0.191	33%	0.325	C	S	.	.	H	α-helix	trans	-68.9	-40.1	173	-80.4	-171.8	167.9	-173.4	0	110.4	Y397 S400 K402 P403 T407 Q408 S409	Y397-K405 WeakPolarHBondContact CB-O 3.42Å; Y397-K405 HydrophobicContact CD1-CD 4.02Å; Y397-K405 HydrophobicContact CD1-CG 4.28Å; Y397-K405 HydrophobicContact CE1-CD 4.18Å; Y397-K405 HydrophobicContact CE1-CG 4.5Å; Y397-K405 HydrophobicContact CG-CB 4.29Å; Y397-K405 HydrophobicContact CG-CG 4.37Å; S400-K405 WeakPolarHBondContact OG-CD 3.48Å; K402-K405 HydrophobicContact CB-CB 4.45Å; K402-K405 PolarHBondContact O-N 3.03Å; K402-K405 VanDerWaalsContact O-N 3.1Å; P403-K405 VanDerWaalsContact C-N 3.33Å; P403-K405 PolarHBondContact O-N 3.49Å; K405-T407 PolarHBondContact O-N 3.16Å; K405-Q408 PolarHBondContact O-N 3.15Å; K405-S409 WeakPolarHBondContact O-CB 3.15Å; K405-S409 PolarHBondContact O-N 3.34Å
406	R	85.6	Confident	87.8	Confident	111 Å²	111	64.6 Å²	64.6	42%	0.419	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-35.3	173.4	-78.1	-174.6	169.3	-167.5	-2.9	113.5	A398 K402 P403 S409 K410 L433	A398-R406 PolarHBondContact O-NE 2.83Å; A398-R406 VanDerWaalsContact O-NE 3.16Å; K402-R406 PolarHBondContact O-N 3.27Å; P403-R406 CarbonylContact O-C 3.48Å; P403-R406 PolarHBondContact O-N 2.83Å; P403-R406 VanDerWaalsContact O-N 3.11Å; R406-S409 WeakPolarHBondContact O-CB 3.47Å; R406-S409 PolarHBondContact O-N 3.1Å; R406-K410 WeakPolarHBondContact O-CG 3.35Å; R406-K410 PolarHBondContact O-N 3.48Å; R406-K410 VanDerWaalsContact O-N 3.11Å; R406-L433 HydrophobicContact CG-CD2 4.43Å
407	T	87.6	Confident	87.8	Confident	73 Å²	73	64.3 Å²	64.3	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-71.9	-37.6	174.5	59.1	0	0	0	0	112.3	P403 D404 K405 S409 K410 Q411	P403-T407 PolarHBondContact O-N 3.32Å; D404-T407 PolarHBondContact O-N 3.35Å; D404-T407 PolarHBondContact O-OG1 3.24Å; K405-T407 PolarHBondContact O-N 3.16Å; T407-S409 VanDerWaalsContact C-N 3.33Å; T407-K410 PolarHBondContact O-N 3.46Å; T407-Q411 PolarHBondContact O-N 3.34Å
408	Q	89.6	Confident	87.8	Confident	85 Å²	85	70 Å²	70	40%	0.397	34%	0.344	S	S	.	.	H	α-helix	trans	-61.7	-40.1	169	-70.4	171.5	0.3	0	0	111.7	Y397 D404 K405 K410 Q411 L412	Y397-Q408 HydrophobicContact CD2-CB 3.83Å; Y397-Q408 HydrophobicContact CE2-CB 4.14Å; Y397-Q408 VanDerWaalsContact CE2-OE1 3.31Å; D404-Q408 VanDerWaalsContact O-CG 3.3Å; D404-Q408 WeakPolarHBondContact O-CG 3.47Å; D404-Q408 PolarHBondContact O-N 3.16Å; K405-Q408 PolarHBondContact O-N 3.15Å; Q408-K410 PolarHBondContact O-N 2.85Å; Q408-Q411 WeakPolarHBondContact O-CB 3.32Å; Q408-Q411 PolarHBondContact O-N 3.42Å; Q408-Q411 VanDerWaalsContact O-N 3.09Å; Q408-L412 WeakPolarHBondContact O-CG 3.16Å; Q408-L412 PolarHBondContact O-N 2.84Å
409	S	90.9	Very high	87.9	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-58.1	-45.3	175.4	-168.7	0	0	0	0	112.3	G394 A398 K405 R406 T407 Q411 L412 F413 L433	G394-S409 PolarHBondContact O-OG 3.33Å; A398-S409 PolarHBondContact N-OG 3.09Å; K405-S409 WeakPolarHBondContact O-CB 3.15Å; K405-S409 PolarHBondContact O-N 3.34Å; R406-S409 WeakPolarHBondContact O-CB 3.47Å; R406-S409 PolarHBondContact O-N 3.1Å; T407-S409 VanDerWaalsContact C-N 3.33Å; S409-Q411 VanDerWaalsContact C-N 3.26Å; S409-Q411 PolarHBondContact O-N 2.98Å; S409-L412 PolarHBondContact O-N 2.95Å; S409-F413 PolarHBondContact O-N 3.46Å; S409-L433 WeakPolarHBondContact OG-CD1 3.47Å
410	K	89.8	Confident	88	Confident	60 Å²	60	70.8 Å²	70.8	26%	0.261	35%	0.353	S	S	.	.	H	α-helix	trans	-56.7	-39.9	174.2	-67.9	176.1	-160.1	-128.5	0	111.9	R406 T407 Q408 K414 L433	R406-K410 WeakPolarHBondContact O-CG 3.35Å; R406-K410 PolarHBondContact O-N 3.48Å; R406-K410 VanDerWaalsContact O-N 3.11Å; T407-K410 PolarHBondContact O-N 3.46Å; Q408-K410 PolarHBondContact O-N 2.85Å; K410-K414 VanDerWaalsContact O-CB 3.29Å; K410-K414 WeakPolarHBondContact O-CB 3.35Å; K410-K414 PolarHBondContact O-N 3.27Å; K410-L433 WeakPolarHBondContact CE-O 3.4Å; K410-L433 HydrophobicContact CG-CB 3.89Å; K410-L433 PolarHBondContact NZ-O 2.96Å
411	Q	91	Very high	88.2	Confident	128 Å²	128	73.2 Å²	73.2	60%	0.598	37%	0.368	S	S	*	.	H	α-helix	trans	-70.5	-42.4	178.3	-65	175.8	0.8	0	0	112.1	T407 Q408 S409 K414 Q415	T407-Q411 PolarHBondContact O-N 3.34Å; Q408-Q411 WeakPolarHBondContact O-CB 3.32Å; Q408-Q411 PolarHBondContact O-N 3.42Å; Q408-Q411 VanDerWaalsContact O-N 3.09Å; S409-Q411 VanDerWaalsContact C-N 3.26Å; S409-Q411 PolarHBondContact O-N 2.98Å; Q411-K414 PolarHBondContact O-N 3.47Å; Q411-Q415 WeakPolarHBondContact O-CG 3.24Å; Q411-Q415 PolarHBondContact O-N 2.94Å; Q411-Q415 VanDerWaalsContact O-N 3.12Å
412	L	91.5	Very high	88.6	Confident	22 Å²	22	72.6 Å²	72.6	12%	0.115	36%	0.361	C	S	.	.	H	α-helix	trans	-63.3	-51.1	176.6	-69.4	173.1	0	0	0	111.4	L390 L393 Y397 Q408 S409 K414 Q415 V416	L390-L412 HydrophobicContact CD2-CD2 3.73Å; L393-L412 HydrophobicContact CB-CD1 4.14Å; L393-L412 HydrophobicContact CD2-CD1 4.03Å; L393-L412 HydrophobicContact CG-CD1 3.87Å; Y397-L412 HydrophobicContact CD2-CD1 3.79Å; Y397-L412 HydrophobicContact CE2-CD1 4.15Å; Q408-L412 WeakPolarHBondContact O-CG 3.16Å; Q408-L412 PolarHBondContact O-N 2.84Å; S409-L412 PolarHBondContact O-N 2.95Å; L412-K414 VanDerWaalsContact C-N 3.31Å; L412-K414 PolarHBondContact O-N 3.25Å; L412-Q415 WeakPolarHBondContact O-CB 3.48Å; L412-Q415 PolarHBondContact O-N 3.46Å; L412-Q415 VanDerWaalsContact O-N 3.1Å; L412-V416 WeakPolarHBondContact O-CG2 3.29Å; L412-V416 PolarHBondContact O-N 2.9Å
413	F	91.9	Very high	88.8	Confident	2 Å²	2	68 Å²	68	1%	0.009	34%	0.341	C	S	.	.	H	α-helix	trans	-64.5	-34	178.5	-84.8	-70.4	0	0	0	113	S409 Q415 V416 T417 A426 E429 Y430 L433	S409-F413 PolarHBondContact O-N 3.46Å; F413-Q415 PolarHBondContact O-N 3.47Å; F413-V416 PolarHBondContact O-N 2.71Å; F413-T417 WeakPolarHBondContact O-CG2 3.37Å; F413-T417 PolarHBondContact O-N 3.38Å; F413-T417 PolarHBondContact O-OG1 2.93Å; F413-A426 HydrophobicContact CD1-CB 4.22Å; F413-E429 HydrophobicContact CD1-CB 4.04Å; F413-E429 HydrophobicContact CD2-CB 4.4Å; F413-E429 HydrophobicContact CE1-CB 3.5Å; F413-E429 VanDerWaalsContact CE1-CB 3.5Å; F413-E429 HydrophobicContact CE1-CG 4.02Å; F413-E429 HydrophobicContact CE2-CB 3.85Å; F413-E429 HydrophobicContact CG-CB 4.46Å; F413-E429 HydrophobicContact CZ-CB 3.38Å; F413-E429 HydrophobicContact CZ-CG 3.77Å; F413-Y430 HydrophobicContact CB-CD2 3.86Å; F413-Y430 HydrophobicContact CB-CG 4.41Å; F413-L433 HydrophobicContact CD2-CD1 3.41Å; F413-L433 VanDerWaalsContact CD2-CD1 3.41Å; F413-L433 HydrophobicContact CE2-CD1 3.91Å; F413-L433 HydrophobicContact CG-CD1 4.28Å
414	K	91.2	Very high	89.2	Confident	99 Å²	99	64.5 Å²	64.5	43%	0.43	32%	0.319	S	S	.	.	H	α-helix	trans	-57.1	-49.7	169.7	-178.4	169.3	175.7	172.6	0	111.2	K410 Q411 L412 V416 T417 E418 Y430	K410-K414 VanDerWaalsContact O-CB 3.29Å; K410-K414 WeakPolarHBondContact O-CB 3.35Å; K410-K414 PolarHBondContact O-N 3.27Å; Q411-K414 PolarHBondContact O-N 3.47Å; L412-K414 VanDerWaalsContact C-N 3.31Å; L412-K414 PolarHBondContact O-N 3.25Å; K414-V416 VanDerWaalsContact C-N 3.32Å; K414-V416 PolarHBondContact O-N 3.09Å; K414-T417 PolarHBondContact O-N 3.1Å; K414-T417 PolarHBondContact O-OG1 2.87Å; K414-E418 WeakPolarHBondContact CE-OE1 3.45Å; K414-E418 HydrophobicContact CG-CG 4.49Å; K414-E418 WeakPolarHBondContact CG-OE1 3.44Å; K414-E418 IonicContact NZ-OE1 3.89Å; K414-E418 WeakPolarHBondContact O-CB 3.49Å; K414-E418 WeakPolarHBondContact O-CG 3.22Å; K414-E418 PolarHBondContact O-N 3.36Å; K414-Y430 HydrophobicContact CB-CE2 3.98Å
415	Q	90.8	Very high	89.3	Confident	96 Å²	96	61.5 Å²	61.5	45%	0.449	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-38	175.3	-68.6	173.8	2.6	0	0	112.9	Q411 L412 F413 E418 S419	Q411-Q415 WeakPolarHBondContact O-CG 3.24Å; Q411-Q415 PolarHBondContact O-N 2.94Å; Q411-Q415 VanDerWaalsContact O-N 3.12Å; L412-Q415 WeakPolarHBondContact O-CB 3.48Å; L412-Q415 PolarHBondContact O-N 3.46Å; L412-Q415 VanDerWaalsContact O-N 3.1Å; F413-Q415 PolarHBondContact O-N 3.47Å; Q415-E418 PolarHBondContact O-N 2.97Å; Q415-S419 VanDerWaalsContact O-CB 3.3Å; Q415-S419 WeakPolarHBondContact O-CB 3.46Å; Q415-S419 PolarHBondContact O-N 3.47Å; Q415-S419 PolarHBondContact O-OG 2.97Å
416	V	91.9	Very high	89.5	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.6	-53.2	174.6	176.1	0	0	0	0	110.3	Y387 L390 K391 L412 F413 K414 E418 S419 Q420 A426	Y387-V416 HydrophobicContact CD2-CG1 3.97Å; Y387-V416 HydrophobicContact CE2-CG1 3.67Å; L390-V416 HydrophobicContact CB-CG2 3.58Å; K391-V416 HydrophobicContact CB-CG1 4.38Å; K391-V416 HydrophobicContact CB-CG2 4.28Å; L412-V416 WeakPolarHBondContact O-CG2 3.29Å; L412-V416 PolarHBondContact O-N 2.9Å; F413-V416 PolarHBondContact O-N 2.71Å; K414-V416 VanDerWaalsContact C-N 3.32Å; K414-V416 PolarHBondContact O-N 3.09Å; V416-E418 VanDerWaalsContact C-N 3.3Å; V416-E418 PolarHBondContact O-N 2.99Å; V416-S419 PolarHBondContact O-N 3.43Å; V416-S419 PolarHBondContact O-OG 3.18Å; V416-Q420 PolarHBondContact O-N 3.43Å; V416-A426 HydrophobicContact CB-CB 4.39Å; V416-A426 HydrophobicContact CG1-CB 3.54Å
417	T	90	Very high	89.8	Confident	7 Å²	7	55.3 Å²	55.3	4%	0.043	28%	0.276	C	S	.	.	H	α-helix	trans	-64.7	-29	179.6	60.6	0	0	0	0	113.9	F413 K414 P421 A426 W427	F413-T417 WeakPolarHBondContact O-CG2 3.37Å; F413-T417 PolarHBondContact O-N 3.38Å; F413-T417 PolarHBondContact O-OG1 2.93Å; K414-T417 PolarHBondContact O-N 3.1Å; K414-T417 PolarHBondContact O-OG1 2.87Å; T417-P421 WeakPolarHBondContact O-CA 3.19Å; T417-A426 HydrophobicContact CG2-CB 3.9Å; T417-W427 HydrophobicContact CG2-CD2 3.75Å; T417-W427 HydrophobicContact CG2-CE3 3.8Å; T417-W427 HydrophobicContact CG2-CG 4.26Å; T417-W427 HydrophobicContact CG2-CH2 4.16Å; T417-W427 HydrophobicContact CG2-CZ2 4.15Å; T417-W427 HydrophobicContact CG2-CZ3 4Å
418	E	90.5	Very high	89.9	Confident	131 Å²	131	52.2 Å²	52.2	61%	0.612	26%	0.257	S	S	*	.	H	α-helix	trans	-73.5	-30.6	171.3	-73.4	173.5	-179.9	0	0	112.3	K414 Q415 V416	K414-E418 WeakPolarHBondContact CE-OE1 3.45Å; K414-E418 HydrophobicContact CG-CG 4.49Å; K414-E418 WeakPolarHBondContact CG-OE1 3.44Å; K414-E418 IonicContact NZ-OE1 3.89Å; K414-E418 WeakPolarHBondContact O-CB 3.49Å; K414-E418 WeakPolarHBondContact O-CG 3.22Å; K414-E418 PolarHBondContact O-N 3.36Å; Q415-E418 PolarHBondContact O-N 2.97Å; V416-E418 VanDerWaalsContact C-N 3.3Å; V416-E418 PolarHBondContact O-N 2.99Å
419	S	89	Confident	89.9	Confident	64 Å²	64	49.7 Å²	49.7	45%	0.448	25%	0.245	S	C	.	.	H	α-helix	trans	-83.1	-36	-178.7	72.7	0	0	0	0	114.4	Q415 V416	Q415-S419 VanDerWaalsContact O-CB 3.3Å; Q415-S419 WeakPolarHBondContact O-CB 3.46Å; Q415-S419 PolarHBondContact O-N 3.47Å; Q415-S419 PolarHBondContact O-OG 2.97Å; V416-S419 PolarHBondContact O-N 3.43Å; V416-S419 PolarHBondContact O-OG 3.18Å
420	Q	88.6	Confident	89.9	Confident	71 Å²	71	51.7 Å²	51.7	33%	0.332	25%	0.253	S	S	.	.			trans	-142.1	84.9	179.4	-176.6	58.4	30.7	0	0	108.9	Y387 V416 E422 D423	Y387-Q420 HydrophobicContact CD2-CB 4.01Å; Y387-Q420 HydrophobicContact CE2-CB 3.68Å; Y387-Q420 HydrophobicContact CE2-CG 4.19Å; V416-Q420 PolarHBondContact O-N 3.43Å; Q420-E422 PolarHBondContact NE2-OE2 2.91Å; Q420-E422 PolarHBondContact O-N 3.42Å; Q420-E422 VanDerWaalsContact O-N 3.12Å; Q420-D423 HydrophobicContact CG-CB 4.47Å; Q420-D423 PolarHBondContact O-N 3.37Å
421	P	88.8	Confident	90	Very high	73 Å²	73	48.9 Å²	48.9	47%	0.474	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-9.3	-171.7	28.5	-36.3	0	0	0	114.3	T417 W427 I451	T417-P421 WeakPolarHBondContact O-CA 3.19Å; P421-W427 PolarHBondContact O-NE1 3.36Å; P421-I451 VanDerWaalsContact O-CD1 3.31Å; P421-I451 WeakPolarHBondContact O-CD1 3.37Å
422	E	87	Confident	89.8	Confident	140 Å²	140	45.2 Å²	45.2	65%	0.654	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-7.8	178.9	-54.9	172.2	144.6	0	0	112.9	Q420 V424	Q420-E422 PolarHBondContact NE2-OE2 2.91Å; Q420-E422 PolarHBondContact O-N 3.42Å; Q420-E422 VanDerWaalsContact O-N 3.12Å; E422-V424 PolarHBondContact O-N 2.64Å
423	D	88.1	Confident	89.6	Confident	19 Å²	19	44.9 Å²	44.9	10%	0.102	22%	0.222	C	C	.	.			trans	-77.2	101.7	179.7	-179.4	19.2	0	0	0	112.3	Y387 K391 Q420 E425 A426 W427	Y387-D423 PolarHBondContact OH-OD2 3.45Å; Y387-D423 VanDerWaalsContact OH-OD2 3.13Å; K391-D423 WeakPolarHBondContact CD-OD2 3.44Å; K391-D423 VanDerWaalsContact CE-OD2 3.28Å; K391-D423 WeakPolarHBondContact CE-OD2 3.44Å; K391-D423 IonicContact NZ-OD1 2.75Å; K391-D423 PolarHBondContact NZ-OD1 3.42Å; K391-D423 IonicContact NZ-OD2 3.9Å; K391-D423 PolarHBondContact NZ-OD2 3.23Å; Q420-D423 HydrophobicContact CG-CB 4.47Å; Q420-D423 PolarHBondContact O-N 3.37Å; D423-E425 VanDerWaalsContact C-N 3.29Å; D423-E425 PolarHBondContact O-N 2.82Å; D423-E425 PolarHBondContact OD1-N 2.83Å; D423-E425 VanDerWaalsContact OD1-N 3.09Å; D423-A426 HydrophobicContact CB-CB 4.12Å; D423-A426 PolarHBondContact O-N 3.32Å; D423-A426 WeakPolarHBondContact OD2-CB 3.45Å; D423-A426 PolarHBondContact OD2-N 2.87Å; D423-W427 VanDerWaalsContact O-CD1 3.23Å; D423-W427 PolarHBondContact O-N 2.64Å
424	V	88.7	Confident	89.3	Confident	17 Å²	17	45.4 Å²	45.4	10%	0.103	23%	0.225	C	C	.	.	H	α-helix	trans	-58.6	-38	177.5	-179.4	0	0	0	0	112.1	E422 W427 I428 A448 I451 L452	E422-V424 PolarHBondContact O-N 2.64Å; V424-W427 PolarHBondContact O-N 2.79Å; V424-I428 HydrophobicContact CG1-CD1 3.78Å; V424-I428 HydrophobicContact CG1-CG1 4.47Å; V424-I428 WeakPolarHBondContact O-CG1 3.48Å; V424-I428 PolarHBondContact O-N 3.22Å; V424-I428 VanDerWaalsContact O-N 3.1Å; V424-A448 HydrophobicContact CG1-CB 4.21Å; V424-I451 HydrophobicContact CG2-CB 3.97Å; V424-I451 HydrophobicContact CG2-CG2 3.42Å; V424-I451 VanDerWaalsContact CG2-CG2 3.42Å; V424-L452 HydrophobicContact CG1-CD1 4Å; V424-L452 HydrophobicContact CG1-CD2 4.09Å; V424-L452 HydrophobicContact CG1-CG 3.9Å; V424-L452 HydrophobicContact CG2-CD2 4.32Å; V424-L452 HydrophobicContact CG2-CG 4.28Å
425	E	87	Confident	88.5	Confident	50 Å²	50	44.5 Å²	44.5	23%	0.234	22%	0.224	C	C	.	.	H	α-helix	trans	-67.9	-42.1	-177.3	-63.1	-173.3	120.2	0	0	111.5	K391 D423 W427 I428 E429 L997 Q1001	K391-E425 VanDerWaalsContact CE-OE2 3.32Å; K391-E425 WeakPolarHBondContact CE-OE2 3.43Å; K391-E425 IonicContact NZ-OE2 2.63Å; K391-E425 PolarHBondContact NZ-OE2 3.47Å; D423-E425 VanDerWaalsContact C-N 3.29Å; D423-E425 PolarHBondContact O-N 2.82Å; D423-E425 PolarHBondContact OD1-N 2.83Å; D423-E425 VanDerWaalsContact OD1-N 3.09Å; E425-W427 VanDerWaalsContact C-N 3.29Å; E425-W427 PolarHBondContact O-N 3.36Å; E425-I428 PolarHBondContact O-N 3.21Å; E425-I428 VanDerWaalsContact O-N 3.16Å; E425-E429 WeakPolarHBondContact O-CG 3.2Å; E425-E429 PolarHBondContact O-N 3.3Å; E425-L997 HydrophobicContact CG-CD2 3.98Å; E425-Q1001 WeakPolarHBondContact OE1-CG 3.33Å; E425-Q1001 PolarHBondContact OE1-NE2 3.24Å
426	A	90.5	Very high	87.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.4	-37.7	176.4	0	0	0	0	0	112.1	F413 V416 T417 D423 Y430	F413-A426 HydrophobicContact CD1-CB 4.22Å; V416-A426 HydrophobicContact CB-CB 4.39Å; V416-A426 HydrophobicContact CG1-CB 3.54Å; T417-A426 HydrophobicContact CG2-CB 3.9Å; D423-A426 HydrophobicContact CB-CB 4.12Å; D423-A426 PolarHBondContact O-N 3.32Å; D423-A426 WeakPolarHBondContact OD2-CB 3.45Å; D423-A426 PolarHBondContact OD2-N 2.87Å; A426-Y430 WeakPolarHBondContact O-CB 3.39Å; A426-Y430 PolarHBondContact O-N 3.47Å
427	W	92.2	Very high	87.5	Confident	25 Å²	25	49.7 Å²	49.7	10%	0.095	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-37.7	173.7	-73.7	114.4	0	0	0	112.9	T417 P421 D423 V424 E425 Y430 A431 A444 K447 A448	T417-W427 HydrophobicContact CG2-CD2 3.75Å; T417-W427 HydrophobicContact CG2-CE3 3.8Å; T417-W427 HydrophobicContact CG2-CG 4.26Å; T417-W427 HydrophobicContact CG2-CH2 4.16Å; T417-W427 HydrophobicContact CG2-CZ2 4.15Å; T417-W427 HydrophobicContact CG2-CZ3 4Å; P421-W427 PolarHBondContact O-NE1 3.36Å; D423-W427 VanDerWaalsContact O-CD1 3.23Å; D423-W427 PolarHBondContact O-N 2.64Å; V424-W427 PolarHBondContact O-N 2.79Å; E425-W427 VanDerWaalsContact C-N 3.29Å; E425-W427 PolarHBondContact O-N 3.36Å; W427-Y430 HydrophobicContact CE3-CD1 4.22Å; W427-Y430 HydrophobicContact CZ3-CD1 4.18Å; W427-Y430 HydrophobicContact CZ3-CE1 4.45Å; W427-A431 VanDerWaalsContact O-CB 3.28Å; W427-A431 WeakPolarHBondContact O-CB 3.3Å; W427-A431 PolarHBondContact O-N 3.24Å; W427-A444 HydrophobicContact CE3-CB 4.08Å; W427-K447 HydrophobicContact CD2-CB 3.98Å; W427-K447 HydrophobicContact CD2-CD 4.17Å; W427-K447 HydrophobicContact CE3-CB 4.33Å; W427-K447 HydrophobicContact CE3-CD 3.91Å; W427-K447 HydrophobicContact CG-CB 4.26Å; W427-K447 HydrophobicContact CH2-CD 3.53Å; W427-K447 HydrophobicContact CZ2-CD 3.74Å; W427-K447 HydrophobicContact CZ3-CD 3.61Å; W427-A448 HydrophobicContact CB-CB 3.94Å
428	I	89.7	Confident	87.3	Confident	7 Å²	7	51.2 Å²	51.2	4%	0.036	26%	0.263	C	S	.	.	H	α-helix	trans	-69.6	-49.1	178.4	-67.9	165.4	0	0	0	111.3	V424 E425 Y430 A431 Q432 Y445 A448 I463 L997 I1005	V424-I428 HydrophobicContact CG1-CD1 3.78Å; V424-I428 HydrophobicContact CG1-CG1 4.47Å; V424-I428 WeakPolarHBondContact O-CG1 3.48Å; V424-I428 PolarHBondContact O-N 3.22Å; V424-I428 VanDerWaalsContact O-N 3.1Å; E425-I428 PolarHBondContact O-N 3.21Å; E425-I428 VanDerWaalsContact O-N 3.16Å; I428-Y430 VanDerWaalsContact C-N 3.31Å; I428-Y430 PolarHBondContact O-N 3.02Å; I428-A431 PolarHBondContact O-N 2.91Å; I428-Q432 WeakPolarHBondContact O-CG 3.45Å; I428-Q432 PolarHBondContact O-N 3.46Å; I428-Y445 HydrophobicContact CG2-CE1 4.4Å; I428-A448 HydrophobicContact CG1-CB 4Å; I428-I463 HydrophobicContact CD1-CD1 3.61Å; I428-I463 HydrophobicContact CD1-CG1 4.25Å; I428-I463 HydrophobicContact CG1-CD1 4.41Å; I428-L997 HydrophobicContact CD1-CD1 4.35Å; I428-I1005 HydrophobicContact CD1-CD1 4.02Å; I428-I1005 HydrophobicContact CG2-CD1 4.23Å; I428-I1005 HydrophobicContact CG2-CG1 4.15Å; I428-I1005 HydrophobicContact CG2-CG2 4.38Å
429	E	88.5	Confident	87.3	Confident	32 Å²	32	47.7 Å²	47.7	15%	0.15	25%	0.248	C	C	.	.	H	α-helix	trans	-61	-40.7	176.1	-69.9	-93.1	177.3	0	0	111	F413 E425 Q432 L433	F413-E429 HydrophobicContact CD1-CB 4.04Å; F413-E429 HydrophobicContact CD2-CB 4.4Å; F413-E429 HydrophobicContact CE1-CB 3.5Å; F413-E429 VanDerWaalsContact CE1-CB 3.5Å; F413-E429 HydrophobicContact CE1-CG 4.02Å; F413-E429 HydrophobicContact CE2-CB 3.85Å; F413-E429 HydrophobicContact CG-CB 4.46Å; F413-E429 HydrophobicContact CZ-CB 3.38Å; F413-E429 HydrophobicContact CZ-CG 3.77Å; E425-E429 WeakPolarHBondContact O-CG 3.2Å; E425-E429 PolarHBondContact O-N 3.3Å; E429-Q432 PolarHBondContact O-N 3.13Å; E429-L433 WeakPolarHBondContact O-CD1 3.47Å; E429-L433 VanDerWaalsContact O-CG 3.3Å; E429-L433 WeakPolarHBondContact O-CG 3.46Å; E429-L433 PolarHBondContact O-N 3.45Å
430	Y	91.7	Very high	87.4	Confident	43 Å²	43	45.4 Å²	45.4	17%	0.169	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-43.1	173.3	-172.6	-118.8	0	0	0	112.2	F413 K414 A426 W427 I428 L433 L434 A444	F413-Y430 HydrophobicContact CB-CD2 3.86Å; F413-Y430 HydrophobicContact CB-CG 4.41Å; K414-Y430 HydrophobicContact CB-CE2 3.98Å; A426-Y430 WeakPolarHBondContact O-CB 3.39Å; A426-Y430 PolarHBondContact O-N 3.47Å; W427-Y430 HydrophobicContact CE3-CD1 4.22Å; W427-Y430 HydrophobicContact CZ3-CD1 4.18Å; W427-Y430 HydrophobicContact CZ3-CE1 4.45Å; I428-Y430 VanDerWaalsContact C-N 3.31Å; I428-Y430 PolarHBondContact O-N 3.02Å; Y430-L433 PolarHBondContact O-N 2.93Å; Y430-L434 HydrophobicContact CD1-CD1 3.96Å; Y430-L434 HydrophobicContact CE1-CD1 3.58Å; Y430-L434 HydrophobicContact CE1-CG 4.5Å; Y430-L434 HydrophobicContact CE2-CD1 4.48Å; Y430-L434 WeakPolarHBondContact O-CG 3.28Å; Y430-L434 PolarHBondContact O-N 2.94Å; Y430-A444 HydrophobicContact CD1-CB 3.91Å
431	A	90.7	Very high	87.5	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-64.9	-40.6	178	0	0	0	0	0	112.8	W427 I428 L433 L434 A444 Y445	W427-A431 VanDerWaalsContact O-CB 3.28Å; W427-A431 WeakPolarHBondContact O-CB 3.3Å; W427-A431 PolarHBondContact O-N 3.24Å; I428-A431 PolarHBondContact O-N 2.91Å; A431-L433 VanDerWaalsContact C-N 3.32Å; A431-L433 PolarHBondContact O-N 3.42Å; A431-L434 PolarHBondContact O-N 3.15Å; A431-L434 VanDerWaalsContact O-N 3.11Å; A431-A444 HydrophobicContact CB-CB 3.64Å; A431-Y445 HydrophobicContact CB-CD1 3.81Å; A431-Y445 HydrophobicContact CB-CD2 3.57Å; A431-Y445 HydrophobicContact CB-CE1 3.79Å; A431-Y445 HydrophobicContact CB-CE2 3.52Å; A431-Y445 HydrophobicContact CB-CG 3.7Å
432	Q	87.4	Confident	87.6	Confident	50 Å²	50	39.4 Å²	39.4	23%	0.234	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-39.7	173.2	-69.4	179.2	19.8	0	0	111.7	I428 E429 L434 D435 Y445	I428-Q432 WeakPolarHBondContact O-CG 3.45Å; I428-Q432 PolarHBondContact O-N 3.46Å; E429-Q432 PolarHBondContact O-N 3.13Å; Q432-L434 PolarHBondContact O-N 3.4Å; Q432-D435 PolarHBondContact O-N 3.03Å; Q432-Y445 WeakPolarHBondContact CG-OH 3.42Å
433	L	87.4	Confident	87.9	Confident	16 Å²	16	37.3 Å²	37.3	8%	0.084	20%	0.195	C	C	.	.	H	α-helix	trans	-67.2	-17.8	175.4	-71.8	162.4	0	0	0	113.4	A398 R406 S409 K410 F413 E429 Y430 A431 D435	A398-L433 HydrophobicContact CB-CD1 4.25Å; A398-L433 HydrophobicContact CB-CD2 3.81Å; A398-L433 HydrophobicContact CB-CG 4.27Å; R406-L433 HydrophobicContact CG-CD2 4.43Å; S409-L433 WeakPolarHBondContact OG-CD1 3.47Å; K410-L433 WeakPolarHBondContact CE-O 3.4Å; K410-L433 HydrophobicContact CG-CB 3.89Å; K410-L433 PolarHBondContact NZ-O 2.96Å; F413-L433 HydrophobicContact CD2-CD1 3.41Å; F413-L433 VanDerWaalsContact CD2-CD1 3.41Å; F413-L433 HydrophobicContact CE2-CD1 3.91Å; F413-L433 HydrophobicContact CG-CD1 4.28Å; E429-L433 WeakPolarHBondContact O-CD1 3.47Å; E429-L433 VanDerWaalsContact O-CG 3.3Å; E429-L433 WeakPolarHBondContact O-CG 3.46Å; E429-L433 PolarHBondContact O-N 3.45Å; Y430-L433 PolarHBondContact O-N 2.93Å; A431-L433 VanDerWaalsContact C-N 3.32Å; A431-L433 PolarHBondContact O-N 3.42Å; L433-D435 VanDerWaalsContact C-N 3.31Å; L433-D435 PolarHBondContact O-N 3.06Å
434	L	86.4	Confident	88.1	Confident	13 Å²	13	36.5 Å²	36.5	7%	0.068	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	23.6	179	-69.6	176.7	0	0	0	113.9	Y430 A431 Q432 N436 D437 G440 A441	Y430-L434 HydrophobicContact CD1-CD1 3.96Å; Y430-L434 HydrophobicContact CE1-CD1 3.58Å; Y430-L434 HydrophobicContact CE1-CG 4.5Å; Y430-L434 HydrophobicContact CE2-CD1 4.48Å; Y430-L434 WeakPolarHBondContact O-CG 3.28Å; Y430-L434 PolarHBondContact O-N 2.94Å; A431-L434 PolarHBondContact O-N 3.15Å; A431-L434 VanDerWaalsContact O-N 3.11Å; Q432-L434 PolarHBondContact O-N 3.4Å; L434-N436 PolarHBondContact O-N 3.32Å; L434-D437 HydrophobicContact CB-CB 4.48Å; L434-D437 HydrophobicContact CD2-CB 4.37Å; L434-D437 CarbonylContact O-C 3.56Å; L434-D437 WeakPolarHBondContact O-CA 3.33Å; L434-D437 PolarHBondContact O-N 2.94Å; L434-G440 VanDerWaalsContact CD1-C 3.48Å; L434-G440 WeakPolarHBondContact CD1-O 3.33Å; L434-A441 HydrophobicContact CB-CB 3.88Å
435	D	74.1	Confident	88.3	Confident	79 Å²	79	36.1 Å²	36.1	42%	0.422	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43	-33.9	179.3	-96.4	-32.3	0	0	0	116.9	Q432 L433 K1008	Q432-D435 PolarHBondContact O-N 3.03Å; L433-D435 VanDerWaalsContact C-N 3.31Å; L433-D435 PolarHBondContact O-N 3.06Å; D435-K1008 IonicContact OD1-NZ 3.04Å; D435-K1008 PolarHBondContact OD1-NZ 2.98Å
436	N	75.8	Confident	88.4	Confident	136 Å²	136	36.2 Å²	36.2	73%	0.727	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-17	179.1	-62.5	25.8	0	0	0	113.8	L434	L434-N436 PolarHBondContact O-N 3.32Å
437	D	85.6	Confident	88.5	Confident	70 Å²	70	40.2 Å²	40.2	37%	0.374	21%	0.211	S	C	.	.			trans	-113	83.4	-176.2	174.4	9.7	0	0	0	108.3	L434 N439 G440 A441	L434-D437 HydrophobicContact CB-CB 4.48Å; L434-D437 HydrophobicContact CD2-CB 4.37Å; L434-D437 CarbonylContact O-C 3.56Å; L434-D437 WeakPolarHBondContact O-CA 3.33Å; L434-D437 PolarHBondContact O-N 2.94Å; D437-N439 PolarHBondContact O-N 3.49Å; D437-N439 PolarHBondContact OD1-N 3.42Å; D437-G440 PolarHBondContact O-N 2.95Å; D437-G440 PolarHBondContact OD1-N 3.5Å; D437-G440 WeakPolarHBondContact OD2-CA 3.25Å; D437-A441 VanDerWaalsContact O-CB 3.3Å; D437-A441 WeakPolarHBondContact O-CB 3.5Å; D437-A441 PolarHBondContact O-N 3.04Å
438	I	86.5	Confident	88.4	Confident	38 Å²	38	39 Å²	39	20%	0.195	21%	0.207	C	C	.	.	H	α-helix	trans	-58	-37.2	-175.6	-59.9	168.2	0	0	0	110.9	L442 L470 K474	I438-L442 HydrophobicContact CG2-CD1 4.19Å; I438-L442 WeakPolarHBondContact O-CB 3.45Å; I438-L442 VanDerWaalsContact O-CG 3.28Å; I438-L442 WeakPolarHBondContact O-CG 3.48Å; I438-L442 PolarHBondContact O-N 3.21Å; I438-L442 VanDerWaalsContact O-N 3.09Å; I438-L470 HydrophobicContact CG2-CB 4.38Å; I438-L470 HydrophobicContact CG2-CD2 4.15Å; I438-K474 HydrophobicContact CG2-CB 4.27Å
439	N	90.4	Very high	88.4	Confident	57 Å²	57	39.5 Å²	39.5	31%	0.305	21%	0.209	S	C	.	.	H	α-helix	trans	-72.5	-48.9	-179.8	-73.9	-32.9	0	0	0	110.9	D437 A441 L442 D443 K474 E1022	D437-N439 PolarHBondContact O-N 3.49Å; D437-N439 PolarHBondContact OD1-N 3.42Å; N439-A441 VanDerWaalsContact C-N 3.33Å; N439-A441 PolarHBondContact O-N 3.43Å; N439-L442 PolarHBondContact O-N 3.43Å; N439-D443 PolarHBondContact O-N 2.89Å; N439-K474 WeakPolarHBondContact OD1-CE 3.28Å; N439-K474 PolarHBondContact OD1-NZ 2.99Å; N439-E1022 PolarHBondContact ND2-OE1 3.26Å
440	G	90.3	Very high	88.5	Confident	16 Å²	16	41.2 Å²	41.2	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-35.8	175.8	0	0	0	0	0	113.7	L434 D437 D443 A444	L434-G440 VanDerWaalsContact CD1-C 3.48Å; L434-G440 WeakPolarHBondContact CD1-O 3.33Å; D437-G440 PolarHBondContact O-N 2.95Å; D437-G440 PolarHBondContact OD1-N 3.5Å; D437-G440 WeakPolarHBondContact OD2-CA 3.25Å; G440-D443 PolarHBondContact O-N 2.92Å; G440-A444 WeakPolarHBondContact O-CB 3.31Å; G440-A444 PolarHBondContact O-N 3.49Å
441	A	91.2	Very high	88.4	Confident	2 Å²	2	40.6 Å²	40.6	2%	0.017	22%	0.221	C	C	.	.	H	α-helix	trans	-66.1	-44	174.2	0	0	0	0	0	111.9	L434 D437 N439 A444 Y445 L470	L434-A441 HydrophobicContact CB-CB 3.88Å; D437-A441 VanDerWaalsContact O-CB 3.3Å; D437-A441 WeakPolarHBondContact O-CB 3.5Å; D437-A441 PolarHBondContact O-N 3.04Å; N439-A441 VanDerWaalsContact C-N 3.33Å; N439-A441 PolarHBondContact O-N 3.43Å; A441-A444 PolarHBondContact O-N 2.94Å; A441-Y445 VanDerWaalsContact O-CD2 3.23Å; A441-Y445 WeakPolarHBondContact O-CD2 3.29Å; A441-Y445 PolarHBondContact O-N 3.26Å; A441-L470 HydrophobicContact CB-CD1 3.75Å; A441-L470 HydrophobicContact CB-CD2 4.34Å
442	L	91.3	Very high	88.2	Confident	17 Å²	17	40.8 Å²	40.8	9%	0.089	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-40.7	173.4	-76.8	170.3	0	0	0	112	I438 N439 Y445 S446 I467 L470 K474	I438-L442 HydrophobicContact CG2-CD1 4.19Å; I438-L442 WeakPolarHBondContact O-CB 3.45Å; I438-L442 VanDerWaalsContact O-CG 3.28Å; I438-L442 WeakPolarHBondContact O-CG 3.48Å; I438-L442 PolarHBondContact O-N 3.21Å; I438-L442 VanDerWaalsContact O-N 3.09Å; N439-L442 PolarHBondContact O-N 3.43Å; L442-Y445 PolarHBondContact O-N 3.25Å; L442-S446 VanDerWaalsContact O-CB 3.3Å; L442-S446 WeakPolarHBondContact O-CB 3.31Å; L442-S446 PolarHBondContact O-N 2.85Å; L442-S446 PolarHBondContact O-OG 3.23Å; L442-I467 HydrophobicContact CD2-CG2 4.34Å; L442-L470 HydrophobicContact CD1-CB 4.3Å; L442-L470 HydrophobicContact CD2-CB 3.59Å; L442-L470 HydrophobicContact CD2-CD1 4.17Å; L442-L470 HydrophobicContact CG-CB 3.8Å; L442-L470 HydrophobicContact CG-CD1 4.22Å; L442-K474 HydrophobicContact CD1-CD 4.06Å
443	D	92.3	Very high	88.3	Confident	96 Å²	96	42.2 Å²	42.2	51%	0.513	23%	0.229	S	C	.	.	H	α-helix	trans	-62.6	-40.7	175.1	-96.9	24.2	0	0	0	112.2	N439 G440 S446 K447	N439-D443 PolarHBondContact O-N 2.89Å; G440-D443 PolarHBondContact O-N 2.92Å; D443-S446 PolarHBondContact O-OG 3.2Å; D443-K447 WeakPolarHBondContact O-CG 3.46Å; D443-K447 PolarHBondContact O-N 2.88Å
444	A	92.4	Very high	88.3	Confident	2 Å²	2	48 Å²	48	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-69.2	-45.7	176.6	0	0	0	0	0	112	W427 Y430 A431 G440 A441 S446 K447 A448	W427-A444 HydrophobicContact CE3-CB 4.08Å; Y430-A444 HydrophobicContact CD1-CB 3.91Å; A431-A444 HydrophobicContact CB-CB 3.64Å; G440-A444 WeakPolarHBondContact O-CB 3.31Å; G440-A444 PolarHBondContact O-N 3.49Å; A441-A444 PolarHBondContact O-N 2.94Å; A444-S446 PolarHBondContact O-N 3.48Å; A444-K447 PolarHBondContact O-N 2.7Å; A444-A448 PolarHBondContact O-N 2.83Å; A444-A448 VanDerWaalsContact O-N 3.09Å
445	Y	92.3	Very high	88.2	Confident	8 Å²	8	52.4 Å²	52.4	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-65.3	-34.8	175.4	-79.4	-57.9	0	0	0	113	I428 A431 Q432 A441 L442 K447 A448 L449 I463 N466 I467 L470	I428-Y445 HydrophobicContact CG2-CE1 4.4Å; A431-Y445 HydrophobicContact CB-CD1 3.81Å; A431-Y445 HydrophobicContact CB-CD2 3.57Å; A431-Y445 HydrophobicContact CB-CE1 3.79Å; A431-Y445 HydrophobicContact CB-CE2 3.52Å; A431-Y445 HydrophobicContact CB-CG 3.7Å; Q432-Y445 WeakPolarHBondContact CG-OH 3.42Å; A441-Y445 VanDerWaalsContact O-CD2 3.23Å; A441-Y445 WeakPolarHBondContact O-CD2 3.29Å; A441-Y445 PolarHBondContact O-N 3.26Å; L442-Y445 PolarHBondContact O-N 3.25Å; Y445-K447 VanDerWaalsContact C-N 3.34Å; Y445-K447 PolarHBondContact O-N 3.25Å; Y445-A448 PolarHBondContact O-N 2.71Å; Y445-L449 WeakPolarHBondContact O-CB 3.21Å; Y445-L449 PolarHBondContact O-N 3.46Å; Y445-I463 HydrophobicContact CD1-CG2 3.95Å; Y445-I463 HydrophobicContact CE1-CG2 4.39Å; Y445-N466 HydrophobicContact CE1-CB 4.49Å; Y445-N466 HydrophobicContact CE2-CB 4.14Å; Y445-N466 PolarHBondContact OH-ND2 3.48Å; Y445-I467 HydrophobicContact CD2-CG1 4.46Å; Y445-I467 HydrophobicContact CG-CG1 4.05Å; Y445-L470 HydrophobicContact CD2-CD1 3.67Å; Y445-L470 HydrophobicContact CE2-CD1 3.77Å
446	S	90.7	Very high	88.4	Confident	52 Å²	52	57.5 Å²	57.5	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-69.3	-30.4	176.5	68.3	0	0	0	0	112.8	L442 D443 A444 T450	L442-S446 VanDerWaalsContact O-CB 3.3Å; L442-S446 WeakPolarHBondContact O-CB 3.31Å; L442-S446 PolarHBondContact O-N 2.85Å; L442-S446 PolarHBondContact O-OG 3.23Å; D443-S446 PolarHBondContact O-OG 3.2Å; A444-S446 PolarHBondContact O-N 3.48Å; S446-T450 WeakPolarHBondContact O-CB 3.42Å; S446-T450 WeakPolarHBondContact O-CG2 3.49Å; S446-T450 PolarHBondContact O-N 2.9Å; S446-T450 PolarHBondContact O-OG1 3.42Å
447	K	91.3	Very high	88.4	Confident	85 Å²	85	53.7 Å²	53.7	37%	0.37	28%	0.283	S	S	.	.	H	α-helix	trans	-67.3	-47.7	169.2	-70.3	166.1	-167.9	164.5	0	111.2	W427 D443 A444 Y445 L449 T450 I451	W427-K447 HydrophobicContact CD2-CB 3.98Å; W427-K447 HydrophobicContact CD2-CD 4.17Å; W427-K447 HydrophobicContact CE3-CB 4.33Å; W427-K447 HydrophobicContact CE3-CD 3.91Å; W427-K447 HydrophobicContact CG-CB 4.26Å; W427-K447 HydrophobicContact CH2-CD 3.53Å; W427-K447 HydrophobicContact CZ2-CD 3.74Å; W427-K447 HydrophobicContact CZ3-CD 3.61Å; D443-K447 WeakPolarHBondContact O-CG 3.46Å; D443-K447 PolarHBondContact O-N 2.88Å; A444-K447 PolarHBondContact O-N 2.7Å; Y445-K447 VanDerWaalsContact C-N 3.34Å; Y445-K447 PolarHBondContact O-N 3.25Å; K447-L449 VanDerWaalsContact C-N 3.31Å; K447-L449 PolarHBondContact O-N 2.73Å; K447-T450 PolarHBondContact O-N 2.73Å; K447-T450 PolarHBondContact O-OG1 3.25Å; K447-T450 VanDerWaalsContact O-OG1 3.11Å; K447-I451 WeakPolarHBondContact O-CD1 3.39Å; K447-I451 WeakPolarHBondContact O-CG1 3.5Å; K447-I451 PolarHBondContact O-N 3.1Å
448	A	90.7	Very high	87.9	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-55.9	-45.7	174	0	0	0	0	0	111.9	V424 W427 I428 A444 Y445 I451 L452	V424-A448 HydrophobicContact CG1-CB 4.21Å; W427-A448 HydrophobicContact CB-CB 3.94Å; I428-A448 HydrophobicContact CG1-CB 4Å; A444-A448 PolarHBondContact O-N 2.83Å; A444-A448 VanDerWaalsContact O-N 3.09Å; Y445-A448 PolarHBondContact O-N 2.71Å; A448-I451 PolarHBondContact O-N 3.37Å; A448-L452 WeakPolarHBondContact O-CG 3.21Å; A448-L452 PolarHBondContact O-N 2.79Å
449	L	89.6	Confident	87.7	Confident	16 Å²	16	55.6 Å²	55.6	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-61.8	-49.2	177.6	-178.1	65.1	0	0	0	112.1	Y445 K447 I451 L452 E453 I459 L464 I467 F483	Y445-L449 WeakPolarHBondContact O-CB 3.21Å; Y445-L449 PolarHBondContact O-N 3.46Å; K447-L449 VanDerWaalsContact C-N 3.31Å; K447-L449 PolarHBondContact O-N 2.73Å; L449-I451 VanDerWaalsContact C-N 3.31Å; L449-I451 PolarHBondContact O-N 2.89Å; L449-L452 PolarHBondContact O-N 2.63Å; L449-E453 HydrophobicContact CD1-CG 4.23Å; L449-E453 HydrophobicContact CG-CG 4.46Å; L449-E453 WeakPolarHBondContact O-CB 3.38Å; L449-E453 WeakPolarHBondContact O-CG 3.42Å; L449-E453 PolarHBondContact O-N 2.67Å; L449-I459 HydrophobicContact CD1-CD1 3.58Å; L449-I459 HydrophobicContact CD1-CG1 4Å; L449-I459 HydrophobicContact CD1-CG2 4.02Å; L449-L464 HydrophobicContact CD1-CD2 4.37Å; L449-I467 HydrophobicContact CD2-CD1 4.34Å; L449-F483 HydrophobicContact CD2-CE1 4.08Å; L449-F483 HydrophobicContact CD2-CZ 4.43Å
450	T	90.7	Very high	87.5	Confident	69 Å²	69	53.1 Å²	53.1	42%	0.423	28%	0.276	S	S	.	.	H	α-helix	trans	-66.7	-31.2	179.8	48.7	0	0	0	0	112.7	S446 K447 N454	S446-T450 WeakPolarHBondContact O-CB 3.42Å; S446-T450 WeakPolarHBondContact O-CG2 3.49Å; S446-T450 PolarHBondContact O-N 2.9Å; S446-T450 PolarHBondContact O-OG1 3.42Å; K447-T450 PolarHBondContact O-N 2.73Å; K447-T450 PolarHBondContact O-OG1 3.25Å; K447-T450 VanDerWaalsContact O-OG1 3.11Å; T450-N454 VanDerWaalsContact O-CB 3.26Å; T450-N454 WeakPolarHBondContact O-CB 3.41Å; T450-N454 PolarHBondContact O-N 2.86Å; T450-N454 PolarHBondContact O-ND2 2.74Å
451	I	89.5	Confident	87.5	Confident	30 Å²	30	52.4 Å²	52.4	15%	0.154	27%	0.269	C	S	.	.	H	α-helix	trans	-67.6	-46.7	172.4	-63.9	160.9	0	0	0	110.4	P421 V424 K447 A448 L449 E453 N454 I455	P421-I451 VanDerWaalsContact O-CD1 3.31Å; P421-I451 WeakPolarHBondContact O-CD1 3.37Å; V424-I451 HydrophobicContact CG2-CB 3.97Å; V424-I451 HydrophobicContact CG2-CG2 3.42Å; V424-I451 VanDerWaalsContact CG2-CG2 3.42Å; K447-I451 WeakPolarHBondContact O-CD1 3.39Å; K447-I451 WeakPolarHBondContact O-CG1 3.5Å; K447-I451 PolarHBondContact O-N 3.1Å; A448-I451 PolarHBondContact O-N 3.37Å; L449-I451 VanDerWaalsContact C-N 3.31Å; L449-I451 PolarHBondContact O-N 2.89Å; I451-E453 PolarHBondContact O-N 3.16Å; I451-N454 PolarHBondContact O-N 3.09Å; I451-I455 HydrophobicContact CG2-CD1 3.75Å; I451-I455 VanDerWaalsContact O-CG1 3.29Å; I451-I455 WeakPolarHBondContact O-CG1 3.3Å; I451-I455 PolarHBondContact O-N 3.45Å
452	L	87.3	Confident	87.3	Confident	5 Å²	5	52.4 Å²	52.4	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-46.3	176.2	-72.7	167.1	0	0	0	112.3	V424 A448 L449 N454 I455 Q456 L457 I459 I463	V424-L452 HydrophobicContact CG1-CD1 4Å; V424-L452 HydrophobicContact CG1-CD2 4.09Å; V424-L452 HydrophobicContact CG1-CG 3.9Å; V424-L452 HydrophobicContact CG2-CD2 4.32Å; V424-L452 HydrophobicContact CG2-CG 4.28Å; A448-L452 WeakPolarHBondContact O-CG 3.21Å; A448-L452 PolarHBondContact O-N 2.79Å; L449-L452 PolarHBondContact O-N 2.63Å; L452-N454 PolarHBondContact O-N 3.37Å; L452-I455 PolarHBondContact O-N 2.93Å; L452-Q456 PolarHBondContact O-N 3.17Å; L452-Q456 VanDerWaalsContact O-N 3.07Å; L452-L457 HydrophobicContact CD2-CB 4.15Å; L452-L457 HydrophobicContact CD2-CD2 3.72Å; L452-L457 PolarHBondContact O-N 3.02Å; L452-L457 VanDerWaalsContact O-N 3.11Å; L452-I459 HydrophobicContact CB-CG1 4.16Å; L452-I459 HydrophobicContact CD1-CG1 4.43Å; L452-I459 HydrophobicContact CD1-CG2 4.41Å; L452-I463 HydrophobicContact CD1-CD1 4.09Å
453	E	87.8	Confident	87.2	Confident	80 Å²	80	51.6 Å²	51.6	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-65.2	-35.9	178.2	-71.4	-179.6	161.4	0	0	112.1	L449 I451 Q456 I459 R486	L449-E453 HydrophobicContact CD1-CG 4.23Å; L449-E453 HydrophobicContact CG-CG 4.46Å; L449-E453 WeakPolarHBondContact O-CB 3.38Å; L449-E453 WeakPolarHBondContact O-CG 3.42Å; L449-E453 PolarHBondContact O-N 2.67Å; I451-E453 PolarHBondContact O-N 3.16Å; E453-Q456 PolarHBondContact O-N 3.13Å; E453-I459 HydrophobicContact CG-CD1 3.82Å; E453-R486 IonicContact OE1-CZ 2.73Å; E453-R486 VanDerWaalsContact OE1-CZ 3.3Å; E453-R486 IonicContact OE1-NH1 3.57Å; E453-R486 PolarHBondContact OE1-NH1 3.44Å; E453-R486 IonicContact OE1-NH2 3.84Å; E453-R486 PolarHBondContact OE1-NH2 2.78Å
454	N	87.2	Confident	87.2	Confident	137 Å²	137	47.1 Å²	47.1	73%	0.733	24%	0.24	S	C	*	.	H	α-helix	trans	-68.8	-33.3	173.4	-79.7	-44.3	0	0	0	113.4	T450 I451 L452	T450-N454 VanDerWaalsContact O-CB 3.26Å; T450-N454 WeakPolarHBondContact O-CB 3.41Å; T450-N454 PolarHBondContact O-N 2.86Å; T450-N454 PolarHBondContact O-ND2 2.74Å; I451-N454 PolarHBondContact O-N 3.09Å; L452-N454 PolarHBondContact O-N 3.37Å
455	I	84.5	Confident	87.2	Confident	106 Å²	106	47 Å²	47	54%	0.544	24%	0.24	S	C	.	.	H	α-helix	trans	-76.3	-14.8	175.1	-66.2	168	0	0	0	111.2	I451 L452 L457	I451-I455 HydrophobicContact CG2-CD1 3.75Å; I451-I455 VanDerWaalsContact O-CG1 3.29Å; I451-I455 WeakPolarHBondContact O-CG1 3.3Å; I451-I455 PolarHBondContact O-N 3.45Å; L452-I455 PolarHBondContact O-N 2.93Å; I455-L457 HydrophobicContact CG2-CB 4.09Å; I455-L457 HydrophobicContact CG2-CD1 4.49Å
456	Q	79.8	Confident	87.1	Confident	185 Å²	185	47 Å²	47	86%	0.864	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	31.5	-170.4	-51	-171.8	-43.5	0	0	112.6	L452 E453	L452-Q456 PolarHBondContact O-N 3.17Å; L452-Q456 VanDerWaalsContact O-N 3.07Å; E453-Q456 PolarHBondContact O-N 3.13Å
457	L	74.7	Confident	87.2	Confident	57 Å²	57	44.8 Å²	44.8	30%	0.298	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-86.9	148.8	175.8	-156.2	97.7	0	0	0	110.8	L452 I455 I459	L452-L457 HydrophobicContact CD2-CB 4.15Å; L452-L457 HydrophobicContact CD2-CD2 3.72Å; L452-L457 PolarHBondContact O-N 3.02Å; L452-L457 VanDerWaalsContact O-N 3.11Å; I455-L457 HydrophobicContact CG2-CB 4.09Å; I455-L457 HydrophobicContact CG2-CD1 4.49Å; L457-I459 PolarHBondContact O-N 3.49Å
458	E	75	Confident	87.2	Confident	131 Å²	131	40.8 Å²	40.8	61%	0.612	21%	0.206	S	C	*	.	P	Polyproline II helix	trans	-63	132.3	173	-63.6	179.4	-176.1	0	0	111.3	R490	E458-R490 IonicContact OE2-CZ 3.5Å; E458-R490 IonicContact OE2-NH1 3.31Å; E458-R490 IonicContact OE2-NH2 3.44Å; E458-R490 PolarHBondContact OE2-NH2 3.07Å
459	I	83.4	Confident	87.3	Confident	17 Å²	17	41 Å²	41	9%	0.087	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-88.5	130.1	-177.4	-58.7	146.4	0	0	0	108.8	L449 L452 E453 L457 L464	L449-I459 HydrophobicContact CD1-CD1 3.58Å; L449-I459 HydrophobicContact CD1-CG1 4Å; L449-I459 HydrophobicContact CD1-CG2 4.02Å; L452-I459 HydrophobicContact CB-CG1 4.16Å; L452-I459 HydrophobicContact CD1-CG1 4.43Å; L452-I459 HydrophobicContact CD1-CG2 4.41Å; E453-I459 HydrophobicContact CG-CD1 3.82Å; L457-I459 PolarHBondContact O-N 3.49Å; I459-L464 HydrophobicContact CG2-CD1 4.2Å; I459-L464 HydrophobicContact CG2-CD2 3.94Å; I459-L464 HydrophobicContact CG2-CG 3.84Å
460	A	85.8	Confident	87.3	Confident	5 Å²	5	40.7 Å²	40.7	4%	0.041	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-68.9	128.6	-178.9	0	0	0	0	0	110.6	E462 I463 L997	A460-E462 VanDerWaalsContact C-OE2 3.22Å; A460-E462 WeakPolarHBondContact CB-OE2 3.47Å; A460-E462 PolarHBondContact O-N 3.42Å; A460-E462 VanDerWaalsContact O-N 3.15Å; A460-I463 HydrophobicContact CB-CD1 3.88Å; A460-I463 HydrophobicContact CB-CG1 4.19Å; A460-I463 WeakPolarHBondContact O-CB 3.24Å; A460-I463 PolarHBondContact O-N 3.14Å; A460-L997 HydrophobicContact CB-CD1 4.37Å
461	P	89	Confident	87.4	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.006	19%	0.191	C	C	.	.	H	α-helix	trans	-62.4	-23.1	-171.7	21.6	-31.8	0	0	0	114.4	L464 N465 S487 R490 I491 L518	P461-L464 PolarHBondContact O-N 2.76Å; P461-N465 WeakPolarHBondContact O-CB 3.09Å; P461-N465 PolarHBondContact O-N 3.18Å; P461-S487 PolarHBondContact O-OG 3.39Å; P461-R490 HydrophobicContact CB-CB 4.41Å; P461-R490 HydrophobicContact CB-CG 4.22Å; P461-R490 HydrophobicContact CG-CG 4.4Å; P461-I491 HydrophobicContact CB-CD1 4.11Å; P461-I491 HydrophobicContact CB-CG1 3.64Å; P461-I491 HydrophobicContact CG-CG1 3.91Å; P461-L518 HydrophobicContact CB-CD2 4.01Å; P461-L518 HydrophobicContact CG-CD2 3.62Å
462	E	88	Confident	87.5	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-39	175.1	-46.7	82.4	172.3	0	0	111.3	A460 N465 N466 Y514 L518 I1005	A460-E462 VanDerWaalsContact C-OE2 3.22Å; A460-E462 WeakPolarHBondContact CB-OE2 3.47Å; A460-E462 PolarHBondContact O-N 3.42Å; A460-E462 VanDerWaalsContact O-N 3.15Å; E462-N465 PolarHBondContact O-N 3.03Å; E462-N466 WeakPolarHBondContact O-CB 3.38Å; E462-N466 PolarHBondContact O-N 3.3Å; E462-N466 PolarHBondContact O-OD1 3.07Å; E462-Y514 PolarHBondContact OE1-OH 3.19Å; E462-L518 HydrophobicContact CG-CD1 4.1Å; E462-L518 HydrophobicContact CG-CD2 3.87Å; E462-I1005 HydrophobicContact CB-CB 4.17Å; E462-I1005 HydrophobicContact CB-CG2 3.73Å
463	I	89.2	Confident	87.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.6	-45.7	176.7	-56.7	169.9	0	0	0	109.6	I428 Y445 L452 A460 N466 I467 L997 I1005	I428-I463 HydrophobicContact CD1-CD1 3.61Å; I428-I463 HydrophobicContact CD1-CG1 4.25Å; I428-I463 HydrophobicContact CG1-CD1 4.41Å; Y445-I463 HydrophobicContact CD1-CG2 3.95Å; Y445-I463 HydrophobicContact CE1-CG2 4.39Å; L452-I463 HydrophobicContact CD1-CD1 4.09Å; A460-I463 HydrophobicContact CB-CD1 3.88Å; A460-I463 HydrophobicContact CB-CG1 4.19Å; A460-I463 WeakPolarHBondContact O-CB 3.24Å; A460-I463 PolarHBondContact O-N 3.14Å; I463-N466 PolarHBondContact O-N 3.01Å; I463-I467 HydrophobicContact CG2-CD1 3.97Å; I463-I467 WeakPolarHBondContact O-CG1 3.4Å; I463-I467 PolarHBondContact O-N 3.09Å; I463-L997 HydrophobicContact CD1-CD1 4.32Å; I463-I1005 HydrophobicContact CD1-CD1 4.09Å; I463-I1005 HydrophobicContact CG1-CD1 3.99Å; I463-I1005 HydrophobicContact CG1-CG2 4.24Å
464	L	92.1	Very high	87.5	Confident	3 Å²	3	42.2 Å²	42.2	2%	0.016	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-41.7	178.1	-62.8	172.3	0	0	0	111.5	L449 I459 P461 N466 I467 A468 F483 R486	L449-L464 HydrophobicContact CD1-CD2 4.37Å; I459-L464 HydrophobicContact CG2-CD1 4.2Å; I459-L464 HydrophobicContact CG2-CD2 3.94Å; I459-L464 HydrophobicContact CG2-CG 3.84Å; P461-L464 PolarHBondContact O-N 2.76Å; L464-N466 PolarHBondContact O-N 3.5Å; L464-I467 PolarHBondContact O-N 3.32Å; L464-A468 VanDerWaalsContact O-CB 3.32Å; L464-A468 WeakPolarHBondContact O-CB 3.43Å; L464-A468 PolarHBondContact O-N 3.05Å; L464-F483 HydrophobicContact CD2-CD1 3.98Å; L464-F483 HydrophobicContact CD2-CE1 4.34Å; L464-R486 HydrophobicContact CD1-CB 4.44Å; L464-R486 HydrophobicContact CD1-CG 3.98Å
465	N	92.5	Very high	87.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.5	-42.5	172.9	173.3	84.2	0	0	0	112.1	P461 E462 A468 A469 F484 V522 N525 K1008	P461-N465 WeakPolarHBondContact O-CB 3.09Å; P461-N465 PolarHBondContact O-N 3.18Å; E462-N465 PolarHBondContact O-N 3.03Å; N465-A468 PolarHBondContact O-N 3.25Å; N465-A469 WeakPolarHBondContact O-CB 3.33Å; N465-A469 PolarHBondContact O-N 3.42Å; N465-F484 WeakPolarHBondContact OD1-CE1 3.47Å; N465-V522 HydrophobicContact CB-CG2 4.08Å; N465-N525 PolarHBondContact OD1-ND2 2.95Å; N465-K1008 PolarHBondContact ND2-N 3.37Å; N465-K1008 PolarHBondContact ND2-O 3.36Å
466	N	90.8	Very high	87.9	Confident	7 Å²	7	34.6 Å²	34.6	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-69.5	-40	-178.6	-70.1	2.2	0	0	0	111.8	Y445 E462 I463 L464 A469 L470 V1006 S1007 K1008	Y445-N466 HydrophobicContact CE1-CB 4.49Å; Y445-N466 HydrophobicContact CE2-CB 4.14Å; Y445-N466 PolarHBondContact OH-ND2 3.48Å; E462-N466 WeakPolarHBondContact O-CB 3.38Å; E462-N466 PolarHBondContact O-N 3.3Å; E462-N466 PolarHBondContact O-OD1 3.07Å; I463-N466 PolarHBondContact O-N 3.01Å; L464-N466 PolarHBondContact O-N 3.5Å; N466-A469 PolarHBondContact O-N 3.2Å; N466-L470 WeakPolarHBondContact O-CG 3.41Å; N466-L470 PolarHBondContact O-N 2.84Å; N466-V1006 PolarHBondContact ND2-O 3.26Å; N466-S1007 WeakPolarHBondContact OD1-CA 3.31Å; N466-K1008 PolarHBondContact OD1-N 3.4Å
467	I	92	Very high	88.5	Confident	6 Å²	6	29.9 Å²	29.9	3%	0.031	16%	0.155	C	C	.	.	H	α-helix	trans	-59.4	-47.4	170.2	-69.3	165.8	0	0	0	110.5	L442 Y445 L449 I463 L464 A469 L470 H471 F483	L442-I467 HydrophobicContact CD2-CG2 4.34Å; Y445-I467 HydrophobicContact CD2-CG1 4.46Å; Y445-I467 HydrophobicContact CG-CG1 4.05Å; L449-I467 HydrophobicContact CD2-CD1 4.34Å; I463-I467 HydrophobicContact CG2-CD1 3.97Å; I463-I467 WeakPolarHBondContact O-CG1 3.4Å; I463-I467 PolarHBondContact O-N 3.09Å; L464-I467 PolarHBondContact O-N 3.32Å; I467-A469 PolarHBondContact O-N 2.92Å; I467-L470 PolarHBondContact O-N 3.23Å; I467-H471 PolarHBondContact O-CD2 3.28Å; I467-H471 VanDerWaalsContact O-CD2 3.25Å; I467-H471 PolarHBondContact O-N 3.36Å; I467-F483 HydrophobicContact CG2-CB 4.47Å; I467-F483 HydrophobicContact CG2-CD1 3.91Å; I467-F483 HydrophobicContact CG2-CD2 3.65Å; I467-F483 HydrophobicContact CG2-CE1 3.96Å; I467-F483 HydrophobicContact CG2-CE2 3.69Å; I467-F483 HydrophobicContact CG2-CG 3.77Å; I467-F483 HydrophobicContact CG2-CZ 3.86Å
468	A	92.1	Very high	89.3	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62	-39.4	179.2	0	0	0	0	0	113.1	L464 N465 H471 F472 S480 F483 F484	L464-A468 VanDerWaalsContact O-CB 3.32Å; L464-A468 WeakPolarHBondContact O-CB 3.43Å; L464-A468 PolarHBondContact O-N 3.05Å; N465-A468 PolarHBondContact O-N 3.25Å; A468-H471 PolarHBondContact O-N 3.27Å; A468-F472 PolarHBondContact O-N 3.15Å; A468-S480 WeakPolarHBondContact O-CB 3.27Å; A468-S480 PolarHBondContact O-OG 2.84Å; A468-F483 HydrophobicContact CB-CB 3.57Å; A468-F484 HydrophobicContact CB-CB 4.33Å; A468-F484 HydrophobicContact CB-CD1 3.33Å; A468-F484 HydrophobicContact CB-CD2 3.77Å; A468-F484 HydrophobicContact CB-CE1 3.3Å; A468-F484 HydrophobicContact CB-CE2 3.76Å; A468-F484 HydrophobicContact CB-CG 3.53Å; A468-F484 HydrophobicContact CB-CZ 3.49Å; A468-F484 VanDerWaalsContact CB-CZ 3.49Å
469	A	91.5	Very high	90.2	Very high	5 Å²	5	32 Å²	32	4%	0.041	17%	0.166	C	C	.	.	H	α-helix	trans	-67.7	-37	176	0	0	0	0	0	112.5	N465 N466 I467 F472 T473 F484 I1010	N465-A469 WeakPolarHBondContact O-CB 3.33Å; N465-A469 PolarHBondContact O-N 3.42Å; N466-A469 PolarHBondContact O-N 3.2Å; I467-A469 PolarHBondContact O-N 2.92Å; A469-F472 WeakPolarHBondContact O-CB 3.42Å; A469-F472 PolarHBondContact O-N 3.42Å; A469-T473 PolarHBondContact O-N 3.04Å; A469-T473 PolarHBondContact O-OG1 2.97Å; A469-F484 HydrophobicContact CB-CZ 4.26Å; A469-I1010 HydrophobicContact CB-CG1 4.16Å
470	L	90.9	Very high	90.6	Very high	9 Å²	9	31.2 Å²	31.2	5%	0.047	16%	0.162	C	C	.	.	H	α-helix	trans	-69.8	-37.7	173.4	-70.8	168.8	0	0	0	112.3	I438 A441 L442 Y445 N466 I467 F472 T473 K474	I438-L470 HydrophobicContact CG2-CB 4.38Å; I438-L470 HydrophobicContact CG2-CD2 4.15Å; A441-L470 HydrophobicContact CB-CD1 3.75Å; A441-L470 HydrophobicContact CB-CD2 4.34Å; L442-L470 HydrophobicContact CD1-CB 4.3Å; L442-L470 HydrophobicContact CD2-CB 3.59Å; L442-L470 HydrophobicContact CD2-CD1 4.17Å; L442-L470 HydrophobicContact CG-CB 3.8Å; L442-L470 HydrophobicContact CG-CD1 4.22Å; Y445-L470 HydrophobicContact CD2-CD1 3.67Å; Y445-L470 HydrophobicContact CE2-CD1 3.77Å; N466-L470 WeakPolarHBondContact O-CG 3.41Å; N466-L470 PolarHBondContact O-N 2.84Å; I467-L470 PolarHBondContact O-N 3.23Å; L470-F472 VanDerWaalsContact C-N 3.31Å; L470-F472 PolarHBondContact O-N 3.39Å; L470-T473 PolarHBondContact O-N 3.44Å; L470-T473 PolarHBondContact O-OG1 3.5Å; L470-K474 WeakPolarHBondContact O-CB 3.35Å; L470-K474 PolarHBondContact O-N 2.84Å; L470-K474 VanDerWaalsContact O-N 3.13Å
471	H	92.4	Very high	91	Very high	20 Å²	20	32.7 Å²	32.7	9%	0.093	17%	0.172	C	C	.	.	H	α-helix	trans	-65.4	-33.6	170.1	-77.7	-67	0	0	0	112.2	I467 A468 K474 G475 E476 K479 F483	I467-H471 PolarHBondContact O-CD2 3.28Å; I467-H471 VanDerWaalsContact O-CD2 3.25Å; I467-H471 PolarHBondContact O-N 3.36Å; A468-H471 PolarHBondContact O-N 3.27Å; H471-K474 PolarHBondContact O-N 3.36Å; H471-G475 PolarHBondContact O-N 3.49Å; H471-E476 HydrophobicContact CB-CB 4.2Å; H471-E476 IonicContact CE1-OE2 3.57Å; H471-E476 PolarHBondContact CE1-OE2 3.41Å; H471-E476 VanDerWaalsContact CE1-OE2 3.25Å; H471-E476 IonicContact ND1-OE2 2.7Å; H471-E476 PolarHBondContact ND1-OE2 3.42Å; H471-E476 PolarHBondContact O-N 3.1Å; H471-K479 HydrophobicContact CB-CB 4.46Å; H471-F483 AromaticContact CD2-CD2 3.9Å; H471-F483 AromaticContact CD2-CE2 3.99Å; H471-F483 AromaticContact NE2-CE2 3.87Å
472	F	91.9	Very high	91.2	Very high	20 Å²	20	38.9 Å²	38.9	9%	0.088	20%	0.201	C	C	.	.	H	α-helix	trans	-62.4	-50.7	172.4	175.2	-85	0	0	0	111.6	A468 A469 L470 K474 G475 Y477 L529 A532 I1010	A468-F472 PolarHBondContact O-N 3.15Å; A469-F472 WeakPolarHBondContact O-CB 3.42Å; A469-F472 PolarHBondContact O-N 3.42Å; L470-F472 VanDerWaalsContact C-N 3.31Å; L470-F472 PolarHBondContact O-N 3.39Å; F472-K474 PolarHBondContact O-N 3.29Å; F472-G475 PolarHBondContact O-N 2.95Å; F472-Y477 HydrophobicContact CD2-CD1 4.19Å; F472-Y477 HydrophobicContact CD2-CE1 4.06Å; F472-Y477 HydrophobicContact CE2-CE1 4.14Å; F472-L529 HydrophobicContact CD2-CB 4.34Å; F472-L529 HydrophobicContact CD2-CD1 4Å; F472-A532 HydrophobicContact CE2-CB 3.63Å; F472-A532 HydrophobicContact CZ-CB 4.07Å; F472-I1010 HydrophobicContact CB-CD1 3.86Å; F472-I1010 HydrophobicContact CD1-CD1 3.76Å; F472-I1010 HydrophobicContact CD1-CG1 4.3Å; F472-I1010 HydrophobicContact CD1-CG2 3.68Å; F472-I1010 HydrophobicContact CD2-CD1 3.91Å; F472-I1010 HydrophobicContact CE1-CD1 4.31Å; F472-I1010 HydrophobicContact CE1-CG2 3.39Å; F472-I1010 HydrophobicContact CE2-CD1 4.41Å; F472-I1010 HydrophobicContact CG-CD1 3.56Å; F472-I1010 HydrophobicContact CZ-CG2 3.99Å
473	T	87.4	Confident	91.5	Very high	84 Å²	84	40.3 Å²	40.3	52%	0.515	21%	0.207	S	C	.	.	H	α-helix	trans	-64.7	-25.2	-179.6	54	0	0	0	0	112.8	A469 L470 G475	A469-T473 PolarHBondContact O-N 3.04Å; A469-T473 PolarHBondContact O-OG1 2.97Å; L470-T473 PolarHBondContact O-N 3.44Å; L470-T473 PolarHBondContact O-OG1 3.5Å; T473-G475 VanDerWaalsContact C-N 3.34Å
474	K	87.7	Confident	91.8	Very high	92 Å²	92	40.3 Å²	40.3	40%	0.4	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-7.4	172.4	-158	177	176	-156.7	0	114.2	I438 N439 L442 L470 H471 F472 E476	I438-K474 HydrophobicContact CG2-CB 4.27Å; N439-K474 WeakPolarHBondContact OD1-CE 3.28Å; N439-K474 PolarHBondContact OD1-NZ 2.99Å; L442-K474 HydrophobicContact CD1-CD 4.06Å; L470-K474 WeakPolarHBondContact O-CB 3.35Å; L470-K474 PolarHBondContact O-N 2.84Å; L470-K474 VanDerWaalsContact O-N 3.13Å; H471-K474 PolarHBondContact O-N 3.36Å; F472-K474 PolarHBondContact O-N 3.29Å; K474-E476 VanDerWaalsContact C-N 3.3Å; K474-E476 HydrophobicContact CB-CG 4.42Å; K474-E476 HydrophobicContact CD-CG 4.28Å; K474-E476 WeakPolarHBondContact CD-OE1 3.35Å; K474-E476 VanDerWaalsContact CE-OE1 3.23Å; K474-E476 WeakPolarHBondContact CE-OE1 3.41Å; K474-E476 HydrophobicContact CG-CG 4.32Å; K474-E476 IonicContact NZ-OE1 3.85Å; K474-E476 PolarHBondContact NZ-OE1 2.87Å; K474-E476 PolarHBondContact O-N 3.2Å
475	G	87.3	Confident	91.8	Very high	36 Å²	36	43.2 Å²	43.2	37%	0.371	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	10.4	-175.4	0	0	0	0	0	115	H471 F472 T473 Y477	H471-G475 PolarHBondContact O-N 3.49Å; F472-G475 PolarHBondContact O-N 2.95Å; T473-G475 VanDerWaalsContact C-N 3.34Å; G475-Y477 PolarHBondContact O-N 3.15Å
476	E	92	Very high	91.9	Very high	47 Å²	47	47.8 Å²	47.8	22%	0.22	24%	0.242	C	C	.	.			trans	-82.2	58	177.3	-64.2	-173.3	-171	0	0	110.8	H471 K474 D478 K479 S480	H471-E476 HydrophobicContact CB-CB 4.2Å; H471-E476 IonicContact CE1-OE2 3.57Å; H471-E476 PolarHBondContact CE1-OE2 3.41Å; H471-E476 VanDerWaalsContact CE1-OE2 3.25Å; H471-E476 IonicContact ND1-OE2 2.7Å; H471-E476 PolarHBondContact ND1-OE2 3.42Å; H471-E476 PolarHBondContact O-N 3.1Å; K474-E476 VanDerWaalsContact C-N 3.3Å; K474-E476 HydrophobicContact CB-CG 4.42Å; K474-E476 HydrophobicContact CD-CG 4.28Å; K474-E476 WeakPolarHBondContact CD-OE1 3.35Å; K474-E476 VanDerWaalsContact CE-OE1 3.23Å; K474-E476 WeakPolarHBondContact CE-OE1 3.41Å; K474-E476 HydrophobicContact CG-CG 4.32Å; K474-E476 IonicContact NZ-OE1 3.85Å; K474-E476 PolarHBondContact NZ-OE1 2.87Å; K474-E476 PolarHBondContact O-N 3.2Å; E476-D478 VanDerWaalsContact C-N 3.29Å; E476-D478 PolarHBondContact O-N 2.89Å; E476-D478 VanDerWaalsContact O-N 3.16Å; E476-K479 PolarHBondContact O-N 2.95Å; E476-K479 IonicContact OE1-NZ 2.71Å; E476-K479 WeakPolarHBondContact OE2-CD 3.39Å; E476-K479 WeakPolarHBondContact OE2-CE 3.4Å; E476-K479 IonicContact OE2-NZ 3.49Å; E476-K479 PolarHBondContact OE2-NZ 3.05Å; E476-S480 PolarHBondContact O-N 3.18Å
477	Y	92.5	Very high	91.9	Very high	87 Å²	87	47.4 Å²	47.4	34%	0.341	24%	0.24	S	C	.	.	H	α-helix	trans	-57.3	-32	-167.3	-61.4	-46.4	0	0	0	115.3	F472 G475 S480 S481 L529 A532 Q533	F472-Y477 HydrophobicContact CD2-CD1 4.19Å; F472-Y477 HydrophobicContact CD2-CE1 4.06Å; F472-Y477 HydrophobicContact CE2-CE1 4.14Å; G475-Y477 PolarHBondContact O-N 3.15Å; Y477-S480 WeakPolarHBondContact O-CB 3.11Å; Y477-S480 PolarHBondContact O-N 3.22Å; Y477-S481 PolarHBondContact O-N 3.02Å; Y477-L529 HydrophobicContact CD1-CD1 3.64Å; Y477-L529 HydrophobicContact CG-CD1 4.07Å; Y477-A532 HydrophobicContact CE1-CB 3.89Å; Y477-Q533 HydrophobicContact CG-CG 4.44Å
478	D	92.7	Very high	91.9	Very high	136 Å²	136	49 Å²	49	73%	0.727	25%	0.246	S	C	*	.	H	α-helix	trans	-69.4	-45.4	-179.6	-60.2	-40.7	0	0	0	111.6	E476 S480 S481 E482	E476-D478 VanDerWaalsContact C-N 3.29Å; E476-D478 PolarHBondContact O-N 2.89Å; E476-D478 VanDerWaalsContact O-N 3.16Å; D478-S480 VanDerWaalsContact C-N 3.34Å; D478-S481 VanDerWaalsContact O-CB 3.29Å; D478-S481 WeakPolarHBondContact O-CB 3.4Å; D478-S481 PolarHBondContact O-N 3.49Å; D478-E482 PolarHBondContact O-N 2.64Å
479	K	92.2	Very high	91.9	Very high	97 Å²	97	52.8 Å²	52.8	42%	0.422	27%	0.266	S	S	.	.	H	α-helix	trans	-66	-38.9	173.7	-59.5	-176.1	-164.1	164.2	0	111.4	H471 E476 S481 E482 F483	H471-K479 HydrophobicContact CB-CB 4.46Å; E476-K479 PolarHBondContact O-N 2.95Å; E476-K479 IonicContact OE1-NZ 2.71Å; E476-K479 WeakPolarHBondContact OE2-CD 3.39Å; E476-K479 WeakPolarHBondContact OE2-CE 3.4Å; E476-K479 IonicContact OE2-NZ 3.49Å; E476-K479 PolarHBondContact OE2-NZ 3.05Å; K479-S481 PolarHBondContact O-N 2.97Å; K479-E482 WeakPolarHBondContact O-CB 3.32Å; K479-E482 PolarHBondContact O-N 3.05Å; K479-F483 HydrophobicContact CB-CD2 4.49Å; K479-F483 VanDerWaalsContact O-CD2 3.29Å; K479-F483 WeakPolarHBondContact O-CD2 3.24Å; K479-F483 PolarHBondContact O-N 2.98Å
480	S	93.1	Very high	91.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-56.4	-42.5	173.1	-172.5	0	0	0	0	110.9	A468 E476 Y477 D478 F484	A468-S480 WeakPolarHBondContact O-CB 3.27Å; A468-S480 PolarHBondContact O-OG 2.84Å; E476-S480 PolarHBondContact O-N 3.18Å; Y477-S480 WeakPolarHBondContact O-CB 3.11Å; Y477-S480 PolarHBondContact O-N 3.22Å; D478-S480 VanDerWaalsContact C-N 3.34Å; S480-F484 WeakPolarHBondContact O-CB 3.49Å; S480-F484 WeakPolarHBondContact O-CD2 3.31Å; S480-F484 WeakPolarHBondContact O-CG 3.4Å; S480-F484 PolarHBondContact O-N 3.44Å; S480-F484 WeakPolarHBondContact OG-CE2 3.2Å
481	S	93.5	Very high	91.7	Very high	36 Å²	36	53.4 Å²	53.4	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-62.5	-43.8	174.2	-156	0	0	0	0	112.7	Y477 D478 K479 T485 L529	Y477-S481 PolarHBondContact O-N 3.02Å; D478-S481 VanDerWaalsContact O-CB 3.29Å; D478-S481 WeakPolarHBondContact O-CB 3.4Å; D478-S481 PolarHBondContact O-N 3.49Å; K479-S481 PolarHBondContact O-N 2.97Å; S481-T485 WeakPolarHBondContact O-CB 3.01Å; S481-T485 PolarHBondContact O-N 3.12Å; S481-T485 PolarHBondContact O-OG1 3.06Å; S481-L529 VanDerWaalsContact CA-CD2 3.41Å
482	E	94.2	Very high	91.4	Very high	130 Å²	130	54.4 Å²	54.4	61%	0.607	27%	0.273	S	S	*	.	H	α-helix	trans	-61.2	-51.8	177.9	-173.6	-179.5	173.6	0	0	111.3	D478 K479 T485 R486	D478-E482 PolarHBondContact O-N 2.64Å; K479-E482 WeakPolarHBondContact O-CB 3.32Å; K479-E482 PolarHBondContact O-N 3.05Å; E482-T485 PolarHBondContact O-N 2.88Å; E482-R486 WeakPolarHBondContact O-CB 3.39Å; E482-R486 PolarHBondContact O-N 2.85Å
483	F	93.6	Very high	91.2	Very high	31 Å²	31	58 Å²	58	14%	0.136	29%	0.29	C	S	.	.	H	α-helix	trans	-68.9	-35.1	-179.2	-75.7	-71.1	0	0	0	113.4	L449 L464 I467 A468 H471 K479 T485 S487	L449-F483 HydrophobicContact CD2-CE1 4.08Å; L449-F483 HydrophobicContact CD2-CZ 4.43Å; L464-F483 HydrophobicContact CD2-CD1 3.98Å; L464-F483 HydrophobicContact CD2-CE1 4.34Å; I467-F483 HydrophobicContact CG2-CB 4.47Å; I467-F483 HydrophobicContact CG2-CD1 3.91Å; I467-F483 HydrophobicContact CG2-CD2 3.65Å; I467-F483 HydrophobicContact CG2-CE1 3.96Å; I467-F483 HydrophobicContact CG2-CE2 3.69Å; I467-F483 HydrophobicContact CG2-CG 3.77Å; I467-F483 HydrophobicContact CG2-CZ 3.86Å; A468-F483 HydrophobicContact CB-CB 3.57Å; H471-F483 AromaticContact CD2-CD2 3.9Å; H471-F483 AromaticContact CD2-CE2 3.99Å; H471-F483 AromaticContact NE2-CE2 3.87Å; K479-F483 HydrophobicContact CB-CD2 4.49Å; K479-F483 VanDerWaalsContact O-CD2 3.29Å; K479-F483 WeakPolarHBondContact O-CD2 3.24Å; K479-F483 PolarHBondContact O-N 2.98Å; F483-T485 VanDerWaalsContact C-N 3.32Å; F483-S487 VanDerWaalsContact O-CB 3.24Å; F483-S487 WeakPolarHBondContact O-CB 3.4Å; F483-S487 PolarHBondContact O-N 3.09Å
484	F	94.6	Very high	91	Very high	1 Å²	1	54.8 Å²	54.8	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-68.6	-29.5	171.5	-76.2	-47.4	0	0	0	113	N465 A468 A469 S480 Y488 V522 N525 Q526 L529 I1010	N465-F484 WeakPolarHBondContact OD1-CE1 3.47Å; A468-F484 HydrophobicContact CB-CB 4.33Å; A468-F484 HydrophobicContact CB-CD1 3.33Å; A468-F484 HydrophobicContact CB-CD2 3.77Å; A468-F484 HydrophobicContact CB-CE1 3.3Å; A468-F484 HydrophobicContact CB-CE2 3.76Å; A468-F484 HydrophobicContact CB-CG 3.53Å; A468-F484 HydrophobicContact CB-CZ 3.49Å; A468-F484 VanDerWaalsContact CB-CZ 3.49Å; A469-F484 HydrophobicContact CB-CZ 4.26Å; S480-F484 WeakPolarHBondContact O-CB 3.49Å; S480-F484 WeakPolarHBondContact O-CD2 3.31Å; S480-F484 WeakPolarHBondContact O-CG 3.4Å; S480-F484 PolarHBondContact O-N 3.44Å; S480-F484 WeakPolarHBondContact OG-CE2 3.2Å; F484-Y488 VanDerWaalsContact O-CB 3.3Å; F484-Y488 WeakPolarHBondContact O-CB 3.33Å; F484-Y488 PolarHBondContact O-N 3Å; F484-Y488 VanDerWaalsContact O-N 3.11Å; F484-V522 HydrophobicContact CD1-CG1 4.41Å; F484-N525 HydrophobicContact CD1-CB 4.04Å; F484-N525 HydrophobicContact CE1-CB 3.44Å; F484-N525 VanDerWaalsContact CE1-CB 3.44Å; F484-N525 HydrophobicContact CE2-CB 4.15Å; F484-N525 HydrophobicContact CZ-CB 3.53Å; F484-Q526 HydrophobicContact CB-CG 3.8Å; F484-Q526 HydrophobicContact CG-CG 4.33Å; F484-Q526 PolarHBondContact O-NE2 3.37Å; F484-Q526 VanDerWaalsContact O-NE2 3.09Å; F484-L529 HydrophobicContact CD2-CD2 4.05Å; F484-I1010 HydrophobicContact CE2-CD1 4.02Å; F484-I1010 HydrophobicContact CZ-CD1 3.73Å
485	T	93.6	Very high	90.7	Very high	63 Å²	63	52 Å²	52	39%	0.387	26%	0.257	S	S	.	.	H	α-helix	trans	-72.1	-50.4	174	-52.1	0	0	0	0	109.5	S481 E482 F483 S487 Y488 D489	S481-T485 WeakPolarHBondContact O-CB 3.01Å; S481-T485 PolarHBondContact O-N 3.12Å; S481-T485 PolarHBondContact O-OG1 3.06Å; E482-T485 PolarHBondContact O-N 2.88Å; F483-T485 VanDerWaalsContact C-N 3.32Å; T485-S487 VanDerWaalsContact C-N 3.28Å; T485-S487 PolarHBondContact O-N 2.93Å; T485-Y488 PolarHBondContact O-N 3.26Å; T485-D489 PolarHBondContact O-N 3.25Å
486	R	93.2	Very high	90.5	Very high	96 Å²	96	56.8 Å²	56.8	36%	0.362	26%	0.264	S	S	.	.	H	α-helix	trans	-57.2	-37.1	175.8	-165.2	-178.3	177.7	-173.4	-0.1	112.8	E453 L464 E482 R490	E453-R486 IonicContact OE1-CZ 2.73Å; E453-R486 VanDerWaalsContact OE1-CZ 3.3Å; E453-R486 IonicContact OE1-NH1 3.57Å; E453-R486 PolarHBondContact OE1-NH1 3.44Å; E453-R486 IonicContact OE1-NH2 3.84Å; E453-R486 PolarHBondContact OE1-NH2 2.78Å; L464-R486 HydrophobicContact CD1-CB 4.44Å; L464-R486 HydrophobicContact CD1-CG 3.98Å; E482-R486 WeakPolarHBondContact O-CB 3.39Å; E482-R486 PolarHBondContact O-N 2.85Å; R486-R490 WeakPolarHBondContact O-CB 3.47Å; R486-R490 PolarHBondContact O-N 2.87Å
487	S	92.3	Very high	89.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.1	-47	173.3	-178.9	0	0	0	0	111.9	P461 F483 T485 R490 I491 V522	P461-S487 PolarHBondContact O-OG 3.39Å; F483-S487 VanDerWaalsContact O-CB 3.24Å; F483-S487 WeakPolarHBondContact O-CB 3.4Å; F483-S487 PolarHBondContact O-N 3.09Å; T485-S487 VanDerWaalsContact C-N 3.28Å; T485-S487 PolarHBondContact O-N 2.93Å; S487-R490 PolarHBondContact O-N 3.11Å; S487-I491 WeakPolarHBondContact O-CD1 3.37Å; S487-I491 VanDerWaalsContact O-CG1 3.31Å; S487-I491 WeakPolarHBondContact O-CG1 3.46Å; S487-I491 PolarHBondContact O-N 3.25Å; S487-I491 VanDerWaalsContact O-N 3.13Å; S487-V522 WeakPolarHBondContact OG-CG2 3.45Å
488	Y	92	Very high	88.7	Confident	39 Å²	39	56 Å²	56	15%	0.153	27%	0.266	C	S	.	.	H	α-helix	trans	-69.4	-42	-178.3	-174.5	-110.3	0	0	0	113.2	F484 T485 R490 I491 L492 V522 R523 Q526	F484-Y488 VanDerWaalsContact O-CB 3.3Å; F484-Y488 WeakPolarHBondContact O-CB 3.33Å; F484-Y488 PolarHBondContact O-N 3Å; F484-Y488 VanDerWaalsContact O-N 3.11Å; T485-Y488 PolarHBondContact O-N 3.26Å; Y488-R490 VanDerWaalsContact C-N 3.33Å; Y488-R490 PolarHBondContact O-N 2.77Å; Y488-I491 PolarHBondContact O-N 2.9Å; Y488-L492 HydrophobicContact CD1-CD1 4.02Å; Y488-L492 HydrophobicContact CD1-CG 4.46Å; Y488-L492 HydrophobicContact CE1-CD1 3.53Å; Y488-L492 HydrophobicContact CE1-CG 4.09Å; Y488-L492 PolarHBondContact O-N 3.22Å; Y488-V522 HydrophobicContact CD2-CG1 4.36Å; Y488-R523 HydrophobicContact CD2-CG 3.88Å; Y488-R523 VanDerWaalsContact CE2-CD 3.5Å; Y488-R523 HydrophobicContact CE2-CG 3.51Å; Y488-R523 PolarHBondContact OH-NH1 3.1Å; Y488-R523 VanDerWaalsContact OH-NH1 3.1Å; Y488-Q526 VanDerWaalsContact CB-NE2 3.32Å
489	D	91.8	Very high	87.6	Confident	79 Å²	79	56.6 Å²	56.6	42%	0.422	26%	0.264	S	S	.	.	H	α-helix	trans	-61.3	-43.1	175.9	-68.7	-26.3	0	0	0	110.7	T485 I491 L492 E493	T485-D489 PolarHBondContact O-N 3.25Å; D489-I491 VanDerWaalsContact C-N 3.32Å; D489-I491 PolarHBondContact O-N 3.4Å; D489-L492 PolarHBondContact O-N 3.47Å; D489-L492 VanDerWaalsContact O-N 3.13Å; D489-E493 WeakPolarHBondContact O-CG 3.49Å; D489-E493 PolarHBondContact O-N 3.5Å
490	R	89	Confident	86.3	Confident	27 Å²	27	58.4 Å²	58.4	10%	0.102	28%	0.279	C	S	.	.	H	α-helix	trans	-60.5	-38.2	174.5	-179	64.1	-176.4	113.5	10.1	112.4	E458 P461 R486 S487 Y488 E493 E494	E458-R490 IonicContact OE2-CZ 3.5Å; E458-R490 IonicContact OE2-NH1 3.31Å; E458-R490 IonicContact OE2-NH2 3.44Å; E458-R490 PolarHBondContact OE2-NH2 3.07Å; P461-R490 HydrophobicContact CB-CB 4.41Å; P461-R490 HydrophobicContact CB-CG 4.22Å; P461-R490 HydrophobicContact CG-CG 4.4Å; R486-R490 WeakPolarHBondContact O-CB 3.47Å; R486-R490 PolarHBondContact O-N 2.87Å; S487-R490 PolarHBondContact O-N 3.11Å; Y488-R490 VanDerWaalsContact C-N 3.33Å; Y488-R490 PolarHBondContact O-N 2.77Å; R490-E493 PolarHBondContact O-N 2.7Å; R490-E494 IonicContact CZ-OE1 3.21Å; R490-E494 IonicContact CZ-OE2 3.77Å; R490-E494 VanDerWaalsContact CZ-OE2 3.25Å; R490-E494 IonicContact NH1-OE1 3.63Å; R490-E494 IonicContact NH1-OE2 2.67Å; R490-E494 PolarHBondContact NH1-OE2 3.22Å; R490-E494 IonicContact NH2-OE1 2.6Å; R490-E494 PolarHBondContact NH2-OE1 3.27Å; R490-E494 IonicContact NH2-OE2 3.87Å; R490-E494 PolarHBondContact NH2-OE2 2.92Å; R490-E494 WeakPolarHBondContact O-CG 3.37Å; R490-E494 PolarHBondContact O-N 2.98Å
491	I	87.9	Confident	84.8	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.8	-41.2	174.6	-65.9	160.1	0	0	0	111	P461 S487 Y488 D489 E493 E494 Q495 L518 V522	P461-I491 HydrophobicContact CB-CD1 4.11Å; P461-I491 HydrophobicContact CB-CG1 3.64Å; P461-I491 HydrophobicContact CG-CG1 3.91Å; S487-I491 WeakPolarHBondContact O-CD1 3.37Å; S487-I491 VanDerWaalsContact O-CG1 3.31Å; S487-I491 WeakPolarHBondContact O-CG1 3.46Å; S487-I491 PolarHBondContact O-N 3.25Å; S487-I491 VanDerWaalsContact O-N 3.13Å; Y488-I491 PolarHBondContact O-N 2.9Å; D489-I491 VanDerWaalsContact C-N 3.32Å; D489-I491 PolarHBondContact O-N 3.4Å; I491-E493 VanDerWaalsContact C-N 3.29Å; I491-E493 PolarHBondContact O-N 2.56Å; I491-E494 PolarHBondContact O-N 2.91Å; I491-Q495 HydrophobicContact CG2-CG 4.43Å; I491-Q495 WeakPolarHBondContact O-CG 3.45Å; I491-Q495 PolarHBondContact O-N 3.47Å; I491-L518 HydrophobicContact CD1-CB 4.42Å; I491-L518 HydrophobicContact CD1-CD2 3.85Å; I491-L518 HydrophobicContact CD1-CG 3.69Å; I491-L518 HydrophobicContact CG1-CD2 4Å; I491-L518 HydrophobicContact CG1-CG 4.34Å; I491-V522 HydrophobicContact CD1-CB 4.29Å; I491-V522 HydrophobicContact CD1-CG2 3.69Å
492	L	87.8	Confident	82.9	Confident	41 Å²	41	68.8 Å²	68.8	22%	0.215	33%	0.332	C	S	.	.	H	α-helix	trans	-67	-28.6	175.3	-68.3	179.8	0	0	0	113	Y488 D489 R496	Y488-L492 HydrophobicContact CD1-CD1 4.02Å; Y488-L492 HydrophobicContact CD1-CG 4.46Å; Y488-L492 HydrophobicContact CE1-CD1 3.53Å; Y488-L492 HydrophobicContact CE1-CG 4.09Å; Y488-L492 PolarHBondContact O-N 3.22Å; D489-L492 PolarHBondContact O-N 3.47Å; D489-L492 VanDerWaalsContact O-N 3.13Å; L492-R496 WeakPolarHBondContact O-CB 3.31Å; L492-R496 WeakPolarHBondContact O-CD 3.3Å; L492-R496 WeakPolarHBondContact O-CG 3.38Å; L492-R496 PolarHBondContact O-N 2.87Å
493	E	86.6	Confident	80.7	Confident	96 Å²	96	66 Å²	66	45%	0.449	34%	0.338	S	S	.	.	H	α-helix	trans	-68.6	-47.5	170.8	-71.2	171	162.8	0	0	111.3	D489 R490 I491 R496 N497	D489-E493 WeakPolarHBondContact O-CG 3.49Å; D489-E493 PolarHBondContact O-N 3.5Å; R490-E493 PolarHBondContact O-N 2.7Å; I491-E493 VanDerWaalsContact C-N 3.29Å; I491-E493 PolarHBondContact O-N 2.56Å; E493-R496 PolarHBondContact O-N 3.13Å; E493-N497 PolarHBondContact O-N 3.45Å; E493-N497 PolarHBondContact O-ND2 2.94Å; E493-N497 PolarHBondContact O-OD1 3Å
494	E	83.4	Confident	78.5	Confident	17 Å²	17	67.6 Å²	67.6	8%	0.079	36%	0.363	C	S	.	.	H	α-helix	trans	-58.6	-49.9	175.8	-63	-75.8	-122.6	0	0	111.5	R490 I491 R496 N497 E498 Y515 R1002	R490-E494 IonicContact CZ-OE1 3.21Å; R490-E494 IonicContact CZ-OE2 3.77Å; R490-E494 VanDerWaalsContact CZ-OE2 3.25Å; R490-E494 IonicContact NH1-OE1 3.63Å; R490-E494 IonicContact NH1-OE2 2.67Å; R490-E494 PolarHBondContact NH1-OE2 3.22Å; R490-E494 IonicContact NH2-OE1 2.6Å; R490-E494 PolarHBondContact NH2-OE1 3.27Å; R490-E494 IonicContact NH2-OE2 3.87Å; R490-E494 PolarHBondContact NH2-OE2 2.92Å; R490-E494 WeakPolarHBondContact O-CG 3.37Å; R490-E494 PolarHBondContact O-N 2.98Å; I491-E494 PolarHBondContact O-N 2.91Å; E494-R496 VanDerWaalsContact C-N 3.3Å; E494-R496 PolarHBondContact O-N 3.05Å; E494-N497 WeakPolarHBondContact O-CB 3.39Å; E494-N497 PolarHBondContact O-N 3.25Å; E494-E498 WeakPolarHBondContact O-CG 3.48Å; E494-E498 PolarHBondContact O-N 3.39Å; E494-Y515 HydrophobicContact CB-CD1 3.86Å; E494-Y515 HydrophobicContact CB-CD2 4.28Å; E494-Y515 HydrophobicContact CB-CE1 3.66Å; E494-Y515 HydrophobicContact CB-CE2 4.11Å; E494-Y515 HydrophobicContact CB-CG 4.17Å; E494-Y515 HydrophobicContact CG-CD1 4.11Å; E494-Y515 HydrophobicContact CG-CE1 3.49Å; E494-Y515 VanDerWaalsContact CG-CE1 3.49Å; E494-Y515 PolarHBondContact OE1-OH 2.93Å; E494-R1002 IonicContact OE1-NH2 3.65Å
495	Q	81.7	Confident	76.2	Confident	32 Å²	32	74.8 Å²	74.8	15%	0.15	40%	0.402	C	S	.	.	H	α-helix	trans	-60.1	-39.1	179.7	-69.9	-173.1	-61.2	0	0	112	I491 E498 E499	I491-Q495 HydrophobicContact CG2-CG 4.43Å; I491-Q495 WeakPolarHBondContact O-CG 3.45Å; I491-Q495 PolarHBondContact O-N 3.47Å; Q495-E498 PolarHBondContact O-N 3.27Å; Q495-E499 WeakPolarHBondContact O-CB 3.47Å; Q495-E499 VanDerWaalsContact O-CG 3.32Å; Q495-E499 WeakPolarHBondContact O-CG 3.23Å; Q495-E499 PolarHBondContact O-N 3.09Å
496	R	82.5	Confident	73.7	Confident	138 Å²	138	77.7 Å²	77.7	52%	0.521	42%	0.424	S	S	.	.	H	α-helix	trans	-68.7	-36.5	173.9	-74	169.6	-171.4	157	6	112.8	L492 E493 E494 E498 E499 N500	L492-R496 WeakPolarHBondContact O-CB 3.31Å; L492-R496 WeakPolarHBondContact O-CD 3.3Å; L492-R496 WeakPolarHBondContact O-CG 3.38Å; L492-R496 PolarHBondContact O-N 2.87Å; E493-R496 PolarHBondContact O-N 3.13Å; E494-R496 VanDerWaalsContact C-N 3.3Å; E494-R496 PolarHBondContact O-N 3.05Å; R496-E498 VanDerWaalsContact C-N 3.34Å; R496-E499 PolarHBondContact O-N 2.91Å; R496-N500 WeakPolarHBondContact O-CB 3.28Å; R496-N500 PolarHBondContact O-N 2.93Å; R496-N500 PolarHBondContact O-ND2 3.36Å
497	N	77.7	Confident	71.3	Confident	79 Å²	79	78.7 Å²	78.7	42%	0.422	45%	0.446	S	S	.	.	H	α-helix	trans	-64.5	-44.5	176.7	-67.9	-20	0	0	0	109.7	E493 E494 N500 E501	E493-N497 PolarHBondContact O-N 3.45Å; E493-N497 PolarHBondContact O-ND2 2.94Å; E493-N497 PolarHBondContact O-OD1 3Å; E494-N497 WeakPolarHBondContact O-CB 3.39Å; E494-N497 PolarHBondContact O-N 3.25Å; N497-N500 PolarHBondContact O-N 3.22Å; N497-N500 VanDerWaalsContact O-N 3.14Å; N497-E501 PolarHBondContact O-N 3.22Å
498	E	69.5	Low	68.7	Low	37 Å²	37	80.8 Å²	80.8	17%	0.173	47%	0.468	C	S	.	.	H	α-helix	trans	-66.5	-38.8	176.8	-65.5	-174.7	158.7	0	0	112.4	E494 Q495 R496 N500 E501 C502 N511 Y515	E494-E498 WeakPolarHBondContact O-CG 3.48Å; E494-E498 PolarHBondContact O-N 3.39Å; Q495-E498 PolarHBondContact O-N 3.27Å; R496-E498 VanDerWaalsContact C-N 3.34Å; E498-N500 VanDerWaalsContact C-N 3.28Å; E498-N500 PolarHBondContact O-N 3.07Å; E498-E501 PolarHBondContact O-N 3.26Å; E498-C502 WeakPolarHBondContact O-CB 3.43Å; E498-C502 PolarHBondContact O-N 3.2Å; E498-N511 VanDerWaalsContact CD-CB 3.49Å; E498-N511 WeakPolarHBondContact OE1-CB 3.38Å; E498-N511 PolarHBondContact OE1-ND2 3.38Å; E498-N511 VanDerWaalsContact OE2-CB 3.29Å; E498-N511 WeakPolarHBondContact OE2-CB 3.19Å; E498-Y515 WeakPolarHBondContact OE1-CE2 3.44Å; E498-Y515 WeakPolarHBondContact OE2-CD2 3.38Å
499	E	68.7	Low	66.3	Low	149 Å²	149	87 Å²	87	70%	0.696	50%	0.503	S	S	*	.	H	α-helix	trans	-59.7	-32.8	169.7	-78.9	176.9	168.3	0	0	113.2	Q495 R496	Q495-E499 WeakPolarHBondContact O-CB 3.47Å; Q495-E499 VanDerWaalsContact O-CG 3.32Å; Q495-E499 WeakPolarHBondContact O-CG 3.23Å; Q495-E499 PolarHBondContact O-N 3.09Å; R496-E499 PolarHBondContact O-N 2.91Å
500	N	65.4	Low	64.4	Low	136 Å²	136	87.5 Å²	87.5	73%	0.727	51%	0.509	S	S	*	.	H	α-helix	trans	-84.4	-29.9	179.5	-78.9	-70.4	0	0	0	113.2	R496 N497 E498	R496-N500 WeakPolarHBondContact O-CB 3.28Å; R496-N500 PolarHBondContact O-N 2.93Å; R496-N500 PolarHBondContact O-ND2 3.36Å; N497-N500 PolarHBondContact O-N 3.22Å; N497-N500 VanDerWaalsContact O-N 3.14Å; E498-N500 VanDerWaalsContact C-N 3.28Å; E498-N500 PolarHBondContact O-N 3.07Å
501	E	62.2	Low	62.7	Low	169 Å²	169	90.2 Å²	90.2	79%	0.79	53%	0.526	S	S	*	.	H	α-helix	trans	-83.6	-36.9	176	-69	-169.3	174.9	0	0	112.5	N497 E498 G503	N497-E501 PolarHBondContact O-N 3.22Å; E498-E501 PolarHBondContact O-N 3.26Å; E501-G503 VanDerWaalsContact C-N 3.32Å; E501-G503 PolarHBondContact O-N 3.48Å
502	C	52.7	Low	61.4	Low	84 Å²	84	94.8 Å²	94.8	57%	0.568	55%	0.55	S	S	*	*	S	Bend	trans	-81	74	178.1	-66.8	0	0	0	0	112	E498 G504	E498-C502 WeakPolarHBondContact O-CB 3.43Å; E498-C502 PolarHBondContact O-N 3.2Å; C502-G504 VanDerWaalsContact C-N 3.31Å; C502-G504 PolarHBondContact O-N 3.05Å
503	G	47.6	Very low	60.6	Low	72 Å²	72	98.6 Å²	98.6	74%	0.742	57%	0.571	S	S	*	*			trans	-63.6	78.6	175.5	0	0	0	0	0	114.6	E501 D505	E501-G503 VanDerWaalsContact C-N 3.32Å; E501-G503 PolarHBondContact O-N 3.48Å; G503-D505 PolarHBondContact O-N 3.49Å
504	G	48.6	Very low	60.2	Low	65 Å²	65	97.4 Å²	97.4	67%	0.67	56%	0.563	S	S	*	*	S	Bend	trans	89.2	-36.8	163.3	0	0	0	0	0	117.2	C502 S506	C502-G504 VanDerWaalsContact C-N 3.31Å; C502-G504 PolarHBondContact O-N 3.05Å; G504-S506 PolarHBondContact O-N 3.27Å; G504-S506 VanDerWaalsContact O-N 3.12Å
505	D	46	Very low	60.1	Low	152 Å²	152	96.8 Å²	96.8	81%	0.813	56%	0.56	S	S	*	*			trans	-89.4	71.2	-171.7	-76	-20.4	0	0	0	113.4	G503 S507	G503-D505 PolarHBondContact O-N 3.49Å; D505-S507 PolarHBondContact O-N 3.24Å
506	S	41.8	Very low	60.2	Low	123 Å²	123	97.8 Å²	97.8	86%	0.86	56%	0.564	S	S	*	*			trans	-75.1	77.8	175.8	49.3	0	0	0	0	113	G504	G504-S506 PolarHBondContact O-N 3.27Å; G504-S506 VanDerWaalsContact O-N 3.12Å
507	S	41.3	Very low	60.2	Low	117 Å²	117	92.8 Å²	92.8	82%	0.818	56%	0.555	S	S	*	*			trans	-131.3	15.9	177.7	75.6	0	0	0	0	115.6	D505	D505-S507 PolarHBondContact O-N 3.24Å
508	G	38.3	Very low	60.6	Low	45 Å²	45	89.3 Å²	89.3	46%	0.464	54%	0.537	S	S	.	.	S	Bend	trans	-107.9	148.9	172.2	0	0	0	0	0	112	T510	G508-T510 PolarHBondContact O-N 2.96Å; G508-T510 PolarHBondContact O-OG1 3.36Å
509	L	42	Very low	61.6	Low	170 Å²	170	88 Å²	88	89%	0.89	53%	0.532	S	S	*	.			trans	-79.5	71.7	160.9	-67.8	100.6	0	0	0	108.1
510	T	50.8	Low	62.6	Low	89 Å²	89	82.1 Å²	82.1	55%	0.546	51%	0.505	S	S	.	.			trans	-128.5	102.8	-164	44.5	0	0	0	0	110.8	G508 D512	G508-T510 PolarHBondContact O-N 2.96Å; G508-T510 PolarHBondContact O-OG1 3.36Å; T510-D512 PolarHBondContact O-N 3.49Å
511	N	55.2	Low	63.7	Low	83 Å²	83	76.8 Å²	76.8	44%	0.444	48%	0.477	S	S	.	.	S	Bend	trans	57.3	-36	170.4	-61.4	4.1	0	0	0	119.9	E498 D513 Y514 Y515	E498-N511 VanDerWaalsContact CD-CB 3.49Å; E498-N511 WeakPolarHBondContact OE1-CB 3.38Å; E498-N511 PolarHBondContact OE1-ND2 3.38Å; E498-N511 VanDerWaalsContact OE2-CB 3.29Å; E498-N511 WeakPolarHBondContact OE2-CB 3.19Å; N511-D513 PolarHBondContact O-N 2.99Å; N511-Y514 WeakPolarHBondContact O-CA 3.23Å; N511-Y514 VanDerWaalsContact O-CB 3.28Å; N511-Y514 WeakPolarHBondContact O-CB 3.34Å; N511-Y514 PolarHBondContact O-N 2.88Å; N511-Y515 HydrophobicContact CB-CD2 4.3Å; N511-Y515 HydrophobicContact CB-CE2 4.32Å; N511-Y515 PolarHBondContact O-N 2.92Å; N511-Y515 VanDerWaalsContact O-N 3.09Å
512	D	59.9	Low	65.2	Low	97 Å²	97	68.7 Å²	68.7	52%	0.519	44%	0.439	S	S	.	.	H	α-helix	trans	-58.4	-46.2	-174.5	-174	21.3	0	0	0	111.7	T510 Y514 Y515 H516	T510-D512 PolarHBondContact O-N 3.49Å; D512-Y514 PolarHBondContact O-N 2.85Å; D512-Y514 VanDerWaalsContact O-N 3.16Å; D512-Y515 PolarHBondContact O-N 3.16Å; D512-H516 WeakPolarHBondContact O-CB 3.45Å; D512-H516 PolarHBondContact O-N 3.26Å
513	D	71.1	Confident	67.1	Low	121 Å²	121	67.9 Å²	67.9	65%	0.647	42%	0.424	S	S	*	.	H	α-helix	trans	-53.9	-34.3	172.2	-77.6	-32.9	0	0	0	113.4	N511 G517	N511-D513 PolarHBondContact O-N 2.99Å; D513-G517 PolarHBondContact O-N 3.26Å
514	Y	77.9	Confident	69.3	Low	71 Å²	71	64.4 Å²	64.4	28%	0.278	39%	0.389	S	S	.	.	H	α-helix	trans	-73.7	-53.5	-179.3	176.9	-94.9	0	0	0	111.2	E462 N511 D512 H516 G517 L518 M1003	E462-Y514 PolarHBondContact OE1-OH 3.19Å; N511-Y514 WeakPolarHBondContact O-CA 3.23Å; N511-Y514 VanDerWaalsContact O-CB 3.28Å; N511-Y514 WeakPolarHBondContact O-CB 3.34Å; N511-Y514 PolarHBondContact O-N 2.88Å; D512-Y514 PolarHBondContact O-N 2.85Å; D512-Y514 VanDerWaalsContact O-N 3.16Å; Y514-H516 VanDerWaalsContact C-N 3.29Å; Y514-H516 PolarHBondContact O-N 3.11Å; Y514-G517 PolarHBondContact O-N 3.48Å; Y514-L518 WeakPolarHBondContact O-CB 3.39Å; Y514-L518 PolarHBondContact O-N 3.41Å; Y514-M1003 HydrophobicContact CD2-CG 4.24Å; Y514-M1003 HydrophobicContact CE2-CG 3.76Å
515	Y	81.5	Confident	71.4	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.016	36%	0.357	C	S	.	.	H	α-helix	trans	-67.6	-32	178.6	-71.7	-70.8	0	0	0	111.5	E494 E498 N511 D512 S519 R1002	E494-Y515 HydrophobicContact CB-CD1 3.86Å; E494-Y515 HydrophobicContact CB-CD2 4.28Å; E494-Y515 HydrophobicContact CB-CE1 3.66Å; E494-Y515 HydrophobicContact CB-CE2 4.11Å; E494-Y515 HydrophobicContact CB-CG 4.17Å; E494-Y515 HydrophobicContact CG-CD1 4.11Å; E494-Y515 HydrophobicContact CG-CE1 3.49Å; E494-Y515 VanDerWaalsContact CG-CE1 3.49Å; E494-Y515 PolarHBondContact OE1-OH 2.93Å; E498-Y515 WeakPolarHBondContact OE1-CE2 3.44Å; E498-Y515 WeakPolarHBondContact OE2-CD2 3.38Å; N511-Y515 HydrophobicContact CB-CD2 4.3Å; N511-Y515 HydrophobicContact CB-CE2 4.32Å; N511-Y515 PolarHBondContact O-N 2.92Å; N511-Y515 VanDerWaalsContact O-N 3.09Å; D512-Y515 PolarHBondContact O-N 3.16Å; Y515-S519 VanDerWaalsContact O-CB 3.22Å; Y515-S519 WeakPolarHBondContact O-CB 3.3Å; Y515-S519 PolarHBondContact O-N 3.07Å; Y515-R1002 PolarHBondContact OH-NH2 3.29Å
516	H	82.8	Confident	73.7	Confident	53 Å²	53	55.4 Å²	55.4	25%	0.245	32%	0.324	C	S	.	.	H	α-helix	trans	-65.3	-45.2	170.6	-164.9	97.4	0	0	0	112	D512 Y514 L518 S519 I520 H550	D512-H516 WeakPolarHBondContact O-CB 3.45Å; D512-H516 PolarHBondContact O-N 3.26Å; Y514-H516 VanDerWaalsContact C-N 3.29Å; Y514-H516 PolarHBondContact O-N 3.11Å; H516-L518 PolarHBondContact O-N 3.18Å; H516-S519 WeakPolarHBondContact O-CB 3.27Å; H516-S519 PolarHBondContact O-N 3.47Å; H516-I520 WeakPolarHBondContact O-CG1 3.48Å; H516-I520 PolarHBondContact O-N 3.46Å; H516-I520 VanDerWaalsContact O-N 3.08Å; H516-H550 AromaticContact CD2-NE2 3.47Å; H516-H550 PolarHBondContact CD2-NE2 3.4Å; H516-H550 AromaticContact NE2-CE1 3.8Å; H516-H550 AromaticContact NE2-NE2 3Å; H516-H550 PolarHBondContact NE2-NE2 3.35Å
517	G	83.7	Confident	76.1	Confident	32 Å²	32	49.5 Å²	49.5	33%	0.33	28%	0.283	S	S	.	.	H	α-helix	trans	-59.2	-43.3	174.7	0	0	0	0	0	113.1	D513 Y514 I520 T521	D513-G517 PolarHBondContact O-N 3.26Å; Y514-G517 PolarHBondContact O-N 3.48Å; G517-I520 PolarHBondContact O-N 2.96Å; G517-T521 PolarHBondContact O-N 3.26Å; G517-T521 PolarHBondContact O-OG1 3.25Å
518	L	85.9	Confident	78.6	Confident	7 Å²	7	44.8 Å²	44.8	4%	0.037	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-40.2	175	-175.5	62.1	0	0	0	111.9	P461 E462 I491 Y514 H516 I520 T521 V522 S1007	P461-L518 HydrophobicContact CB-CD2 4.01Å; P461-L518 HydrophobicContact CG-CD2 3.62Å; E462-L518 HydrophobicContact CG-CD1 4.1Å; E462-L518 HydrophobicContact CG-CD2 3.87Å; I491-L518 HydrophobicContact CD1-CB 4.42Å; I491-L518 HydrophobicContact CD1-CD2 3.85Å; I491-L518 HydrophobicContact CD1-CG 3.69Å; I491-L518 HydrophobicContact CG1-CD2 4Å; I491-L518 HydrophobicContact CG1-CG 4.34Å; Y514-L518 WeakPolarHBondContact O-CB 3.39Å; Y514-L518 PolarHBondContact O-N 3.41Å; H516-L518 PolarHBondContact O-N 3.18Å; L518-I520 VanDerWaalsContact C-N 3.32Å; L518-I520 PolarHBondContact O-N 2.86Å; L518-T521 WeakPolarHBondContact O-CB 3.4Å; L518-T521 PolarHBondContact O-N 2.8Å; L518-T521 VanDerWaalsContact O-N 3.08Å; L518-V522 HydrophobicContact CD1-CG2 4.46Å; L518-V522 HydrophobicContact CG-CG2 4.49Å; L518-V522 WeakPolarHBondContact O-CG2 3.49Å; L518-V522 PolarHBondContact O-N 2.71Å; L518-S1007 WeakPolarHBondContact CD1-OG 3.18Å
519	S	89.5	Confident	81.2	Confident	10 Å²	10	42.9 Å²	42.9	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-56.4	-42.6	175.4	-166.5	0	0	0	0	112	Y515 H516 T521 V522 R523	Y515-S519 VanDerWaalsContact O-CB 3.22Å; Y515-S519 WeakPolarHBondContact O-CB 3.3Å; Y515-S519 PolarHBondContact O-N 3.07Å; H516-S519 WeakPolarHBondContact O-CB 3.27Å; H516-S519 PolarHBondContact O-N 3.47Å; S519-T521 PolarHBondContact O-N 2.83Å; S519-V522 PolarHBondContact O-N 2.92Å; S519-R523 WeakPolarHBondContact O-CB 3.4Å; S519-R523 VanDerWaalsContact O-CG 3.26Å; S519-R523 WeakPolarHBondContact O-CG 3.19Å; S519-R523 PolarHBondContact O-N 3.18Å
520	I	89.9	Confident	83.7	Confident	25 Å²	25	36.2 Å²	36.2	13%	0.128	19%	0.191	C	C	.	.	H	α-helix	trans	-59.5	-47	174.3	-59.9	157.6	0	0	0	110.7	H516 G517 L518 R523 Y524 I546 H550 Y553	H516-I520 WeakPolarHBondContact O-CG1 3.48Å; H516-I520 PolarHBondContact O-N 3.46Å; H516-I520 VanDerWaalsContact O-N 3.08Å; G517-I520 PolarHBondContact O-N 2.96Å; L518-I520 VanDerWaalsContact C-N 3.32Å; L518-I520 PolarHBondContact O-N 2.86Å; I520-R523 PolarHBondContact O-N 3.16Å; I520-Y524 WeakPolarHBondContact O-CB 3.5Å; I520-Y524 PolarHBondContact O-N 3.31Å; I520-I546 HydrophobicContact CG2-CG2 3.89Å; I520-H550 WeakPolarHBondContact CD1-CD2 3.3Å; I520-H550 VanDerWaalsContact CD1-NE2 3.31Å; I520-H550 WeakPolarHBondContact CD1-NE2 3.33Å; I520-Y553 HydrophobicContact CG2-CD2 4.25Å; I520-Y553 HydrophobicContact CG2-CE2 4.07Å
521	T	89.9	Confident	85.6	Confident	23 Å²	23	33.4 Å²	33.4	14%	0.141	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-46.7	-178.5	-60.7	0	0	0	0	111.5	G517 L518 S519 Y524 N525 A1009	G517-T521 PolarHBondContact O-N 3.26Å; G517-T521 PolarHBondContact O-OG1 3.25Å; L518-T521 WeakPolarHBondContact O-CB 3.4Å; L518-T521 PolarHBondContact O-N 2.8Å; L518-T521 VanDerWaalsContact O-N 3.08Å; S519-T521 PolarHBondContact O-N 2.83Å; T521-Y524 PolarHBondContact O-N 2.9Å; T521-N525 WeakPolarHBondContact O-CB 3.4Å; T521-N525 PolarHBondContact O-N 2.92Å; T521-N525 PolarHBondContact O-ND2 3.46Å; T521-A1009 HydrophobicContact CG2-CB 4.1Å
522	V	92.3	Very high	87.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.1	-40.9	178.2	177	0	0	0	0	111.3	N465 F484 S487 Y488 I491 L518 S519 N525 Q526	N465-V522 HydrophobicContact CB-CG2 4.08Å; F484-V522 HydrophobicContact CD1-CG1 4.41Å; S487-V522 WeakPolarHBondContact OG-CG2 3.45Å; Y488-V522 HydrophobicContact CD2-CG1 4.36Å; I491-V522 HydrophobicContact CD1-CB 4.29Å; I491-V522 HydrophobicContact CD1-CG2 3.69Å; L518-V522 HydrophobicContact CD1-CG2 4.46Å; L518-V522 HydrophobicContact CG-CG2 4.49Å; L518-V522 WeakPolarHBondContact O-CG2 3.49Å; L518-V522 PolarHBondContact O-N 2.71Å; S519-V522 PolarHBondContact O-N 2.92Å; V522-N525 WeakPolarHBondContact O-CB 3.48Å; V522-N525 PolarHBondContact O-N 3.42Å; V522-Q526 WeakPolarHBondContact O-CG 3.29Å; V522-Q526 PolarHBondContact O-N 2.91Å
523	R	93.2	Very high	88.7	Confident	66 Å²	66	29.3 Å²	29.3	25%	0.249	15%	0.153	C	C	.	.	H	α-helix	trans	-71	-35.7	178.2	-67	-173.4	85.6	161.2	2.1	113	Y488 S519 I520 N525 Q526 A527 I542 I546	Y488-R523 HydrophobicContact CD2-CG 3.88Å; Y488-R523 VanDerWaalsContact CE2-CD 3.5Å; Y488-R523 HydrophobicContact CE2-CG 3.51Å; Y488-R523 PolarHBondContact OH-NH1 3.1Å; Y488-R523 VanDerWaalsContact OH-NH1 3.1Å; S519-R523 WeakPolarHBondContact O-CB 3.4Å; S519-R523 VanDerWaalsContact O-CG 3.26Å; S519-R523 WeakPolarHBondContact O-CG 3.19Å; S519-R523 PolarHBondContact O-N 3.18Å; I520-R523 PolarHBondContact O-N 3.16Å; R523-N525 VanDerWaalsContact C-N 3.32Å; R523-Q526 PolarHBondContact O-N 2.79Å; R523-A527 PolarHBondContact O-N 3.33Å; R523-I542 HydrophobicContact CB-CG2 4.15Å; R523-I542 WeakPolarHBondContact O-CG2 3.39Å; R523-I546 HydrophobicContact CB-CD1 4.25Å
524	Y	93.6	Very high	89.5	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.2	-44.3	170	172	-101.1	0	0	0	110.7	I520 T521 A527 R528 Y543 Y553 E555 R559 A1009 I1010 V1011	I520-Y524 WeakPolarHBondContact O-CB 3.5Å; I520-Y524 PolarHBondContact O-N 3.31Å; T521-Y524 PolarHBondContact O-N 2.9Å; Y524-A527 WeakPolarHBondContact O-CB 3.43Å; Y524-A527 PolarHBondContact O-N 3.09Å; Y524-R528 HydrophobicContact CD1-CG 4.38Å; Y524-R528 HydrophobicContact CE1-CG 3.88Å; Y524-R528 HydrophobicContact CE2-CG 4.18Å; Y524-R528 WeakPolarHBondContact O-CG 3.47Å; Y524-R528 PolarHBondContact O-N 3.28Å; Y524-R528 WeakPolarHBondContact OH-CD 3.38Å; Y524-Y543 HydrophobicContact CD2-CD1 4.11Å; Y524-Y543 AromaticContact CD2-CE1 3.65Å; Y524-Y543 HydrophobicContact CD2-CE1 3.65Å; Y524-Y543 HydrophobicContact CE2-CD1 4.45Å; Y524-Y543 AromaticContact CE2-CE1 3.75Å; Y524-Y543 HydrophobicContact CE2-CE1 3.75Å; Y524-Y553 AromaticContact CD2-CE1 3.72Å; Y524-Y553 HydrophobicContact CD2-CE1 3.72Å; Y524-Y553 HydrophobicContact CE2-CE1 4.2Å; Y524-Y553 HydrophobicContact CG-CE1 4.02Å; Y524-E555 HydrophobicContact CE2-CB 3.86Å; Y524-R559 HydrophobicContact CE2-CG 4.02Å; Y524-A1009 HydrophobicContact CD1-CB 4.45Å; Y524-I1010 WeakPolarHBondContact CE1-O 3.41Å; Y524-I1010 PolarHBondContact OH-O 3.35Å; Y524-V1011 HydrophobicContact CE1-CG2 4.35Å
525	N	92.8	Very high	90.2	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.5	-40.2	176.1	-71.1	-11.7	0	0	0	113	N465 F484 T521 V522 R523 A527 R528 L529 K1008 A1009 I1010	N465-N525 PolarHBondContact OD1-ND2 2.95Å; F484-N525 HydrophobicContact CD1-CB 4.04Å; F484-N525 HydrophobicContact CE1-CB 3.44Å; F484-N525 VanDerWaalsContact CE1-CB 3.44Å; F484-N525 HydrophobicContact CE2-CB 4.15Å; F484-N525 HydrophobicContact CZ-CB 3.53Å; T521-N525 WeakPolarHBondContact O-CB 3.4Å; T521-N525 PolarHBondContact O-N 2.92Å; T521-N525 PolarHBondContact O-ND2 3.46Å; V522-N525 WeakPolarHBondContact O-CB 3.48Å; V522-N525 PolarHBondContact O-N 3.42Å; R523-N525 VanDerWaalsContact C-N 3.32Å; N525-A527 VanDerWaalsContact C-N 3.33Å; N525-A527 PolarHBondContact O-N 3.5Å; N525-R528 PolarHBondContact O-N 2.84Å; N525-L529 PolarHBondContact O-N 3.16Å; N525-K1008 PolarHBondContact ND2-O 3.45Å; N525-A1009 WeakPolarHBondContact OD1-CA 3.45Å; N525-I1010 HydrophobicContact CB-CD1 4.04Å; N525-I1010 HydrophobicContact CB-CG1 4.36Å; N525-I1010 PolarHBondContact OD1-N 2.95Å
526	Q	93.3	Very high	90.6	Very high	27 Å²	27	29.5 Å²	29.5	13%	0.126	17%	0.168	C	C	.	.	H	α-helix	trans	-59.5	-42.4	171	-72.8	170.4	-5.8	0	0	111.6	F484 Y488 V522 R523 L529 H530	F484-Q526 HydrophobicContact CB-CG 3.8Å; F484-Q526 HydrophobicContact CG-CG 4.33Å; F484-Q526 PolarHBondContact O-NE2 3.37Å; F484-Q526 VanDerWaalsContact O-NE2 3.09Å; Y488-Q526 VanDerWaalsContact CB-NE2 3.32Å; V522-Q526 WeakPolarHBondContact O-CG 3.29Å; V522-Q526 PolarHBondContact O-N 2.91Å; R523-Q526 PolarHBondContact O-N 2.79Å; Q526-L529 WeakPolarHBondContact O-CB 3.42Å; Q526-L529 PolarHBondContact O-N 3.02Å; Q526-H530 PolarHBondContact O-CD2 2.86Å; Q526-H530 PolarHBondContact O-N 3.42Å
527	A	93.9	Very high	91.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-40.1	176.6	0	0	0	0	0	112.3	R523 Y524 N525 L529 H530 E531 A539 I542 Y543	R523-A527 PolarHBondContact O-N 3.33Å; Y524-A527 WeakPolarHBondContact O-CB 3.43Å; Y524-A527 PolarHBondContact O-N 3.09Å; N525-A527 VanDerWaalsContact C-N 3.33Å; N525-A527 PolarHBondContact O-N 3.5Å; A527-L529 VanDerWaalsContact C-N 3.32Å; A527-L529 PolarHBondContact O-N 3.31Å; A527-H530 PolarHBondContact O-N 3.24Å; A527-E531 WeakPolarHBondContact O-CB 3.3Å; A527-E531 PolarHBondContact O-N 3.47Å; A527-A539 HydrophobicContact CB-CB 4.43Å; A527-A539 VanDerWaalsContact O-CB 3.32Å; A527-A539 WeakPolarHBondContact O-CB 3.34Å; A527-I542 HydrophobicContact CB-CB 3.89Å; A527-I542 HydrophobicContact CB-CD1 4.36Å; A527-I542 HydrophobicContact CB-CG2 3.83Å; A527-Y543 HydrophobicContact CB-CD1 3.68Å; A527-Y543 HydrophobicContact CB-CD2 4.49Å; A527-Y543 HydrophobicContact CB-CE1 3.28Å; A527-Y543 HydrophobicContact CB-CE2 4.16Å; A527-Y543 HydrophobicContact CB-CG 4.27Å
528	R	93.3	Very high	91.6	Very high	18 Å²	18	33.5 Å²	33.5	7%	0.068	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-38	171.9	-69	-72	-65.5	111.8	6.5	112.2	Y524 N525 E531 A532 Y543 I1010	Y524-R528 HydrophobicContact CD1-CG 4.38Å; Y524-R528 HydrophobicContact CE1-CG 3.88Å; Y524-R528 HydrophobicContact CE2-CG 4.18Å; Y524-R528 WeakPolarHBondContact O-CG 3.47Å; Y524-R528 PolarHBondContact O-N 3.28Å; Y524-R528 WeakPolarHBondContact OH-CD 3.38Å; N525-R528 PolarHBondContact O-N 2.84Å; R528-E531 IonicContact CZ-OE2 2.69Å; R528-E531 IonicContact NH1-OE2 3.96Å; R528-E531 PolarHBondContact NH1-OE2 3.17Å; R528-A532 PolarHBondContact O-N 3.48Å; R528-Y543 WeakPolarHBondContact CA-OH 3.29Å; R528-Y543 WeakPolarHBondContact CD-OH 3.26Å; R528-Y543 PolarHBondContact N-OH 3.36Å; R528-I1010 HydrophobicContact CB-CB 4.25Å; R528-I1010 HydrophobicContact CB-CD1 4.35Å; R528-I1010 HydrophobicContact CB-CG2 4.3Å; R528-I1010 HydrophobicContact CG-CB 4.25Å; R528-I1010 HydrophobicContact CG-CG2 4.48Å; R528-I1010 PolarHBondContact NE-O 3Å
529	L	93.1	Very high	92	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-66.3	-46.5	172.8	178.6	66.8	0	0	0	112.3	F472 Y477 S481 F484 N525 Q526 A527 E531 A532 Q533	F472-L529 HydrophobicContact CD2-CB 4.34Å; F472-L529 HydrophobicContact CD2-CD1 4Å; Y477-L529 HydrophobicContact CD1-CD1 3.64Å; Y477-L529 HydrophobicContact CG-CD1 4.07Å; S481-L529 VanDerWaalsContact CA-CD2 3.41Å; F484-L529 HydrophobicContact CD2-CD2 4.05Å; N525-L529 PolarHBondContact O-N 3.16Å; Q526-L529 WeakPolarHBondContact O-CB 3.42Å; Q526-L529 PolarHBondContact O-N 3.02Å; A527-L529 VanDerWaalsContact C-N 3.32Å; A527-L529 PolarHBondContact O-N 3.31Å; L529-E531 VanDerWaalsContact C-N 3.29Å; L529-E531 PolarHBondContact O-N 3Å; L529-A532 PolarHBondContact O-N 3.39Å; L529-Q533 HydrophobicContact CD1-CG 4.35Å; L529-Q533 WeakPolarHBondContact O-CB 3.34Å; L529-Q533 VanDerWaalsContact O-CG 3.3Å; L529-Q533 WeakPolarHBondContact O-CG 3.37Å; L529-Q533 PolarHBondContact O-N 2.85Å
530	H	93.7	Very high	92.2	Very high	31 Å²	31	34.5 Å²	34.5	14%	0.144	19%	0.187	C	C	.	.	H	α-helix	trans	-58.7	-41.4	175	-79.5	-67.9	0	0	0	111.8	Q526 A527 Q533 G534 R535 A539	Q526-H530 PolarHBondContact O-CD2 2.86Å; Q526-H530 PolarHBondContact O-N 3.42Å; A527-H530 PolarHBondContact O-N 3.24Å; H530-Q533 CarbonylContact O-C 3.26Å; H530-Q533 PolarHBondContact O-N 2.97Å; H530-G534 PolarHBondContact O-N 3.11Å; H530-R535 HydrophobicContact CB-CB 4.28Å; H530-R535 VanDerWaalsContact CE1-CZ 3.49Å; H530-R535 PolarHBondContact CE1-NH2 2.92Å; H530-R535 PolarHBondContact ND1-NE 2.86Å; H530-R535 PolarHBondContact ND1-NH2 3.32Å; H530-R535 WeakPolarHBondContact O-CA 3.28Å; H530-R535 WeakPolarHBondContact O-CB 3.4Å; H530-R535 PolarHBondContact O-N 3.48Å; H530-A539 HydrophobicContact CB-CB 4.05Å
531	E	91.9	Very high	92.5	Very high	30 Å²	30	39.5 Å²	39.5	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-48.7	175.1	-170.4	-176.9	-176.8	0	0	111.6	A527 R528 L529 Q533 G534 A539 Y543 R559 I563	A527-E531 WeakPolarHBondContact O-CB 3.3Å; A527-E531 PolarHBondContact O-N 3.47Å; R528-E531 IonicContact CZ-OE2 2.69Å; R528-E531 IonicContact NH1-OE2 3.96Å; R528-E531 PolarHBondContact NH1-OE2 3.17Å; L529-E531 VanDerWaalsContact C-N 3.29Å; L529-E531 PolarHBondContact O-N 3Å; E531-Q533 VanDerWaalsContact C-N 3.29Å; E531-Q533 PolarHBondContact O-N 3.31Å; E531-G534 PolarHBondContact O-N 3Å; E531-A539 HydrophobicContact CB-CB 4.09Å; E531-Y543 PolarHBondContact OE2-OH 3.21Å; E531-R559 VanDerWaalsContact CD-NH2 3.33Å; E531-R559 IonicContact OE1-CZ 3.96Å; E531-R559 IonicContact OE1-NE 3.94Å; E531-R559 PolarHBondContact OE1-NE 2.81Å; E531-R559 IonicContact OE1-NH2 3.55Å; E531-R559 PolarHBondContact OE1-NH2 2.6Å; E531-R559 IonicContact OE2-CZ 2.72Å; E531-R559 IonicContact OE2-NE 3.8Å; E531-R559 PolarHBondContact OE2-NE 3.23Å; E531-R559 IonicContact OE2-NH2 3.77Å; E531-R559 PolarHBondContact OE2-NH2 3Å; E531-I563 HydrophobicContact CG-CD1 4.32Å; E531-I563 HydrophobicContact CG-CG1 4.25Å
532	A	89.4	Confident	92.7	Very high	40 Å²	40	39.4 Å²	39.4	33%	0.331	21%	0.208	S	C	.	.	H	α-helix	trans	-64.8	-29.8	177.4	0	0	0	0	0	113.6	F472 Y477 R528 L529 G534	F472-A532 HydrophobicContact CE2-CB 3.63Å; F472-A532 HydrophobicContact CZ-CB 4.07Å; Y477-A532 HydrophobicContact CE1-CB 3.89Å; R528-A532 PolarHBondContact O-N 3.48Å; L529-A532 PolarHBondContact O-N 3.39Å; A532-G534 PolarHBondContact O-N 3.5Å
533	Q	90.2	Very high	92.8	Very high	53 Å²	53	39.4 Å²	39.4	25%	0.248	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	4.8	172.5	-68.3	170.2	-19.2	0	0	113.4	Y477 L529 H530 E531 R535	Y477-Q533 HydrophobicContact CG-CG 4.44Å; L529-Q533 HydrophobicContact CD1-CG 4.35Å; L529-Q533 WeakPolarHBondContact O-CB 3.34Å; L529-Q533 VanDerWaalsContact O-CG 3.3Å; L529-Q533 WeakPolarHBondContact O-CG 3.37Å; L529-Q533 PolarHBondContact O-N 2.85Å; H530-Q533 CarbonylContact O-C 3.26Å; H530-Q533 PolarHBondContact O-N 2.97Å; E531-Q533 VanDerWaalsContact C-N 3.29Å; E531-Q533 PolarHBondContact O-N 3.31Å; Q533-R535 HydrophobicContact CB-CG 4.3Å; Q533-R535 PolarHBondContact O-N 3.07Å; Q533-R535 VanDerWaalsContact OE1-CZ 3.31Å; Q533-R535 VanDerWaalsContact OE1-NE 3.12Å
534	G	87.9	Confident	92.9	Very high	61 Å²	61	40 Å²	40	63%	0.629	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	74	4.8	-178.4	0	0	0	0	0	114.8	H530 E531 A532 S536	H530-G534 PolarHBondContact O-N 3.11Å; E531-G534 PolarHBondContact O-N 3Å; A532-G534 PolarHBondContact O-N 3.5Å; G534-S536 PolarHBondContact O-N 3.42Å
535	R	91.9	Very high	92.9	Very high	108 Å²	108	41.8 Å²	41.8	41%	0.408	23%	0.225	S	C	.	.			trans	-83.5	53.2	179.4	-56.9	-164.8	-78.6	171.5	-6.5	110.7	H530 Q533 D537 L538 A539	H530-R535 HydrophobicContact CB-CB 4.28Å; H530-R535 VanDerWaalsContact CE1-CZ 3.49Å; H530-R535 PolarHBondContact CE1-NH2 2.92Å; H530-R535 PolarHBondContact ND1-NE 2.86Å; H530-R535 PolarHBondContact ND1-NH2 3.32Å; H530-R535 WeakPolarHBondContact O-CA 3.28Å; H530-R535 WeakPolarHBondContact O-CB 3.4Å; H530-R535 PolarHBondContact O-N 3.48Å; Q533-R535 HydrophobicContact CB-CG 4.3Å; Q533-R535 PolarHBondContact O-N 3.07Å; Q533-R535 VanDerWaalsContact OE1-CZ 3.31Å; Q533-R535 VanDerWaalsContact OE1-NE 3.12Å; R535-D537 PolarHBondContact O-N 2.89Å; R535-D537 VanDerWaalsContact O-N 3.12Å; R535-L538 HydrophobicContact CB-CD1 4.33Å; R535-L538 PolarHBondContact O-N 3.21Å; R535-A539 PolarHBondContact O-N 3.31Å
536	S	91.1	Very high	92.8	Very high	31 Å²	31	42.1 Å²	42.1	22%	0.217	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-28.5	-167.3	69.4	0	0	0	0	114.4	G534 A539 E540	G534-S536 PolarHBondContact O-N 3.42Å; S536-A539 PolarHBondContact O-N 3.38Å; S536-E540 WeakPolarHBondContact O-CB 3.39Å; S536-E540 PolarHBondContact O-N 3.11Å
537	D	93.9	Very high	92.8	Very high	99 Å²	99	41.7 Å²	41.7	53%	0.529	23%	0.225	S	C	.	.	H	α-helix	trans	-72.5	-39.9	-177.4	-43.8	-38.9	0	0	0	111.1	R535 E540 E541 R567	R535-D537 PolarHBondContact O-N 2.89Å; R535-D537 VanDerWaalsContact O-N 3.12Å; D537-E540 PolarHBondContact O-N 3.25Å; D537-E541 WeakPolarHBondContact O-CG 3.47Å; D537-E541 PolarHBondContact O-N 3.26Å; D537-R567 IonicContact OD1-CZ 3.5Å; D537-R567 IonicContact OD1-NH2 2.67Å; D537-R567 PolarHBondContact OD1-NH2 3.48Å
538	L	93.3	Very high	92.7	Very high	70 Å²	70	49 Å²	49	37%	0.366	26%	0.263	S	S	.	.	H	α-helix	trans	-67.3	-37.4	172.8	-64.4	177.2	0	0	0	111.6	R535 E541 I542	R535-L538 HydrophobicContact CB-CD1 4.33Å; R535-L538 PolarHBondContact O-N 3.21Å; L538-E541 PolarHBondContact O-N 3.21Å; L538-I542 WeakPolarHBondContact O-CD1 3.3Å; L538-I542 VanDerWaalsContact O-CG1 3.27Å; L538-I542 WeakPolarHBondContact O-CG1 3.35Å; L538-I542 PolarHBondContact O-N 3.09Å
539	A	93.9	Very high	92.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-44.6	174.1	0	0	0	0	0	111.1	A527 H530 E531 R535 S536 I542 Y543 I563	A527-A539 HydrophobicContact CB-CB 4.43Å; A527-A539 VanDerWaalsContact O-CB 3.32Å; A527-A539 WeakPolarHBondContact O-CB 3.34Å; H530-A539 HydrophobicContact CB-CB 4.05Å; E531-A539 HydrophobicContact CB-CB 4.09Å; R535-A539 PolarHBondContact O-N 3.31Å; S536-A539 PolarHBondContact O-N 3.38Å; A539-I542 PolarHBondContact O-N 3.01Å; A539-Y543 HydrophobicContact CB-CD2 4.43Å; A539-Y543 HydrophobicContact CB-CE2 3.97Å; A539-Y543 WeakPolarHBondContact O-CD2 3.21Å; A539-Y543 VanDerWaalsContact O-CG 3.27Å; A539-Y543 PolarHBondContact O-N 3.25Å; A539-I563 HydrophobicContact CB-CD1 4.09Å
540	E	94.6	Very high	92.1	Very high	39 Å²	39	57.9 Å²	57.9	18%	0.182	30%	0.299	C	S	.	.	H	α-helix	trans	-61.4	-43	175.2	171.8	173.1	-163.6	0	0	113	S536 D537 K544 L560 R567	S536-E540 WeakPolarHBondContact O-CB 3.39Å; S536-E540 PolarHBondContact O-N 3.11Å; D537-E540 PolarHBondContact O-N 3.25Å; E540-K544 HydrophobicContact CG-CD 3.95Å; E540-K544 WeakPolarHBondContact O-CB 3.46Å; E540-K544 VanDerWaalsContact O-CG 3.3Å; E540-K544 WeakPolarHBondContact O-CG 3.4Å; E540-K544 PolarHBondContact O-N 3.1Å; E540-K544 WeakPolarHBondContact OE1-CE 3.5Å; E540-K544 IonicContact OE1-NZ 2.61Å; E540-K544 PolarHBondContact OE1-NZ 3.45Å; E540-L560 HydrophobicContact CB-CD2 4.06Å; E540-L560 HydrophobicContact CG-CD2 3.76Å; E540-R567 IonicContact OE1-NH1 2.7Å; E540-R567 IonicContact OE2-CZ 2.73Å; E540-R567 IonicContact OE2-NH1 2.77Å; E540-R567 PolarHBondContact OE2-NH1 3.08Å; E540-R567 IonicContact OE2-NH2 2.64Å; E540-R567 PolarHBondContact OE2-NH2 3.12Å
541	E	95.1	Very high	92	Very high	129 Å²	129	60.2 Å²	60.2	60%	0.603	32%	0.316	S	S	*	.	H	α-helix	trans	-59.4	-45.6	173.5	-75.8	179.7	176.2	0	0	111.7	D537 L538 K544 S545	D537-E541 WeakPolarHBondContact O-CG 3.47Å; D537-E541 PolarHBondContact O-N 3.26Å; L538-E541 PolarHBondContact O-N 3.21Å; E541-K544 PolarHBondContact O-N 3.24Å; E541-S545 WeakPolarHBondContact O-CB 3.38Å; E541-S545 PolarHBondContact O-N 3.18Å
542	I	94	Very high	91.9	Very high	21 Å²	21	62.9 Å²	62.9	11%	0.108	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-47.9	179.7	-62.8	160.9	0	0	0	111	R523 A527 L538 A539 K544 S545 I546	R523-I542 HydrophobicContact CB-CG2 4.15Å; R523-I542 WeakPolarHBondContact O-CG2 3.39Å; A527-I542 HydrophobicContact CB-CB 3.89Å; A527-I542 HydrophobicContact CB-CD1 4.36Å; A527-I542 HydrophobicContact CB-CG2 3.83Å; L538-I542 WeakPolarHBondContact O-CD1 3.3Å; L538-I542 VanDerWaalsContact O-CG1 3.27Å; L538-I542 WeakPolarHBondContact O-CG1 3.35Å; L538-I542 PolarHBondContact O-N 3.09Å; A539-I542 PolarHBondContact O-N 3.01Å; I542-K544 VanDerWaalsContact C-N 3.31Å; I542-K544 PolarHBondContact O-N 2.78Å; I542-S545 WeakPolarHBondContact O-CA 3.26Å; I542-S545 WeakPolarHBondContact O-CB 3.45Å; I542-S545 PolarHBondContact O-N 3.37Å; I542-S545 PolarHBondContact O-OG 3.34Å; I542-I546 HydrophobicContact CG2-CD1 4.15Å; I542-I546 WeakPolarHBondContact O-CG1 3.4Å; I542-I546 PolarHBondContact O-N 3.36Å
543	Y	95.2	Very high	91.9	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.5	-42.1	177.6	-65.4	-44.7	0	0	0	111.7	Y524 A527 R528 E531 A539 I546 L547 C556 R559 L560 I563	Y524-Y543 HydrophobicContact CD2-CD1 4.11Å; Y524-Y543 AromaticContact CD2-CE1 3.65Å; Y524-Y543 HydrophobicContact CD2-CE1 3.65Å; Y524-Y543 HydrophobicContact CE2-CD1 4.45Å; Y524-Y543 AromaticContact CE2-CE1 3.75Å; Y524-Y543 HydrophobicContact CE2-CE1 3.75Å; A527-Y543 HydrophobicContact CB-CD1 3.68Å; A527-Y543 HydrophobicContact CB-CD2 4.49Å; A527-Y543 HydrophobicContact CB-CE1 3.28Å; A527-Y543 HydrophobicContact CB-CE2 4.16Å; A527-Y543 HydrophobicContact CB-CG 4.27Å; R528-Y543 WeakPolarHBondContact CA-OH 3.29Å; R528-Y543 WeakPolarHBondContact CD-OH 3.26Å; R528-Y543 PolarHBondContact N-OH 3.36Å; E531-Y543 PolarHBondContact OE2-OH 3.21Å; A539-Y543 HydrophobicContact CB-CD2 4.43Å; A539-Y543 HydrophobicContact CB-CE2 3.97Å; A539-Y543 WeakPolarHBondContact O-CD2 3.21Å; A539-Y543 VanDerWaalsContact O-CG 3.27Å; A539-Y543 PolarHBondContact O-N 3.25Å; Y543-I546 PolarHBondContact O-N 2.86Å; Y543-L547 WeakPolarHBondContact O-CG 3.43Å; Y543-L547 PolarHBondContact O-N 2.66Å; Y543-C556 HydrophobicContact CD1-CB 4.4Å; Y543-C556 VanDerWaalsContact CD1-SG 3.59Å; Y543-R559 HydrophobicContact CD2-CB 4.01Å; Y543-R559 HydrophobicContact CE1-CB 4.07Å; Y543-R559 HydrophobicContact CE1-CG 4.09Å; Y543-R559 HydrophobicContact CE2-CB 3.44Å; Y543-R559 VanDerWaalsContact CE2-CB 3.44Å; Y543-R559 HydrophobicContact CE2-CG 4.2Å; Y543-R559 VanDerWaalsContact CZ-CB 3.49Å; Y543-L560 HydrophobicContact CD2-CD2 4.27Å; Y543-L560 HydrophobicContact CD2-CG 4.36Å; Y543-I563 HydrophobicContact CD2-CD1 4.13Å; Y543-I563 HydrophobicContact CE2-CD1 3.8Å
544	K	94.6	Very high	91.9	Very high	80 Å²	80	62.7 Å²	62.7	35%	0.348	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-37.8	173.7	-73.7	172.2	175.1	175.1	0	112.2	E540 E541 I542 I546 L547 L548 L560	E540-K544 HydrophobicContact CG-CD 3.95Å; E540-K544 WeakPolarHBondContact O-CB 3.46Å; E540-K544 VanDerWaalsContact O-CG 3.3Å; E540-K544 WeakPolarHBondContact O-CG 3.4Å; E540-K544 PolarHBondContact O-N 3.1Å; E540-K544 WeakPolarHBondContact OE1-CE 3.5Å; E540-K544 IonicContact OE1-NZ 2.61Å; E540-K544 PolarHBondContact OE1-NZ 3.45Å; E541-K544 PolarHBondContact O-N 3.24Å; I542-K544 VanDerWaalsContact C-N 3.31Å; I542-K544 PolarHBondContact O-N 2.78Å; K544-I546 VanDerWaalsContact C-N 3.28Å; K544-I546 PolarHBondContact O-N 3.44Å; K544-L547 PolarHBondContact O-N 3.39Å; K544-L548 WeakPolarHBondContact O-CB 3.47Å; K544-L548 VanDerWaalsContact O-CG 3.31Å; K544-L548 WeakPolarHBondContact O-CG 3.12Å; K544-L548 PolarHBondContact O-N 2.96Å; K544-L560 HydrophobicContact CG-CD1 4.2Å; K544-L560 HydrophobicContact CG-CD2 4.44Å
545	S	93.4	Very high	92.1	Very high	37 Å²	37	61.6 Å²	61.6	26%	0.259	31%	0.308	S	S	.	.	H	α-helix	trans	-65	-30.2	175.6	82.2	0	0	0	0	113.3	E541 I542	E541-S545 WeakPolarHBondContact O-CB 3.38Å; E541-S545 PolarHBondContact O-N 3.18Å; I542-S545 WeakPolarHBondContact O-CA 3.26Å; I542-S545 WeakPolarHBondContact O-CB 3.45Å; I542-S545 PolarHBondContact O-N 3.37Å; I542-S545 PolarHBondContact O-OG 3.34Å
546	I	92.2	Very high	92.2	Very high	7 Å²	7	56.4 Å²	56.4	4%	0.036	29%	0.289	C	S	.	.	H	α-helix	trans	-72.1	-51.2	172.2	-66.9	167.2	0	0	0	109.7	I520 R523 I542 Y543 K544 L548 R549 H550 Y553	I520-I546 HydrophobicContact CG2-CG2 3.89Å; R523-I546 HydrophobicContact CB-CD1 4.25Å; I542-I546 HydrophobicContact CG2-CD1 4.15Å; I542-I546 WeakPolarHBondContact O-CG1 3.4Å; I542-I546 PolarHBondContact O-N 3.36Å; Y543-I546 PolarHBondContact O-N 2.86Å; K544-I546 VanDerWaalsContact C-N 3.28Å; K544-I546 PolarHBondContact O-N 3.44Å; I546-L548 VanDerWaalsContact C-N 3.29Å; I546-L548 PolarHBondContact O-N 3.44Å; I546-R549 PolarHBondContact O-N 2.7Å; I546-H550 PolarHBondContact O-N 2.72Å; I546-Y553 HydrophobicContact CG2-CD1 4.34Å; I546-Y553 HydrophobicContact CG2-CG 4.37Å
547	L	92.1	Very high	92.3	Very high	17 Å²	17	56.4 Å²	56.4	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-31.3	-179.1	-70.3	179	0	0	0	113.9	Y543 K544 R549 H550 P551 C556 Y557 L560	Y543-L547 WeakPolarHBondContact O-CG 3.43Å; Y543-L547 PolarHBondContact O-N 2.66Å; K544-L547 PolarHBondContact O-N 3.39Å; L547-R549 PolarHBondContact O-N 3.11Å; L547-H550 CarbonylContact O-C 3.26Å; L547-P551 WeakPolarHBondContact O-CG 3.46Å; L547-C556 HydrophobicContact CD1-CB 3.87Å; L547-C556 HydrophobicContact CD2-CB 3.67Å; L547-C556 HydrophobicContact CG-CB 3.59Å; L547-Y557 HydrophobicContact CD1-CD1 4.03Å; L547-Y557 HydrophobicContact CD1-CD2 4.13Å; L547-Y557 HydrophobicContact CD1-CE1 3.89Å; L547-Y557 HydrophobicContact CD1-CE2 4Å; L547-Y557 HydrophobicContact CD1-CG 4.14Å; L547-Y557 HydrophobicContact CD2-CD2 3.71Å; L547-Y557 HydrophobicContact CD2-CE2 3.28Å; L547-Y557 HydrophobicContact CG-CE2 4.26Å; L547-L560 HydrophobicContact CD1-CD1 3.71Å
548	L	91.6	Very high	92.3	Very high	154 Å²	154	52 Å²	52	81%	0.806	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.4	172.7	-78	170.8	0	0	0	113.8	K544 I546	K544-L548 WeakPolarHBondContact O-CB 3.47Å; K544-L548 VanDerWaalsContact O-CG 3.31Å; K544-L548 WeakPolarHBondContact O-CG 3.12Å; K544-L548 PolarHBondContact O-N 2.96Å; I546-L548 VanDerWaalsContact C-N 3.29Å; I546-L548 PolarHBondContact O-N 3.44Å
549	R	86.8	Confident	92.3	Very high	157 Å²	157	50.2 Å²	50.2	59%	0.592	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-37.3	176.1	-64.1	179.1	175.8	-160.2	-5.4	112	I546 L547	I546-R549 PolarHBondContact O-N 2.7Å; L547-R549 PolarHBondContact O-N 3.11Å
550	H	87.7	Confident	92.3	Very high	52 Å²	52	50.3 Å²	50.3	24%	0.241	25%	0.249	C	C	.	.			trans	-131.7	76.7	-172.7	-64.2	-75.3	0	0	0	111.3	H516 I520 I546 L547 S552 Y553	H516-H550 AromaticContact CD2-NE2 3.47Å; H516-H550 PolarHBondContact CD2-NE2 3.4Å; H516-H550 AromaticContact NE2-CE1 3.8Å; H516-H550 AromaticContact NE2-NE2 3Å; H516-H550 PolarHBondContact NE2-NE2 3.35Å; I520-H550 WeakPolarHBondContact CD1-CD2 3.3Å; I520-H550 VanDerWaalsContact CD1-NE2 3.31Å; I520-H550 WeakPolarHBondContact CD1-NE2 3.33Å; I546-H550 PolarHBondContact O-N 2.72Å; L547-H550 CarbonylContact O-C 3.26Å; H550-S552 PolarHBondContact O-N 3.34Å; H550-Y553 WeakPolarHBondContact O-CB 3.37Å; H550-Y553 PolarHBondContact O-N 3.04Å; H550-Y553 VanDerWaalsContact O-N 3.13Å
551	P	90.7	Very high	92.3	Very high	79 Å²	79	48.5 Å²	48.5	51%	0.513	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.4	-179.2	-21.8	33.4	0	0	0	114.9	L547 Y557	L547-P551 WeakPolarHBondContact O-CG 3.46Å; P551-Y557 WeakPolarHBondContact O-CE2 3.02Å
552	S	89.5	Confident	92.1	Very high	86 Å²	86	42.6 Å²	42.6	60%	0.601	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-2.4	175.9	53	0	0	0	0	114.1	H550 I554	H550-S552 PolarHBondContact O-N 3.34Å; S552-I554 PolarHBondContact O-N 3.4Å
553	Y	89.5	Confident	92.1	Very high	54 Å²	54	42 Å²	42	21%	0.212	21%	0.21	C	C	.	.			trans	-83.3	80.2	-174.5	-160.7	-89.8	0	0	0	111.9	I520 Y524 I546 H550 E555 C556	I520-Y553 HydrophobicContact CG2-CD2 4.25Å; I520-Y553 HydrophobicContact CG2-CE2 4.07Å; Y524-Y553 AromaticContact CD2-CE1 3.72Å; Y524-Y553 HydrophobicContact CD2-CE1 3.72Å; Y524-Y553 HydrophobicContact CE2-CE1 4.2Å; Y524-Y553 HydrophobicContact CG-CE1 4.02Å; I546-Y553 HydrophobicContact CG2-CD1 4.34Å; I546-Y553 HydrophobicContact CG2-CG 4.37Å; H550-Y553 WeakPolarHBondContact O-CB 3.37Å; H550-Y553 PolarHBondContact O-N 3.04Å; H550-Y553 VanDerWaalsContact O-N 3.13Å; Y553-E555 VanDerWaalsContact C-N 3.27Å; Y553-E555 HydrophobicContact CD1-CB 4.12Å; Y553-E555 HydrophobicContact CE1-CB 3.74Å; Y553-E555 HydrophobicContact CE1-CG 4.47Å; Y553-E555 PolarHBondContact O-N 3.38Å; Y553-E555 VanDerWaalsContact O-N 3.14Å; Y553-C556 HydrophobicContact CD1-CB 4.13Å; Y553-C556 VanDerWaalsContact CD1-SG 3.52Å; Y553-C556 PolarHBondContact O-N 3.09Å; Y553-C556 VanDerWaalsContact O-N 3.08Å
554	I	91.6	Very high	92	Very high	35 Å²	35	42.1 Å²	42.1	18%	0.179	21%	0.212	C	C	.	.	H	α-helix	trans	-49	-43.4	-171.1	-58.8	163	0	0	0	112.8	S552 C556 Y557 L558 A580 V583 D584	S552-I554 PolarHBondContact O-N 3.4Å; I554-C556 PolarHBondContact O-N 3.37Å; I554-C556 VanDerWaalsContact O-N 3.13Å; I554-Y557 WeakPolarHBondContact O-CB 3.47Å; I554-Y557 PolarHBondContact O-N 3.13Å; I554-L558 HydrophobicContact CG2-CD1 4.19Å; I554-L558 HydrophobicContact CG2-CG 4.14Å; I554-L558 PolarHBondContact O-N 3.28Å; I554-L558 VanDerWaalsContact O-N 3.14Å; I554-A580 HydrophobicContact CG2-CB 4.14Å; I554-V583 HydrophobicContact CD1-CG1 4.13Å; I554-V583 HydrophobicContact CG1-CB 4.14Å; I554-V583 HydrophobicContact CG1-CG1 3.62Å; I554-D584 HydrophobicContact CD1-CB 3.68Å
555	E	91.1	Very high	91.8	Very high	38 Å²	38	42 Å²	42	18%	0.178	21%	0.209	C	C	.	.	H	α-helix	trans	-53.2	-36.1	-178.9	-68.6	-56.2	133.7	0	0	113.8	Y524 Y553 Y557 L558 R559 V1011	Y524-E555 HydrophobicContact CE2-CB 3.86Å; Y553-E555 VanDerWaalsContact C-N 3.27Å; Y553-E555 HydrophobicContact CD1-CB 4.12Å; Y553-E555 HydrophobicContact CE1-CB 3.74Å; Y553-E555 HydrophobicContact CE1-CG 4.47Å; Y553-E555 PolarHBondContact O-N 3.38Å; Y553-E555 VanDerWaalsContact O-N 3.14Å; E555-Y557 VanDerWaalsContact C-N 3.35Å; E555-Y557 PolarHBondContact O-N 2.88Å; E555-L558 PolarHBondContact O-N 2.99Å; E555-R559 WeakPolarHBondContact O-CG 3.39Å; E555-R559 PolarHBondContact O-N 3.34Å; E555-V1011 HydrophobicContact CG-CG2 4.17Å
556	C	93.3	Very high	91.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.3	-38.2	177.4	-78.8	0	0	0	0	111.8	Y543 L547 Y553 I554 L560	Y543-C556 HydrophobicContact CD1-CB 4.4Å; Y543-C556 VanDerWaalsContact CD1-SG 3.59Å; L547-C556 HydrophobicContact CD1-CB 3.87Å; L547-C556 HydrophobicContact CD2-CB 3.67Å; L547-C556 HydrophobicContact CG-CB 3.59Å; Y553-C556 HydrophobicContact CD1-CB 4.13Å; Y553-C556 VanDerWaalsContact CD1-SG 3.52Å; Y553-C556 PolarHBondContact O-N 3.09Å; Y553-C556 VanDerWaalsContact O-N 3.08Å; I554-C556 PolarHBondContact O-N 3.37Å; I554-C556 VanDerWaalsContact O-N 3.13Å; C556-L560 WeakPolarHBondContact O-CB 3.46Å; C556-L560 WeakPolarHBondContact O-CG 3.32Å; C556-L560 PolarHBondContact O-N 3.19Å
557	Y	94.4	Very high	91.5	Very high	31 Å²	31	49.2 Å²	49.2	12%	0.122	24%	0.238	C	C	.	.	H	α-helix	trans	-65.4	-39.6	172.8	-65.9	-85	0	0	0	111.6	L547 P551 I554 E555 L560 G561 W576 E579 V583	L547-Y557 HydrophobicContact CD1-CD1 4.03Å; L547-Y557 HydrophobicContact CD1-CD2 4.13Å; L547-Y557 HydrophobicContact CD1-CE1 3.89Å; L547-Y557 HydrophobicContact CD1-CE2 4Å; L547-Y557 HydrophobicContact CD1-CG 4.14Å; L547-Y557 HydrophobicContact CD2-CD2 3.71Å; L547-Y557 HydrophobicContact CD2-CE2 3.28Å; L547-Y557 HydrophobicContact CG-CE2 4.26Å; P551-Y557 WeakPolarHBondContact O-CE2 3.02Å; I554-Y557 WeakPolarHBondContact O-CB 3.47Å; I554-Y557 PolarHBondContact O-N 3.13Å; E555-Y557 VanDerWaalsContact C-N 3.35Å; E555-Y557 PolarHBondContact O-N 2.88Å; Y557-L560 PolarHBondContact O-N 2.92Å; Y557-G561 PolarHBondContact O-N 2.78Å; Y557-W576 HydrophobicContact CD1-CE3 4.09Å; Y557-E579 HydrophobicContact CD1-CB 3.63Å; Y557-E579 HydrophobicContact CE1-CB 3.73Å; Y557-E579 WeakPolarHBondContact CE1-OE2 3.41Å; Y557-V583 HydrophobicContact CE2-CG2 4.29Å
558	L	93.6	Very high	91.3	Very high	6 Å²	6	50.9 Å²	50.9	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-44	177.9	-57.8	-174.2	0	0	0	111.9	I554 E555 G561 C562 F577 A580 D589 A590 L593	I554-L558 HydrophobicContact CG2-CD1 4.19Å; I554-L558 HydrophobicContact CG2-CG 4.14Å; I554-L558 PolarHBondContact O-N 3.28Å; I554-L558 VanDerWaalsContact O-N 3.14Å; E555-L558 PolarHBondContact O-N 2.99Å; L558-G561 PolarHBondContact O-N 2.94Å; L558-C562 PolarHBondContact O-N 3.28Å; L558-C562 PolarHBondContact O-SG 2.93Å; L558-F577 HydrophobicContact CD2-CD1 4.31Å; L558-A580 HydrophobicContact CD2-CB 3.6Å; L558-A580 HydrophobicContact CG-CB 4.46Å; L558-D589 HydrophobicContact CD1-CB 3.91Å; L558-A590 HydrophobicContact CD2-CB 3.92Å; L558-L593 HydrophobicContact CB-CD1 4.18Å; L558-L593 HydrophobicContact CD2-CD1 4.12Å
559	R	93.6	Very high	91.3	Very high	32 Å²	32	47.4 Å²	47.4	12%	0.121	24%	0.239	C	C	.	.	H	α-helix	trans	-66.6	-41.2	175.1	-59.8	-43	-55.3	178.1	8.7	112.3	Y524 E531 Y543 E555 G561 C562 I563 S1012	Y524-R559 HydrophobicContact CE2-CG 4.02Å; E531-R559 VanDerWaalsContact CD-NH2 3.33Å; E531-R559 IonicContact OE1-CZ 3.96Å; E531-R559 IonicContact OE1-NE 3.94Å; E531-R559 PolarHBondContact OE1-NE 2.81Å; E531-R559 IonicContact OE1-NH2 3.55Å; E531-R559 PolarHBondContact OE1-NH2 2.6Å; E531-R559 IonicContact OE2-CZ 2.72Å; E531-R559 IonicContact OE2-NE 3.8Å; E531-R559 PolarHBondContact OE2-NE 3.23Å; E531-R559 IonicContact OE2-NH2 3.77Å; E531-R559 PolarHBondContact OE2-NH2 3Å; Y543-R559 HydrophobicContact CD2-CB 4.01Å; Y543-R559 HydrophobicContact CE1-CB 4.07Å; Y543-R559 HydrophobicContact CE1-CG 4.09Å; Y543-R559 HydrophobicContact CE2-CB 3.44Å; Y543-R559 VanDerWaalsContact CE2-CB 3.44Å; Y543-R559 HydrophobicContact CE2-CG 4.2Å; Y543-R559 VanDerWaalsContact CZ-CB 3.49Å; E555-R559 WeakPolarHBondContact O-CG 3.39Å; E555-R559 PolarHBondContact O-N 3.34Å; R559-G561 VanDerWaalsContact C-N 3.33Å; R559-G561 PolarHBondContact O-N 3.06Å; R559-C562 WeakPolarHBondContact O-CB 3.3Å; R559-C562 PolarHBondContact O-N 2.94Å; R559-I563 WeakPolarHBondContact O-CG1 3.37Å; R559-I563 PolarHBondContact O-N 3.41Å; R559-S1012 PolarHBondContact NH1-OG 3.42Å
560	L	94.5	Very high	91.4	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-41	173.9	-74.5	171.1	0	0	0	112.1	E540 Y543 K544 L547 C556 Y557 I563 A564 W576	E540-L560 HydrophobicContact CB-CD2 4.06Å; E540-L560 HydrophobicContact CG-CD2 3.76Å; Y543-L560 HydrophobicContact CD2-CD2 4.27Å; Y543-L560 HydrophobicContact CD2-CG 4.36Å; K544-L560 HydrophobicContact CG-CD1 4.2Å; K544-L560 HydrophobicContact CG-CD2 4.44Å; L547-L560 HydrophobicContact CD1-CD1 3.71Å; C556-L560 WeakPolarHBondContact O-CB 3.46Å; C556-L560 WeakPolarHBondContact O-CG 3.32Å; C556-L560 PolarHBondContact O-N 3.19Å; Y557-L560 PolarHBondContact O-N 2.92Å; L560-I563 PolarHBondContact O-N 3.24Å; L560-A564 WeakPolarHBondContact O-CB 3.46Å; L560-A564 PolarHBondContact O-N 3.05Å; L560-W576 HydrophobicContact CB-CD2 4.02Å; L560-W576 HydrophobicContact CB-CE3 4.48Å; L560-W576 HydrophobicContact CB-CG 4.11Å; L560-W576 HydrophobicContact CD1-CE3 4.32Å; L560-W576 HydrophobicContact CD1-CH2 4.3Å; L560-W576 HydrophobicContact CD1-CZ3 4.19Å
561	G	93.1	Very high	91.6	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-37.5	174	0	0	0	0	0	113.5	Y557 L558 R559 R565 A573 F577	Y557-G561 PolarHBondContact O-N 2.78Å; L558-G561 PolarHBondContact O-N 2.94Å; R559-G561 VanDerWaalsContact C-N 3.33Å; R559-G561 PolarHBondContact O-N 3.06Å; G561-R565 WeakPolarHBondContact O-CB 3.31Å; G561-R565 PolarHBondContact O-N 3.02Å; G561-A573 WeakPolarHBondContact O-CB 3.22Å; G561-F577 VanDerWaalsContact C-CE1 3.47Å; G561-F577 VanDerWaalsContact CA-CE1 3.45Å; G561-F577 WeakPolarHBondContact O-CZ 3.4Å
562	C	92.1	Very high	91.7	Very high	5 Å²	5	50.3 Å²	50.3	3%	0.034	25%	0.247	C	C	.	.	H	α-helix	trans	-65.3	-46.6	172	-75.9	0	0	0	0	112.4	L558 R559 A564 R565 D566	L558-C562 PolarHBondContact O-N 3.28Å; L558-C562 PolarHBondContact O-SG 2.93Å; R559-C562 WeakPolarHBondContact O-CB 3.3Å; R559-C562 PolarHBondContact O-N 2.94Å; C562-A564 VanDerWaalsContact C-N 3.33Å; C562-A564 PolarHBondContact O-N 3.42Å; C562-R565 WeakPolarHBondContact O-CB 3.45Å; C562-R565 PolarHBondContact O-N 3.33Å; C562-R565 VanDerWaalsContact O-N 3.16Å; C562-D566 WeakPolarHBondContact O-CB 3.28Å; C562-D566 VanDerWaalsContact O-CG 3.3Å; C562-D566 PolarHBondContact O-N 2.89Å
563	I	93	Very high	91.8	Very high	8 Å²	8	46.2 Å²	46.2	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-58.7	-45.2	175.7	-71.1	169.3	0	0	0	110.7	E531 A539 Y543 R559 L560 D566 R567	E531-I563 HydrophobicContact CG-CD1 4.32Å; E531-I563 HydrophobicContact CG-CG1 4.25Å; A539-I563 HydrophobicContact CB-CD1 4.09Å; Y543-I563 HydrophobicContact CD2-CD1 4.13Å; Y543-I563 HydrophobicContact CE2-CD1 3.8Å; R559-I563 WeakPolarHBondContact O-CG1 3.37Å; R559-I563 PolarHBondContact O-N 3.41Å; L560-I563 PolarHBondContact O-N 3.24Å; I563-D566 PolarHBondContact O-N 3.27Å; I563-R567 WeakPolarHBondContact O-CB 3.09Å; I563-R567 WeakPolarHBondContact O-CG 3.2Å; I563-R567 PolarHBondContact O-N 3.03Å
564	A	93.1	Very high	91.9	Very high	3 Å²	3	45 Å²	45	3%	0.025	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-43.3	175.2	0	0	0	0	0	112.1	L560 C562 D566 R567 G568 Q569 D572 A573	L560-A564 WeakPolarHBondContact O-CB 3.46Å; L560-A564 PolarHBondContact O-N 3.05Å; C562-A564 VanDerWaalsContact C-N 3.33Å; C562-A564 PolarHBondContact O-N 3.42Å; A564-D566 VanDerWaalsContact C-N 3.33Å; A564-D566 PolarHBondContact O-N 3.12Å; A564-R567 PolarHBondContact O-N 3.01Å; A564-G568 PolarHBondContact O-N 2.69Å; A564-Q569 HydrophobicContact CB-CB 4.26Å; A564-Q569 WeakPolarHBondContact O-CA 3.46Å; A564-Q569 VanDerWaalsContact O-CB 3.29Å; A564-Q569 WeakPolarHBondContact O-CB 3.34Å; A564-Q569 PolarHBondContact O-N 3.11Å; A564-D572 HydrophobicContact CB-CB 4.4Å; A564-A573 HydrophobicContact CB-CB 4.05Å
565	R	90.8	Very high	92.1	Very high	77 Å²	77	47.1 Å²	47.1	29%	0.291	23%	0.229	S	C	.	.	H	α-helix	trans	-58	-45.7	176.3	-178.8	-162.4	70.3	-157.5	-6	111.1	G561 C562 G568 A573 L597	G561-R565 WeakPolarHBondContact O-CB 3.31Å; G561-R565 PolarHBondContact O-N 3.02Å; C562-R565 WeakPolarHBondContact O-CB 3.45Å; C562-R565 PolarHBondContact O-N 3.33Å; C562-R565 VanDerWaalsContact O-N 3.16Å; R565-G568 WeakPolarHBondContact O-CA 3.38Å; R565-G568 PolarHBondContact O-N 3.14Å; R565-A573 HydrophobicContact CB-CB 3.99Å; R565-L597 HydrophobicContact CG-CD1 4.14Å
566	D	87.6	Confident	92.3	Very high	108 Å²	108	47.9 Å²	47.9	58%	0.578	23%	0.23	S	C	*	.	H	α-helix	trans	-79.4	-24.7	-172.4	-64.4	-14.4	0	0	0	112.4	C562 I563 A564 G568	C562-D566 WeakPolarHBondContact O-CB 3.28Å; C562-D566 VanDerWaalsContact O-CG 3.3Å; C562-D566 PolarHBondContact O-N 2.89Å; I563-D566 PolarHBondContact O-N 3.27Å; A564-D566 VanDerWaalsContact C-N 3.33Å; A564-D566 PolarHBondContact O-N 3.12Å; D566-G568 PolarHBondContact O-N 2.97Å
567	R	90.9	Very high	92.3	Very high	89 Å²	89	47.9 Å²	47.9	34%	0.336	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-1.6	161.3	-70	177.2	-178.9	156.2	-4.7	113.9	D537 E540 I563 A564 Q569	D537-R567 IonicContact OD1-CZ 3.5Å; D537-R567 IonicContact OD1-NH2 2.67Å; D537-R567 PolarHBondContact OD1-NH2 3.48Å; E540-R567 IonicContact OE1-NH1 2.7Å; E540-R567 IonicContact OE2-CZ 2.73Å; E540-R567 IonicContact OE2-NH1 2.77Å; E540-R567 PolarHBondContact OE2-NH1 3.08Å; E540-R567 IonicContact OE2-NH2 2.64Å; E540-R567 PolarHBondContact OE2-NH2 3.12Å; I563-R567 WeakPolarHBondContact O-CB 3.09Å; I563-R567 WeakPolarHBondContact O-CG 3.2Å; I563-R567 PolarHBondContact O-N 3.03Å; A564-R567 PolarHBondContact O-N 3.01Å; R567-Q569 VanDerWaalsContact C-N 3.3Å; R567-Q569 HydrophobicContact CB-CG 4.28Å; R567-Q569 PolarHBondContact O-N 3.42Å
568	G	88	Confident	92.2	Very high	51 Å²	51	51.8 Å²	51.8	53%	0.526	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	5.8	-177.2	0	0	0	0	0	114.9	A564 R565 D566 I570	A564-G568 PolarHBondContact O-N 2.69Å; R565-G568 WeakPolarHBondContact O-CA 3.38Å; R565-G568 PolarHBondContact O-N 3.14Å; D566-G568 PolarHBondContact O-N 2.97Å; G568-I570 PolarHBondContact O-N 3.45Å
569	Q	91.5	Very high	92.2	Very high	81 Å²	81	54.7 Å²	54.7	38%	0.379	26%	0.261	S	S	.	.			trans	-79.7	59.7	179.6	-64.1	169.1	-48.5	0	0	110.9	A564 R567 R571 D572 A573	A564-Q569 HydrophobicContact CB-CB 4.26Å; A564-Q569 WeakPolarHBondContact O-CA 3.46Å; A564-Q569 VanDerWaalsContact O-CB 3.29Å; A564-Q569 WeakPolarHBondContact O-CB 3.34Å; A564-Q569 PolarHBondContact O-N 3.11Å; R567-Q569 VanDerWaalsContact C-N 3.3Å; R567-Q569 HydrophobicContact CB-CG 4.28Å; R567-Q569 PolarHBondContact O-N 3.42Å; Q569-R571 PolarHBondContact O-N 3.26Å; Q569-D572 HydrophobicContact CB-CB 4.22Å; Q569-D572 PolarHBondContact O-N 3.4Å; Q569-A573 PolarHBondContact O-N 3.05Å
570	I	90	Very high	92.2	Very high	74 Å²	74	53.2 Å²	53.2	38%	0.379	26%	0.256	S	S	.	.	H	α-helix	trans	-55.3	-27.5	-174.5	-68.6	169.5	0	0	0	113.3	G568 S574 L597	G568-I570 PolarHBondContact O-N 3.45Å; I570-S574 PolarHBondContact O-N 2.91Å; I570-L597 HydrophobicContact CG2-CD1 4.13Å; I570-L597 HydrophobicContact CG2-CG 4.45Å
571	R	91	Very high	92.1	Very high	207 Å²	207	53.7 Å²	53.7	78%	0.781	26%	0.258	S	S	*	.	H	α-helix	trans	-71.8	-49	174.9	-68.2	-175.4	180	-174.4	0.5	111.2	Q569 S574 I575	Q569-R571 PolarHBondContact O-N 3.26Å; R571-S574 CarbonylContact O-C 3.48Å; R571-S574 WeakPolarHBondContact O-CA 3.32Å; R571-S574 WeakPolarHBondContact O-CB 3.48Å; R571-S574 PolarHBondContact O-N 3.38Å; R571-S574 PolarHBondContact O-OG 3.29Å; R571-I575 PolarHBondContact O-N 3.21Å
572	D	92.7	Very high	92.1	Very high	69 Å²	69	59.8 Å²	59.8	37%	0.369	29%	0.291	S	S	.	.	H	α-helix	trans	-73.7	-36.1	-172.9	-46.9	-31.1	0	0	0	110.3	A564 Q569 S574 I575 W576	A564-D572 HydrophobicContact CB-CB 4.4Å; Q569-D572 HydrophobicContact CB-CB 4.22Å; Q569-D572 PolarHBondContact O-N 3.4Å; D572-S574 VanDerWaalsContact C-N 3.26Å; D572-S574 PolarHBondContact O-N 2.95Å; D572-I575 WeakPolarHBondContact O-CA 3.3Å; D572-I575 WeakPolarHBondContact O-CB 3.35Å; D572-I575 PolarHBondContact O-N 2.81Å; D572-W576 PolarHBondContact O-N 3.1Å
573	A	93.1	Very high	92.1	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-53.7	-41.7	164.8	0	0	0	0	0	112.5	G561 A564 R565 Q569 I575 F577 L597	G561-A573 WeakPolarHBondContact O-CB 3.22Å; A564-A573 HydrophobicContact CB-CB 4.05Å; R565-A573 HydrophobicContact CB-CB 3.99Å; Q569-A573 PolarHBondContact O-N 3.05Å; A573-I575 PolarHBondContact O-N 3.08Å; A573-F577 HydrophobicContact CB-CE2 4.12Å; A573-F577 WeakPolarHBondContact O-CD2 3.3Å; A573-F577 VanDerWaalsContact O-CG 3.25Å; A573-F577 WeakPolarHBondContact O-CG 3.39Å; A573-F577 PolarHBondContact O-N 3.34Å; A573-L597 HydrophobicContact CB-CD1 4.44Å; A573-L597 HydrophobicContact CB-CD2 4.46Å
574	S	91.6	Very high	91.9	Very high	28 Å²	28	64.8 Å²	64.8	20%	0.196	32%	0.319	C	S	.	.	H	α-helix	trans	-76.7	-1.5	176.6	84.1	0	0	0	0	115	I570 R571 D572 K578	I570-S574 PolarHBondContact O-N 2.91Å; R571-S574 CarbonylContact O-C 3.48Å; R571-S574 WeakPolarHBondContact O-CA 3.32Å; R571-S574 WeakPolarHBondContact O-CB 3.48Å; R571-S574 PolarHBondContact O-N 3.38Å; R571-S574 PolarHBondContact O-OG 3.29Å; D572-S574 VanDerWaalsContact C-N 3.26Å; D572-S574 PolarHBondContact O-N 2.95Å; S574-K578 WeakPolarHBondContact O-CD 3.16Å; S574-K578 WeakPolarHBondContact O-CE 3.41Å; S574-K578 WeakPolarHBondContact O-CG 3.4Å; S574-K578 PolarHBondContact O-NZ 3.04Å
575	I	94.8	Very high	91.8	Very high	79 Å²	79	71 Å²	71	41%	0.405	35%	0.348	S	S	.	.	H	α-helix	trans	-95.1	-54	168.5	-67.1	164	0	0	0	108.2	R571 D572 A573 F577 K578 E579	R571-I575 PolarHBondContact O-N 3.21Å; D572-I575 WeakPolarHBondContact O-CA 3.3Å; D572-I575 WeakPolarHBondContact O-CB 3.35Å; D572-I575 PolarHBondContact O-N 2.81Å; A573-I575 PolarHBondContact O-N 3.08Å; I575-F577 VanDerWaalsContact C-N 3.34Å; I575-F577 PolarHBondContact O-N 3.33Å; I575-K578 WeakPolarHBondContact O-CA 3.43Å; I575-K578 WeakPolarHBondContact O-CB 3.44Å; I575-K578 PolarHBondContact O-N 3.05Å; I575-E579 HydrophobicContact CG2-CG 4.43Å; I575-E579 VanDerWaalsContact CG2-OE1 3.29Å; I575-E579 WeakPolarHBondContact CG2-OE1 3.37Å; I575-E579 PolarHBondContact O-N 3.28Å
576	W	94.6	Very high	91.6	Very high	54 Å²	54	70.9 Å²	70.9	21%	0.205	35%	0.353	C	S	.	.	H	α-helix	trans	-54.9	-43.1	177.7	-64.1	125.7	0	0	0	113.5	Y557 L560 D572 K578 E579 A580	Y557-W576 HydrophobicContact CD1-CE3 4.09Å; L560-W576 HydrophobicContact CB-CD2 4.02Å; L560-W576 HydrophobicContact CB-CE3 4.48Å; L560-W576 HydrophobicContact CB-CG 4.11Å; L560-W576 HydrophobicContact CD1-CE3 4.32Å; L560-W576 HydrophobicContact CD1-CH2 4.3Å; L560-W576 HydrophobicContact CD1-CZ3 4.19Å; D572-W576 PolarHBondContact O-N 3.1Å; W576-K578 PolarHBondContact O-N 3.1Å; W576-E579 VanDerWaalsContact CE3-OE2 3.25Å; W576-E579 VanDerWaalsContact CZ3-OE2 3.27Å; W576-E579 WeakPolarHBondContact CZ3-OE2 3.48Å; W576-E579 PolarHBondContact O-N 3.08Å; W576-A580 PolarHBondContact O-N 2.91Å
577	F	94	Very high	91.6	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.9	-15.9	175.8	-56.9	-38.6	0	0	0	114	L558 G561 A573 I575 L581 L593 I594 L597	L558-F577 HydrophobicContact CD2-CD1 4.31Å; G561-F577 VanDerWaalsContact C-CE1 3.47Å; G561-F577 VanDerWaalsContact CA-CE1 3.45Å; G561-F577 WeakPolarHBondContact O-CZ 3.4Å; A573-F577 HydrophobicContact CB-CE2 4.12Å; A573-F577 WeakPolarHBondContact O-CD2 3.3Å; A573-F577 VanDerWaalsContact O-CG 3.25Å; A573-F577 WeakPolarHBondContact O-CG 3.39Å; A573-F577 PolarHBondContact O-N 3.34Å; I575-F577 VanDerWaalsContact C-N 3.34Å; I575-F577 PolarHBondContact O-N 3.33Å; F577-L581 WeakPolarHBondContact O-CG 3.45Å; F577-L593 HydrophobicContact CD1-CB 4.05Å; F577-L593 HydrophobicContact CD1-CD1 4.21Å; F577-L593 HydrophobicContact CD2-CB 4.18Å; F577-L593 HydrophobicContact CE1-CB 3.83Å; F577-L593 HydrophobicContact CE1-CD1 3.75Å; F577-L593 HydrophobicContact CE1-CD2 4.47Å; F577-L593 HydrophobicContact CE1-CG 4.22Å; F577-L593 HydrophobicContact CE2-CB 3.98Å; F577-L593 HydrophobicContact CG-CB 4.24Å; F577-L593 HydrophobicContact CZ-CB 3.81Å; F577-L593 HydrophobicContact CZ-CD1 4.32Å; F577-L593 HydrophobicContact CZ-CD2 4.24Å; F577-L593 HydrophobicContact CZ-CG 4.35Å; F577-I594 HydrophobicContact CB-CD1 3.93Å; F577-I594 HydrophobicContact CB-CG1 3.6Å; F577-I594 HydrophobicContact CD2-CG1 4.23Å; F577-I594 HydrophobicContact CG-CG1 4.29Å; F577-L597 HydrophobicContact CD2-CD2 4.3Å; F577-L597 HydrophobicContact CE2-CD2 4.42Å
578	K	93.2	Very high	91.6	Very high	114 Å²	114	63 Å²	63	50%	0.496	32%	0.318	S	S	.	.	H	α-helix	trans	-86.1	-40.2	170.5	-70.1	174.2	-168.3	148	0	111.5	S574 I575 W576 A580 L581 D582	S574-K578 WeakPolarHBondContact O-CD 3.16Å; S574-K578 WeakPolarHBondContact O-CE 3.41Å; S574-K578 WeakPolarHBondContact O-CG 3.4Å; S574-K578 PolarHBondContact O-NZ 3.04Å; I575-K578 WeakPolarHBondContact O-CA 3.43Å; I575-K578 WeakPolarHBondContact O-CB 3.44Å; I575-K578 PolarHBondContact O-N 3.05Å; W576-K578 PolarHBondContact O-N 3.1Å; K578-A580 PolarHBondContact O-N 3.47Å; K578-L581 CarbonylContact O-C 3.4Å; K578-L581 VanDerWaalsContact O-CA 3.32Å; K578-L581 WeakPolarHBondContact O-CA 3.41Å; K578-L581 WeakPolarHBondContact O-CB 3.44Å; K578-L581 PolarHBondContact O-N 2.99Å; K578-D582 PolarHBondContact O-N 2.92Å
579	E	94	Very high	91.6	Very high	67 Å²	67	62.3 Å²	62.3	31%	0.313	30%	0.303	S	S	.	.	H	α-helix	trans	-58.9	-37.2	173.8	-66.9	177.1	-168	0	0	110.7	Y557 I575 W576 L581 D582 V583	Y557-E579 HydrophobicContact CD1-CB 3.63Å; Y557-E579 HydrophobicContact CE1-CB 3.73Å; Y557-E579 WeakPolarHBondContact CE1-OE2 3.41Å; I575-E579 HydrophobicContact CG2-CG 4.43Å; I575-E579 VanDerWaalsContact CG2-OE1 3.29Å; I575-E579 WeakPolarHBondContact CG2-OE1 3.37Å; I575-E579 PolarHBondContact O-N 3.28Å; W576-E579 VanDerWaalsContact CE3-OE2 3.25Å; W576-E579 VanDerWaalsContact CZ3-OE2 3.27Å; W576-E579 WeakPolarHBondContact CZ3-OE2 3.48Å; W576-E579 PolarHBondContact O-N 3.08Å; E579-L581 VanDerWaalsContact C-N 3.33Å; E579-L581 PolarHBondContact O-N 2.93Å; E579-D582 PolarHBondContact O-N 3.46Å; E579-V583 PolarHBondContact O-N 3.48Å
580	A	93.1	Very high	91.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-57.6	-40.5	167.9	0	0	0	0	0	113.6	I554 L558 W576 K578 V583 D584 A590	I554-A580 HydrophobicContact CG2-CB 4.14Å; L558-A580 HydrophobicContact CD2-CB 3.6Å; L558-A580 HydrophobicContact CG-CB 4.46Å; W576-A580 PolarHBondContact O-N 2.91Å; K578-A580 PolarHBondContact O-N 3.47Å; A580-V583 PolarHBondContact O-N 3Å; A580-D584 PolarHBondContact O-N 2.79Å; A580-A590 HydrophobicContact CB-CB 4.25Å
581	L	92.2	Very high	91.8	Very high	14 Å²	14	56.3 Å²	56.3	7%	0.073	27%	0.272	C	S	.	.	H	α-helix	trans	-77.1	-22.3	176.3	-71.5	174.7	0	0	0	113.8	F577 K578 E579 V583 D584 Q585 A590 W591 I594	F577-L581 WeakPolarHBondContact O-CG 3.45Å; K578-L581 CarbonylContact O-C 3.4Å; K578-L581 VanDerWaalsContact O-CA 3.32Å; K578-L581 WeakPolarHBondContact O-CA 3.41Å; K578-L581 WeakPolarHBondContact O-CB 3.44Å; K578-L581 PolarHBondContact O-N 2.99Å; E579-L581 VanDerWaalsContact C-N 3.33Å; E579-L581 PolarHBondContact O-N 2.93Å; L581-V583 VanDerWaalsContact C-N 3.26Å; L581-D584 WeakPolarHBondContact CA-O 3.45Å; L581-D584 WeakPolarHBondContact CD2-O 3.49Å; L581-D584 CarbonylContact O-C 3.59Å; L581-D584 VanDerWaalsContact O-C 3.26Å; L581-Q585 WeakPolarHBondContact O-CA 3.2Å; L581-Q585 WeakPolarHBondContact O-CG 3.39Å; L581-Q585 PolarHBondContact O-N 3.45Å; L581-Q585 VanDerWaalsContact O-N 3.09Å; L581-A590 HydrophobicContact CD2-CB 3.64Å; L581-A590 HydrophobicContact CG-CB 3.85Å; L581-W591 HydrophobicContact CD1-CD2 4.07Å; L581-W591 HydrophobicContact CD1-CE3 4.07Å; L581-W591 HydrophobicContact CD1-CH2 3.52Å; L581-W591 HydrophobicContact CD1-CZ2 3.5Å; L581-W591 VanDerWaalsContact CD1-CZ2 3.5Å; L581-W591 HydrophobicContact CD1-CZ3 3.81Å; L581-W591 HydrophobicContact CD2-CD2 4.11Å; L581-W591 HydrophobicContact CD2-CG 4.28Å; L581-W591 HydrophobicContact CD2-CZ2 3.86Å; L581-W591 HydrophobicContact CG-CZ2 4.29Å; L581-I594 HydrophobicContact CD1-CD1 3.44Å; L581-I594 VanDerWaalsContact CD1-CD1 3.44Å; L581-I594 HydrophobicContact CG-CD1 4.4Å
582	D	93.1	Very high	91.8	Very high	127 Å²	127	46.6 Å²	46.6	68%	0.679	24%	0.236	S	C	*	.	H	α-helix	trans	-74.1	-23.1	173	-66.2	-41.2	0	0	0	110.7	K578 E579	K578-D582 PolarHBondContact O-N 2.92Å; E579-D582 PolarHBondContact O-N 3.46Å
583	V	90.9	Very high	91.7	Very high	63 Å²	63	44.5 Å²	44.5	38%	0.382	22%	0.224	S	C	.	.	H	α-helix	trans	-81.5	-49.5	167.6	-179.4	0	0	0	0	111.9	I554 Y557 E579 A580 L581	I554-V583 HydrophobicContact CD1-CG1 4.13Å; I554-V583 HydrophobicContact CG1-CB 4.14Å; I554-V583 HydrophobicContact CG1-CG1 3.62Å; Y557-V583 HydrophobicContact CE2-CG2 4.29Å; E579-V583 PolarHBondContact O-N 3.48Å; A580-V583 PolarHBondContact O-N 3Å; L581-V583 VanDerWaalsContact C-N 3.26Å
584	D	89	Confident	91.7	Very high	55 Å²	55	45.4 Å²	45.4	29%	0.294	23%	0.229	S	C	.	.			trans	-135.5	103.9	173.9	174.9	9.4	0	0	0	111.9	I554 A580 L581 D586 N587	I554-D584 HydrophobicContact CD1-CB 3.68Å; A580-D584 PolarHBondContact O-N 2.79Å; L581-D584 WeakPolarHBondContact CA-O 3.45Å; L581-D584 WeakPolarHBondContact CD2-O 3.49Å; L581-D584 CarbonylContact O-C 3.59Å; L581-D584 VanDerWaalsContact O-C 3.26Å; D584-D586 PolarHBondContact O-N 3.37Å; D584-D586 VanDerWaalsContact O-N 3.14Å; D584-D586 PolarHBondContact OD1-N 3.11Å; D584-N587 HydrophobicContact CB-CB 4.05Å; D584-N587 WeakPolarHBondContact O-CB 3.43Å; D584-N587 PolarHBondContact O-N 3.38Å; D584-N587 PolarHBondContact OD1-N 3.29Å; D584-N587 WeakPolarHBondContact OD2-CB 3.42Å; D584-N587 PolarHBondContact OD2-N 3.42Å
585	Q	90.7	Very high	91.7	Very high	134 Å²	134	44 Å²	44	63%	0.626	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-15.1	-175	-64.3	-178.3	19.9	0	0	114.7	L581 W591 R613	L581-Q585 WeakPolarHBondContact O-CA 3.2Å; L581-Q585 WeakPolarHBondContact O-CG 3.39Å; L581-Q585 PolarHBondContact O-N 3.45Å; L581-Q585 VanDerWaalsContact O-N 3.09Å; Q585-W591 PolarHBondContact O-NE1 3.08Å; Q585-R613 PolarHBondContact O-NH2 3.49Å
586	D	87.4	Confident	91.5	Very high	75 Å²	75	43 Å²	43	40%	0.401	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115	1	-176.8	-84.9	-36.7	0	0	0	113.7	D584 R613 Q617	D584-D586 PolarHBondContact O-N 3.37Å; D584-D586 VanDerWaalsContact O-N 3.14Å; D584-D586 PolarHBondContact OD1-N 3.11Å; D586-R613 IonicContact OD1-CZ 3.42Å; D586-R613 IonicContact OD1-NE 3.85Å; D586-R613 PolarHBondContact OD1-NE 2.83Å; D586-R613 IonicContact OD1-NH2 2.7Å; D586-R613 PolarHBondContact OD1-NH2 3.49Å; D586-Q617 VanDerWaalsContact CB-NE2 3.26Å; D586-Q617 PolarHBondContact O-NE2 3.4Å; D586-Q617 PolarHBondContact OD1-NE2 2.91Å
587	N	88.6	Confident	91.3	Very high	15 Å²	15	40.9 Å²	40.9	8%	0.08	21%	0.207	C	C	.	.			trans	-49.9	121.1	176.5	-175.3	-77.7	0	0	0	112.8	D584 D589 A590 W591	D584-N587 HydrophobicContact CB-CB 4.05Å; D584-N587 WeakPolarHBondContact O-CB 3.43Å; D584-N587 PolarHBondContact O-N 3.38Å; D584-N587 PolarHBondContact OD1-N 3.29Å; D584-N587 WeakPolarHBondContact OD2-CB 3.42Å; D584-N587 PolarHBondContact OD2-N 3.42Å; N587-D589 PolarHBondContact OD1-N 3.31Å; N587-D589 VanDerWaalsContact OD1-N 3.12Å; N587-A590 HydrophobicContact CB-CB 4.08Å; N587-A590 WeakPolarHBondContact OD1-CB 3.24Å; N587-A590 PolarHBondContact OD1-N 2.97Å; N587-W591 PolarHBondContact O-N 3.09Å
588	P	90.2	Very high	91.2	Very high	15 Å²	15	42.2 Å²	42.2	10%	0.097	21%	0.213	C	C	.	.	H	α-helix	trans	-71.1	-35.8	-172.7	30.1	-36.4	0	0	0	112.7	W591 T592 I614 Y620	P588-W591 PolarHBondContact O-N 3.5Å; P588-T592 VanDerWaalsContact O-CB 3.26Å; P588-T592 WeakPolarHBondContact O-CB 3.43Å; P588-T592 PolarHBondContact O-N 3.35Å; P588-T592 PolarHBondContact O-OG1 2.86Å; P588-T592 VanDerWaalsContact O-OG1 3.1Å; P588-I614 HydrophobicContact CB-CG2 4.08Å; P588-I614 WeakPolarHBondContact O-CD1 3.48Å; P588-Y620 HydrophobicContact CB-CD1 4.11Å; P588-Y620 HydrophobicContact CB-CD2 4.24Å; P588-Y620 HydrophobicContact CB-CE1 4.38Å; P588-Y620 HydrophobicContact CB-CE2 4.49Å; P588-Y620 HydrophobicContact CB-CG 4.04Å; P588-Y620 HydrophobicContact CG-CD1 3.86Å; P588-Y620 HydrophobicContact CG-CD2 4.37Å; P588-Y620 HydrophobicContact CG-CE1 3.66Å; P588-Y620 HydrophobicContact CG-CE2 4.19Å; P588-Y620 HydrophobicContact CG-CG 4.21Å
589	D	88.2	Confident	91	Very high	37 Å²	37	39.3 Å²	39.3	20%	0.198	20%	0.203	C	C	.	.	H	α-helix	trans	-71.6	-38.8	-177.3	-62	-72.3	0	0	0	111.9	L558 N587 T592 L593 S1014	L558-D589 HydrophobicContact CD1-CB 3.91Å; N587-D589 PolarHBondContact OD1-N 3.31Å; N587-D589 VanDerWaalsContact OD1-N 3.12Å; D589-T592 PolarHBondContact O-N 3.43Å; D589-L593 WeakPolarHBondContact O-CB 3.43Å; D589-L593 VanDerWaalsContact O-CG 3.28Å; D589-L593 WeakPolarHBondContact O-CG 3.39Å; D589-L593 PolarHBondContact O-N 2.97Å; D589-S1014 WeakPolarHBondContact OD1-CB 3.29Å
590	A	92	Very high	90.5	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-46.8	170.5	0	0	0	0	0	111.6	L558 A580 L581 N587 T592 L593 I594	L558-A590 HydrophobicContact CD2-CB 3.92Å; A580-A590 HydrophobicContact CB-CB 4.25Å; L581-A590 HydrophobicContact CD2-CB 3.64Å; L581-A590 HydrophobicContact CG-CB 3.85Å; N587-A590 HydrophobicContact CB-CB 4.08Å; N587-A590 WeakPolarHBondContact OD1-CB 3.24Å; N587-A590 PolarHBondContact OD1-N 2.97Å; A590-T592 VanDerWaalsContact C-N 3.34Å; A590-T592 PolarHBondContact O-N 3.09Å; A590-L593 PolarHBondContact O-N 3.23Å; A590-I594 WeakPolarHBondContact O-CD1 3.36Å; A590-I594 VanDerWaalsContact O-CG1 3.29Å; A590-I594 WeakPolarHBondContact O-CG1 3.47Å; A590-I594 PolarHBondContact O-N 3.02Å; A590-I594 VanDerWaalsContact O-N 3.08Å
591	W	93.2	Very high	90.3	Very high	30 Å²	30	43.1 Å²	43.1	11%	0.114	24%	0.237	C	C	.	.	H	α-helix	trans	-64.2	-37.7	175	-76.2	118.1	0	0	0	112.8	L581 Q585 N587 P588 G595 K610 I614	L581-W591 HydrophobicContact CD1-CD2 4.07Å; L581-W591 HydrophobicContact CD1-CE3 4.07Å; L581-W591 HydrophobicContact CD1-CH2 3.52Å; L581-W591 HydrophobicContact CD1-CZ2 3.5Å; L581-W591 VanDerWaalsContact CD1-CZ2 3.5Å; L581-W591 HydrophobicContact CD1-CZ3 3.81Å; L581-W591 HydrophobicContact CD2-CD2 4.11Å; L581-W591 HydrophobicContact CD2-CG 4.28Å; L581-W591 HydrophobicContact CD2-CZ2 3.86Å; L581-W591 HydrophobicContact CG-CZ2 4.29Å; Q585-W591 PolarHBondContact O-NE1 3.08Å; N587-W591 PolarHBondContact O-N 3.09Å; P588-W591 PolarHBondContact O-N 3.5Å; W591-G595 PolarHBondContact O-N 3.13Å; W591-K610 HydrophobicContact CE3-CD 3.99Å; W591-K610 HydrophobicContact CZ3-CD 4.02Å; W591-I614 HydrophobicContact CB-CD1 3.85Å; W591-I614 HydrophobicContact CB-CG1 3.81Å
592	T	91.3	Very high	89.9	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-64.1	-49.6	176	-79.9	0	0	0	0	111.5	P588 D589 A590 I594 G595 L596 F611 I614 F625	P588-T592 VanDerWaalsContact O-CB 3.26Å; P588-T592 WeakPolarHBondContact O-CB 3.43Å; P588-T592 PolarHBondContact O-N 3.35Å; P588-T592 PolarHBondContact O-OG1 2.86Å; P588-T592 VanDerWaalsContact O-OG1 3.1Å; D589-T592 PolarHBondContact O-N 3.43Å; A590-T592 VanDerWaalsContact C-N 3.34Å; A590-T592 PolarHBondContact O-N 3.09Å; T592-I594 VanDerWaalsContact C-N 3.32Å; T592-I594 PolarHBondContact O-N 2.91Å; T592-G595 CarbonylContact O-C 3.58Å; T592-G595 WeakPolarHBondContact O-CA 3.48Å; T592-G595 PolarHBondContact O-N 3.1Å; T592-L596 HydrophobicContact CG2-CD1 4.13Å; T592-L596 HydrophobicContact CG2-CG 4.5Å; T592-L596 WeakPolarHBondContact O-CG 3.43Å; T592-L596 PolarHBondContact O-N 3.32Å; T592-F611 HydrophobicContact CG2-CE1 4.41Å; T592-I614 VanDerWaalsContact OG1-CD1 3.22Å; T592-I614 WeakPolarHBondContact OG1-CD1 3.41Å; T592-F625 HydrophobicContact CG2-CD1 3.49Å; T592-F625 VanDerWaalsContact CG2-CD1 3.49Å; T592-F625 HydrophobicContact CG2-CE1 3.4Å; T592-F625 HydrophobicContact CG2-CZ 4.4Å
593	L	91.3	Very high	89.8	Confident	25 Å²	25	46.9 Å²	46.9	13%	0.131	25%	0.254	C	S	.	.	H	α-helix	trans	-63.8	-36.2	179.6	-73.3	164.1	0	0	0	111.8	L558 F577 D589 A590 L596 L597	L558-L593 HydrophobicContact CB-CD1 4.18Å; L558-L593 HydrophobicContact CD2-CD1 4.12Å; F577-L593 HydrophobicContact CD1-CB 4.05Å; F577-L593 HydrophobicContact CD1-CD1 4.21Å; F577-L593 HydrophobicContact CD2-CB 4.18Å; F577-L593 HydrophobicContact CE1-CB 3.83Å; F577-L593 HydrophobicContact CE1-CD1 3.75Å; F577-L593 HydrophobicContact CE1-CD2 4.47Å; F577-L593 HydrophobicContact CE1-CG 4.22Å; F577-L593 HydrophobicContact CE2-CB 3.98Å; F577-L593 HydrophobicContact CG-CB 4.24Å; F577-L593 HydrophobicContact CZ-CB 3.81Å; F577-L593 HydrophobicContact CZ-CD1 4.32Å; F577-L593 HydrophobicContact CZ-CD2 4.24Å; F577-L593 HydrophobicContact CZ-CG 4.35Å; D589-L593 WeakPolarHBondContact O-CB 3.43Å; D589-L593 VanDerWaalsContact O-CG 3.28Å; D589-L593 WeakPolarHBondContact O-CG 3.39Å; D589-L593 PolarHBondContact O-N 2.97Å; A590-L593 PolarHBondContact O-N 3.23Å; L593-L596 HydrophobicContact CD2-CD1 4.49Å; L593-L597 WeakPolarHBondContact O-CB 2.85Å; L593-L597 PolarHBondContact O-N 2.91Å
594	I	92.3	Very high	89.8	Confident	18 Å²	18	46.5 Å²	46.5	9%	0.092	25%	0.252	C	S	.	.	H	α-helix	trans	-67.6	-39	170.4	-66.4	166.4	0	0	0	111.4	F577 L581 A590 T592 L597 H598 K610	F577-I594 HydrophobicContact CB-CD1 3.93Å; F577-I594 HydrophobicContact CB-CG1 3.6Å; F577-I594 HydrophobicContact CD2-CG1 4.23Å; F577-I594 HydrophobicContact CG-CG1 4.29Å; L581-I594 HydrophobicContact CD1-CD1 3.44Å; L581-I594 VanDerWaalsContact CD1-CD1 3.44Å; L581-I594 HydrophobicContact CG-CD1 4.4Å; A590-I594 WeakPolarHBondContact O-CD1 3.36Å; A590-I594 VanDerWaalsContact O-CG1 3.29Å; A590-I594 WeakPolarHBondContact O-CG1 3.47Å; A590-I594 PolarHBondContact O-N 3.02Å; A590-I594 VanDerWaalsContact O-N 3.08Å; T592-I594 VanDerWaalsContact C-N 3.32Å; T592-I594 PolarHBondContact O-N 2.91Å; I594-L597 PolarHBondContact O-N 2.88Å; I594-H598 PolarHBondContact O-CD2 3.2Å; I594-H598 PolarHBondContact O-N 2.91Å; I594-K610 HydrophobicContact CG2-CD 4.4Å; I594-K610 HydrophobicContact CG2-CG 4.19Å
595	G	91.4	Very high	89.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-47.9	173.4	0	0	0	0	0	112.4	W591 T592 L597 H598 L599 A607	W591-G595 PolarHBondContact O-N 3.13Å; T592-G595 CarbonylContact O-C 3.58Å; T592-G595 WeakPolarHBondContact O-CA 3.48Å; T592-G595 PolarHBondContact O-N 3.1Å; G595-L597 VanDerWaalsContact C-N 3.33Å; G595-L597 PolarHBondContact O-N 3.38Å; G595-H598 PolarHBondContact O-N 3.24Å; G595-L599 PolarHBondContact O-N 2.88Å; G595-A607 WeakPolarHBondContact O-CB 3.21Å
596	L	91.3	Very high	90	Very high	56 Å²	56	48.1 Å²	48.1	29%	0.293	26%	0.258	S	S	.	.	H	α-helix	trans	-62.3	-38	174.1	-64.7	173.6	0	0	0	111.8	T592 L593 H598 L599 G600 F611 F625	T592-L596 HydrophobicContact CG2-CD1 4.13Å; T592-L596 HydrophobicContact CG2-CG 4.5Å; T592-L596 WeakPolarHBondContact O-CG 3.43Å; T592-L596 PolarHBondContact O-N 3.32Å; L593-L596 HydrophobicContact CD2-CD1 4.49Å; L596-H598 VanDerWaalsContact C-N 3.34Å; L596-H598 PolarHBondContact O-N 3.06Å; L596-L599 HydrophobicContact CD2-CD1 4.41Å; L596-L599 PolarHBondContact O-N 2.92Å; L596-G600 PolarHBondContact O-N 3.38Å; L596-F611 HydrophobicContact CD2-CZ 4.23Å; L596-F611 HydrophobicContact CG-CZ 4.34Å; L596-F625 HydrophobicContact CD1-CE1 4.13Å; L596-F625 HydrophobicContact CD1-CZ 4.16Å; L596-F625 HydrophobicContact CD2-CE1 4.28Å; L596-F625 HydrophobicContact CD2-CZ 4.42Å; L596-F625 HydrophobicContact CG-CE1 4.45Å
597	L	90.3	Very high	90.2	Very high	11 Å²	11	44.6 Å²	44.6	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-66.8	-32.8	176.2	-164.4	70.7	0	0	0	112.6	R565 I570 A573 F577 L593 I594 G595 K601	R565-L597 HydrophobicContact CG-CD1 4.14Å; I570-L597 HydrophobicContact CG2-CD1 4.13Å; I570-L597 HydrophobicContact CG2-CG 4.45Å; A573-L597 HydrophobicContact CB-CD1 4.44Å; A573-L597 HydrophobicContact CB-CD2 4.46Å; F577-L597 HydrophobicContact CD2-CD2 4.3Å; F577-L597 HydrophobicContact CE2-CD2 4.42Å; L593-L597 WeakPolarHBondContact O-CB 2.85Å; L593-L597 PolarHBondContact O-N 2.91Å; I594-L597 PolarHBondContact O-N 2.88Å; G595-L597 VanDerWaalsContact C-N 3.33Å; G595-L597 PolarHBondContact O-N 3.38Å; L597-K601 WeakPolarHBondContact O-CG 3.38Å
598	H	91.3	Very high	90.5	Very high	28 Å²	28	46.4 Å²	46.4	13%	0.13	25%	0.247	C	C	.	.	H	α-helix	trans	-70.5	-39.2	169.7	-75.4	-68.4	0	0	0	111.8	I594 G595 L596 G600 K601 N602 E603 Q606 A607 K610	I594-H598 PolarHBondContact O-CD2 3.2Å; I594-H598 PolarHBondContact O-N 2.91Å; G595-H598 PolarHBondContact O-N 3.24Å; L596-H598 VanDerWaalsContact C-N 3.34Å; L596-H598 PolarHBondContact O-N 3.06Å; H598-G600 VanDerWaalsContact C-N 3.35Å; H598-G600 PolarHBondContact O-N 3.27Å; H598-K601 PolarHBondContact O-N 3.11Å; H598-K601 VanDerWaalsContact O-N 3.12Å; H598-N602 PolarHBondContact O-N 2.89Å; H598-E603 HydrophobicContact CB-CB 4.16Å; H598-E603 IonicContact CE1-OE2 2.83Å; H598-E603 PolarHBondContact CE1-OE2 3.23Å; H598-E603 IonicContact CG-OE2 3.73Å; H598-E603 IonicContact ND1-OE2 3.65Å; H598-E603 PolarHBondContact ND1-OE2 3.49Å; H598-E603 PolarHBondContact O-N 3.27Å; H598-Q606 HydrophobicContact CB-CB 4.29Å; H598-A607 HydrophobicContact CB-CB 3.8Å; H598-K610 VanDerWaalsContact NE2-CE 3.31Å; H598-K610 WeakPolarHBondContact NE2-CE 3.42Å
599	L	88.4	Confident	90.6	Very high	53 Å²	53	50.9 Å²	50.9	28%	0.277	27%	0.265	S	S	.	.	H	α-helix	trans	-61	-41.9	173.2	-69.1	-179.2	0	0	0	111.9	G595 L596 K601 N602 A607 F611 I633	G595-L599 PolarHBondContact O-N 2.88Å; L596-L599 HydrophobicContact CD2-CD1 4.41Å; L596-L599 PolarHBondContact O-N 2.92Å; L599-K601 PolarHBondContact O-N 3.12Å; L599-K601 VanDerWaalsContact O-N 3.12Å; L599-N602 PolarHBondContact O-N 2.76Å; L599-A607 HydrophobicContact CD2-CB 3.5Å; L599-A607 VanDerWaalsContact CD2-CB 3.5Å; L599-A607 HydrophobicContact CG-CB 3.63Å; L599-F611 HydrophobicContact CD1-CE2 4.08Å; L599-F611 HydrophobicContact CD1-CZ 4.42Å; L599-F611 HydrophobicContact CG-CE2 4.47Å; L599-I633 HydrophobicContact CD2-CD1 4.13Å; L599-I633 HydrophobicContact CD2-CG1 3.98Å
600	G	85.1	Confident	90.9	Very high	65 Å²	65	51.5 Å²	51.5	67%	0.67	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.6	175.1	0	0	0	0	0	114.9	L596 H598	L596-G600 PolarHBondContact O-N 3.38Å; H598-G600 VanDerWaalsContact C-N 3.35Å; H598-G600 PolarHBondContact O-N 3.27Å
601	K	87.4	Confident	90.9	Very high	81 Å²	81	51.5 Å²	51.5	35%	0.352	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	0.9	172.5	-63.9	174.3	-172.1	173	0	113.6	L597 H598 L599 E603	L597-K601 WeakPolarHBondContact O-CG 3.38Å; H598-K601 PolarHBondContact O-N 3.11Å; H598-K601 VanDerWaalsContact O-N 3.12Å; L599-K601 PolarHBondContact O-N 3.12Å; L599-K601 VanDerWaalsContact O-N 3.12Å; K601-E603 HydrophobicContact CB-CB 4.41Å; K601-E603 HydrophobicContact CB-CG 3.8Å; K601-E603 VanDerWaalsContact CD-OE1 3.23Å; K601-E603 WeakPolarHBondContact CD-OE1 3.35Å; K601-E603 PolarHBondContact O-N 2.96Å
602	N	85.1	Confident	90.9	Very high	143 Å²	143	51.4 Å²	51.4	77%	0.765	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	20.4	-165.9	-56	-53.9	0	0	0	114.6	H598 L599 V604	H598-N602 PolarHBondContact O-N 2.89Å; L599-N602 PolarHBondContact O-N 2.76Å; N602-V604 PolarHBondContact O-N 3.02Å
603	E	91.1	Very high	90.9	Very high	78 Å²	78	55.6 Å²	55.6	36%	0.364	28%	0.283	S	S	.	.			trans	-82.8	55	178.5	-66.5	173.7	-166.4	0	0	111.4	H598 K601 E605 Q606 A607	H598-E603 HydrophobicContact CB-CB 4.16Å; H598-E603 IonicContact CE1-OE2 2.83Å; H598-E603 PolarHBondContact CE1-OE2 3.23Å; H598-E603 IonicContact CG-OE2 3.73Å; H598-E603 IonicContact ND1-OE2 3.65Å; H598-E603 PolarHBondContact ND1-OE2 3.49Å; H598-E603 PolarHBondContact O-N 3.27Å; K601-E603 HydrophobicContact CB-CB 4.41Å; K601-E603 HydrophobicContact CB-CG 3.8Å; K601-E603 VanDerWaalsContact CD-OE1 3.23Å; K601-E603 WeakPolarHBondContact CD-OE1 3.35Å; K601-E603 PolarHBondContact O-N 2.96Å; E603-E605 VanDerWaalsContact C-N 3.31Å; E603-E605 PolarHBondContact O-N 3.35Å; E603-E605 VanDerWaalsContact O-N 3.17Å; E603-Q606 HydrophobicContact CB-CB 4.3Å; E603-Q606 HydrophobicContact CB-CG 4.43Å; E603-Q606 PolarHBondContact O-N 3.49Å; E603-A607 PolarHBondContact O-N 3.34Å; E603-A607 VanDerWaalsContact O-N 3.09Å
604	V	90.9	Very high	90.9	Very high	54 Å²	54	54.4 Å²	54.4	33%	0.327	28%	0.277	S	S	.	.	H	α-helix	trans	-53.9	-41.2	-167.2	-176.7	0	0	0	0	113.4	N602 Q606 A607 Q608 I633	N602-V604 PolarHBondContact O-N 3.02Å; V604-Q606 VanDerWaalsContact C-N 3.31Å; V604-Q606 PolarHBondContact O-N 3.09Å; V604-A607 PolarHBondContact O-N 3.41Å; V604-Q608 PolarHBondContact O-N 2.73Å; V604-I633 HydrophobicContact CG1-CG1 4.3Å; V604-I633 HydrophobicContact CG1-CG2 3.71Å
605	E	91.4	Very high	90.8	Very high	139 Å²	139	55 Å²	55	65%	0.65	28%	0.28	S	S	*	.	H	α-helix	trans	-64.5	-32.5	177.4	-69.4	-166.8	-167.8	0	0	113.9	E603 K609	E603-E605 VanDerWaalsContact C-N 3.31Å; E603-E605 PolarHBondContact O-N 3.35Å; E603-E605 VanDerWaalsContact O-N 3.17Å; E605-K609 VanDerWaalsContact O-CD 3.23Å; E605-K609 WeakPolarHBondContact O-CD 3.42Å; E605-K609 WeakPolarHBondContact O-CE 3.49Å; E605-K609 VanDerWaalsContact O-CG 3.22Å; E605-K609 WeakPolarHBondContact O-CG 3.24Å; E605-K609 PolarHBondContact O-N 2.91Å; E605-K609 IonicContact OE2-NZ 3.52Å; E605-K609 PolarHBondContact OE2-NZ 3.03Å
606	Q	92.2	Very high	90.8	Very high	85 Å²	85	64 Å²	64	40%	0.397	31%	0.314	S	S	.	.	H	α-helix	trans	-76.4	-41.3	178.1	-63	-66.6	4.6	0	0	110.1	H598 E603 V604 K609 K610	H598-Q606 HydrophobicContact CB-CB 4.29Å; E603-Q606 HydrophobicContact CB-CB 4.3Å; E603-Q606 HydrophobicContact CB-CG 4.43Å; E603-Q606 PolarHBondContact O-N 3.49Å; V604-Q606 VanDerWaalsContact C-N 3.31Å; V604-Q606 PolarHBondContact O-N 3.09Å; Q606-K609 PolarHBondContact O-N 3.23Å; Q606-K610 WeakPolarHBondContact O-CG 3.34Å; Q606-K610 PolarHBondContact O-N 2.84Å
607	A	91.7	Very high	90.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-56.6	-49.7	172.7	0	0	0	0	0	111.7	G595 H598 L599 E603 V604 K609 K610 F611 I633	G595-A607 WeakPolarHBondContact O-CB 3.21Å; H598-A607 HydrophobicContact CB-CB 3.8Å; L599-A607 HydrophobicContact CD2-CB 3.5Å; L599-A607 VanDerWaalsContact CD2-CB 3.5Å; L599-A607 HydrophobicContact CG-CB 3.63Å; E603-A607 PolarHBondContact O-N 3.34Å; E603-A607 VanDerWaalsContact O-N 3.09Å; V604-A607 PolarHBondContact O-N 3.41Å; A607-K609 VanDerWaalsContact C-N 3.29Å; A607-K609 PolarHBondContact O-N 3.12Å; A607-K610 WeakPolarHBondContact O-CB 3.38Å; A607-K610 PolarHBondContact O-N 3.41Å; A607-F611 HydrophobicContact CB-CE2 4.16Å; A607-F611 WeakPolarHBondContact O-CD2 3.2Å; A607-F611 PolarHBondContact O-N 3.31Å; A607-F611 VanDerWaalsContact O-N 3.16Å; A607-I633 HydrophobicContact CB-CD1 4.34Å
608	Q	93.5	Very high	90.6	Very high	54 Å²	54	67.5 Å²	67.5	25%	0.252	34%	0.339	S	S	.	.	H	α-helix	trans	-55.6	-44.9	177.6	-162	-154.2	-58.5	0	0	111.2	V604 K610 F611 D612 L630 I633	V604-Q608 PolarHBondContact O-N 2.73Å; Q608-K610 PolarHBondContact O-N 2.83Å; Q608-F611 PolarHBondContact O-N 3.33Å; Q608-D612 PolarHBondContact NE2-OD2 3.43Å; Q608-D612 WeakPolarHBondContact O-CB 3.25Å; Q608-D612 PolarHBondContact O-N 3.04Å; Q608-L630 HydrophobicContact CG-CD2 3.53Å; Q608-I633 HydrophobicContact CB-CD1 4.17Å; Q608-I633 HydrophobicContact CG-CG2 4.44Å
609	K	94	Very high	90.3	Very high	108 Å²	108	70 Å²	70	47%	0.47	37%	0.365	S	S	.	.	H	α-helix	trans	-63.1	-21.3	177.3	-69.6	161.4	-165.6	157.1	0	113.9	E605 Q606 A607	E605-K609 VanDerWaalsContact O-CD 3.23Å; E605-K609 WeakPolarHBondContact O-CD 3.42Å; E605-K609 WeakPolarHBondContact O-CE 3.49Å; E605-K609 VanDerWaalsContact O-CG 3.22Å; E605-K609 WeakPolarHBondContact O-CG 3.24Å; E605-K609 PolarHBondContact O-N 2.91Å; E605-K609 IonicContact OE2-NZ 3.52Å; E605-K609 PolarHBondContact OE2-NZ 3.03Å; Q606-K609 PolarHBondContact O-N 3.23Å; A607-K609 VanDerWaalsContact C-N 3.29Å; A607-K609 PolarHBondContact O-N 3.12Å
610	K	92.9	Very high	90.2	Very high	50 Å²	50	72 Å²	72	22%	0.217	37%	0.369	C	S	.	.	H	α-helix	trans	-80.5	-51.7	173	-53.5	-43.7	-178.4	177.6	0	111.2	W591 I594 H598 Q606 A607 Q608 D612 R613 I614	W591-K610 HydrophobicContact CE3-CD 3.99Å; W591-K610 HydrophobicContact CZ3-CD 4.02Å; I594-K610 HydrophobicContact CG2-CD 4.4Å; I594-K610 HydrophobicContact CG2-CG 4.19Å; H598-K610 VanDerWaalsContact NE2-CE 3.31Å; H598-K610 WeakPolarHBondContact NE2-CE 3.42Å; Q606-K610 WeakPolarHBondContact O-CG 3.34Å; Q606-K610 PolarHBondContact O-N 2.84Å; A607-K610 WeakPolarHBondContact O-CB 3.38Å; A607-K610 PolarHBondContact O-N 3.41Å; Q608-K610 PolarHBondContact O-N 2.83Å; K610-D612 VanDerWaalsContact C-N 3.29Å; K610-D612 PolarHBondContact O-N 2.95Å; K610-R613 VanDerWaalsContact O-CB 3.3Å; K610-R613 WeakPolarHBondContact O-CB 3.34Å; K610-R613 PolarHBondContact O-N 2.83Å; K610-I614 PolarHBondContact O-N 3.24Å
611	F	92.9	Very high	90.1	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-62.4	-36.8	177.1	-57.7	-61.5	0	0	0	112	T592 L596 L599 A607 Q608 R613 I614 I615 A626 C629 L630 I633	T592-F611 HydrophobicContact CG2-CE1 4.41Å; L596-F611 HydrophobicContact CD2-CZ 4.23Å; L596-F611 HydrophobicContact CG-CZ 4.34Å; L599-F611 HydrophobicContact CD1-CE2 4.08Å; L599-F611 HydrophobicContact CD1-CZ 4.42Å; L599-F611 HydrophobicContact CG-CE2 4.47Å; A607-F611 HydrophobicContact CB-CE2 4.16Å; A607-F611 WeakPolarHBondContact O-CD2 3.2Å; A607-F611 PolarHBondContact O-N 3.31Å; A607-F611 VanDerWaalsContact O-N 3.16Å; Q608-F611 PolarHBondContact O-N 3.33Å; F611-R613 PolarHBondContact O-N 3.39Å; F611-I614 HydrophobicContact CD1-CD1 4.42Å; F611-I614 PolarHBondContact O-N 3.06Å; F611-I615 PolarHBondContact O-N 3.21Å; F611-A626 HydrophobicContact CB-CB 4.19Å; F611-A626 HydrophobicContact CD1-CB 4.13Å; F611-C629 HydrophobicContact CD1-CB 3.85Å; F611-C629 HydrophobicContact CD2-CB 3.87Å; F611-C629 HydrophobicContact CE1-CB 3.7Å; F611-C629 HydrophobicContact CE2-CB 3.73Å; F611-C629 HydrophobicContact CG-CB 3.94Å; F611-C629 HydrophobicContact CZ-CB 3.64Å; F611-L630 HydrophobicContact CB-CD1 4.11Å; F611-L630 HydrophobicContact CB-CD2 3.92Å; F611-L630 HydrophobicContact CB-CG 3.73Å; F611-I633 HydrophobicContact CD2-CD1 3.84Å; F611-I633 HydrophobicContact CE2-CD1 4.08Å
612	D	92.4	Very high	90	Very high	29 Å²	29	76.2 Å²	76.2	16%	0.155	38%	0.378	C	S	.	.	H	α-helix	trans	-63.1	-20.2	171.3	-83.7	-33.4	0	0	0	113.5	Q608 K610 R616	Q608-D612 PolarHBondContact NE2-OD2 3.43Å; Q608-D612 WeakPolarHBondContact O-CB 3.25Å; Q608-D612 PolarHBondContact O-N 3.04Å; K610-D612 VanDerWaalsContact C-N 3.29Å; K610-D612 PolarHBondContact O-N 2.95Å; D612-R616 WeakPolarHBondContact O-CD 3.47Å; D612-R616 WeakPolarHBondContact O-CG 3.41Å; D612-R616 PolarHBondContact O-NE 2.91Å
613	R	92	Very high	90.2	Very high	91 Å²	91	71.1 Å²	71.1	34%	0.343	35%	0.351	S	S	.	.	H	α-helix	trans	-75	-44.8	172.4	-178.4	179.8	173.4	154.6	-0	110.4	Q585 D586 K610 F611 R616 Q617	Q585-R613 PolarHBondContact O-NH2 3.49Å; D586-R613 IonicContact OD1-CZ 3.42Å; D586-R613 IonicContact OD1-NE 3.85Å; D586-R613 PolarHBondContact OD1-NE 2.83Å; D586-R613 IonicContact OD1-NH2 2.7Å; D586-R613 PolarHBondContact OD1-NH2 3.49Å; K610-R613 VanDerWaalsContact O-CB 3.3Å; K610-R613 WeakPolarHBondContact O-CB 3.34Å; K610-R613 PolarHBondContact O-N 2.83Å; F611-R613 PolarHBondContact O-N 3.39Å; R613-R616 WeakPolarHBondContact O-CB 3.07Å; R613-R616 PolarHBondContact O-N 3.44Å; R613-Q617 PolarHBondContact O-N 3.29Å
614	I	91.1	Very high	90.1	Very high	0 Å²	0	69 Å²	69	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-58.5	-54.7	-177.4	-57.6	170.8	0	0	0	110.3	P588 W591 T592 K610 F611 R616 Q617 D623 A626	P588-I614 HydrophobicContact CB-CG2 4.08Å; P588-I614 WeakPolarHBondContact O-CD1 3.48Å; W591-I614 HydrophobicContact CB-CD1 3.85Å; W591-I614 HydrophobicContact CB-CG1 3.81Å; T592-I614 VanDerWaalsContact OG1-CD1 3.22Å; T592-I614 WeakPolarHBondContact OG1-CD1 3.41Å; K610-I614 PolarHBondContact O-N 3.24Å; F611-I614 HydrophobicContact CD1-CD1 4.42Å; F611-I614 PolarHBondContact O-N 3.06Å; I614-R616 PolarHBondContact O-N 3.09Å; I614-Q617 WeakPolarHBondContact O-CB 3.45Å; I614-Q617 PolarHBondContact O-N 3Å; I614-Q617 PolarHBondContact O-OE1 2.87Å; I614-D623 HydrophobicContact CG2-CB 4.42Å; I614-A626 HydrophobicContact CB-CB 4.14Å; I614-A626 HydrophobicContact CD1-CB 4.12Å; I614-A626 HydrophobicContact CG2-CB 4.17Å
615	I	90.2	Very high	90.1	Very high	30 Å²	30	68.4 Å²	68.4	15%	0.154	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-6.5	-178	64.2	161.4	0	0	0	114.9	F611 A626 L630 F658	F611-I615 PolarHBondContact O-N 3.21Å; I615-A626 HydrophobicContact CG2-CB 4.04Å; I615-L630 HydrophobicContact CD1-CD1 3.55Å; I615-L630 HydrophobicContact CG1-CD1 4.18Å; I615-L630 HydrophobicContact CG2-CD1 4.47Å; I615-F658 HydrophobicContact CD1-CE1 4.21Å
616	R	91.3	Very high	90.1	Very high	188 Å²	188	61.8 Å²	61.8	71%	0.709	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-27.3	172.3	-74.1	170.4	-162.8	-140	1.2	112.8	D612 R613 I614	D612-R616 WeakPolarHBondContact O-CD 3.47Å; D612-R616 WeakPolarHBondContact O-CG 3.41Å; D612-R616 PolarHBondContact O-NE 2.91Å; R613-R616 WeakPolarHBondContact O-CB 3.07Å; R613-R616 PolarHBondContact O-N 3.44Å; I614-R616 PolarHBondContact O-N 3.09Å
617	Q	89.9	Confident	90.1	Very high	22 Å²	22	59.9 Å²	59.9	10%	0.103	30%	0.298	C	S	.	.	S	Bend	trans	-67.2	132.4	174.5	-65.4	156	-34	0	0	108.6	D586 R613 I614 A619 Y620 R621	D586-Q617 VanDerWaalsContact CB-NE2 3.26Å; D586-Q617 PolarHBondContact O-NE2 3.4Å; D586-Q617 PolarHBondContact OD1-NE2 2.91Å; R613-Q617 PolarHBondContact O-N 3.29Å; I614-Q617 WeakPolarHBondContact O-CB 3.45Å; I614-Q617 PolarHBondContact O-N 3Å; I614-Q617 PolarHBondContact O-OE1 2.87Å; Q617-A619 VanDerWaalsContact C-N 3.31Å; Q617-A619 PolarHBondContact O-N 3.23Å; Q617-Y620 HydrophobicContact CB-CD2 4.22Å; Q617-Y620 PolarHBondContact O-N 2.84Å; Q617-R621 WeakPolarHBondContact O-CB 3.04Å; Q617-R621 PolarHBondContact O-N 2.95Å
618	P	87.1	Confident	90.2	Very high	120 Å²	120	60.5 Å²	60.5	78%	0.779	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-37.2	-176.5	-28.2	36.3	0	0	0	114.3	R621	P618-R621 WeakPolarHBondContact O-CB 3.19Å; P618-R621 PolarHBondContact O-N 3.41Å
619	A	86.2	Confident	90.2	Very high	81 Å²	81	58.3 Å²	58.3	67%	0.669	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-52.8	179.3	0	0	0	0	0	112.1	Q617 R621	Q617-A619 VanDerWaalsContact C-N 3.31Å; Q617-A619 PolarHBondContact O-N 3.23Å; A619-R621 VanDerWaalsContact C-N 3.26Å; A619-R621 PolarHBondContact O-N 3.11Å
620	Y	84.9	Confident	90.1	Very high	93 Å²	93	53.1 Å²	53.1	37%	0.365	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-88.5	11.5	-178.5	-48.3	-66.1	0	0	0	113.1	P588 Q617 A622 D623	P588-Y620 HydrophobicContact CB-CD1 4.11Å; P588-Y620 HydrophobicContact CB-CD2 4.24Å; P588-Y620 HydrophobicContact CB-CE1 4.38Å; P588-Y620 HydrophobicContact CB-CE2 4.49Å; P588-Y620 HydrophobicContact CB-CG 4.04Å; P588-Y620 HydrophobicContact CG-CD1 3.86Å; P588-Y620 HydrophobicContact CG-CD2 4.37Å; P588-Y620 HydrophobicContact CG-CE1 3.66Å; P588-Y620 HydrophobicContact CG-CE2 4.19Å; P588-Y620 HydrophobicContact CG-CG 4.21Å; Q617-Y620 HydrophobicContact CB-CD2 4.22Å; Q617-Y620 PolarHBondContact O-N 2.84Å; Y620-A622 PolarHBondContact O-N 3.39Å; Y620-A622 VanDerWaalsContact O-N 3.08Å; Y620-D623 VanDerWaalsContact O-CB 3.28Å; Y620-D623 WeakPolarHBondContact O-CB 3.27Å; Y620-D623 PolarHBondContact O-N 2.93Å
621	R	84.9	Confident	90.1	Very high	161 Å²	161	50.8 Å²	50.8	61%	0.608	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-57.4	-26.3	175.8	-176.2	169.5	-176.3	76.2	-3.4	112.4	Q617 P618 A619 R627	Q617-R621 WeakPolarHBondContact O-CB 3.04Å; Q617-R621 PolarHBondContact O-N 2.95Å; P618-R621 WeakPolarHBondContact O-CB 3.19Å; P618-R621 PolarHBondContact O-N 3.41Å; A619-R621 VanDerWaalsContact C-N 3.26Å; A619-R621 PolarHBondContact O-N 3.11Å; R621-R627 PolarHBondContact O-NH1 3.33Å; R621-R627 PolarHBondContact O-NH2 2.87Å
622	A	84.2	Confident	90.1	Very high	74 Å²	74	53.7 Å²	53.7	61%	0.612	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-91.2	-3.1	178.2	0	0	0	0	0	114.7	Y620 A624 R627	Y620-A622 PolarHBondContact O-N 3.39Å; Y620-A622 VanDerWaalsContact O-N 3.08Å; A622-A624 PolarHBondContact O-N 3.26Å; A622-R627 PolarHBondContact O-NH1 3.28Å
623	D	88.5	Confident	90.1	Very high	37 Å²	37	52.6 Å²	52.6	20%	0.198	27%	0.268	C	S	.	.			trans	-53.7	133.9	-174.1	172.5	37	0	0	0	113.3	I614 Y620 F625 A626 R627	I614-D623 HydrophobicContact CG2-CB 4.42Å; Y620-D623 VanDerWaalsContact O-CB 3.28Å; Y620-D623 WeakPolarHBondContact O-CB 3.27Å; Y620-D623 PolarHBondContact O-N 2.93Å; D623-F625 PolarHBondContact OD1-N 2.97Å; D623-A626 WeakPolarHBondContact OD2-CA 3.42Å; D623-A626 WeakPolarHBondContact OD2-CB 3.3Å; D623-A626 PolarHBondContact OD2-N 3.12Å; D623-R627 WeakPolarHBondContact O-CD 3.42Å; D623-R627 VanDerWaalsContact O-CG 3.3Å; D623-R627 WeakPolarHBondContact O-CG 3.42Å; D623-R627 PolarHBondContact O-NH1 3.14Å
624	A	90.3	Very high	90.1	Very high	32 Å²	32	49.7 Å²	49.7	26%	0.264	26%	0.257	S	S	.	.	H	α-helix	trans	-81.4	-38.9	176.6	0	0	0	0	0	112.1	A622 R627 I628 V662	A622-A624 PolarHBondContact O-N 3.26Å; A624-R627 WeakPolarHBondContact O-CB 3.29Å; A624-R627 PolarHBondContact O-N 3.13Å; A624-I628 HydrophobicContact CB-CD1 4.41Å; A624-I628 WeakPolarHBondContact O-CB 3.25Å; A624-I628 WeakPolarHBondContact O-CD1 3.49Å; A624-I628 VanDerWaalsContact O-CG1 3.25Å; A624-I628 WeakPolarHBondContact O-CG1 3.26Å; A624-I628 PolarHBondContact O-N 3.17Å; A624-V662 HydrophobicContact CB-CG1 3.91Å; A624-V662 HydrophobicContact CB-CG2 4.41Å
625	F	89.8	Confident	90.2	Very high	43 Å²	43	50.6 Å²	50.6	19%	0.189	26%	0.262	C	S	.	.	H	α-helix	trans	-70	-48.4	-170.4	-167	-85.3	0	0	0	112.1	T592 L596 D623 R627 I628 C629 S1014	T592-F625 HydrophobicContact CG2-CD1 3.49Å; T592-F625 VanDerWaalsContact CG2-CD1 3.49Å; T592-F625 HydrophobicContact CG2-CE1 3.4Å; T592-F625 HydrophobicContact CG2-CZ 4.4Å; L596-F625 HydrophobicContact CD1-CE1 4.13Å; L596-F625 HydrophobicContact CD1-CZ 4.16Å; L596-F625 HydrophobicContact CD2-CE1 4.28Å; L596-F625 HydrophobicContact CD2-CZ 4.42Å; L596-F625 HydrophobicContact CG-CE1 4.45Å; D623-F625 PolarHBondContact OD1-N 2.97Å; F625-R627 VanDerWaalsContact C-N 3.28Å; F625-R627 PolarHBondContact O-N 3.21Å; F625-I628 PolarHBondContact O-N 3.05Å; F625-C629 WeakPolarHBondContact CE1-SG 3.45Å; F625-C629 WeakPolarHBondContact O-CB 3.49Å; F625-C629 PolarHBondContact O-N 3.46Å; F625-C629 PolarHBondContact O-SG 3.33Å; F625-C629 VanDerWaalsContact O-SG 3.35Å; F625-S1014 WeakPolarHBondContact CB-OG 3.39Å; F625-S1014 VanDerWaalsContact CD2-O 3.28Å; F625-S1014 WeakPolarHBondContact CD2-O 3.41Å; F625-S1014 WeakPolarHBondContact CE2-O 3.39Å; F625-S1014 WeakPolarHBondContact CG-OG 3.43Å
626	A	91.8	Very high	90.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.4	-34.7	174.5	0	0	0	0	0	111.9	F611 I614 I615 D623 C629 L630	F611-A626 HydrophobicContact CB-CB 4.19Å; F611-A626 HydrophobicContact CD1-CB 4.13Å; I614-A626 HydrophobicContact CB-CB 4.14Å; I614-A626 HydrophobicContact CD1-CB 4.12Å; I614-A626 HydrophobicContact CG2-CB 4.17Å; I615-A626 HydrophobicContact CG2-CB 4.04Å; D623-A626 WeakPolarHBondContact OD2-CA 3.42Å; D623-A626 WeakPolarHBondContact OD2-CB 3.3Å; D623-A626 PolarHBondContact OD2-N 3.12Å; A626-C629 PolarHBondContact O-N 3.48Å; A626-L630 WeakPolarHBondContact O-CB 3.27Å; A626-L630 VanDerWaalsContact O-CG 3.26Å; A626-L630 WeakPolarHBondContact O-CG 3.26Å; A626-L630 PolarHBondContact O-N 3.04Å
627	R	93.2	Very high	89.9	Confident	44 Å²	44	45 Å²	45	17%	0.166	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-47.2	172.1	-82.7	-178.6	174.9	66.3	0.4	112.4	R621 A622 D623 A624 F625 C629 L630 G631 F658 V662	R621-R627 PolarHBondContact O-NH1 3.33Å; R621-R627 PolarHBondContact O-NH2 2.87Å; A622-R627 PolarHBondContact O-NH1 3.28Å; D623-R627 WeakPolarHBondContact O-CD 3.42Å; D623-R627 VanDerWaalsContact O-CG 3.3Å; D623-R627 WeakPolarHBondContact O-CG 3.42Å; D623-R627 PolarHBondContact O-NH1 3.14Å; A624-R627 WeakPolarHBondContact O-CB 3.29Å; A624-R627 PolarHBondContact O-N 3.13Å; F625-R627 VanDerWaalsContact C-N 3.28Å; F625-R627 PolarHBondContact O-N 3.21Å; R627-C629 VanDerWaalsContact C-N 3.29Å; R627-C629 PolarHBondContact O-N 3.13Å; R627-L630 PolarHBondContact O-N 2.97Å; R627-G631 PolarHBondContact O-N 2.9Å; R627-F658 HydrophobicContact CG-CD1 4.27Å; R627-V662 HydrophobicContact CB-CG2 3.48Å; R627-V662 VanDerWaalsContact CB-CG2 3.48Å; R627-V662 VanDerWaalsContact CD-CG2 3.45Å; R627-V662 HydrophobicContact CG-CG2 4.15Å
628	I	93.5	Very high	89.7	Confident	13 Å²	13	44.8 Å²	44.8	7%	0.067	25%	0.25	C	S	.	.	H	α-helix	trans	-61.6	-42.7	177.6	-70.1	156	0	0	0	109.4	A624 F625 G631 N632 V662 W671	A624-I628 HydrophobicContact CB-CD1 4.41Å; A624-I628 WeakPolarHBondContact O-CB 3.25Å; A624-I628 WeakPolarHBondContact O-CD1 3.49Å; A624-I628 VanDerWaalsContact O-CG1 3.25Å; A624-I628 WeakPolarHBondContact O-CG1 3.26Å; A624-I628 PolarHBondContact O-N 3.17Å; F625-I628 PolarHBondContact O-N 3.05Å; I628-G631 PolarHBondContact O-N 3.42Å; I628-N632 VanDerWaalsContact O-CB 3.3Å; I628-N632 WeakPolarHBondContact O-CB 3.19Å; I628-N632 PolarHBondContact O-N 2.71Å; I628-N632 PolarHBondContact O-ND2 3.27Å; I628-N632 PolarHBondContact O-OD1 2.96Å; I628-V662 HydrophobicContact CG1-CG2 4.31Å; I628-W671 HydrophobicContact CD1-CB 3.77Å; I628-W671 HydrophobicContact CG1-CB 4.35Å; I628-W671 HydrophobicContact CG2-CB 4.2Å
629	C	92.2	Very high	89.4	Confident	8 Å²	8	45 Å²	45	5%	0.054	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-43.4	174.8	-71.7	0	0	0	0	112.9	F611 F625 A626 R627 N632 I633	F611-C629 HydrophobicContact CD1-CB 3.85Å; F611-C629 HydrophobicContact CD2-CB 3.87Å; F611-C629 HydrophobicContact CE1-CB 3.7Å; F611-C629 HydrophobicContact CE2-CB 3.73Å; F611-C629 HydrophobicContact CG-CB 3.94Å; F611-C629 HydrophobicContact CZ-CB 3.64Å; F625-C629 WeakPolarHBondContact CE1-SG 3.45Å; F625-C629 WeakPolarHBondContact O-CB 3.49Å; F625-C629 PolarHBondContact O-N 3.46Å; F625-C629 PolarHBondContact O-SG 3.33Å; F625-C629 VanDerWaalsContact O-SG 3.35Å; A626-C629 PolarHBondContact O-N 3.48Å; R627-C629 VanDerWaalsContact C-N 3.29Å; R627-C629 PolarHBondContact O-N 3.13Å; C629-N632 PolarHBondContact O-N 2.89Å; C629-I633 VanDerWaalsContact O-CG1 3.3Å; C629-I633 WeakPolarHBondContact O-CG1 3.47Å; C629-I633 PolarHBondContact O-N 3.26Å
630	L	93.5	Very high	89.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-43.6	174.3	-73.6	166.2	0	0	0	111.7	Q608 F611 I615 A626 R627 N632 I633 W634 F658	Q608-L630 HydrophobicContact CG-CD2 3.53Å; F611-L630 HydrophobicContact CB-CD1 4.11Å; F611-L630 HydrophobicContact CB-CD2 3.92Å; F611-L630 HydrophobicContact CB-CG 3.73Å; I615-L630 HydrophobicContact CD1-CD1 3.55Å; I615-L630 HydrophobicContact CG1-CD1 4.18Å; I615-L630 HydrophobicContact CG2-CD1 4.47Å; A626-L630 WeakPolarHBondContact O-CB 3.27Å; A626-L630 VanDerWaalsContact O-CG 3.26Å; A626-L630 WeakPolarHBondContact O-CG 3.26Å; A626-L630 PolarHBondContact O-N 3.04Å; R627-L630 PolarHBondContact O-N 2.97Å; L630-N632 VanDerWaalsContact C-N 3.34Å; L630-N632 PolarHBondContact O-N 2.67Å; L630-I633 WeakPolarHBondContact O-CB 3.4Å; L630-I633 PolarHBondContact O-N 3.39Å; L630-W634 PolarHBondContact O-N 3.34Å; L630-F658 HydrophobicContact CB-CD1 4.06Å; L630-F658 HydrophobicContact CB-CD2 4.26Å; L630-F658 HydrophobicContact CB-CE1 3.99Å; L630-F658 HydrophobicContact CB-CE2 4.22Å; L630-F658 HydrophobicContact CB-CG 4.2Å; L630-F658 HydrophobicContact CB-CZ 4.08Å; L630-F658 HydrophobicContact CD1-CD1 4.41Å; L630-F658 HydrophobicContact CD1-CE1 3.81Å; L630-F658 HydrophobicContact CD1-CZ 4.22Å
631	G	93.2	Very high	88.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.7	-45.2	173.2	0	0	0	0	0	112.1	R627 I628 I633 W634 L635 Y659	R627-G631 PolarHBondContact O-N 2.9Å; I628-G631 PolarHBondContact O-N 3.42Å; G631-I633 PolarHBondContact O-N 2.91Å; G631-W634 PolarHBondContact O-N 3.01Å; G631-L635 WeakPolarHBondContact O-CB 3.38Å; G631-L635 PolarHBondContact O-N 3.41Å; G631-Y659 PolarHBondContact O-OH 3.24Å
632	N	92.5	Very high	88.3	Confident	62 Å²	62	42.4 Å²	42.4	33%	0.332	24%	0.235	S	C	.	.	H	α-helix	trans	-65.2	-37	176.7	-68.4	-11.3	0	0	0	112.1	I628 C629 L630 L635 T636 Y659	I628-N632 VanDerWaalsContact O-CB 3.3Å; I628-N632 WeakPolarHBondContact O-CB 3.19Å; I628-N632 PolarHBondContact O-N 2.71Å; I628-N632 PolarHBondContact O-ND2 3.27Å; I628-N632 PolarHBondContact O-OD1 2.96Å; C629-N632 PolarHBondContact O-N 2.89Å; L630-N632 VanDerWaalsContact C-N 3.34Å; L630-N632 PolarHBondContact O-N 2.67Å; N632-L635 WeakPolarHBondContact O-CB 3.26Å; N632-L635 PolarHBondContact O-N 3.08Å; N632-T636 WeakPolarHBondContact O-CG2 3.43Å; N632-T636 PolarHBondContact O-N 2.73Å; N632-Y659 PolarHBondContact N-OH 3.18Å; N632-Y659 PolarHBondContact OD1-OH 2.84Å
633	I	92.1	Very high	87.9	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.026	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-45.8	171.3	-74.5	166.4	0	0	0	110.5	L599 V604 A607 Q608 F611 C629 L630 G631 L635 T636 T637	L599-I633 HydrophobicContact CD2-CD1 4.13Å; L599-I633 HydrophobicContact CD2-CG1 3.98Å; V604-I633 HydrophobicContact CG1-CG1 4.3Å; V604-I633 HydrophobicContact CG1-CG2 3.71Å; A607-I633 HydrophobicContact CB-CD1 4.34Å; Q608-I633 HydrophobicContact CB-CD1 4.17Å; Q608-I633 HydrophobicContact CG-CG2 4.44Å; F611-I633 HydrophobicContact CD2-CD1 3.84Å; F611-I633 HydrophobicContact CE2-CD1 4.08Å; C629-I633 VanDerWaalsContact O-CG1 3.3Å; C629-I633 WeakPolarHBondContact O-CG1 3.47Å; C629-I633 PolarHBondContact O-N 3.26Å; L630-I633 WeakPolarHBondContact O-CB 3.4Å; L630-I633 PolarHBondContact O-N 3.39Å; G631-I633 PolarHBondContact O-N 2.91Å; I633-L635 VanDerWaalsContact C-N 3.33Å; I633-L635 PolarHBondContact O-N 3.29Å; I633-T636 PolarHBondContact O-N 3.38Å; I633-T636 PolarHBondContact O-OG1 2.87Å; I633-T637 WeakPolarHBondContact O-CG2 3.44Å; I633-T637 PolarHBondContact O-N 3.25Å
634	W	92.3	Very high	87.8	Confident	30 Å²	30	50.8 Å²	50.8	11%	0.114	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-36.8	174.9	-71.1	106	0	0	0	112	L630 G631 T637 H651 R654 A655 F658	L630-W634 PolarHBondContact O-N 3.34Å; G631-W634 PolarHBondContact O-N 3.01Å; W634-T637 PolarHBondContact O-N 3.29Å; W634-T637 PolarHBondContact O-OG1 3.04Å; W634-H651 HydrophobicContact CE3-CB 4.38Å; W634-H651 AromaticContact CE3-CG 3.97Å; W634-H651 AromaticContact CE3-ND1 3.88Å; W634-H651 AromaticContact CZ3-CE1 3.79Å; W634-H651 AromaticContact CZ3-ND1 3.91Å; W634-H651 AromaticContact CZ3-NE2 3.91Å; W634-R654 HydrophobicContact CD2-CB 4.05Å; W634-R654 HydrophobicContact CE3-CB 4.45Å; W634-R654 HydrophobicContact CG-CB 4.05Å; W634-A655 HydrophobicContact CB-CB 3.83Å; W634-F658 AromaticContact CD1-CD2 3.81Å; W634-F658 AromaticContact CD1-CE2 3.5Å; W634-F658 AromaticContact NE1-CE2 3.53Å
635	L	92.3	Very high	87.5	Confident	19 Å²	19	57 Å²	57	10%	0.099	28%	0.281	C	S	.	.	H	α-helix	trans	-61.2	-47.1	175.6	-171.2	76.7	0	0	0	112.4	G631 N632 I633 T637 L638 C678 V679	G631-L635 WeakPolarHBondContact O-CB 3.38Å; G631-L635 PolarHBondContact O-N 3.41Å; N632-L635 WeakPolarHBondContact O-CB 3.26Å; N632-L635 PolarHBondContact O-N 3.08Å; I633-L635 VanDerWaalsContact C-N 3.33Å; I633-L635 PolarHBondContact O-N 3.29Å; L635-T637 VanDerWaalsContact C-N 3.25Å; L635-T637 PolarHBondContact O-N 3.02Å; L635-L638 HydrophobicContact CD1-CD1 4.34Å; L635-L638 VanDerWaalsContact O-CB 3.28Å; L635-L638 WeakPolarHBondContact O-CB 3.34Å; L635-L638 PolarHBondContact O-N 3.33Å; L635-C678 HydrophobicContact CD1-CB 3.71Å; L635-C678 HydrophobicContact CD2-CB 3.73Å; L635-C678 HydrophobicContact CG-CB 4.36Å; L635-V679 HydrophobicContact CD1-CG2 3.66Å
636	T	88.2	Confident	87.4	Confident	66 Å²	66	59.1 Å²	59.1	41%	0.405	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-32	-179.8	57.9	0	0	0	0	112.4	N632 I633 L638 H639	N632-T636 WeakPolarHBondContact O-CG2 3.43Å; N632-T636 PolarHBondContact O-N 2.73Å; I633-T636 PolarHBondContact O-N 3.38Å; I633-T636 PolarHBondContact O-OG1 2.87Å; T636-L638 PolarHBondContact O-N 3.48Å; T636-L638 VanDerWaalsContact O-N 3.15Å; T636-H639 WeakPolarHBondContact O-CB 3.45Å; T636-H639 PolarHBondContact O-N 3.3Å
637	T	87.4	Confident	87.2	Confident	36 Å²	36	64.1 Å²	64.1	22%	0.221	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-22	174.7	69.8	0	0	0	0	113.8	I633 W634 L635 H639 H651	I633-T637 WeakPolarHBondContact O-CG2 3.44Å; I633-T637 PolarHBondContact O-N 3.25Å; W634-T637 PolarHBondContact O-N 3.29Å; W634-T637 PolarHBondContact O-OG1 3.04Å; L635-T637 VanDerWaalsContact C-N 3.25Å; L635-T637 PolarHBondContact O-N 3.02Å; T637-H639 VanDerWaalsContact C-N 3.32Å; T637-H651 PolarHBondContact OG1-ND1 2.9Å
638	L	85.3	Confident	86.9	Confident	17 Å²	17	67.3 Å²	67.3	9%	0.089	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-18.7	176.1	-56.6	175.8	0	0	0	113.1	L635 T636 H640 I642 R648 H651 Q652 H682	L635-L638 HydrophobicContact CD1-CD1 4.34Å; L635-L638 VanDerWaalsContact O-CB 3.28Å; L635-L638 WeakPolarHBondContact O-CB 3.34Å; L635-L638 PolarHBondContact O-N 3.33Å; T636-L638 PolarHBondContact O-N 3.48Å; T636-L638 VanDerWaalsContact O-N 3.15Å; L638-H640 VanDerWaalsContact C-N 3.29Å; L638-I642 HydrophobicContact CD2-CD1 4.39Å; L638-R648 HydrophobicContact CD2-CG 4.11Å; L638-H651 HydrophobicContact CD2-CB 3.62Å; L638-Q652 HydrophobicContact CD1-CB 4.5Å; L638-Q652 HydrophobicContact CD1-CG 3.62Å; L638-Q652 HydrophobicContact CD2-CG 3.78Å; L638-Q652 HydrophobicContact CG-CG 4.38Å; L638-H682 HydrophobicContact CD1-CB 4.36Å
639	H	80.2	Confident	86.7	Confident	123 Å²	123	72.8 Å²	72.8	57%	0.569	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-22.5	179.9	-65.6	-169.7	0	0	0	111.8	T636 T637 H682	T636-H639 WeakPolarHBondContact O-CB 3.45Å; T636-H639 PolarHBondContact O-N 3.3Å; T637-H639 VanDerWaalsContact C-N 3.32Å; H639-H682 AromaticContact CD2-CE1 3.46Å; H639-H682 PolarHBondContact CD2-CE1 2.91Å; H639-H682 VanDerWaalsContact CD2-CE1 3.46Å; H639-H682 AromaticContact CD2-NE2 3.2Å; H639-H682 PolarHBondContact CD2-NE2 3.43Å; H639-H682 AromaticContact NE2-CE1 3.8Å; H639-H682 AromaticContact NE2-NE2 3.12Å; H639-H682 PolarHBondContact NE2-NE2 3.1Å; H639-H682 VanDerWaalsContact NE2-NE2 3.12Å
640	H	81.1	Confident	86.7	Confident	137 Å²	137	80.3 Å²	80.3	63%	0.634	38%	0.379	S	S	*	.	S	Bend	trans	-80.2	145.4	171.1	-61.5	-71.2	0	0	0	110.8	L638 I642	L638-H640 VanDerWaalsContact C-N 3.29Å; H640-I642 VanDerWaalsContact C-N 3.33Å; H640-I642 PolarHBondContact O-N 3.41Å
641	P	74.8	Confident	86.5	Confident	120 Å²	120	81.4 Å²	81.4	78%	0.779	38%	0.384	S	S	*	.			trans	-72.8	80.6	-175.8	29.3	-35.7	0	0	0	112.6	K643	P641-K643 PolarHBondContact O-N 3.26Å; P641-K643 VanDerWaalsContact O-N 3.1Å
642	I	78.7	Confident	86.5	Confident	24 Å²	24	82 Å²	82	12%	0.123	39%	0.387	C	S	.	.			trans	-65.3	109.6	172.4	-49.5	177.6	0	0	0	108.5	L638 H640 D644 K647 R648	L638-I642 HydrophobicContact CD2-CD1 4.39Å; H640-I642 VanDerWaalsContact C-N 3.33Å; H640-I642 PolarHBondContact O-N 3.41Å; I642-D644 VanDerWaalsContact C-N 3.33Å; I642-D644 HydrophobicContact CG2-CB 4.37Å; I642-D644 VanDerWaalsContact CG2-O 3.26Å; I642-D644 WeakPolarHBondContact CG2-O 3.43Å; I642-K647 HydrophobicContact CG2-CB 4.06Å; I642-K647 HydrophobicContact CG2-CD 4.22Å; I642-K647 HydrophobicContact CG2-CG 4.11Å; I642-R648 HydrophobicContact CB-CB 4.43Å; I642-R648 HydrophobicContact CD1-CB 4.41Å; I642-R648 HydrophobicContact CD1-CG 4.5Å; I642-R648 HydrophobicContact CG2-CB 4.45Å; I642-R648 PolarHBondContact O-NH2 3.07Å
643	K	75.2	Confident	86.5	Confident	209 Å²	209	82.5 Å²	82.5	91%	0.909	39%	0.389	S	S	*	.			trans	-64.6	-36.4	177	-67.8	-175.2	177.8	-178.8	0	112.7	P641	P641-K643 PolarHBondContact O-N 3.26Å; P641-K643 VanDerWaalsContact O-N 3.1Å
644	D	85.4	Confident	86.5	Confident	78 Å²	78	88.2 Å²	88.2	42%	0.417	41%	0.41	S	S	.	.			trans	-78.5	122.7	178.5	174.4	11.2	0	0	0	111.2	I642 D646 K647 R648	I642-D644 VanDerWaalsContact C-N 3.33Å; I642-D644 HydrophobicContact CG2-CB 4.37Å; I642-D644 VanDerWaalsContact CG2-O 3.26Å; I642-D644 WeakPolarHBondContact CG2-O 3.43Å; D644-D646 PolarHBondContact OD1-N 3.01Å; D644-K647 HydrophobicContact CB-CB 4.02Å; D644-K647 PolarHBondContact OD1-N 3.42Å; D644-K647 WeakPolarHBondContact OD2-CB 3.3Å; D644-K647 PolarHBondContact OD2-N 2.81Å; D644-R648 PolarHBondContact O-N 3.24Å
645	K	84.2	Confident	86.6	Confident	164 Å²	164	86.8 Å²	86.8	71%	0.713	41%	0.405	S	S	*	.	H	α-helix	trans	-69.1	-35.1	177.8	-69.6	-177	178	-179.9	0	112.3	R648 K649	K645-R648 WeakPolarHBondContact O-CB 3.12Å; K645-R648 PolarHBondContact O-N 3.31Å; K645-K649 PolarHBondContact O-N 3.43Å
646	D	87.7	Confident	86.7	Confident	87 Å²	87	87 Å²	87	47%	0.465	41%	0.406	S	S	.	.	H	α-helix	trans	-78.1	-40.4	-174.3	-66.2	-17.6	0	0	0	110.8	D644 R648 K649 R650	D644-D646 PolarHBondContact OD1-N 3.01Å; D646-R648 VanDerWaalsContact C-N 3.28Å; D646-R648 PolarHBondContact O-N 3.26Å; D646-K649 PolarHBondContact O-N 2.96Å; D646-R650 WeakPolarHBondContact O-CB 3.31Å; D646-R650 WeakPolarHBondContact O-CG 3.48Å; D646-R650 PolarHBondContact O-N 3.48Å
647	K	88.1	Confident	87	Confident	105 Å²	105	86.9 Å²	86.9	46%	0.457	41%	0.408	S	S	.	.	H	α-helix	trans	-57.8	-41.2	166.6	-175.7	171.1	-175.1	176.6	0	111.5	I642 D644 R650 H651	I642-K647 HydrophobicContact CG2-CB 4.06Å; I642-K647 HydrophobicContact CG2-CD 4.22Å; I642-K647 HydrophobicContact CG2-CG 4.11Å; D644-K647 HydrophobicContact CB-CB 4.02Å; D644-K647 PolarHBondContact OD1-N 3.42Å; D644-K647 WeakPolarHBondContact OD2-CB 3.3Å; D644-K647 PolarHBondContact OD2-N 2.81Å; K647-R650 PolarHBondContact O-N 3.4Å; K647-H651 VanDerWaalsContact CE-NE2 3.26Å; K647-H651 WeakPolarHBondContact CE-NE2 3.48Å; K647-H651 WeakPolarHBondContact CG-NE2 3.5Å; K647-H651 PolarHBondContact O-CD2 3.35Å; K647-H651 PolarHBondContact O-N 3.29Å
648	R	88.1	Confident	87.3	Confident	111 Å²	111	87 Å²	87	42%	0.419	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-47.9	176.6	-167.2	-172.5	-58.3	-160.1	0.5	112.2	L638 I642 D644 K645 D646 H651 Q652	L638-R648 HydrophobicContact CD2-CG 4.11Å; I642-R648 HydrophobicContact CB-CB 4.43Å; I642-R648 HydrophobicContact CD1-CB 4.41Å; I642-R648 HydrophobicContact CD1-CG 4.5Å; I642-R648 HydrophobicContact CG2-CB 4.45Å; I642-R648 PolarHBondContact O-NH2 3.07Å; D644-R648 PolarHBondContact O-N 3.24Å; K645-R648 WeakPolarHBondContact O-CB 3.12Å; K645-R648 PolarHBondContact O-N 3.31Å; D646-R648 VanDerWaalsContact C-N 3.28Å; D646-R648 PolarHBondContact O-N 3.26Å; R648-H651 PolarHBondContact O-N 2.94Å; R648-Q652 WeakPolarHBondContact O-CG 3.43Å; R648-Q652 PolarHBondContact O-N 2.86Å
649	K	89	Confident	87.8	Confident	128 Å²	128	86.2 Å²	86.2	56%	0.557	40%	0.401	S	S	*	.	H	α-helix	trans	-55.3	-55.6	173.9	-75.7	-173.1	173.4	-170.2	0	111	K645 D646 H651 Q652 D653	K645-K649 PolarHBondContact O-N 3.43Å; D646-K649 PolarHBondContact O-N 2.96Å; K649-H651 PolarHBondContact O-N 3.45Å; K649-Q652 WeakPolarHBondContact O-CA 3.2Å; K649-Q652 WeakPolarHBondContact O-CB 3.33Å; K649-Q652 PolarHBondContact O-N 2.68Å; K649-D653 VanDerWaalsContact C-OD2 3.31Å; K649-D653 VanDerWaalsContact O-CG 3.22Å; K649-D653 PolarHBondContact O-N 3.21Å
650	R	90.8	Very high	88.4	Confident	166 Å²	166	82.9 Å²	82.9	63%	0.626	39%	0.385	S	S	*	.	H	α-helix	trans	-53.9	-33.3	178.9	-68.3	169.1	-167.4	177.3	7.4	113.6	D646 K647 R654	D646-R650 WeakPolarHBondContact O-CB 3.31Å; D646-R650 WeakPolarHBondContact O-CG 3.48Å; D646-R650 PolarHBondContact O-N 3.48Å; K647-R650 PolarHBondContact O-N 3.4Å; R650-R654 WeakPolarHBondContact O-CB 3.24Å; R650-R654 WeakPolarHBondContact O-CD 3.48Å; R650-R654 WeakPolarHBondContact O-CG 3.4Å; R650-R654 PolarHBondContact O-N 3.4Å
651	H	91	Very high	88.9	Confident	22 Å²	22	78.2 Å²	78.2	10%	0.102	37%	0.371	C	S	.	.	H	α-helix	trans	-75.1	-41.9	175.1	-76.1	-138.5	0	0	0	112.2	W634 T637 L638 K647 R648 K649 A655	W634-H651 HydrophobicContact CE3-CB 4.38Å; W634-H651 AromaticContact CE3-CG 3.97Å; W634-H651 AromaticContact CE3-ND1 3.88Å; W634-H651 AromaticContact CZ3-CE1 3.79Å; W634-H651 AromaticContact CZ3-ND1 3.91Å; W634-H651 AromaticContact CZ3-NE2 3.91Å; T637-H651 PolarHBondContact OG1-ND1 2.9Å; L638-H651 HydrophobicContact CD2-CB 3.62Å; K647-H651 VanDerWaalsContact CE-NE2 3.26Å; K647-H651 WeakPolarHBondContact CE-NE2 3.48Å; K647-H651 WeakPolarHBondContact CG-NE2 3.5Å; K647-H651 PolarHBondContact O-CD2 3.35Å; K647-H651 PolarHBondContact O-N 3.29Å; R648-H651 PolarHBondContact O-N 2.94Å; K649-H651 PolarHBondContact O-N 3.45Å; H651-A655 PolarHBondContact O-N 3.4Å; H651-A655 VanDerWaalsContact O-N 3.08Å
652	Q	91.7	Very high	89.8	Confident	14 Å²	14	72.7 Å²	72.7	7%	0.065	33%	0.334	C	S	.	.	H	α-helix	trans	-60.6	-46.8	173.5	-70.7	172.8	-24	0	0	111.7	L638 R648 K649 R654 A655 L656 V679 H682	L638-Q652 HydrophobicContact CD1-CB 4.5Å; L638-Q652 HydrophobicContact CD1-CG 3.62Å; L638-Q652 HydrophobicContact CD2-CG 3.78Å; L638-Q652 HydrophobicContact CG-CG 4.38Å; R648-Q652 WeakPolarHBondContact O-CG 3.43Å; R648-Q652 PolarHBondContact O-N 2.86Å; K649-Q652 WeakPolarHBondContact O-CA 3.2Å; K649-Q652 WeakPolarHBondContact O-CB 3.33Å; K649-Q652 PolarHBondContact O-N 2.68Å; Q652-R654 VanDerWaalsContact C-N 3.33Å; Q652-R654 PolarHBondContact O-N 3.29Å; Q652-A655 PolarHBondContact O-N 2.88Å; Q652-L656 WeakPolarHBondContact O-CG 3.44Å; Q652-L656 PolarHBondContact O-N 3.29Å; Q652-V679 HydrophobicContact CB-CG1 3.85Å; Q652-V679 HydrophobicContact CG-CG1 4.11Å; Q652-H682 PolarHBondContact NE2-O 3.31Å; Q652-H682 VanDerWaalsContact NE2-O 3.09Å
653	D	92.6	Very high	90.4	Very high	71 Å²	71	73.1 Å²	73.1	38%	0.38	34%	0.337	S	S	.	.	H	α-helix	trans	-72.6	-29.9	-175.2	-54.4	-37.2	0	0	0	111.3	K649 S657 K683	K649-D653 VanDerWaalsContact C-OD2 3.31Å; K649-D653 VanDerWaalsContact O-CG 3.22Å; K649-D653 PolarHBondContact O-N 3.21Å; D653-S657 WeakPolarHBondContact O-CB 3.36Å; D653-S657 PolarHBondContact O-N 2.92Å; D653-K683 IonicContact OD1-NZ 3.41Å; D653-K683 PolarHBondContact OD1-NZ 3.22Å
654	R	92.8	Very high	91.1	Very high	126 Å²	126	67.5 Å²	67.5	48%	0.475	32%	0.323	S	S	.	.	H	α-helix	trans	-63	-50.3	166.4	-81	174	-179	-167.4	-1.5	112.2	W634 R650 Q652 L656 S657 F658	W634-R654 HydrophobicContact CD2-CB 4.05Å; W634-R654 HydrophobicContact CE3-CB 4.45Å; W634-R654 HydrophobicContact CG-CB 4.05Å; R650-R654 WeakPolarHBondContact O-CB 3.24Å; R650-R654 WeakPolarHBondContact O-CD 3.48Å; R650-R654 WeakPolarHBondContact O-CG 3.4Å; R650-R654 PolarHBondContact O-N 3.4Å; Q652-R654 VanDerWaalsContact C-N 3.33Å; Q652-R654 PolarHBondContact O-N 3.29Å; R654-L656 VanDerWaalsContact C-N 3.33Å; R654-L656 PolarHBondContact O-N 3.28Å; R654-S657 PolarHBondContact O-N 3.14Å; R654-S657 VanDerWaalsContact O-N 3.1Å; R654-S657 PolarHBondContact O-OG 3.05Å; R654-F658 WeakPolarHBondContact O-CD2 3.4Å; R654-F658 PolarHBondContact O-N 3.35Å
655	A	94.1	Very high	91.2	Very high	0 Å²	0	67.4 Å²	67.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-56.6	-47.9	176.9	0	0	0	0	0	111.3	W634 H651 Q652 S657 F658 Y659 V679	W634-A655 HydrophobicContact CB-CB 3.83Å; H651-A655 PolarHBondContact O-N 3.4Å; H651-A655 VanDerWaalsContact O-N 3.08Å; Q652-A655 PolarHBondContact O-N 2.88Å; A655-S657 VanDerWaalsContact C-N 3.32Å; A655-S657 PolarHBondContact O-N 3.1Å; A655-F658 PolarHBondContact O-N 3.33Å; A655-Y659 HydrophobicContact CB-CE2 4.13Å; A655-Y659 WeakPolarHBondContact O-CD2 3.22Å; A655-Y659 PolarHBondContact O-N 3.48Å; A655-Y659 VanDerWaalsContact O-N 3.16Å; A655-V679 HydrophobicContact CB-CG2 3.89Å
656	L	94.1	Very high	91.2	Very high	23 Å²	23	61.9 Å²	61.9	12%	0.12	31%	0.311	C	S	.	.	H	α-helix	trans	-58.9	-38.8	174.5	-70.6	170.6	0	0	0	112.7	Q652 R654 F658 Y659 K660 I676 V679	Q652-L656 WeakPolarHBondContact O-CG 3.44Å; Q652-L656 PolarHBondContact O-N 3.29Å; R654-L656 VanDerWaalsContact C-N 3.33Å; R654-L656 PolarHBondContact O-N 3.28Å; L656-F658 VanDerWaalsContact C-N 3.33Å; L656-F658 PolarHBondContact O-N 2.96Å; L656-Y659 PolarHBondContact O-N 3.36Å; L656-K660 VanDerWaalsContact O-CB 3.27Å; L656-K660 WeakPolarHBondContact O-CB 3.27Å; L656-K660 WeakPolarHBondContact O-CG 3.49Å; L656-K660 PolarHBondContact O-N 2.67Å; L656-I676 HydrophobicContact CD2-CB 4.42Å; L656-I676 HydrophobicContact CD2-CG1 4.01Å; L656-I676 HydrophobicContact CD2-CG2 4.2Å; L656-V679 HydrophobicContact CD1-CG1 3.93Å; L656-V679 HydrophobicContact CD2-CB 3.91Å; L656-V679 HydrophobicContact CD2-CG1 4.02Å; L656-V679 HydrophobicContact CD2-CG2 4.37Å; L656-V679 HydrophobicContact CG-CB 4.16Å; L656-V679 HydrophobicContact CG-CG1 3.76Å; L656-V679 HydrophobicContact CG-CG2 4.46Å
657	S	94	Very high	91.3	Very high	64 Å²	64	61.4 Å²	61.4	45%	0.448	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-38.4	178.6	75.1	0	0	0	0	113	D653 R654 A655 A661	D653-S657 WeakPolarHBondContact O-CB 3.36Å; D653-S657 PolarHBondContact O-N 2.92Å; R654-S657 PolarHBondContact O-N 3.14Å; R654-S657 VanDerWaalsContact O-N 3.1Å; R654-S657 PolarHBondContact O-OG 3.05Å; A655-S657 VanDerWaalsContact C-N 3.32Å; A655-S657 PolarHBondContact O-N 3.1Å; S657-A661 VanDerWaalsContact O-CB 3.24Å; S657-A661 WeakPolarHBondContact O-CB 3.23Å; S657-A661 PolarHBondContact O-N 3.31Å; S657-A661 VanDerWaalsContact O-N 3.1Å
658	F	94.1	Very high	91.1	Very high	39 Å²	39	63.7 Å²	63.7	17%	0.171	32%	0.319	C	S	.	.	H	α-helix	trans	-69.5	-46.2	175.5	-71.8	-71.3	0	0	0	111.7	I615 R627 L630 W634 R654 A655 L656 A661 V662	I615-F658 HydrophobicContact CD1-CE1 4.21Å; R627-F658 HydrophobicContact CG-CD1 4.27Å; L630-F658 HydrophobicContact CB-CD1 4.06Å; L630-F658 HydrophobicContact CB-CD2 4.26Å; L630-F658 HydrophobicContact CB-CE1 3.99Å; L630-F658 HydrophobicContact CB-CE2 4.22Å; L630-F658 HydrophobicContact CB-CG 4.2Å; L630-F658 HydrophobicContact CB-CZ 4.08Å; L630-F658 HydrophobicContact CD1-CD1 4.41Å; L630-F658 HydrophobicContact CD1-CE1 3.81Å; L630-F658 HydrophobicContact CD1-CZ 4.22Å; W634-F658 AromaticContact CD1-CD2 3.81Å; W634-F658 AromaticContact CD1-CE2 3.5Å; W634-F658 AromaticContact NE1-CE2 3.53Å; R654-F658 WeakPolarHBondContact O-CD2 3.4Å; R654-F658 PolarHBondContact O-N 3.35Å; A655-F658 PolarHBondContact O-N 3.33Å; L656-F658 VanDerWaalsContact C-N 3.33Å; L656-F658 PolarHBondContact O-N 2.96Å; F658-A661 PolarHBondContact O-N 3.06Å; F658-V662 PolarHBondContact O-N 2.96Å
659	Y	95.5	Very high	91.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-68.7	-42	179.6	-56.5	-50.6	0	0	0	113	G631 N632 A655 L656 A661 V662 L663 G675 I676 V679	G631-Y659 PolarHBondContact O-OH 3.24Å; N632-Y659 PolarHBondContact N-OH 3.18Å; N632-Y659 PolarHBondContact OD1-OH 2.84Å; A655-Y659 HydrophobicContact CB-CE2 4.13Å; A655-Y659 WeakPolarHBondContact O-CD2 3.22Å; A655-Y659 PolarHBondContact O-N 3.48Å; A655-Y659 VanDerWaalsContact O-N 3.16Å; L656-Y659 PolarHBondContact O-N 3.36Å; Y659-A661 VanDerWaalsContact C-N 3.3Å; Y659-A661 PolarHBondContact O-N 3.36Å; Y659-V662 PolarHBondContact O-N 3.5Å; Y659-V662 VanDerWaalsContact O-N 3.14Å; Y659-L663 PolarHBondContact O-N 3.36Å; Y659-G675 VanDerWaalsContact CE2-C 3.44Å; Y659-G675 VanDerWaalsContact CZ-CA 3.5Å; Y659-I676 HydrophobicContact CD2-CG1 4.14Å; Y659-I676 HydrophobicContact CG-CG1 4.23Å; Y659-V679 HydrophobicContact CE2-CG2 4.13Å
660	K	93.7	Very high	91.2	Very high	52 Å²	52	55.2 Å²	55.2	23%	0.226	29%	0.287	C	S	.	.	H	α-helix	trans	-57.8	-43.6	172.5	-77.2	-167.8	177.4	-168	0	110.3	L656 V662 L663 C664 D1042	L656-K660 VanDerWaalsContact O-CB 3.27Å; L656-K660 WeakPolarHBondContact O-CB 3.27Å; L656-K660 WeakPolarHBondContact O-CG 3.49Å; L656-K660 PolarHBondContact O-N 2.67Å; K660-V662 VanDerWaalsContact C-N 3.27Å; K660-V662 PolarHBondContact O-N 3.1Å; K660-L663 PolarHBondContact O-N 3.32Å; K660-C664 PolarHBondContact O-N 3.42Å; K660-C664 PolarHBondContact O-SG 3.37Å; K660-D1042 IonicContact NZ-OD2 2.65Å; K660-D1042 PolarHBondContact NZ-OD2 3.33Å
661	A	92.3	Very high	91.2	Very high	40 Å²	40	50.7 Å²	50.7	33%	0.331	27%	0.27	S	S	.	.	H	α-helix	trans	-63.6	-28	177.8	0	0	0	0	0	114	S657 F658 Y659	S657-A661 VanDerWaalsContact O-CB 3.24Å; S657-A661 WeakPolarHBondContact O-CB 3.23Å; S657-A661 PolarHBondContact O-N 3.31Å; S657-A661 VanDerWaalsContact O-N 3.1Å; F658-A661 PolarHBondContact O-N 3.06Å; Y659-A661 VanDerWaalsContact C-N 3.3Å; Y659-A661 PolarHBondContact O-N 3.36Å
662	V	93.4	Very high	91.3	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.018	27%	0.265	C	S	.	.	H	α-helix	trans	-74.4	-47.9	171	178.4	0	0	0	0	111	A624 R627 I628 F658 Y659 K660 C664 A665 D666 N669 A672	A624-V662 HydrophobicContact CB-CG1 3.91Å; A624-V662 HydrophobicContact CB-CG2 4.41Å; R627-V662 HydrophobicContact CB-CG2 3.48Å; R627-V662 VanDerWaalsContact CB-CG2 3.48Å; R627-V662 VanDerWaalsContact CD-CG2 3.45Å; R627-V662 HydrophobicContact CG-CG2 4.15Å; I628-V662 HydrophobicContact CG1-CG2 4.31Å; F658-V662 PolarHBondContact O-N 2.96Å; Y659-V662 PolarHBondContact O-N 3.5Å; Y659-V662 VanDerWaalsContact O-N 3.14Å; K660-V662 VanDerWaalsContact C-N 3.27Å; K660-V662 PolarHBondContact O-N 3.1Å; V662-C664 PolarHBondContact O-N 2.94Å; V662-A665 WeakPolarHBondContact O-CA 3.29Å; V662-A665 PolarHBondContact O-N 3.48Å; V662-D666 PolarHBondContact O-N 3.48Å; V662-N669 HydrophobicContact CG1-CB 3.75Å; V662-A672 HydrophobicContact CB-CB 3.84Å; V662-A672 HydrophobicContact CG1-CB 3.84Å
663	L	90.8	Very high	91.4	Very high	33 Å²	33	50.2 Å²	50.2	17%	0.173	27%	0.272	C	S	.	.	H	α-helix	trans	-65.5	-24.4	179.9	-70.5	179.9	0	0	0	113.8	Y659 K660 A665 D666 P667 N669 A672 I676	Y659-L663 PolarHBondContact O-N 3.36Å; K660-L663 PolarHBondContact O-N 3.32Å; L663-A665 VanDerWaalsContact C-N 3.27Å; L663-D666 CarbonylContact O-C 3.59Å; L663-P667 WeakPolarHBondContact O-CA 3.36Å; L663-N669 HydrophobicContact CD2-CB 4.17Å; L663-A672 HydrophobicContact CD2-CB 4.01Å; L663-A672 HydrophobicContact CG-CB 3.84Å; L663-I676 HydrophobicContact CD1-CD1 3.55Å
664	C	90.8	Very high	91.4	Very high	91 Å²	91	47.7 Å²	47.7	62%	0.615	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-19.3	170.1	-69.2	0	0	0	0	113.5	K660 V662	K660-C664 PolarHBondContact O-N 3.42Å; K660-C664 PolarHBondContact O-SG 3.37Å; V662-C664 PolarHBondContact O-N 2.94Å
665	A	87.2	Confident	91.4	Very high	76 Å²	76	41.7 Å²	41.7	63%	0.628	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.5	-45.3	177.4	0	0	0	0	0	112.1	V662 L663	V662-A665 WeakPolarHBondContact O-CA 3.29Å; V662-A665 PolarHBondContact O-N 3.48Å; L663-A665 VanDerWaalsContact C-N 3.27Å
666	D	84.4	Confident	91.4	Very high	49 Å²	49	41.9 Å²	41.9	26%	0.262	24%	0.236	S	C	.	.			trans	-129.1	101.5	168.9	174	38.2	0	0	0	110.6	V662 L663 R668 N669	V662-D666 PolarHBondContact O-N 3.48Å; L663-D666 CarbonylContact O-C 3.59Å; D666-R668 PolarHBondContact O-N 3.3Å; D666-R668 PolarHBondContact OD1-N 2.97Å; D666-R668 IonicContact OD1-NE 2.8Å; D666-R668 PolarHBondContact OD1-NE 2.89Å; D666-R668 IonicContact OD1-NH2 3.29Å; D666-N669 HydrophobicContact CB-CB 4.41Å; D666-N669 WeakPolarHBondContact O-CB 3.33Å; D666-N669 PolarHBondContact O-N 2.88Å; D666-N669 VanDerWaalsContact O-N 3.13Å; D666-N669 PolarHBondContact OD2-N 3.4Å
667	P	88.4	Confident	91.3	Very high	76 Å²	76	40.8 Å²	40.8	49%	0.494	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-10.5	177.5	-25.6	35.5	0	0	0	115.2	L663	L663-P667 WeakPolarHBondContact O-CA 3.36Å
668	R	84.1	Confident	91.3	Very high	154 Å²	154	38.4 Å²	38.4	58%	0.581	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	0.9	178.3	-60.4	170.5	-62	166.5	7.3	113.1	D666 I670	D666-R668 PolarHBondContact O-N 3.3Å; D666-R668 PolarHBondContact OD1-N 2.97Å; D666-R668 IonicContact OD1-NE 2.8Å; D666-R668 PolarHBondContact OD1-NE 2.89Å; D666-R668 IonicContact OD1-NH2 3.29Å; R668-I670 PolarHBondContact O-N 3.33Å
669	N	89.2	Confident	91.2	Very high	24 Å²	24	36.6 Å²	36.6	13%	0.128	21%	0.206	C	C	.	.			trans	-68.7	97.9	-173.4	-166.3	-73	0	0	0	112.5	V662 L663 D666 W671 A672 A673	V662-N669 HydrophobicContact CG1-CB 3.75Å; L663-N669 HydrophobicContact CD2-CB 4.17Å; D666-N669 HydrophobicContact CB-CB 4.41Å; D666-N669 WeakPolarHBondContact O-CB 3.33Å; D666-N669 PolarHBondContact O-N 2.88Å; D666-N669 VanDerWaalsContact O-N 3.13Å; D666-N669 PolarHBondContact OD2-N 3.4Å; N669-W671 VanDerWaalsContact C-N 3.26Å; N669-W671 PolarHBondContact O-N 3.47Å; N669-W671 PolarHBondContact OD1-N 3.01Å; N669-A672 HydrophobicContact CB-CB 4.22Å; N669-A672 PolarHBondContact O-N 3.43Å; N669-A672 PolarHBondContact OD1-N 2.85Å; N669-A673 PolarHBondContact O-N 3.34Å; N669-A673 VanDerWaalsContact O-N 3.15Å
670	I	91.2	Very high	91.1	Very high	36 Å²	36	38 Å²	38	19%	0.185	21%	0.213	C	C	.	.	H	α-helix	trans	-56.7	-39.6	-176.4	-59.2	169.1	0	0	0	111.6	R668 A673 H674 V696 A699 T700 F703	R668-I670 PolarHBondContact O-N 3.33Å; I670-A673 PolarHBondContact O-N 2.89Å; I670-H674 VanDerWaalsContact O-CB 3.31Å; I670-H674 WeakPolarHBondContact O-CB 3.24Å; I670-H674 PolarHBondContact O-N 3.21Å; I670-V696 HydrophobicContact CG2-CB 4.32Å; I670-V696 HydrophobicContact CG2-CG1 3.76Å; I670-V696 HydrophobicContact CG2-CG2 4.23Å; I670-A699 HydrophobicContact CD1-CB 3.8Å; I670-A699 HydrophobicContact CG1-CB 4.09Å; I670-T700 HydrophobicContact CD1-CG2 3.61Å; I670-F703 HydrophobicContact CG2-CE1 4.4Å
671	W	90.8	Very high	91	Very high	72 Å²	72	37.3 Å²	37.3	27%	0.273	22%	0.218	S	C	.	.	H	α-helix	trans	-67.7	-39.1	-178.2	-63.5	108.3	0	0	0	112.9	I628 N669 H674 G675 F703	I628-W671 HydrophobicContact CD1-CB 3.77Å; I628-W671 HydrophobicContact CG1-CB 4.35Å; I628-W671 HydrophobicContact CG2-CB 4.2Å; N669-W671 VanDerWaalsContact C-N 3.26Å; N669-W671 PolarHBondContact O-N 3.47Å; N669-W671 PolarHBondContact OD1-N 3.01Å; W671-H674 PolarHBondContact O-N 3.1Å; W671-G675 PolarHBondContact O-N 3.47Å; W671-F703 HydrophobicContact CE3-CE2 4.18Å; W671-F703 HydrophobicContact CE3-CZ 4.12Å; W671-F703 HydrophobicContact CH2-CB 4.27Å; W671-F703 AromaticContact CH2-CD1 3.78Å; W671-F703 HydrophobicContact CH2-CD1 3.78Å; W671-F703 AromaticContact CH2-CD2 3.66Å; W671-F703 HydrophobicContact CH2-CD2 3.66Å; W671-F703 AromaticContact CH2-CE1 3.87Å; W671-F703 HydrophobicContact CH2-CE1 3.87Å; W671-F703 AromaticContact CH2-CE2 3.76Å; W671-F703 HydrophobicContact CH2-CE2 3.76Å; W671-F703 AromaticContact CH2-CG 3.66Å; W671-F703 HydrophobicContact CH2-CG 3.66Å; W671-F703 AromaticContact CH2-CZ 3.85Å; W671-F703 HydrophobicContact CH2-CZ 3.85Å; W671-F703 HydrophobicContact CZ2-CD1 4.23Å; W671-F703 HydrophobicContact CZ2-CE1 4.23Å; W671-F703 HydrophobicContact CZ3-CD1 4.38Å; W671-F703 AromaticContact CZ3-CD2 3.67Å; W671-F703 HydrophobicContact CZ3-CD2 3.67Å; W671-F703 HydrophobicContact CZ3-CE1 4.14Å; W671-F703 AromaticContact CZ3-CE2 3.38Å; W671-F703 HydrophobicContact CZ3-CE2 3.38Å; W671-F703 HydrophobicContact CZ3-CG 4.17Å; W671-F703 AromaticContact CZ3-CZ 3.63Å; W671-F703 HydrophobicContact CZ3-CZ 3.63Å
672	A	92.5	Very high	90.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-40.4	173.8	0	0	0	0	0	111.9	V662 L663 N669 G675 I676	V662-A672 HydrophobicContact CB-CB 3.84Å; V662-A672 HydrophobicContact CG1-CB 3.84Å; L663-A672 HydrophobicContact CD2-CB 4.01Å; L663-A672 HydrophobicContact CG-CB 3.84Å; N669-A672 HydrophobicContact CB-CB 4.22Å; N669-A672 PolarHBondContact O-N 3.43Å; N669-A672 PolarHBondContact OD1-N 2.85Å; A672-G675 PolarHBondContact O-N 3.49Å; A672-I676 WeakPolarHBondContact O-CG1 3.48Å; A672-I676 PolarHBondContact O-N 3.24Å
673	A	92.9	Very high	90.7	Very high	25 Å²	25	42.2 Å²	42.2	21%	0.207	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-45.1	173.1	0	0	0	0	0	112.1	N669 I670 G675 I676 G677 V692 V696	N669-A673 PolarHBondContact O-N 3.34Å; N669-A673 VanDerWaalsContact O-N 3.15Å; I670-A673 PolarHBondContact O-N 2.89Å; A673-G675 VanDerWaalsContact C-N 3.34Å; A673-G675 PolarHBondContact O-N 3.45Å; A673-I676 PolarHBondContact O-N 3.2Å; A673-G677 PolarHBondContact O-N 3.23Å; A673-V692 WeakPolarHBondContact O-CG1 3.46Å; A673-V696 HydrophobicContact CB-CG2 3.99Å
674	H	92.7	Very high	90.6	Very high	18 Å²	18	43.1 Å²	43.1	8%	0.083	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-44.1	174.9	-179.2	-103.8	0	0	0	111.8	I670 W671 I676 G677 C678 F693 V696 F703 N709	I670-H674 VanDerWaalsContact O-CB 3.31Å; I670-H674 WeakPolarHBondContact O-CB 3.24Å; I670-H674 PolarHBondContact O-N 3.21Å; W671-H674 PolarHBondContact O-N 3.1Å; H674-I676 PolarHBondContact O-N 3.18Å; H674-G677 PolarHBondContact O-N 2.88Å; H674-C678 PolarHBondContact O-N 3.2Å; H674-C678 PolarHBondContact O-SG 3.4Å; H674-C678 VanDerWaalsContact O-SG 3.32Å; H674-F693 AromaticContact CD2-CD1 3.81Å; H674-F693 AromaticContact CD2-CE1 3.57Å; H674-F693 AromaticContact NE2-CE1 3.96Å; H674-V696 HydrophobicContact CB-CG1 4.28Å; H674-V696 HydrophobicContact CB-CG2 4.2Å; H674-F703 AromaticContact NE2-CE2 3.99Å; H674-N709 PolarHBondContact CE1-ND2 3.33Å; H674-N709 PolarHBondContact NE2-ND2 2.82Å
675	G	92.5	Very high	90.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-42.9	173.9	0	0	0	0	0	113.7	Y659 W671 A672 A673 C678 V679	Y659-G675 VanDerWaalsContact CE2-C 3.44Å; Y659-G675 VanDerWaalsContact CZ-CA 3.5Å; W671-G675 PolarHBondContact O-N 3.47Å; A672-G675 PolarHBondContact O-N 3.49Å; A673-G675 VanDerWaalsContact C-N 3.34Å; A673-G675 PolarHBondContact O-N 3.45Å; G675-C678 WeakPolarHBondContact O-CB 3.46Å; G675-C678 PolarHBondContact O-N 3.15Å; G675-V679 PolarHBondContact O-N 3.19Å; G675-V679 VanDerWaalsContact O-N 3.09Å
676	I	94	Very high	90.9	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-43.2	174.2	-69.7	169.9	0	0	0	111	L656 Y659 L663 A672 A673 H674 C678 V679 L680	L656-I676 HydrophobicContact CD2-CB 4.42Å; L656-I676 HydrophobicContact CD2-CG1 4.01Å; L656-I676 HydrophobicContact CD2-CG2 4.2Å; Y659-I676 HydrophobicContact CD2-CG1 4.14Å; Y659-I676 HydrophobicContact CG-CG1 4.23Å; L663-I676 HydrophobicContact CD1-CD1 3.55Å; A672-I676 WeakPolarHBondContact O-CG1 3.48Å; A672-I676 PolarHBondContact O-N 3.24Å; A673-I676 PolarHBondContact O-N 3.2Å; H674-I676 PolarHBondContact O-N 3.18Å; I676-C678 VanDerWaalsContact C-N 3.26Å; I676-C678 PolarHBondContact O-N 2.93Å; I676-V679 PolarHBondContact O-N 2.88Å; I676-V679 VanDerWaalsContact O-N 3.07Å; I676-L680 HydrophobicContact CG2-CD1 3.92Å; I676-L680 HydrophobicContact CG2-CG 4.16Å; I676-L680 WeakPolarHBondContact O-CG 3.45Å; I676-L680 PolarHBondContact O-N 3.15Å
677	G	93.1	Very high	91.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-55.1	-41.5	174	0	0	0	0	0	112.5	A673 H674 L680 A681 A689	A673-G677 PolarHBondContact O-N 3.23Å; H674-G677 PolarHBondContact O-N 2.88Å; G677-L680 PolarHBondContact O-N 3.03Å; G677-A681 PolarHBondContact O-N 3.29Å; G677-A689 WeakPolarHBondContact O-CB 3.2Å
678	C	93.1	Very high	91.5	Very high	15 Å²	15	44.4 Å²	44.4	10%	0.101	23%	0.229	C	C	.	.	H	α-helix	trans	-64.6	-41.8	174.2	-62.8	0	0	0	0	112.6	L635 H674 G675 I676 A681 H682	L635-C678 HydrophobicContact CD1-CB 3.71Å; L635-C678 HydrophobicContact CD2-CB 3.73Å; L635-C678 HydrophobicContact CG-CB 4.36Å; H674-C678 PolarHBondContact O-N 3.2Å; H674-C678 PolarHBondContact O-SG 3.4Å; H674-C678 VanDerWaalsContact O-SG 3.32Å; G675-C678 WeakPolarHBondContact O-CB 3.46Å; G675-C678 PolarHBondContact O-N 3.15Å; I676-C678 VanDerWaalsContact C-N 3.26Å; I676-C678 PolarHBondContact O-N 2.93Å; C678-A681 PolarHBondContact O-N 3.13Å; C678-H682 PolarHBondContact O-CD2 2.84Å; C678-H682 VanDerWaalsContact O-CD2 3.23Å; C678-H682 PolarHBondContact O-N 3.15Å; C678-H682 VanDerWaalsContact O-N 3.09Å
679	V	93.1	Very high	92	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-70.4	-36.4	177.5	-175.2	0	0	0	0	112	L635 Q652 A655 L656 Y659 G675 I676 H682 K683	L635-V679 HydrophobicContact CD1-CG2 3.66Å; Q652-V679 HydrophobicContact CB-CG1 3.85Å; Q652-V679 HydrophobicContact CG-CG1 4.11Å; A655-V679 HydrophobicContact CB-CG2 3.89Å; L656-V679 HydrophobicContact CD1-CG1 3.93Å; L656-V679 HydrophobicContact CD2-CB 3.91Å; L656-V679 HydrophobicContact CD2-CG1 4.02Å; L656-V679 HydrophobicContact CD2-CG2 4.37Å; L656-V679 HydrophobicContact CG-CB 4.16Å; L656-V679 HydrophobicContact CG-CG1 3.76Å; L656-V679 HydrophobicContact CG-CG2 4.46Å; Y659-V679 HydrophobicContact CE2-CG2 4.13Å; G675-V679 PolarHBondContact O-N 3.19Å; G675-V679 VanDerWaalsContact O-N 3.09Å; I676-V679 PolarHBondContact O-N 2.88Å; I676-V679 VanDerWaalsContact O-N 3.07Å; V679-H682 CarbonylContact O-C 3.54Å; V679-H682 PolarHBondContact O-N 2.79Å; V679-H682 VanDerWaalsContact O-N 3.17Å; V679-K683 PolarHBondContact O-N 2.87Å
680	L	93	Very high	92.1	Very high	30 Å²	30	40.2 Å²	40.2	16%	0.157	21%	0.211	C	C	.	.	H	α-helix	trans	-60.4	-44.5	173.7	-73.4	173.5	0	0	0	111.2	I676 G677 H682 K683 G684 F685 E688 A689 V692	I676-L680 HydrophobicContact CG2-CD1 3.92Å; I676-L680 HydrophobicContact CG2-CG 4.16Å; I676-L680 WeakPolarHBondContact O-CG 3.45Å; I676-L680 PolarHBondContact O-N 3.15Å; G677-L680 PolarHBondContact O-N 3.03Å; L680-H682 VanDerWaalsContact C-N 3.33Å; L680-H682 PolarHBondContact O-N 3.49Å; L680-K683 CarbonylContact O-C 3.43Å; L680-K683 PolarHBondContact O-N 3.12Å; L680-K683 VanDerWaalsContact O-N 3.09Å; L680-G684 PolarHBondContact O-N 3.1Å; L680-F685 HydrophobicContact CB-CB 4.23Å; L680-F685 HydrophobicContact CD2-CB 4.16Å; L680-F685 HydrophobicContact CD2-CD2 4.02Å; L680-F685 HydrophobicContact CD2-CG 4.44Å; L680-F685 PolarHBondContact O-N 3.13Å; L680-E688 HydrophobicContact CD1-CB 4.29Å; L680-A689 HydrophobicContact CB-CB 4Å; L680-V692 HydrophobicContact CD1-CG2 4.1Å
681	A	92.4	Very high	92.2	Very high	38 Å²	38	41.6 Å²	41.6	31%	0.314	22%	0.219	S	C	.	.	H	α-helix	trans	-59.1	-42.1	172.7	0	0	0	0	0	112.1	G677 C678 K683 G684 A689 I713	G677-A681 PolarHBondContact O-N 3.29Å; C678-A681 PolarHBondContact O-N 3.13Å; A681-K683 VanDerWaalsContact C-N 3.32Å; A681-K683 PolarHBondContact O-N 3.41Å; A681-G684 PolarHBondContact O-N 3.25Å; A681-G684 VanDerWaalsContact O-N 3.13Å; A681-A689 HydrophobicContact CB-CB 4.14Å; A681-I713 HydrophobicContact CB-CD1 4.13Å
682	H	89.4	Confident	92.3	Very high	72 Å²	72	38.6 Å²	38.6	33%	0.333	21%	0.209	S	C	.	.	H	α-helix	trans	-69.2	-21.9	174.1	-82.8	-67	0	0	0	114.7	L638 H639 Q652 C678 V679 L680	L638-H682 HydrophobicContact CD1-CB 4.36Å; H639-H682 AromaticContact CD2-CE1 3.46Å; H639-H682 PolarHBondContact CD2-CE1 2.91Å; H639-H682 VanDerWaalsContact CD2-CE1 3.46Å; H639-H682 AromaticContact CD2-NE2 3.2Å; H639-H682 PolarHBondContact CD2-NE2 3.43Å; H639-H682 AromaticContact NE2-CE1 3.8Å; H639-H682 AromaticContact NE2-NE2 3.12Å; H639-H682 PolarHBondContact NE2-NE2 3.1Å; H639-H682 VanDerWaalsContact NE2-NE2 3.12Å; Q652-H682 PolarHBondContact NE2-O 3.31Å; Q652-H682 VanDerWaalsContact NE2-O 3.09Å; C678-H682 PolarHBondContact O-CD2 2.84Å; C678-H682 VanDerWaalsContact O-CD2 3.23Å; C678-H682 PolarHBondContact O-N 3.15Å; C678-H682 VanDerWaalsContact O-N 3.09Å; V679-H682 CarbonylContact O-C 3.54Å; V679-H682 PolarHBondContact O-N 2.79Å; V679-H682 VanDerWaalsContact O-N 3.17Å; L680-H682 VanDerWaalsContact C-N 3.33Å; L680-H682 PolarHBondContact O-N 3.49Å
683	K	88.9	Confident	92.3	Very high	74 Å²	74	38.8 Å²	38.8	32%	0.322	21%	0.209	S	C	.	.	H	α-helix	trans	-83.8	-13.6	169.8	-76.4	-170.4	176	-171.9	0	112.8	D653 V679 L680 A681 F685	D653-K683 IonicContact OD1-NZ 3.41Å; D653-K683 PolarHBondContact OD1-NZ 3.22Å; V679-K683 PolarHBondContact O-N 2.87Å; L680-K683 CarbonylContact O-C 3.43Å; L680-K683 PolarHBondContact O-N 3.12Å; L680-K683 VanDerWaalsContact O-N 3.09Å; A681-K683 VanDerWaalsContact C-N 3.32Å; A681-K683 PolarHBondContact O-N 3.41Å; K683-F685 HydrophobicContact CB-CD2 3.59Å; K683-F685 HydrophobicContact CB-CE2 3.81Å; K683-F685 HydrophobicContact CD-CE2 4.31Å
684	G	88.3	Confident	92.1	Very high	51 Å²	51	38.7 Å²	38.7	53%	0.526	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.6	4.3	-179.6	0	0	0	0	0	114.8	L680 A681 V686	L680-G684 PolarHBondContact O-N 3.1Å; A681-G684 PolarHBondContact O-N 3.25Å; A681-G684 VanDerWaalsContact O-N 3.13Å; G684-V686 VanDerWaalsContact C-N 3.25Å; G684-V686 PolarHBondContact O-N 2.89Å
685	F	92.7	Very high	92	Very high	102 Å²	102	40.9 Å²	40.9	45%	0.447	22%	0.219	S	C	.	.			trans	-81.5	69.1	178.3	-63.8	-61.4	0	0	0	110.5	L680 K683 N687 E688 A689	L680-F685 HydrophobicContact CB-CB 4.23Å; L680-F685 HydrophobicContact CD2-CB 4.16Å; L680-F685 HydrophobicContact CD2-CD2 4.02Å; L680-F685 HydrophobicContact CD2-CG 4.44Å; L680-F685 PolarHBondContact O-N 3.13Å; K683-F685 HydrophobicContact CB-CD2 3.59Å; K683-F685 HydrophobicContact CB-CE2 3.81Å; K683-F685 HydrophobicContact CD-CE2 4.31Å; F685-N687 PolarHBondContact O-N 2.73Å; F685-E688 WeakPolarHBondContact CA-OE2 3.47Å; F685-E688 HydrophobicContact CB-CB 4.07Å; F685-E688 HydrophobicContact CB-CG 4.19Å; F685-E688 VanDerWaalsContact CB-OE2 3.3Å; F685-E688 WeakPolarHBondContact CB-OE2 3.49Å; F685-A689 WeakPolarHBondContact O-CB 3.49Å; F685-A689 PolarHBondContact O-N 2.95Å
686	V	93	Very high	91.9	Very high	39 Å²	39	41 Å²	41	24%	0.236	22%	0.22	C	C	.	.	H	α-helix	trans	-68.3	-31.3	-170.5	178.8	0	0	0	0	112.5	G684 R690 I713 Q717	G684-V686 VanDerWaalsContact C-N 3.25Å; G684-V686 PolarHBondContact O-N 2.89Å; V686-R690 WeakPolarHBondContact O-CB 3.28Å; V686-R690 PolarHBondContact O-N 3.38Å; V686-R690 VanDerWaalsContact O-N 3.09Å; V686-I713 HydrophobicContact CG1-CD1 3.99Å; V686-I713 HydrophobicContact CG1-CG2 4Å; V686-Q717 HydrophobicContact CG1-CG 3.68Å
687	N	91.7	Very high	91.7	Very high	87 Å²	87	44.4 Å²	44.4	47%	0.465	23%	0.232	S	C	.	.	H	α-helix	trans	-79.6	-41.5	-178.8	-63.4	-28.8	0	0	0	110.9	F685 R690 D691 Q717	F685-N687 PolarHBondContact O-N 2.73Å; N687-R690 VanDerWaalsContact O-CB 3.29Å; N687-R690 WeakPolarHBondContact O-CB 3.34Å; N687-R690 PolarHBondContact O-N 3.16Å; N687-D691 VanDerWaalsContact O-CG 3.28Å; N687-D691 PolarHBondContact O-N 3.1Å; N687-Q717 PolarHBondContact OD1-NE2 3.5Å
688	E	92.8	Very high	91.5	Very high	92 Å²	92	49.9 Å²	49.9	43%	0.43	26%	0.258	S	S	.	.	H	α-helix	trans	-65.2	-44	176.7	-56.4	72.8	-167.4	0	0	109.9	L680 F685 D691 V692	L680-E688 HydrophobicContact CD1-CB 4.29Å; F685-E688 WeakPolarHBondContact CA-OE2 3.47Å; F685-E688 HydrophobicContact CB-CB 4.07Å; F685-E688 HydrophobicContact CB-CG 4.19Å; F685-E688 VanDerWaalsContact CB-OE2 3.3Å; F685-E688 WeakPolarHBondContact CB-OE2 3.49Å; E688-D691 PolarHBondContact O-N 3.4Å; E688-V692 WeakPolarHBondContact O-CG2 3.41Å; E688-V692 PolarHBondContact O-N 2.97Å
689	A	94	Very high	91.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-42.1	172.2	0	0	0	0	0	112.2	G677 L680 A681 F685 D691 V692 F693 I713	G677-A689 WeakPolarHBondContact O-CB 3.2Å; L680-A689 HydrophobicContact CB-CB 4Å; A681-A689 HydrophobicContact CB-CB 4.14Å; F685-A689 WeakPolarHBondContact O-CB 3.49Å; F685-A689 PolarHBondContact O-N 2.95Å; A689-D691 VanDerWaalsContact C-N 3.29Å; A689-D691 PolarHBondContact O-N 3.48Å; A689-V692 PolarHBondContact O-N 3.15Å; A689-F693 HydrophobicContact CB-CD2 4.42Å; A689-F693 HydrophobicContact CB-CE2 4.21Å; A689-F693 WeakPolarHBondContact O-CB 3.24Å; A689-F693 WeakPolarHBondContact O-CD2 3.11Å; A689-F693 WeakPolarHBondContact O-CG 3.33Å; A689-F693 PolarHBondContact O-N 3.2Å; A689-I713 HydrophobicContact CB-CD1 3.79Å
690	R	92.7	Very high	90.5	Very high	89 Å²	89	52 Å²	52	34%	0.336	28%	0.276	S	S	.	.	H	α-helix	trans	-55.3	-46.7	174.3	-170.5	-163.3	62.5	-165.1	-6.9	111.2	V686 N687 F693 A694 I713	V686-R690 WeakPolarHBondContact O-CB 3.28Å; V686-R690 PolarHBondContact O-N 3.38Å; V686-R690 VanDerWaalsContact O-N 3.09Å; N687-R690 VanDerWaalsContact O-CB 3.29Å; N687-R690 WeakPolarHBondContact O-CB 3.34Å; N687-R690 PolarHBondContact O-N 3.16Å; R690-F693 PolarHBondContact O-N 2.89Å; R690-A694 WeakPolarHBondContact O-CB 3.43Å; R690-A694 PolarHBondContact O-N 3.22Å; R690-I713 HydrophobicContact CB-CG2 3.73Å; R690-I713 HydrophobicContact CG-CG2 3.98Å
691	D	92.1	Very high	90	Very high	66 Å²	66	51.9 Å²	51.9	35%	0.353	28%	0.279	S	S	.	.	H	α-helix	trans	-75.5	-32.8	-172.5	-64.4	-7.3	0	0	0	111.6	N687 E688 A689 A694 Q695	N687-D691 VanDerWaalsContact O-CG 3.28Å; N687-D691 PolarHBondContact O-N 3.1Å; E688-D691 PolarHBondContact O-N 3.4Å; A689-D691 VanDerWaalsContact C-N 3.29Å; A689-D691 PolarHBondContact O-N 3.48Å; D691-A694 PolarHBondContact O-N 2.96Å; D691-Q695 WeakPolarHBondContact O-CG 3.4Å; D691-Q695 PolarHBondContact O-N 3.09Å
692	V	92.4	Very high	89.5	Confident	9 Å²	9	54.1 Å²	54.1	6%	0.055	29%	0.286	C	S	.	.	H	α-helix	trans	-64.3	-47.7	167.3	171.2	0	0	0	0	111.4	A673 L680 E688 A689 A694 Q695 V696 L1034 I1038	A673-V692 WeakPolarHBondContact O-CG1 3.46Å; L680-V692 HydrophobicContact CD1-CG2 4.1Å; E688-V692 WeakPolarHBondContact O-CG2 3.41Å; E688-V692 PolarHBondContact O-N 2.97Å; A689-V692 PolarHBondContact O-N 3.15Å; V692-A694 VanDerWaalsContact C-N 3.28Å; V692-A694 PolarHBondContact O-N 3.09Å; V692-Q695 PolarHBondContact O-N 2.86Å; V692-V696 WeakPolarHBondContact O-CG2 3.32Å; V692-V696 PolarHBondContact O-N 3.22Å; V692-L1034 HydrophobicContact CG2-CD2 3.86Å; V692-I1038 HydrophobicContact CG2-CD1 4.29Å
693	F	93.2	Very high	89.3	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.013	27%	0.272	C	S	.	.	H	α-helix	trans	-66.9	-28.6	177.9	-69.3	-53.2	0	0	0	112.9	H674 A689 R690 V696 R697 N709 I710 I713	H674-F693 AromaticContact CD2-CD1 3.81Å; H674-F693 AromaticContact CD2-CE1 3.57Å; H674-F693 AromaticContact NE2-CE1 3.96Å; A689-F693 HydrophobicContact CB-CD2 4.42Å; A689-F693 HydrophobicContact CB-CE2 4.21Å; A689-F693 WeakPolarHBondContact O-CB 3.24Å; A689-F693 WeakPolarHBondContact O-CD2 3.11Å; A689-F693 WeakPolarHBondContact O-CG 3.33Å; A689-F693 PolarHBondContact O-N 3.2Å; R690-F693 PolarHBondContact O-N 2.89Å; F693-V696 PolarHBondContact O-N 3.48Å; F693-R697 WeakPolarHBondContact O-CB 3.47Å; F693-R697 PolarHBondContact O-N 3.36Å; F693-N709 HydrophobicContact CD1-CB 4.23Å; F693-N709 HydrophobicContact CD2-CB 4.31Å; F693-N709 HydrophobicContact CE1-CB 3.84Å; F693-N709 HydrophobicContact CE2-CB 3.92Å; F693-N709 HydrophobicContact CG-CB 4.47Å; F693-N709 HydrophobicContact CZ-CB 3.66Å; F693-I710 HydrophobicContact CB-CD1 4.2Å; F693-I710 HydrophobicContact CB-CG1 3.64Å; F693-I710 HydrophobicContact CG-CG1 4.47Å; F693-I713 HydrophobicContact CD2-CG1 4.07Å; F693-I713 HydrophobicContact CE2-CG1 4.17Å
694	A	89.9	Confident	89.3	Confident	23 Å²	23	48.3 Å²	48.3	19%	0.19	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-46.8	172.7	0	0	0	0	0	111.4	R690 D691 V692 V696 R697 E698	R690-A694 WeakPolarHBondContact O-CB 3.43Å; R690-A694 PolarHBondContact O-N 3.22Å; D691-A694 PolarHBondContact O-N 2.96Å; V692-A694 VanDerWaalsContact C-N 3.28Å; V692-A694 PolarHBondContact O-N 3.09Å; A694-V696 PolarHBondContact O-N 3.26Å; A694-R697 PolarHBondContact O-N 3.43Å; A694-E698 WeakPolarHBondContact O-CG 3.43Å; A694-E698 PolarHBondContact O-N 2.89Å
695	Q	89.8	Confident	89.3	Confident	64 Å²	64	49.2 Å²	49.2	30%	0.299	25%	0.254	S	S	.	.	H	α-helix	trans	-63	-41.5	175.7	-68.2	177.1	16.8	0	0	112	D691 V692 R697 E698 A699	D691-Q695 WeakPolarHBondContact O-CG 3.4Å; D691-Q695 PolarHBondContact O-N 3.09Å; V692-Q695 PolarHBondContact O-N 2.86Å; Q695-R697 VanDerWaalsContact C-N 3.32Å; Q695-R697 PolarHBondContact O-N 3.31Å; Q695-E698 PolarHBondContact O-N 3.16Å; Q695-A699 PolarHBondContact O-N 3.46Å
696	V	91.1	Very high	89.2	Confident	4 Å²	4	44.4 Å²	44.4	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-58.2	-42.8	173.3	165	0	0	0	0	111.7	I670 A673 H674 V692 F693 A694 T700 F703 V706	I670-V696 HydrophobicContact CG2-CB 4.32Å; I670-V696 HydrophobicContact CG2-CG1 3.76Å; I670-V696 HydrophobicContact CG2-CG2 4.23Å; A673-V696 HydrophobicContact CB-CG2 3.99Å; H674-V696 HydrophobicContact CB-CG1 4.28Å; H674-V696 HydrophobicContact CB-CG2 4.2Å; V692-V696 WeakPolarHBondContact O-CG2 3.32Å; V692-V696 PolarHBondContact O-N 3.22Å; F693-V696 PolarHBondContact O-N 3.48Å; A694-V696 PolarHBondContact O-N 3.26Å; V696-T700 PolarHBondContact O-N 3.28Å; V696-T700 PolarHBondContact O-OG1 3.49Å; V696-F703 HydrophobicContact CG1-CZ 4.14Å; V696-V706 HydrophobicContact CG1-CB 4.45Å; V696-V706 HydrophobicContact CG1-CG1 3.91Å; V696-V706 HydrophobicContact CG1-CG2 3.69Å
697	R	88.8	Confident	89.1	Confident	74 Å²	74	44.2 Å²	44.2	28%	0.279	23%	0.228	S	C	.	.	H	α-helix	trans	-70.5	-33.7	177.9	-167.8	-166.7	60.5	-167.4	-5.9	113.1	F693 A694 Q695 T700 V706 I710	F693-R697 WeakPolarHBondContact O-CB 3.47Å; F693-R697 PolarHBondContact O-N 3.36Å; A694-R697 PolarHBondContact O-N 3.43Å; Q695-R697 VanDerWaalsContact C-N 3.32Å; Q695-R697 PolarHBondContact O-N 3.31Å; R697-T700 WeakPolarHBondContact CA-O 3.47Å; R697-T700 CarbonylContact O-C 3.58Å; R697-V706 HydrophobicContact CB-CG1 3.66Å; R697-V706 HydrophobicContact CG-CG1 4.16Å; R697-I710 HydrophobicContact CB-CD1 3.95Å; R697-I710 HydrophobicContact CG-CD1 4.25Å
698	E	88.8	Confident	89.2	Confident	116 Å²	116	41 Å²	41	54%	0.542	21%	0.21	S	C	.	.	H	α-helix	trans	-68.9	-38.4	175.8	-77.3	167.6	-155.9	0	0	111.3	A694 Q695 H1027	A694-E698 WeakPolarHBondContact O-CG 3.43Å; A694-E698 PolarHBondContact O-N 2.89Å; Q695-E698 PolarHBondContact O-N 3.16Å; E698-H1027 IonicContact OE2-ND1 2.91Å
699	A	85.4	Confident	89.2	Confident	48 Å²	48	38.1 Å²	38.1	40%	0.397	20%	0.198	S	C	.	.	H	α-helix	trans	-72	-44.5	173.9	0	0	0	0	0	112.8	I670 Q695	I670-A699 HydrophobicContact CD1-CB 3.8Å; I670-A699 HydrophobicContact CG1-CB 4.09Å; Q695-A699 PolarHBondContact O-N 3.46Å
700	T	80.4	Confident	89.1	Confident	11 Å²	11	38.3 Å²	38.3	7%	0.067	20%	0.199	C	C	.	.			trans	-147.1	133.6	177.7	52.4	0	0	0	0	111.9	I670 V696 R697	I670-T700 HydrophobicContact CD1-CG2 3.61Å; V696-T700 PolarHBondContact O-N 3.28Å; V696-T700 PolarHBondContact O-OG1 3.49Å; R697-T700 WeakPolarHBondContact CA-O 3.47Å; R697-T700 CarbonylContact O-C 3.58Å
701	A	83.1	Confident	89.2	Confident	28 Å²	28	34.1 Å²	34.1	23%	0.231	18%	0.183	C	C	.	.			trans	-109.3	12.1	178.4	0	0	0	0	0	112.4	W707 K733	A701-W707 HydrophobicContact CB-CZ2 4.25Å; A701-W707 PolarHBondContact O-NE1 2.9Å; A701-K733 PolarHBondContact O-NZ 2.88Å
702	D	81.6	Confident	89.3	Confident	85 Å²	85	33.5 Å²	33.5	46%	0.455	18%	0.178	S	C	.	.			trans	-109.6	5.4	-153.7	-58.4	-66.8	0	0	0	114.9	K733 F734	D702-K733 WeakPolarHBondContact OD1-CE 3.24Å; D702-K733 IonicContact OD1-NZ 3.3Å; D702-K733 PolarHBondContact OD1-NZ 2.9Å; D702-F734 WeakPolarHBondContact O-CE1 3.46Å
703	F	84.4	Confident	89.4	Confident	11 Å²	11	33.5 Å²	33.5	5%	0.048	18%	0.177	C	C	.	.	S	Bend	trans	-118.5	145.8	162.9	63.8	-80.6	0	0	0	112	I670 W671 H674 V696 D705 V706	I670-F703 HydrophobicContact CG2-CE1 4.4Å; W671-F703 HydrophobicContact CE3-CE2 4.18Å; W671-F703 HydrophobicContact CE3-CZ 4.12Å; W671-F703 HydrophobicContact CH2-CB 4.27Å; W671-F703 AromaticContact CH2-CD1 3.78Å; W671-F703 HydrophobicContact CH2-CD1 3.78Å; W671-F703 AromaticContact CH2-CD2 3.66Å; W671-F703 HydrophobicContact CH2-CD2 3.66Å; W671-F703 AromaticContact CH2-CE1 3.87Å; W671-F703 HydrophobicContact CH2-CE1 3.87Å; W671-F703 AromaticContact CH2-CE2 3.76Å; W671-F703 HydrophobicContact CH2-CE2 3.76Å; W671-F703 AromaticContact CH2-CG 3.66Å; W671-F703 HydrophobicContact CH2-CG 3.66Å; W671-F703 AromaticContact CH2-CZ 3.85Å; W671-F703 HydrophobicContact CH2-CZ 3.85Å; W671-F703 HydrophobicContact CZ2-CD1 4.23Å; W671-F703 HydrophobicContact CZ2-CE1 4.23Å; W671-F703 HydrophobicContact CZ3-CD1 4.38Å; W671-F703 AromaticContact CZ3-CD2 3.67Å; W671-F703 HydrophobicContact CZ3-CD2 3.67Å; W671-F703 HydrophobicContact CZ3-CE1 4.14Å; W671-F703 AromaticContact CZ3-CE2 3.38Å; W671-F703 HydrophobicContact CZ3-CE2 3.38Å; W671-F703 HydrophobicContact CZ3-CG 4.17Å; W671-F703 AromaticContact CZ3-CZ 3.63Å; W671-F703 HydrophobicContact CZ3-CZ 3.63Å; H674-F703 AromaticContact NE2-CE2 3.99Å; V696-F703 HydrophobicContact CG1-CZ 4.14Å; F703-D705 VanDerWaalsContact C-N 3.27Å; F703-D705 HydrophobicContact CD2-CB 3.98Å; F703-D705 HydrophobicContact CE2-CB 4.24Å; F703-D705 PolarHBondContact O-N 3.46Å; F703-V706 HydrophobicContact CD1-CG2 3.98Å; F703-V706 HydrophobicContact CD2-CG2 3.8Å; F703-V706 HydrophobicContact CE1-CG2 3.53Å; F703-V706 HydrophobicContact CE2-CG2 3.33Å; F703-V706 HydrophobicContact CG-CG2 4.1Å; F703-V706 HydrophobicContact CZ-CG2 3.19Å
704	P	88.8	Confident	89.5	Confident	13 Å²	13	35.2 Å²	35.2	8%	0.084	18%	0.184	C	C	.	.	H	α-helix	trans	-58.9	-32.5	-175.3	-27.9	35.9	0	0	0	115.2	V706 W707 I708 F734	P704-V706 VanDerWaalsContact C-N 3.33Å; P704-V706 PolarHBondContact O-N 3.49Å; P704-W707 WeakPolarHBondContact O-CB 3.42Å; P704-W707 PolarHBondContact O-N 3.31Å; P704-W707 VanDerWaalsContact O-N 3.09Å; P704-I708 HydrophobicContact CB-CD1 4.22Å; P704-I708 WeakPolarHBondContact O-CG1 3.3Å; P704-I708 PolarHBondContact O-N 3.36Å; P704-I708 VanDerWaalsContact O-N 3.1Å; P704-F734 HydrophobicContact CB-CD2 4.01Å; P704-F734 HydrophobicContact CB-CE2 4.26Å; P704-F734 HydrophobicContact CG-CB 4.23Å; P704-F734 HydrophobicContact CG-CD1 4.18Å; P704-F734 HydrophobicContact CG-CD2 3.71Å; P704-F734 HydrophobicContact CG-CE2 4.1Å; P704-F734 HydrophobicContact CG-CG 3.76Å; P704-F734 HydrophobicContact CG-CZ 4.48Å
705	D	89.1	Confident	89.7	Confident	70 Å²	70	34.3 Å²	34.3	37%	0.374	18%	0.176	S	C	.	.	H	α-helix	trans	-72.5	-28.3	-161.8	-52.8	-24	0	0	0	112.3	F703 W707 I708 N709	F703-D705 VanDerWaalsContact C-N 3.27Å; F703-D705 HydrophobicContact CD2-CB 3.98Å; F703-D705 HydrophobicContact CE2-CB 4.24Å; F703-D705 PolarHBondContact O-N 3.46Å; D705-W707 VanDerWaalsContact C-N 3.35Å; D705-W707 PolarHBondContact O-N 3.04Å; D705-I708 PolarHBondContact O-N 3.01Å; D705-N709 VanDerWaalsContact O-CB 3.31Å; D705-N709 WeakPolarHBondContact O-CB 3.44Å; D705-N709 VanDerWaalsContact O-CG 3.32Å; D705-N709 PolarHBondContact O-N 2.95Å; D705-N709 PolarHBondContact O-ND2 3.46Å
706	V	89.4	Confident	89.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.4	-47.3	170.1	-166.8	0	0	0	0	111	V696 R697 F703 P704 N709 I710	V696-V706 HydrophobicContact CG1-CB 4.45Å; V696-V706 HydrophobicContact CG1-CG1 3.91Å; V696-V706 HydrophobicContact CG1-CG2 3.69Å; R697-V706 HydrophobicContact CB-CG1 3.66Å; R697-V706 HydrophobicContact CG-CG1 4.16Å; F703-V706 HydrophobicContact CD1-CG2 3.98Å; F703-V706 HydrophobicContact CD2-CG2 3.8Å; F703-V706 HydrophobicContact CE1-CG2 3.53Å; F703-V706 HydrophobicContact CE2-CG2 3.33Å; F703-V706 HydrophobicContact CG-CG2 4.1Å; F703-V706 HydrophobicContact CZ-CG2 3.19Å; P704-V706 VanDerWaalsContact C-N 3.33Å; P704-V706 PolarHBondContact O-N 3.49Å; V706-N709 PolarHBondContact O-N 3.01Å; V706-I710 HydrophobicContact CG1-CD1 3.92Å; V706-I710 WeakPolarHBondContact O-CB 3.46Å; V706-I710 VanDerWaalsContact O-CG1 3.29Å; V706-I710 WeakPolarHBondContact O-CG1 3.46Å; V706-I710 PolarHBondContact O-N 3.11Å
707	W	91.9	Very high	90	Very high	36 Å²	36	37.7 Å²	37.7	14%	0.136	19%	0.192	C	C	.	.	H	α-helix	trans	-66.4	-40.1	-179.7	-61.8	82.7	0	0	0	111.4	A701 P704 D705 A711 M726 N729 C730 K733 F734	A701-W707 HydrophobicContact CB-CZ2 4.25Å; A701-W707 PolarHBondContact O-NE1 2.9Å; P704-W707 WeakPolarHBondContact O-CB 3.42Å; P704-W707 PolarHBondContact O-N 3.31Å; P704-W707 VanDerWaalsContact O-N 3.09Å; D705-W707 VanDerWaalsContact C-N 3.35Å; D705-W707 PolarHBondContact O-N 3.04Å; W707-A711 WeakPolarHBondContact O-CB 3.47Å; W707-A711 PolarHBondContact O-N 3.47Å; W707-M726 HydrophobicContact CE3-SD 3.69Å; W707-M726 HydrophobicContact CZ3-SD 3.77Å; W707-N729 HydrophobicContact CE3-CB 4.13Å; W707-N729 HydrophobicContact CZ3-CB 3.84Å; W707-C730 HydrophobicContact CB-CB 3.74Å; W707-C730 HydrophobicContact CG-CB 4.29Å; W707-K733 HydrophobicContact CZ2-CD 4.4Å; W707-F734 AromaticContact CD1-CE2 3.71Å; W707-F734 AromaticContact NE1-CE2 3.84Å
708	I	93.3	Very high	90.2	Very high	19 Å²	19	41.6 Å²	41.6	10%	0.097	21%	0.211	C	C	.	.	H	α-helix	trans	-63.8	-47	176.5	-65.9	169	0	0	0	110.5	P704 D705 A711 H712 L742 Y745	P704-I708 HydrophobicContact CB-CD1 4.22Å; P704-I708 WeakPolarHBondContact O-CG1 3.3Å; P704-I708 PolarHBondContact O-N 3.36Å; P704-I708 VanDerWaalsContact O-N 3.1Å; D705-I708 PolarHBondContact O-N 3.01Å; I708-A711 CarbonylContact O-C 3.6Å; I708-A711 WeakPolarHBondContact O-CB 3.32Å; I708-A711 PolarHBondContact O-N 3.26Å; I708-H712 WeakPolarHBondContact CG2-CE1 3.46Å; I708-H712 PolarHBondContact O-N 3.25Å; I708-H712 PolarHBondContact O-ND1 3.15Å; I708-L742 HydrophobicContact CD1-CD2 3.68Å; I708-L742 HydrophobicContact CD1-CG 4.38Å; I708-L742 HydrophobicContact CG1-CD2 3.58Å; I708-Y745 HydrophobicContact CG2-CD2 4.42Å; I708-Y745 HydrophobicContact CG2-CE2 4.38Å
709	N	92.7	Very high	90.5	Very high	31 Å²	31	40.3 Å²	40.3	17%	0.166	21%	0.205	C	C	.	.	H	α-helix	trans	-71	-39.2	-177.2	-73.6	-29.9	0	0	0	112.5	H674 F693 D705 V706 A711 H712 I713	H674-N709 PolarHBondContact CE1-ND2 3.33Å; H674-N709 PolarHBondContact NE2-ND2 2.82Å; F693-N709 HydrophobicContact CD1-CB 4.23Å; F693-N709 HydrophobicContact CD2-CB 4.31Å; F693-N709 HydrophobicContact CE1-CB 3.84Å; F693-N709 HydrophobicContact CE2-CB 3.92Å; F693-N709 HydrophobicContact CG-CB 4.47Å; F693-N709 HydrophobicContact CZ-CB 3.66Å; D705-N709 VanDerWaalsContact O-CB 3.31Å; D705-N709 WeakPolarHBondContact O-CB 3.44Å; D705-N709 VanDerWaalsContact O-CG 3.32Å; D705-N709 PolarHBondContact O-N 2.95Å; D705-N709 PolarHBondContact O-ND2 3.46Å; V706-N709 PolarHBondContact O-N 3.01Å; N709-A711 VanDerWaalsContact C-N 3.31Å; N709-A711 PolarHBondContact O-N 2.91Å; N709-H712 WeakPolarHBondContact O-CB 3.39Å; N709-H712 PolarHBondContact O-N 2.98Å; N709-I713 WeakPolarHBondContact O-CG1 3.19Å; N709-I713 PolarHBondContact O-N 3.19Å
710	I	93.2	Very high	91	Very high	5 Å²	5	40.7 Å²	40.7	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-41	169.8	-69.5	173.2	0	0	0	110.8	F693 R697 V706 I713 Y714 M726	F693-I710 HydrophobicContact CB-CD1 4.2Å; F693-I710 HydrophobicContact CB-CG1 3.64Å; F693-I710 HydrophobicContact CG-CG1 4.47Å; R697-I710 HydrophobicContact CB-CD1 3.95Å; R697-I710 HydrophobicContact CG-CD1 4.25Å; V706-I710 HydrophobicContact CG1-CD1 3.92Å; V706-I710 WeakPolarHBondContact O-CB 3.46Å; V706-I710 VanDerWaalsContact O-CG1 3.29Å; V706-I710 WeakPolarHBondContact O-CG1 3.46Å; V706-I710 PolarHBondContact O-N 3.11Å; I710-I713 PolarHBondContact O-N 3.2Å; I710-Y714 HydrophobicContact CG2-CD2 3.83Å; I710-Y714 HydrophobicContact CG2-CE2 3.34Å; I710-Y714 WeakPolarHBondContact O-CD2 3.42Å; I710-Y714 PolarHBondContact O-N 2.64Å; I710-M726 HydrophobicContact CG2-CG 4.27Å
711	A	94	Very high	91.7	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.5	-35.8	176.3	0	0	0	0	0	112.9	W707 I708 N709 Y714 V715 M726 Y727	W707-A711 WeakPolarHBondContact O-CB 3.47Å; W707-A711 PolarHBondContact O-N 3.47Å; I708-A711 CarbonylContact O-C 3.6Å; I708-A711 WeakPolarHBondContact O-CB 3.32Å; I708-A711 PolarHBondContact O-N 3.26Å; N709-A711 VanDerWaalsContact C-N 3.31Å; N709-A711 PolarHBondContact O-N 2.91Å; A711-Y714 PolarHBondContact O-N 2.73Å; A711-V715 WeakPolarHBondContact O-CB 3.43Å; A711-V715 VanDerWaalsContact O-CG2 3.31Å; A711-V715 WeakPolarHBondContact O-CG2 3.48Å; A711-V715 PolarHBondContact O-N 2.88Å; A711-M726 HydrophobicContact CB-CB 3.78Å; A711-Y727 HydrophobicContact CB-CD1 3.74Å; A711-Y727 HydrophobicContact CB-CD2 3.9Å; A711-Y727 HydrophobicContact CB-CE1 3.44Å; A711-Y727 VanDerWaalsContact CB-CE1 3.44Å; A711-Y727 HydrophobicContact CB-CE2 3.6Å; A711-Y727 HydrophobicContact CB-CG 3.94Å
712	H	94.3	Very high	92.2	Very high	54 Å²	54	44.6 Å²	44.6	25%	0.25	22%	0.22	C	C	.	.	H	α-helix	trans	-61.3	-46.1	170.7	-72.1	145.5	0	0	0	111.7	I708 N709 Y714 V715 E716 Y727 Y745	I708-H712 WeakPolarHBondContact CG2-CE1 3.46Å; I708-H712 PolarHBondContact O-N 3.25Å; I708-H712 PolarHBondContact O-ND1 3.15Å; N709-H712 WeakPolarHBondContact O-CB 3.39Å; N709-H712 PolarHBondContact O-N 2.98Å; H712-Y714 PolarHBondContact O-N 2.81Å; H712-V715 WeakPolarHBondContact O-CB 3.34Å; H712-V715 PolarHBondContact O-N 2.77Å; H712-V715 VanDerWaalsContact O-N 3.15Å; H712-E716 PolarHBondContact O-N 2.79Å; H712-E716 VanDerWaalsContact O-N 3.16Å; H712-Y727 PolarHBondContact CD2-OH 3.34Å; H712-Y727 PolarHBondContact N-OH 2.7Å; H712-Y745 AromaticContact NE2-CD1 3.9Å; H712-Y745 AromaticContact NE2-CD2 3.93Å; H712-Y745 AromaticContact NE2-CE1 3.99Å; H712-Y745 AromaticContact NE2-CG 3.88Å
713	I	94.3	Very high	92.9	Very high	8 Å²	8	40.6 Å²	40.6	4%	0.041	20%	0.198	C	C	.	.	H	α-helix	trans	-59.3	-46.5	176.2	-69.1	-66.9	0	0	0	111.1	A681 V686 A689 R690 F693 N709 I710 V715 E716 Q717	A681-I713 HydrophobicContact CB-CD1 4.13Å; V686-I713 HydrophobicContact CG1-CD1 3.99Å; V686-I713 HydrophobicContact CG1-CG2 4Å; A689-I713 HydrophobicContact CB-CD1 3.79Å; R690-I713 HydrophobicContact CB-CG2 3.73Å; R690-I713 HydrophobicContact CG-CG2 3.98Å; F693-I713 HydrophobicContact CD2-CG1 4.07Å; F693-I713 HydrophobicContact CE2-CG1 4.17Å; N709-I713 WeakPolarHBondContact O-CG1 3.19Å; N709-I713 PolarHBondContact O-N 3.19Å; I710-I713 PolarHBondContact O-N 3.2Å; I713-V715 VanDerWaalsContact C-N 3.33Å; I713-V715 PolarHBondContact O-N 2.95Å; I713-E716 PolarHBondContact O-N 3.02Å; I713-Q717 HydrophobicContact CG2-CG 4.49Å; I713-Q717 WeakPolarHBondContact O-CG 3.41Å; I713-Q717 PolarHBondContact O-N 3.19Å
714	Y	95.1	Very high	93.4	Very high	39 Å²	39	40.6 Å²	40.6	15%	0.153	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-33.8	174.6	-68.2	-34.7	0	0	0	113.3	I710 A711 H712 E716 Q717 K718 Q719 A722 M726	I710-Y714 HydrophobicContact CG2-CD2 3.83Å; I710-Y714 HydrophobicContact CG2-CE2 3.34Å; I710-Y714 WeakPolarHBondContact O-CD2 3.42Å; I710-Y714 PolarHBondContact O-N 2.64Å; A711-Y714 PolarHBondContact O-N 2.73Å; H712-Y714 PolarHBondContact O-N 2.81Å; Y714-E716 VanDerWaalsContact C-N 3.29Å; Y714-E716 PolarHBondContact O-N 3.23Å; Y714-Q717 PolarHBondContact O-N 2.87Å; Y714-K718 PolarHBondContact O-N 2.85Å; Y714-K718 VanDerWaalsContact O-N 3.15Å; Y714-Q719 HydrophobicContact CD1-CB 4.39Å; Y714-Q719 PolarHBondContact O-N 2.9Å; Y714-A722 HydrophobicContact CD2-CB 3.81Å; Y714-A722 HydrophobicContact CE2-CB 4.05Å; Y714-A722 HydrophobicContact CG-CB 4.11Å; Y714-M726 HydrophobicContact CD2-CG 4.04Å; Y714-M726 HydrophobicContact CE2-CE 4.2Å; Y714-M726 HydrophobicContact CE2-CG 3.87Å
715	V	94.7	Very high	93.7	Very high	4 Å²	4	45.6 Å²	45.6	2%	0.024	22%	0.221	C	C	.	.	H	α-helix	trans	-64.7	-29.7	174.7	161.9	0	0	0	0	112.6	A711 H712 I713 A723 Y727 A749 K752	A711-V715 WeakPolarHBondContact O-CB 3.43Å; A711-V715 VanDerWaalsContact O-CG2 3.31Å; A711-V715 WeakPolarHBondContact O-CG2 3.48Å; A711-V715 PolarHBondContact O-N 2.88Å; H712-V715 WeakPolarHBondContact O-CB 3.34Å; H712-V715 PolarHBondContact O-N 2.77Å; H712-V715 VanDerWaalsContact O-N 3.15Å; I713-V715 VanDerWaalsContact C-N 3.33Å; I713-V715 PolarHBondContact O-N 2.95Å; V715-A723 HydrophobicContact CG2-CB 3.58Å; V715-Y727 HydrophobicContact CG2-CE2 4.05Å; V715-A749 HydrophobicContact CG2-CB 4.09Å; V715-K752 HydrophobicContact CG1-CD 4.04Å; V715-K752 PolarHBondContact O-NZ 3.47Å
716	E	92.3	Very high	93.9	Very high	99 Å²	99	43.6 Å²	43.6	46%	0.463	21%	0.209	S	C	.	.	H	α-helix	trans	-92.3	-30.1	176.2	-62	-50.2	133.3	0	0	112.9	H712 I713 Y714 K718 R748 K752	H712-E716 PolarHBondContact O-N 2.79Å; H712-E716 VanDerWaalsContact O-N 3.16Å; I713-E716 PolarHBondContact O-N 3.02Å; Y714-E716 VanDerWaalsContact C-N 3.29Å; Y714-E716 PolarHBondContact O-N 3.23Å; E716-K718 PolarHBondContact O-N 3.21Å; E716-K718 VanDerWaalsContact O-N 3.1Å; E716-R748 IonicContact OE1-NH2 2.69Å; E716-K752 VanDerWaalsContact CD-NZ 3.33Å; E716-K752 IonicContact OE1-NZ 2.69Å; E716-K752 PolarHBondContact OE1-NZ 3.44Å; E716-K752 IonicContact OE2-NZ 2.77Å; E716-K752 PolarHBondContact OE2-NZ 3.34Å
717	Q	93.3	Very high	94.1	Very high	41 Å²	41	43.7 Å²	43.7	19%	0.192	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	3.1	164.6	-69.1	-176.9	-25.4	0	0	113.6	V686 N687 I713 Y714 Q719	V686-Q717 HydrophobicContact CG1-CG 3.68Å; N687-Q717 PolarHBondContact OD1-NE2 3.5Å; I713-Q717 HydrophobicContact CG2-CG 4.49Å; I713-Q717 WeakPolarHBondContact O-CG 3.41Å; I713-Q717 PolarHBondContact O-N 3.19Å; Y714-Q717 PolarHBondContact O-N 2.87Å; Q717-Q719 HydrophobicContact CB-CG 4.29Å; Q717-Q719 PolarHBondContact O-N 3.42Å
718	K	93.8	Very high	94.2	Very high	155 Å²	155	45.2 Å²	45.2	67%	0.674	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.5	13.2	-178.6	-51.3	176.3	-173.9	170.7	0	115.2	Y714 E716 Y720	Y714-K718 PolarHBondContact O-N 2.85Å; Y714-K718 VanDerWaalsContact O-N 3.15Å; E716-K718 PolarHBondContact O-N 3.21Å; E716-K718 VanDerWaalsContact O-N 3.1Å; K718-Y720 HydrophobicContact CB-CE1 4.17Å; K718-Y720 HydrophobicContact CB-CE2 4.46Å; K718-Y720 PolarHBondContact O-N 3.36Å
719	Q	94.8	Very high	94.1	Very high	89 Å²	89	47.3 Å²	47.3	42%	0.416	23%	0.23	S	C	.	.			trans	-84.5	60.4	179.5	-62.8	-175	-2.9	0	0	110.9	Y714 Q717 T721 A722 A723	Y714-Q719 HydrophobicContact CD1-CB 4.39Å; Y714-Q719 PolarHBondContact O-N 2.9Å; Q717-Q719 HydrophobicContact CB-CG 4.29Å; Q717-Q719 PolarHBondContact O-N 3.42Å; Q719-T721 VanDerWaalsContact C-N 3.29Å; Q719-T721 PolarHBondContact O-N 3.23Å; Q719-A722 HydrophobicContact CB-CB 4.35Å; Q719-A722 PolarHBondContact O-N 3.06Å; Q719-A723 PolarHBondContact O-N 3.26Å
720	Y	96.3	Very high	94.1	Very high	56 Å²	56	45.8 Å²	45.8	22%	0.22	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-32.3	-167.7	-47.4	-49.5	0	0	0	114.1	K718 A723 I724 K752 A753	K718-Y720 HydrophobicContact CB-CE1 4.17Å; K718-Y720 HydrophobicContact CB-CE2 4.46Å; K718-Y720 PolarHBondContact O-N 3.36Å; Y720-A723 PolarHBondContact O-N 2.89Å; Y720-I724 WeakPolarHBondContact O-CB 3.33Å; Y720-I724 WeakPolarHBondContact O-CD1 3.28Å; Y720-I724 WeakPolarHBondContact O-CG1 3.44Å; Y720-I724 PolarHBondContact O-N 3.06Å; Y720-K752 HydrophobicContact CD1-CB 3.81Å; Y720-K752 HydrophobicContact CD1-CD 4.09Å; Y720-K752 HydrophobicContact CD2-CB 4.29Å; Y720-K752 HydrophobicContact CE1-CB 3.59Å; Y720-K752 HydrophobicContact CE1-CD 3.33Å; Y720-K752 HydrophobicContact CE1-CG 4.1Å; Y720-K752 HydrophobicContact CE2-CB 4.08Å; Y720-K752 WeakPolarHBondContact CE2-O 3.4Å; Y720-K752 HydrophobicContact CG-CB 4.17Å; Y720-A753 HydrophobicContact CD2-CB 4.26Å; Y720-A753 HydrophobicContact CG-CB 4.35Å
721	T	94.6	Very high	94	Very high	101 Å²	101	46.7 Å²	46.7	62%	0.62	23%	0.226	S	C	*	.	H	α-helix	trans	-63.2	-46.8	176.1	45.5	0	0	0	0	112	Q719 I724 Q725	Q719-T721 VanDerWaalsContact C-N 3.29Å; Q719-T721 PolarHBondContact O-N 3.23Å; T721-I724 PolarHBondContact O-N 3.44Å; T721-Q725 WeakPolarHBondContact O-CG 3.39Å; T721-Q725 PolarHBondContact O-N 2.86Å; T721-Q725 VanDerWaalsContact O-N 3.1Å
722	A	94.2	Very high	93.8	Very high	21 Å²	21	52.8 Å²	52.8	17%	0.174	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-40.7	174.6	0	0	0	0	0	111.4	Y714 Q719 Q725 M726	Y714-A722 HydrophobicContact CD2-CB 3.81Å; Y714-A722 HydrophobicContact CE2-CB 4.05Å; Y714-A722 HydrophobicContact CG-CB 4.11Å; Q719-A722 HydrophobicContact CB-CB 4.35Å; Q719-A722 PolarHBondContact O-N 3.06Å; A722-Q725 PolarHBondContact O-N 3.45Å; A722-M726 VanDerWaalsContact O-CG 3.31Å; A722-M726 WeakPolarHBondContact O-CG 3.43Å; A722-M726 PolarHBondContact O-N 3.1Å
723	A	95.8	Very high	93.5	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-47.4	175.4	0	0	0	0	0	113	V715 Q719 Y720 Q725 M726 Y727	V715-A723 HydrophobicContact CG2-CB 3.58Å; Q719-A723 PolarHBondContact O-N 3.26Å; Y720-A723 PolarHBondContact O-N 2.89Å; A723-Q725 VanDerWaalsContact C-N 3.32Å; A723-Q725 PolarHBondContact O-N 2.91Å; A723-M726 PolarHBondContact O-N 2.96Å; A723-Y727 HydrophobicContact CB-CE2 4.19Å; A723-Y727 WeakPolarHBondContact O-CD2 3.43Å; A723-Y727 PolarHBondContact O-N 3.42Å
724	I	95.7	Very high	93.2	Very high	12 Å²	12	56.4 Å²	56.4	6%	0.062	27%	0.268	C	S	.	.	H	α-helix	trans	-58.2	-45.8	177.6	-70.5	159.7	0	0	0	110.2	Y720 T721 M726 Y727 E728 A749 A753	Y720-I724 WeakPolarHBondContact O-CB 3.33Å; Y720-I724 WeakPolarHBondContact O-CD1 3.28Å; Y720-I724 WeakPolarHBondContact O-CG1 3.44Å; Y720-I724 PolarHBondContact O-N 3.06Å; T721-I724 PolarHBondContact O-N 3.44Å; I724-M726 PolarHBondContact O-N 3.18Å; I724-Y727 PolarHBondContact O-N 2.6Å; I724-E728 HydrophobicContact CG2-CG 4.48Å; I724-E728 WeakPolarHBondContact O-CB 3.46Å; I724-E728 PolarHBondContact O-N 3.36Å; I724-A749 HydrophobicContact CG1-CB 3.79Å; I724-A753 HydrophobicContact CD1-CB 4.11Å
725	Q	94.5	Very high	92.6	Very high	117 Å²	117	59.1 Å²	59.1	55%	0.547	29%	0.293	S	S	.	.	H	α-helix	trans	-59.3	-42.7	175.8	-71.9	173.2	-8.2	0	0	112.5	T721 A722 A723 E728 N729	T721-Q725 WeakPolarHBondContact O-CG 3.39Å; T721-Q725 PolarHBondContact O-N 2.86Å; T721-Q725 VanDerWaalsContact O-N 3.1Å; A722-Q725 PolarHBondContact O-N 3.45Å; A723-Q725 VanDerWaalsContact C-N 3.32Å; A723-Q725 PolarHBondContact O-N 2.91Å; Q725-E728 PolarHBondContact O-N 3.42Å; Q725-N729 VanDerWaalsContact O-CB 3.24Å; Q725-N729 WeakPolarHBondContact O-CB 3.41Å; Q725-N729 PolarHBondContact O-N 3.43Å; Q725-N729 PolarHBondContact O-ND2 3.34Å; Q725-N729 PolarHBondContact O-OD1 2.92Å
726	M	92.9	Very high	91.9	Very high	28 Å²	28	64.2 Å²	64.2	14%	0.138	31%	0.311	C	S	.	.	H	α-helix	trans	-66.8	-42	178.5	-67.3	-64	157.6	0	0	112.5	W707 I710 A711 Y714 A722 A723 I724 N729 C730	W707-M726 HydrophobicContact CE3-SD 3.69Å; W707-M726 HydrophobicContact CZ3-SD 3.77Å; I710-M726 HydrophobicContact CG2-CG 4.27Å; A711-M726 HydrophobicContact CB-CB 3.78Å; Y714-M726 HydrophobicContact CD2-CG 4.04Å; Y714-M726 HydrophobicContact CE2-CE 4.2Å; Y714-M726 HydrophobicContact CE2-CG 3.87Å; A722-M726 VanDerWaalsContact O-CG 3.31Å; A722-M726 WeakPolarHBondContact O-CG 3.43Å; A722-M726 PolarHBondContact O-N 3.1Å; A723-M726 PolarHBondContact O-N 2.96Å; I724-M726 PolarHBondContact O-N 3.18Å; M726-N729 PolarHBondContact O-N 3.33Å; M726-C730 WeakPolarHBondContact O-CB 3.1Å; M726-C730 PolarHBondContact O-N 3.41Å
727	Y	94.7	Very high	91.3	Very high	2 Å²	2	66.1 Å²	66.1	1%	0.008	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-44.3	173.3	-67.3	-60.3	0	0	0	112.1	A711 H712 V715 A723 I724 N729 C730 I731 L742 Y745 L746 A749	A711-Y727 HydrophobicContact CB-CD1 3.74Å; A711-Y727 HydrophobicContact CB-CD2 3.9Å; A711-Y727 HydrophobicContact CB-CE1 3.44Å; A711-Y727 VanDerWaalsContact CB-CE1 3.44Å; A711-Y727 HydrophobicContact CB-CE2 3.6Å; A711-Y727 HydrophobicContact CB-CG 3.94Å; H712-Y727 PolarHBondContact CD2-OH 3.34Å; H712-Y727 PolarHBondContact N-OH 2.7Å; V715-Y727 HydrophobicContact CG2-CE2 4.05Å; A723-Y727 HydrophobicContact CB-CE2 4.19Å; A723-Y727 WeakPolarHBondContact O-CD2 3.43Å; A723-Y727 PolarHBondContact O-N 3.42Å; I724-Y727 PolarHBondContact O-N 2.6Å; Y727-N729 PolarHBondContact O-N 2.77Å; Y727-C730 WeakPolarHBondContact O-CB 3.49Å; Y727-C730 PolarHBondContact O-N 2.69Å; Y727-I731 VanDerWaalsContact O-CG1 3.32Å; Y727-I731 WeakPolarHBondContact O-CG1 3.35Å; Y727-I731 PolarHBondContact O-N 3.3Å; Y727-L742 HydrophobicContact CD1-CD2 4.4Å; Y727-Y745 HydrophobicContact CE1-CD2 4.39Å; Y727-Y745 HydrophobicContact CE1-CG 4.37Å; Y727-L746 HydrophobicContact CD2-CB 4.35Å; Y727-L746 HydrophobicContact CG-CB 4.25Å; Y727-A749 HydrophobicContact CD2-CB 4.21Å; Y727-A749 HydrophobicContact CE2-CB 3.97Å
728	E	92.9	Very high	90.7	Very high	69 Å²	69	69.8 Å²	69.8	32%	0.322	34%	0.341	S	S	.	.	H	α-helix	trans	-60.9	-43.9	176.1	-83.1	-164.6	-155.8	0	0	112	I724 Q725 C730 I731 K732 L746	I724-E728 HydrophobicContact CG2-CG 4.48Å; I724-E728 WeakPolarHBondContact O-CB 3.46Å; I724-E728 PolarHBondContact O-N 3.36Å; Q725-E728 PolarHBondContact O-N 3.42Å; E728-C730 VanDerWaalsContact C-N 3.35Å; E728-I731 PolarHBondContact O-N 3.43Å; E728-K732 WeakPolarHBondContact O-CB 3.31Å; E728-K732 WeakPolarHBondContact O-CD 3.36Å; E728-K732 WeakPolarHBondContact O-CG 3.43Å; E728-K732 PolarHBondContact O-N 3.29Å; E728-K732 WeakPolarHBondContact OE2-CE 3.29Å; E728-K732 IonicContact OE2-NZ 2.68Å; E728-K732 PolarHBondContact OE2-NZ 2.85Å; E728-L746 HydrophobicContact CG-CD1 3.77Å
729	N	91.6	Very high	90.5	Very high	62 Å²	62	64.4 Å²	64.4	33%	0.332	32%	0.32	S	S	.	.	H	α-helix	trans	-67.7	-36	179.8	-69.6	-11.4	0	0	0	111.5	W707 Q725 M726 Y727 K732 K733	W707-N729 HydrophobicContact CE3-CB 4.13Å; W707-N729 HydrophobicContact CZ3-CB 3.84Å; Q725-N729 VanDerWaalsContact O-CB 3.24Å; Q725-N729 WeakPolarHBondContact O-CB 3.41Å; Q725-N729 PolarHBondContact O-N 3.43Å; Q725-N729 PolarHBondContact O-ND2 3.34Å; Q725-N729 PolarHBondContact O-OD1 2.92Å; M726-N729 PolarHBondContact O-N 3.33Å; Y727-N729 PolarHBondContact O-N 2.77Å; N729-K732 PolarHBondContact O-N 3.39Å; N729-K733 VanDerWaalsContact O-CB 3.3Å; N729-K733 WeakPolarHBondContact O-CB 3.16Å; N729-K733 PolarHBondContact O-N 3.33Å
730	C	92	Very high	90.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.2	-48.1	169.6	-176.4	0	0	0	0	112	W707 M726 Y727 E728 K732 F734	W707-C730 HydrophobicContact CB-CB 3.74Å; W707-C730 HydrophobicContact CG-CB 4.29Å; M726-C730 WeakPolarHBondContact O-CB 3.1Å; M726-C730 PolarHBondContact O-N 3.41Å; Y727-C730 WeakPolarHBondContact O-CB 3.49Å; Y727-C730 PolarHBondContact O-N 2.69Å; E728-C730 VanDerWaalsContact C-N 3.35Å; C730-K732 VanDerWaalsContact C-N 3.32Å; C730-K732 PolarHBondContact O-N 3.38Å; C730-F734 WeakPolarHBondContact O-CD2 3.42Å; C730-F734 PolarHBondContact O-N 3.04Å; C730-F734 VanDerWaalsContact O-N 3.13Å
731	I	91.2	Very high	89.9	Confident	23 Å²	23	62.7 Å²	62.7	12%	0.118	31%	0.314	C	S	.	.	H	α-helix	trans	-63.1	-38.6	178.3	-68.4	165.4	0	0	0	111.5	Y727 E728 S735 R736 Q737 L742 L746	Y727-I731 VanDerWaalsContact O-CG1 3.32Å; Y727-I731 WeakPolarHBondContact O-CG1 3.35Å; Y727-I731 PolarHBondContact O-N 3.3Å; E728-I731 PolarHBondContact O-N 3.43Å; I731-S735 PolarHBondContact O-N 2.88Å; I731-R736 PolarHBondContact O-N 3.28Å; I731-Q737 HydrophobicContact CG2-CG 4.29Å; I731-L742 HydrophobicContact CD1-CB 4.27Å; I731-L742 HydrophobicContact CG1-CB 4.19Å; I731-L742 HydrophobicContact CG1-CD1 4.02Å; I731-L746 HydrophobicContact CD1-CD1 4.17Å
732	K	90.9	Very high	89.7	Confident	128 Å²	128	57.9 Å²	57.9	56%	0.557	29%	0.285	S	S	*	.	H	α-helix	trans	-69.5	-53.6	177.4	-69.4	161.9	-165.7	166.8	0	111.9	E728 N729 C730 F734 S735	E728-K732 WeakPolarHBondContact O-CB 3.31Å; E728-K732 WeakPolarHBondContact O-CD 3.36Å; E728-K732 WeakPolarHBondContact O-CG 3.43Å; E728-K732 PolarHBondContact O-N 3.29Å; E728-K732 WeakPolarHBondContact OE2-CE 3.29Å; E728-K732 IonicContact OE2-NZ 2.68Å; E728-K732 PolarHBondContact OE2-NZ 2.85Å; N729-K732 PolarHBondContact O-N 3.39Å; C730-K732 VanDerWaalsContact C-N 3.32Å; C730-K732 PolarHBondContact O-N 3.38Å; K732-F734 PolarHBondContact O-N 2.65Å; K732-S735 PolarHBondContact O-N 2.76Å
733	K	88.5	Confident	89.7	Confident	97 Å²	97	57.2 Å²	57.2	42%	0.422	28%	0.278	S	S	.	.	H	α-helix	trans	-62.5	-42.5	-175.3	-176.8	172.6	179.1	177.1	0	112.3	A701 D702 W707 N729	A701-K733 PolarHBondContact O-NZ 2.88Å; D702-K733 WeakPolarHBondContact OD1-CE 3.24Å; D702-K733 IonicContact OD1-NZ 3.3Å; D702-K733 PolarHBondContact OD1-NZ 2.9Å; W707-K733 HydrophobicContact CZ2-CD 4.4Å; N729-K733 VanDerWaalsContact O-CB 3.3Å; N729-K733 WeakPolarHBondContact O-CB 3.16Å; N729-K733 PolarHBondContact O-N 3.33Å
734	F	87.1	Confident	89.5	Confident	41 Å²	41	59.6 Å²	59.6	18%	0.18	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	12.9	-173.9	-58.1	-66.4	0	0	0	114.2	D702 P704 W707 C730 K732 R736	D702-F734 WeakPolarHBondContact O-CE1 3.46Å; P704-F734 HydrophobicContact CB-CD2 4.01Å; P704-F734 HydrophobicContact CB-CE2 4.26Å; P704-F734 HydrophobicContact CG-CB 4.23Å; P704-F734 HydrophobicContact CG-CD1 4.18Å; P704-F734 HydrophobicContact CG-CD2 3.71Å; P704-F734 HydrophobicContact CG-CE2 4.1Å; P704-F734 HydrophobicContact CG-CG 3.76Å; P704-F734 HydrophobicContact CG-CZ 4.48Å; W707-F734 AromaticContact CD1-CE2 3.71Å; W707-F734 AromaticContact NE1-CE2 3.84Å; C730-F734 WeakPolarHBondContact O-CD2 3.42Å; C730-F734 PolarHBondContact O-N 3.04Å; C730-F734 VanDerWaalsContact O-N 3.13Å; K732-F734 PolarHBondContact O-N 2.65Å; F734-R736 HydrophobicContact CB-CG 4.11Å; F734-R736 WeakPolarHBondContact O-CG 3.5Å; F734-R736 PolarHBondContact O-N 2.93Å
735	S	83.6	Confident	89.4	Confident	97 Å²	97	62.8 Å²	62.8	68%	0.678	30%	0.301	S	S	*	.			trans	50.5	14.4	-177.2	70.6	0	0	0	0	116.5	I731 K732 Q737	I731-S735 PolarHBondContact O-N 2.88Å; K732-S735 PolarHBondContact O-N 2.76Å; S735-Q737 PolarHBondContact O-N 2.96Å
736	R	78.3	Confident	89.4	Confident	110 Å²	110	57.3 Å²	57.3	42%	0.415	28%	0.276	S	S	.	.			trans	-73.5	40.4	-175	-69.4	-171.4	173.1	-171.2	-2.8	114.1	I731 F734 N738 N739 L742	I731-R736 PolarHBondContact O-N 3.28Å; F734-R736 HydrophobicContact CB-CG 4.11Å; F734-R736 WeakPolarHBondContact O-CG 3.5Å; F734-R736 PolarHBondContact O-N 2.93Å; R736-N738 PolarHBondContact O-N 3.21Å; R736-N738 VanDerWaalsContact O-N 3.13Å; R736-N739 HydrophobicContact CB-CB 4.19Å; R736-N739 PolarHBondContact O-N 2.93Å; R736-N739 VanDerWaalsContact O-N 3.09Å; R736-L742 HydrophobicContact CB-CD1 3.92Å
737	Q	80.3	Confident	89.5	Confident	139 Å²	139	56.1 Å²	56.1	65%	0.65	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-31.2	-176	-59.8	-172.3	20.2	0	0	113.8	I731 S735	I731-Q737 HydrophobicContact CG2-CG 4.29Å; S735-Q737 PolarHBondContact O-N 2.96Å
738	N	81.6	Confident	89.4	Confident	119 Å²	119	62.2 Å²	62.2	64%	0.636	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	4.4	-177.5	-65.2	-13.2	0	0	0	113.9	R736 T740 V769	R736-N738 PolarHBondContact O-N 3.21Å; R736-N738 VanDerWaalsContact O-N 3.13Å; N738-T740 PolarHBondContact O-N 2.91Å; N738-T740 VanDerWaalsContact O-N 3.15Å; N738-V769 HydrophobicContact CB-CG2 3.99Å
739	N	88.7	Confident	89.5	Confident	42 Å²	42	59 Å²	59	23%	0.225	28%	0.278	C	S	.	.			trans	-72.2	111.9	179.4	-178.7	-8.8	0	0	0	110.8	R736 E741 L742 L743	R736-N739 HydrophobicContact CB-CB 4.19Å; R736-N739 PolarHBondContact O-N 2.93Å; R736-N739 VanDerWaalsContact O-N 3.09Å; N739-E741 VanDerWaalsContact C-N 3.29Å; N739-E741 PolarHBondContact O-N 3.22Å; N739-E741 PolarHBondContact OD1-N 3.18Å; N739-L742 HydrophobicContact CB-CB 4.18Å; N739-L742 HydrophobicContact CB-CD1 4.07Å; N739-L742 HydrophobicContact CB-CG 4.39Å; N739-L742 PolarHBondContact O-N 3Å; N739-L743 WeakPolarHBondContact O-CG 3.21Å; N739-L743 PolarHBondContact O-N 3.37Å; N739-L743 VanDerWaalsContact O-N 3.1Å
740	T	89.5	Confident	89.7	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-31.8	-178.5	55.5	0	0	0	0	114.2	N738 Q744 V769 K770	N738-T740 PolarHBondContact O-N 2.91Å; N738-T740 VanDerWaalsContact O-N 3.15Å; T740-Q744 VanDerWaalsContact O-CG 3.3Å; T740-Q744 WeakPolarHBondContact O-CG 3.44Å; T740-Q744 PolarHBondContact O-N 3.26Å; T740-V769 HydrophobicContact CG2-CB 3.85Å; T740-V769 HydrophobicContact CG2-CG1 3.89Å; T740-K770 HydrophobicContact CG2-CB 4.27Å; T740-K770 HydrophobicContact CG2-CD 3.78Å; T740-K770 HydrophobicContact CG2-CG 3.84Å; T740-K770 PolarHBondContact OG1-NZ 2.97Å
741	E	89.3	Confident	89.9	Confident	103 Å²	103	59.1 Å²	59.1	48%	0.481	28%	0.276	S	S	.	.	H	α-helix	trans	-75	-46.6	-177.4	-69.4	163.2	-157.5	0	0	110.8	N739 L743 Q744 Y745	N739-E741 VanDerWaalsContact C-N 3.29Å; N739-E741 PolarHBondContact O-N 3.22Å; N739-E741 PolarHBondContact OD1-N 3.18Å; E741-L743 VanDerWaalsContact C-N 3.29Å; E741-L743 PolarHBondContact O-N 3.01Å; E741-Q744 WeakPolarHBondContact O-CB 3.46Å; E741-Q744 PolarHBondContact O-N 3.44Å; E741-Q744 VanDerWaalsContact O-N 3.07Å; E741-Y745 HydrophobicContact CB-CE2 4.23Å; E741-Y745 VanDerWaalsContact O-CD2 3.29Å; E741-Y745 WeakPolarHBondContact O-CD2 3.4Å; E741-Y745 VanDerWaalsContact O-CG 3.29Å; E741-Y745 PolarHBondContact O-N 2.96Å
742	L	91.2	Very high	90	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-55.3	-44.1	170.9	-81.6	174.7	0	0	0	111.9	I708 Y727 I731 R736 N739 Y745 L746	I708-L742 HydrophobicContact CD1-CD2 3.68Å; I708-L742 HydrophobicContact CD1-CG 4.38Å; I708-L742 HydrophobicContact CG1-CD2 3.58Å; Y727-L742 HydrophobicContact CD1-CD2 4.4Å; I731-L742 HydrophobicContact CD1-CB 4.27Å; I731-L742 HydrophobicContact CG1-CB 4.19Å; I731-L742 HydrophobicContact CG1-CD1 4.02Å; R736-L742 HydrophobicContact CB-CD1 3.92Å; N739-L742 HydrophobicContact CB-CB 4.18Å; N739-L742 HydrophobicContact CB-CD1 4.07Å; N739-L742 HydrophobicContact CB-CG 4.39Å; N739-L742 PolarHBondContact O-N 3Å; L742-Y745 PolarHBondContact O-N 3.2Å; L742-L746 WeakPolarHBondContact O-CB 3.47Å; L742-L746 PolarHBondContact O-N 2.88Å
743	L	93.1	Very high	90.1	Very high	6 Å²	6	56.9 Å²	56.9	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-66.3	-34.3	176.7	-69.3	170.6	0	0	0	112.6	N739 E741 A747 M762 K765 A766	N739-L743 WeakPolarHBondContact O-CG 3.21Å; N739-L743 PolarHBondContact O-N 3.37Å; N739-L743 VanDerWaalsContact O-N 3.1Å; E741-L743 VanDerWaalsContact C-N 3.29Å; E741-L743 PolarHBondContact O-N 3.01Å; L743-A747 WeakPolarHBondContact O-CB 3.4Å; L743-A747 PolarHBondContact O-N 3.15Å; L743-M762 HydrophobicContact CD2-SD 4.37Å; L743-K765 HydrophobicContact CD1-CB 3.99Å; L743-K765 HydrophobicContact CD2-CB 4.46Å; L743-K765 HydrophobicContact CD2-CD 4.47Å; L743-A766 HydrophobicContact CB-CB 3.87Å; L743-A766 HydrophobicContact CD1-CB 4.12Å
744	Q	92.6	Very high	90.3	Very high	51 Å²	51	54.3 Å²	54.3	24%	0.238	27%	0.274	C	S	.	.	H	α-helix	trans	-68.7	-41.9	172.7	-76.7	-176.7	37.8	0	0	112.2	T740 E741 A747 R748 L776	T740-Q744 VanDerWaalsContact O-CG 3.3Å; T740-Q744 WeakPolarHBondContact O-CG 3.44Å; T740-Q744 PolarHBondContact O-N 3.26Å; E741-Q744 WeakPolarHBondContact O-CB 3.46Å; E741-Q744 PolarHBondContact O-N 3.44Å; E741-Q744 VanDerWaalsContact O-N 3.07Å; Q744-A747 PolarHBondContact O-N 3.03Å; Q744-R748 WeakPolarHBondContact O-CB 3.41Å; Q744-R748 PolarHBondContact O-N 2.93Å; Q744-L776 HydrophobicContact CG-CD2 3.61Å; Q744-L776 HydrophobicContact CG-CG 4.5Å
745	Y	93.5	Very high	90.6	Very high	78 Å²	78	56 Å²	56	31%	0.306	28%	0.282	S	S	.	.	H	α-helix	trans	-65.5	-43.9	177.1	-57.8	-36.4	0	0	0	112.1	I708 H712 Y727 E741 L742 R748 A749	I708-Y745 HydrophobicContact CG2-CD2 4.42Å; I708-Y745 HydrophobicContact CG2-CE2 4.38Å; H712-Y745 AromaticContact NE2-CD1 3.9Å; H712-Y745 AromaticContact NE2-CD2 3.93Å; H712-Y745 AromaticContact NE2-CE1 3.99Å; H712-Y745 AromaticContact NE2-CG 3.88Å; Y727-Y745 HydrophobicContact CE1-CD2 4.39Å; Y727-Y745 HydrophobicContact CE1-CG 4.37Å; E741-Y745 HydrophobicContact CB-CE2 4.23Å; E741-Y745 VanDerWaalsContact O-CD2 3.29Å; E741-Y745 WeakPolarHBondContact O-CD2 3.4Å; E741-Y745 VanDerWaalsContact O-CG 3.29Å; E741-Y745 PolarHBondContact O-N 2.96Å; L742-Y745 PolarHBondContact O-N 3.2Å; Y745-R748 WeakPolarHBondContact O-CB 3.34Å; Y745-R748 PolarHBondContact O-N 3.32Å; Y745-A749 PolarHBondContact O-N 3.36Å
746	L	93.9	Very high	91	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-65.8	-40.2	174.9	175.2	140.8	0	0	0	111.7	Y727 E728 I731 L742 R748 A749 H750 M762	Y727-L746 HydrophobicContact CD2-CB 4.35Å; Y727-L746 HydrophobicContact CG-CB 4.25Å; E728-L746 HydrophobicContact CG-CD1 3.77Å; I731-L746 HydrophobicContact CD1-CD1 4.17Å; L742-L746 WeakPolarHBondContact O-CB 3.47Å; L742-L746 PolarHBondContact O-N 2.88Å; L746-R748 PolarHBondContact O-N 2.85Å; L746-A749 WeakPolarHBondContact O-CB 3.42Å; L746-A749 PolarHBondContact O-N 3.46Å; L746-H750 WeakPolarHBondContact CD2-NE2 3.42Å; L746-H750 PolarHBondContact O-CD2 2.72Å; L746-H750 PolarHBondContact O-N 3.02Å; L746-M762 HydrophobicContact CD2-CB 3.82Å; L746-M762 HydrophobicContact CD2-CE 4.3Å; L746-M762 HydrophobicContact CD2-CG 3.38Å; L746-M762 HydrophobicContact CD2-SD 3.76Å
747	A	94.4	Very high	91.7	Very high	3 Å²	3	54 Å²	54	3%	0.025	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-40.4	171.7	0	0	0	0	0	112.5	L743 Q744 A749 H750 F751 C759 M762 L763	L743-A747 WeakPolarHBondContact O-CB 3.4Å; L743-A747 PolarHBondContact O-N 3.15Å; Q744-A747 PolarHBondContact O-N 3.03Å; A747-A749 VanDerWaalsContact C-N 3.32Å; A747-A749 PolarHBondContact O-N 2.96Å; A747-H750 PolarHBondContact O-N 3.41Å; A747-F751 WeakPolarHBondContact O-CB 3.45Å; A747-F751 PolarHBondContact O-N 2.63Å; A747-C759 PolarHBondContact O-SG 3.28Å; A747-M762 HydrophobicContact CB-CB 4.26Å; A747-L763 HydrophobicContact CB-CD2 3.91Å; A747-L763 HydrophobicContact CB-CG 3.86Å
748	R	94.2	Very high	92.3	Very high	130 Å²	130	51.2 Å²	51.2	49%	0.491	25%	0.252	S	S	.	.	H	α-helix	trans	-63.3	-37	173.9	-177.3	179.7	176.4	-152.7	-5.9	111.7	E716 Q744 Y745 L746 F751 K752	E716-R748 IonicContact OE1-NH2 2.69Å; Q744-R748 WeakPolarHBondContact O-CB 3.41Å; Q744-R748 PolarHBondContact O-N 2.93Å; Y745-R748 WeakPolarHBondContact O-CB 3.34Å; Y745-R748 PolarHBondContact O-N 3.32Å; L746-R748 PolarHBondContact O-N 2.85Å; R748-F751 PolarHBondContact O-N 2.63Å; R748-K752 PolarHBondContact O-N 3.36Å
749	A	95	Very high	93	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-66.8	-49.3	174.9	0	0	0	0	0	111.8	V715 I724 Y727 Y745 L746 A747 F751 K752 A753	V715-A749 HydrophobicContact CG2-CB 4.09Å; I724-A749 HydrophobicContact CG1-CB 3.79Å; Y727-A749 HydrophobicContact CD2-CB 4.21Å; Y727-A749 HydrophobicContact CE2-CB 3.97Å; Y745-A749 PolarHBondContact O-N 3.36Å; L746-A749 WeakPolarHBondContact O-CB 3.42Å; L746-A749 PolarHBondContact O-N 3.46Å; A747-A749 VanDerWaalsContact C-N 3.32Å; A747-A749 PolarHBondContact O-N 2.96Å; A749-F751 VanDerWaalsContact C-N 3.29Å; A749-F751 PolarHBondContact O-N 2.79Å; A749-K752 PolarHBondContact O-N 3.32Å; A749-A753 WeakPolarHBondContact O-CB 3.39Å; A749-A753 PolarHBondContact O-N 2.86Å
750	H	95.8	Very high	93.3	Very high	7 Å²	7	45.8 Å²	45.8	3%	0.032	22%	0.221	C	C	.	.	H	α-helix	trans	-57.8	-39.9	172.7	-70.5	-63.9	0	0	0	112.2	L746 A747 A753 G754 Q755 E758 C759	L746-H750 WeakPolarHBondContact CD2-NE2 3.42Å; L746-H750 PolarHBondContact O-CD2 2.72Å; L746-H750 PolarHBondContact O-N 3.02Å; A747-H750 PolarHBondContact O-N 3.41Å; H750-A753 CarbonylContact O-C 3.59Å; H750-A753 PolarHBondContact O-N 3.21Å; H750-A753 VanDerWaalsContact O-N 3.17Å; H750-G754 PolarHBondContact O-N 3.47Å; H750-Q755 HydrophobicContact CB-CB 4Å; H750-Q755 PolarHBondContact ND1-OE1 2.9Å; H750-Q755 PolarHBondContact O-N 2.89Å; H750-E758 HydrophobicContact CB-CB 4.46Å; H750-C759 HydrophobicContact CB-CB 3.99Å
751	F	95	Very high	93.5	Very high	59 Å²	59	48.8 Å²	48.8	26%	0.259	24%	0.239	S	C	.	.	H	α-helix	trans	-65.2	-41.8	177.2	-174.2	-92	0	0	0	113	A747 R748 A749 A753 G754 L756 F782 V783 R786	A747-F751 WeakPolarHBondContact O-CB 3.45Å; A747-F751 PolarHBondContact O-N 2.63Å; R748-F751 PolarHBondContact O-N 2.63Å; A749-F751 VanDerWaalsContact C-N 3.29Å; A749-F751 PolarHBondContact O-N 2.79Å; F751-A753 VanDerWaalsContact C-N 3.3Å; F751-G754 PolarHBondContact O-N 3.07Å; F751-L756 HydrophobicContact CD2-CD2 3.83Å; F751-L756 HydrophobicContact CE2-CD2 4.12Å; F751-F782 HydrophobicContact CE2-CD1 4.34Å; F751-F782 HydrophobicContact CE2-CE1 4.31Å; F751-F782 HydrophobicContact CZ-CD1 4.25Å; F751-F782 AromaticContact CZ-CE1 3.79Å; F751-F782 HydrophobicContact CZ-CE1 3.79Å; F751-V783 HydrophobicContact CD2-CG2 3.94Å; F751-V783 HydrophobicContact CE2-CG2 4.18Å; F751-R786 VanDerWaalsContact CE2-NH1 3.3Å
752	K	93.5	Very high	93.7	Very high	65 Å²	65	45.3 Å²	45.3	28%	0.283	22%	0.224	S	C	.	.	H	α-helix	trans	-64.7	-33.9	170.9	-78.6	-159.6	-169.5	-176.8	0	111.5	V715 E716 Y720 R748 A749 G754	V715-K752 HydrophobicContact CG1-CD 4.04Å; V715-K752 PolarHBondContact O-NZ 3.47Å; E716-K752 VanDerWaalsContact CD-NZ 3.33Å; E716-K752 IonicContact OE1-NZ 2.69Å; E716-K752 PolarHBondContact OE1-NZ 3.44Å; E716-K752 IonicContact OE2-NZ 2.77Å; E716-K752 PolarHBondContact OE2-NZ 3.34Å; Y720-K752 HydrophobicContact CD1-CB 3.81Å; Y720-K752 HydrophobicContact CD1-CD 4.09Å; Y720-K752 HydrophobicContact CD2-CB 4.29Å; Y720-K752 HydrophobicContact CE1-CB 3.59Å; Y720-K752 HydrophobicContact CE1-CD 3.33Å; Y720-K752 HydrophobicContact CE1-CG 4.1Å; Y720-K752 HydrophobicContact CE2-CB 4.08Å; Y720-K752 WeakPolarHBondContact CE2-O 3.4Å; Y720-K752 HydrophobicContact CG-CB 4.17Å; R748-K752 PolarHBondContact O-N 3.36Å; A749-K752 PolarHBondContact O-N 3.32Å; K752-G754 VanDerWaalsContact C-N 3.31Å; K752-G754 PolarHBondContact O-N 3.49Å
753	A	93.6	Very high	93.8	Very high	38 Å²	38	45.6 Å²	45.6	31%	0.314	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-6.9	176.6	0	0	0	0	0	115.1	Y720 I724 A749 H750 F751 Q755	Y720-A753 HydrophobicContact CD2-CB 4.26Å; Y720-A753 HydrophobicContact CG-CB 4.35Å; I724-A753 HydrophobicContact CD1-CB 4.11Å; A749-A753 WeakPolarHBondContact O-CB 3.39Å; A749-A753 PolarHBondContact O-N 2.86Å; H750-A753 CarbonylContact O-C 3.59Å; H750-A753 PolarHBondContact O-N 3.21Å; H750-A753 VanDerWaalsContact O-N 3.17Å; F751-A753 VanDerWaalsContact C-N 3.3Å; A753-Q755 VanDerWaalsContact C-N 3.29Å; A753-Q755 HydrophobicContact CB-CG 4.38Å; A753-Q755 PolarHBondContact O-N 3.32Å
754	G	91.2	Very high	93.8	Very high	44 Å²	44	49.2 Å²	49.2	45%	0.454	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	80	2.5	-175.3	0	0	0	0	0	115.2	H750 F751 K752 L756	H750-G754 PolarHBondContact O-N 3.47Å; F751-G754 PolarHBondContact O-N 3.07Å; K752-G754 VanDerWaalsContact C-N 3.31Å; K752-G754 PolarHBondContact O-N 3.49Å; G754-L756 VanDerWaalsContact C-N 3.29Å; G754-L756 PolarHBondContact O-N 2.79Å
755	Q	93.6	Very high	93.8	Very high	75 Å²	75	52 Å²	52	35%	0.35	26%	0.255	S	S	.	.			trans	-79.9	71.5	-179.9	-73.1	176.9	-19.6	0	0	110.9	H750 A753 E758 C759	H750-Q755 HydrophobicContact CB-CB 4Å; H750-Q755 PolarHBondContact ND1-OE1 2.9Å; H750-Q755 PolarHBondContact O-N 2.89Å; A753-Q755 VanDerWaalsContact C-N 3.29Å; A753-Q755 HydrophobicContact CB-CG 4.38Å; A753-Q755 PolarHBondContact O-N 3.32Å; Q755-E758 VanDerWaalsContact CA-OE2 3.28Å; Q755-E758 WeakPolarHBondContact CA-OE2 3.42Å; Q755-E758 HydrophobicContact CB-CB 4.13Å; Q755-E758 HydrophobicContact CB-CG 4.15Å; Q755-E758 VanDerWaalsContact CB-OE2 3.28Å; Q755-E758 WeakPolarHBondContact CB-OE2 3.21Å; Q755-C759 VanDerWaalsContact O-CB 3.24Å; Q755-C759 WeakPolarHBondContact O-CB 3.23Å; Q755-C759 PolarHBondContact O-N 3.43Å
756	L	93.2	Very high	93.8	Very high	17 Å²	17	48.3 Å²	48.3	9%	0.089	24%	0.241	C	C	.	.	H	α-helix	trans	-71.7	-30.4	-171.3	-61.3	-177	0	0	0	113.8	F751 G754 K760 R786 T790	F751-L756 HydrophobicContact CD2-CD2 3.83Å; F751-L756 HydrophobicContact CE2-CD2 4.12Å; G754-L756 VanDerWaalsContact C-N 3.29Å; G754-L756 PolarHBondContact O-N 2.79Å; L756-K760 WeakPolarHBondContact O-CB 3.42Å; L756-K760 PolarHBondContact O-N 2.95Å; L756-R786 HydrophobicContact CD1-CB 4.31Å; L756-R786 HydrophobicContact CD1-CG 3.76Å; L756-T790 HydrophobicContact CD1-CG2 4.45Å
757	K	92.6	Very high	93.7	Very high	150 Å²	150	52.1 Å²	52.1	65%	0.652	26%	0.255	S	S	*	.	H	α-helix	trans	-69.8	-47.7	178.8	-67.2	-178	179.9	179.9	0	109.8	K760 T761 L787	K757-K760 WeakPolarHBondContact O-CB 3.39Å; K757-K760 PolarHBondContact O-N 3.14Å; K757-T761 WeakPolarHBondContact O-CG2 3.34Å; K757-T761 PolarHBondContact O-N 2.81Å; K757-L787 HydrophobicContact CG-CD1 4.12Å
758	E	93.7	Very high	93.6	Very high	79 Å²	79	59.6 Å²	59.6	37%	0.369	29%	0.289	S	S	.	.	H	α-helix	trans	-58.1	-51.4	175.8	-58.8	64.8	-146.3	0	0	109.2	H750 Q755 K760 T761 M762	H750-E758 HydrophobicContact CB-CB 4.46Å; Q755-E758 VanDerWaalsContact CA-OE2 3.28Å; Q755-E758 WeakPolarHBondContact CA-OE2 3.42Å; Q755-E758 HydrophobicContact CB-CB 4.13Å; Q755-E758 HydrophobicContact CB-CG 4.15Å; Q755-E758 VanDerWaalsContact CB-OE2 3.28Å; Q755-E758 WeakPolarHBondContact CB-OE2 3.21Å; E758-K760 PolarHBondContact O-N 3.16Å; E758-T761 PolarHBondContact O-N 2.98Å; E758-T761 PolarHBondContact O-OG1 3.01Å; E758-M762 VanDerWaalsContact O-CG 3.32Å; E758-M762 WeakPolarHBondContact O-CG 3.44Å; E758-M762 PolarHBondContact O-N 2.99Å
759	C	95.3	Very high	93.4	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.02	28%	0.28	C	S	.	.	H	α-helix	trans	-52.9	-47.1	174.2	-173	0	0	0	0	112.7	A747 H750 Q755 T761 M762 L763 V783	A747-C759 PolarHBondContact O-SG 3.28Å; H750-C759 HydrophobicContact CB-CB 3.99Å; Q755-C759 VanDerWaalsContact O-CB 3.24Å; Q755-C759 WeakPolarHBondContact O-CB 3.23Å; Q755-C759 PolarHBondContact O-N 3.43Å; C759-T761 PolarHBondContact O-N 3.37Å; C759-M762 PolarHBondContact O-N 3.17Å; C759-L763 WeakPolarHBondContact O-CG 3.48Å; C759-L763 PolarHBondContact O-N 3.38Å; C759-V783 HydrophobicContact CB-CG1 4.37Å
760	K	94.2	Very high	93.2	Very high	45 Å²	45	59 Å²	59	20%	0.196	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-45.2	174.9	-172.3	-178.8	179.1	-179.4	0	111.4	L756 K757 E758 M762 L764 L780 V783 Q784 L787 D808	L756-K760 WeakPolarHBondContact O-CB 3.42Å; L756-K760 PolarHBondContact O-N 2.95Å; K757-K760 WeakPolarHBondContact O-CB 3.39Å; K757-K760 PolarHBondContact O-N 3.14Å; E758-K760 PolarHBondContact O-N 3.16Å; K760-M762 VanDerWaalsContact C-N 3.33Å; K760-M762 PolarHBondContact O-N 3Å; K760-L764 HydrophobicContact CG-CD1 4.13Å; K760-L764 WeakPolarHBondContact O-CB 3.34Å; K760-L764 VanDerWaalsContact O-CG 3.26Å; K760-L764 WeakPolarHBondContact O-CG 3.43Å; K760-L764 PolarHBondContact O-N 3.01Å; K760-L780 HydrophobicContact CG-CD1 4.07Å; K760-V783 HydrophobicContact CB-CG1 4.01Å; K760-Q784 HydrophobicContact CD-CG 4.39Å; K760-L787 HydrophobicContact CD-CD1 4.27Å; K760-D808 IonicContact NZ-OD1 3.36Å; K760-D808 PolarHBondContact NZ-OD1 3.13Å; K760-D808 IonicContact NZ-OD2 2.94Å; K760-D808 PolarHBondContact NZ-OD2 2.92Å
761	T	94.3	Very high	92.8	Very high	68 Å²	68	62 Å²	62	42%	0.417	32%	0.315	S	S	.	.	H	α-helix	trans	-63.8	-35.6	178.8	69.1	0	0	0	0	113.2	K757 E758 C759 L764 K765	K757-T761 WeakPolarHBondContact O-CG2 3.34Å; K757-T761 PolarHBondContact O-N 2.81Å; E758-T761 PolarHBondContact O-N 2.98Å; E758-T761 PolarHBondContact O-OG1 3.01Å; C759-T761 PolarHBondContact O-N 3.37Å; T761-L764 PolarHBondContact O-N 3.02Å; T761-K765 WeakPolarHBondContact O-CG 3.14Å; T761-K765 PolarHBondContact O-N 3.47Å
762	M	93.5	Very high	92.5	Very high	30 Å²	30	68.6 Å²	68.6	15%	0.148	34%	0.338	C	S	.	.	H	α-helix	trans	-80	-34.6	-176.3	-58.5	-64.5	174.7	0	0	111.8	L743 L746 A747 E758 C759 K760 K765 A766	L743-M762 HydrophobicContact CD2-SD 4.37Å; L746-M762 HydrophobicContact CD2-CB 3.82Å; L746-M762 HydrophobicContact CD2-CE 4.3Å; L746-M762 HydrophobicContact CD2-CG 3.38Å; L746-M762 HydrophobicContact CD2-SD 3.76Å; A747-M762 HydrophobicContact CB-CB 4.26Å; E758-M762 VanDerWaalsContact O-CG 3.32Å; E758-M762 WeakPolarHBondContact O-CG 3.44Å; E758-M762 PolarHBondContact O-N 2.99Å; C759-M762 PolarHBondContact O-N 3.17Å; K760-M762 VanDerWaalsContact C-N 3.33Å; K760-M762 PolarHBondContact O-N 3Å; M762-K765 PolarHBondContact O-N 3.25Å; M762-K765 HydrophobicContact SD-CD 3.85Å; M762-A766 PolarHBondContact O-N 3.08Å
763	L	94.1	Very high	92.2	Very high	6 Å²	6	66.9 Å²	66.9	3%	0.031	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-36.4	167.4	-69.6	171.3	0	0	0	112.2	A747 C759 A766 R767 L776 N779 L780 V783	A747-L763 HydrophobicContact CB-CD2 3.91Å; A747-L763 HydrophobicContact CB-CG 3.86Å; C759-L763 WeakPolarHBondContact O-CG 3.48Å; C759-L763 PolarHBondContact O-N 3.38Å; L763-A766 PolarHBondContact O-N 3.41Å; L763-R767 VanDerWaalsContact O-CB 3.26Å; L763-R767 WeakPolarHBondContact O-CB 3.34Å; L763-R767 PolarHBondContact O-N 3.49Å; L763-L776 HydrophobicContact CD2-CD2 3.98Å; L763-N779 HydrophobicContact CD1-CB 4.13Å; L763-N779 HydrophobicContact CD2-CB 4.03Å; L763-L780 HydrophobicContact CB-CB 4.44Å; L763-L780 HydrophobicContact CB-CD1 4.09Å; L763-V783 HydrophobicContact CD1-CB 4.23Å; L763-V783 HydrophobicContact CD1-CG2 3.73Å
764	L	93.3	Very high	91.9	Very high	82 Å²	82	67 Å²	67	43%	0.429	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-42.4	172.5	-75.7	168.4	0	0	0	112.1	K760 T761 R767 H768 L780	K760-L764 HydrophobicContact CG-CD1 4.13Å; K760-L764 WeakPolarHBondContact O-CB 3.34Å; K760-L764 VanDerWaalsContact O-CG 3.26Å; K760-L764 WeakPolarHBondContact O-CG 3.43Å; K760-L764 PolarHBondContact O-N 3.01Å; T761-L764 PolarHBondContact O-N 3.02Å; L764-R767 PolarHBondContact O-N 2.96Å; L764-H768 WeakPolarHBondContact O-CB 3.44Å; L764-H768 PolarHBondContact O-N 2.87Å; L764-L780 HydrophobicContact CD2-CD1 4.09Å; L764-L780 HydrophobicContact CD2-CD2 3.75Å; L764-L780 HydrophobicContact CG-CD1 3.96Å; L764-L780 HydrophobicContact CG-CD2 4.46Å
765	K	92.6	Very high	91.8	Very high	110 Å²	110	68.4 Å²	68.4	48%	0.478	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-47.9	172.3	-72	175.4	-175.3	175.5	0	111.9	L743 T761 M762 R767 H768 V769	L743-K765 HydrophobicContact CD1-CB 3.99Å; L743-K765 HydrophobicContact CD2-CB 4.46Å; L743-K765 HydrophobicContact CD2-CD 4.47Å; T761-K765 WeakPolarHBondContact O-CG 3.14Å; T761-K765 PolarHBondContact O-N 3.47Å; M762-K765 PolarHBondContact O-N 3.25Å; M762-K765 HydrophobicContact SD-CD 3.85Å; K765-R767 PolarHBondContact O-N 2.9Å; K765-H768 WeakPolarHBondContact O-CB 3.49Å; K765-H768 PolarHBondContact O-N 3.16Å; K765-V769 PolarHBondContact O-N 3.16Å
766	A	93	Very high	91.7	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.7	-42.2	179	0	0	0	0	0	112.1	L743 M762 L763 H768 V769 K770 L776	L743-A766 HydrophobicContact CB-CB 3.87Å; L743-A766 HydrophobicContact CD1-CB 4.12Å; M762-A766 PolarHBondContact O-N 3.08Å; L763-A766 PolarHBondContact O-N 3.41Å; A766-H768 VanDerWaalsContact C-N 3.32Å; A766-H768 PolarHBondContact O-N 3.29Å; A766-V769 PolarHBondContact O-N 2.92Å; A766-K770 PolarHBondContact O-N 3.14Å; A766-L776 HydrophobicContact CB-CD1 3.9Å; A766-L776 HydrophobicContact CB-CD2 3.53Å; A766-L776 HydrophobicContact CB-CG 4.4Å
767	R	91.7	Very high	91.6	Very high	83 Å²	83	64.8 Å²	64.8	31%	0.313	31%	0.312	S	S	.	.	H	α-helix	trans	-68.8	-26.9	176.8	-171	177.2	178.8	-136.6	-5.6	112.9	L763 L764 K765 V769 K770 P771	L763-R767 VanDerWaalsContact O-CB 3.26Å; L763-R767 WeakPolarHBondContact O-CB 3.34Å; L763-R767 PolarHBondContact O-N 3.49Å; L764-R767 PolarHBondContact O-N 2.96Å; K765-R767 PolarHBondContact O-N 2.9Å; R767-V769 VanDerWaalsContact C-N 3.3Å; R767-K770 CarbonylContact O-C 3.55Å; R767-K770 VanDerWaalsContact O-C 3.26Å; R767-P771 WeakPolarHBondContact O-CA 3.34Å; R767-P771 WeakPolarHBondContact O-CD 3.21Å; R767-P771 WeakPolarHBondContact O-CG 3.45Å
768	H	92.7	Very high	91.5	Very high	160 Å²	160	59.5 Å²	59.5	74%	0.741	29%	0.289	S	S	*	.	H	α-helix	trans	-64.5	-35.8	171.1	-177.9	61.3	0	0	0	111.7	L764 K765 A766	L764-H768 WeakPolarHBondContact O-CB 3.44Å; L764-H768 PolarHBondContact O-N 2.87Å; K765-H768 WeakPolarHBondContact O-CB 3.49Å; K765-H768 PolarHBondContact O-N 3.16Å; A766-H768 VanDerWaalsContact C-N 3.32Å; A766-H768 PolarHBondContact O-N 3.29Å
769	V	90.2	Very high	91.4	Very high	51 Å²	51	58.3 Å²	58.3	31%	0.309	29%	0.286	S	S	.	.	H	α-helix	trans	-79.2	-38.4	177	-177.3	0	0	0	0	112.6	N738 T740 K765 A766 R767	N738-V769 HydrophobicContact CB-CG2 3.99Å; T740-V769 HydrophobicContact CG2-CB 3.85Å; T740-V769 HydrophobicContact CG2-CG1 3.89Å; K765-V769 PolarHBondContact O-N 3.16Å; A766-V769 PolarHBondContact O-N 2.92Å; R767-V769 VanDerWaalsContact C-N 3.3Å
770	K	90.1	Very high	91.3	Very high	67 Å²	67	58.4 Å²	58.4	29%	0.291	29%	0.286	S	S	.	.			trans	-127.3	80.6	174.4	-68.5	178.9	-174.3	161.6	0	111.8	T740 A766 R767 W772 D773 L776	T740-K770 HydrophobicContact CG2-CB 4.27Å; T740-K770 HydrophobicContact CG2-CD 3.78Å; T740-K770 HydrophobicContact CG2-CG 3.84Å; T740-K770 PolarHBondContact OG1-NZ 2.97Å; A766-K770 PolarHBondContact O-N 3.14Å; R767-K770 CarbonylContact O-C 3.55Å; R767-K770 VanDerWaalsContact O-C 3.26Å; K770-W772 VanDerWaalsContact C-N 3.26Å; K770-W772 HydrophobicContact CB-CH2 4.43Å; K770-W772 HydrophobicContact CB-CZ2 4.29Å; K770-W772 HydrophobicContact CG-CH2 4.08Å; K770-W772 HydrophobicContact CG-CZ2 3.91Å; K770-W772 PolarHBondContact O-N 3.11Å; K770-D773 HydrophobicContact CB-CB 4.22Å; K770-D773 PolarHBondContact O-N 3.2Å; K770-L776 HydrophobicContact CB-CD1 4.27Å
771	P	88.3	Confident	91.2	Very high	71 Å²	71	56.3 Å²	56.3	46%	0.461	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-23.8	-178	-24.7	34	0	0	0	115.3	R767	R767-P771 WeakPolarHBondContact O-CA 3.34Å; R767-P771 WeakPolarHBondContact O-CD 3.21Å; R767-P771 WeakPolarHBondContact O-CG 3.45Å
772	W	87.8	Confident	91.2	Very high	197 Å²	197	56.4 Å²	56.4	75%	0.746	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-6.9	-176.3	63.7	88.8	0	0	0	114.2	K770 P774	K770-W772 VanDerWaalsContact C-N 3.26Å; K770-W772 HydrophobicContact CB-CH2 4.43Å; K770-W772 HydrophobicContact CB-CZ2 4.29Å; K770-W772 HydrophobicContact CG-CH2 4.08Å; K770-W772 HydrophobicContact CG-CZ2 3.91Å; K770-W772 PolarHBondContact O-N 3.11Å; W772-P774 VanDerWaalsContact O-CD 3.32Å; W772-P774 WeakPolarHBondContact O-CD 3.33Å
773	D	88.1	Confident	91.2	Very high	28 Å²	28	55.2 Å²	55.2	15%	0.15	27%	0.266	C	S	.	.			trans	-71.6	116.8	-178.3	179.3	-6.2	0	0	0	110.8	K770 V775 L776 T777	K770-D773 HydrophobicContact CB-CB 4.22Å; K770-D773 PolarHBondContact O-N 3.2Å; D773-V775 VanDerWaalsContact C-N 3.29Å; D773-V775 PolarHBondContact O-N 3.15Å; D773-V775 WeakPolarHBondContact OD1-CA 3.43Å; D773-V775 VanDerWaalsContact OD1-CB 3.27Å; D773-V775 WeakPolarHBondContact OD1-CB 3.44Å; D773-V775 PolarHBondContact OD1-N 2.96Å; D773-L776 HydrophobicContact CB-CB 4.07Å; D773-L776 HydrophobicContact CB-CD1 4.01Å; D773-L776 HydrophobicContact CB-CG 4.25Å; D773-L776 PolarHBondContact OD1-N 2.98Å; D773-L776 WeakPolarHBondContact OD2-CD1 3.34Å; D773-L776 WeakPolarHBondContact OD2-CG 3.49Å; D773-T777 PolarHBondContact O-N 3.46Å; D773-T777 VanDerWaalsContact O-N 3.11Å; D773-T777 PolarHBondContact O-OG1 2.88Å
774	P	87.1	Confident	91.2	Very high	40 Å²	40	55.4 Å²	55.4	26%	0.26	27%	0.267	S	S	.	.	H	α-helix	trans	-69.2	-26.8	178.6	28.4	-33.9	0	0	0	112.6	W772 T777 F778 L819 V825	W772-P774 VanDerWaalsContact O-CD 3.32Å; W772-P774 WeakPolarHBondContact O-CD 3.33Å; P774-T777 PolarHBondContact O-N 2.98Å; P774-F778 VanDerWaalsContact O-CB 3.28Å; P774-F778 WeakPolarHBondContact O-CB 3.23Å; P774-F778 PolarHBondContact O-N 3.4Å; P774-L819 HydrophobicContact CB-CD2 3.84Å; P774-V825 HydrophobicContact CB-CG2 3.91Å
775	V	87.9	Confident	91.2	Very high	74 Å²	74	52.5 Å²	52.5	45%	0.448	25%	0.251	S	S	.	.	H	α-helix	trans	-70.7	-45.5	179	-176.5	0	0	0	0	110	D773 T777 F778 N779	D773-V775 VanDerWaalsContact C-N 3.29Å; D773-V775 PolarHBondContact O-N 3.15Å; D773-V775 WeakPolarHBondContact OD1-CA 3.43Å; D773-V775 VanDerWaalsContact OD1-CB 3.27Å; D773-V775 WeakPolarHBondContact OD1-CB 3.44Å; D773-V775 PolarHBondContact OD1-N 2.96Å; V775-T777 VanDerWaalsContact C-N 3.32Å; V775-T777 PolarHBondContact O-N 3.22Å; V775-F778 PolarHBondContact O-N 2.92Å; V775-N779 VanDerWaalsContact O-CB 3.32Å; V775-N779 WeakPolarHBondContact O-CB 3.41Å; V775-N779 PolarHBondContact O-N 3.37Å; V775-N779 PolarHBondContact O-ND2 3.41Å
776	L	91.2	Very high	91.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-61.5	-40.1	172	-78.7	173.4	0	0	0	112.3	Q744 L763 A766 K770 D773 L780	Q744-L776 HydrophobicContact CG-CD2 3.61Å; Q744-L776 HydrophobicContact CG-CG 4.5Å; L763-L776 HydrophobicContact CD2-CD2 3.98Å; A766-L776 HydrophobicContact CB-CD1 3.9Å; A766-L776 HydrophobicContact CB-CD2 3.53Å; A766-L776 HydrophobicContact CB-CG 4.4Å; K770-L776 HydrophobicContact CB-CD1 4.27Å; D773-L776 HydrophobicContact CB-CB 4.07Å; D773-L776 HydrophobicContact CB-CD1 4.01Å; D773-L776 HydrophobicContact CB-CG 4.25Å; D773-L776 PolarHBondContact OD1-N 2.98Å; D773-L776 WeakPolarHBondContact OD2-CD1 3.34Å; D773-L776 WeakPolarHBondContact OD2-CG 3.49Å; L776-L780 VanDerWaalsContact O-CB 3.28Å; L776-L780 WeakPolarHBondContact O-CB 3.33Å; L776-L780 PolarHBondContact O-N 3.01Å
777	T	91	Very high	91.2	Very high	16 Å²	16	53.3 Å²	53.3	10%	0.098	25%	0.253	C	S	.	.	H	α-helix	trans	-68.1	-41.7	179	-57.6	0	0	0	0	111.8	D773 P774 V775 A781 T815 L819	D773-T777 PolarHBondContact O-N 3.46Å; D773-T777 VanDerWaalsContact O-N 3.11Å; D773-T777 PolarHBondContact O-OG1 2.88Å; P774-T777 PolarHBondContact O-N 2.98Å; V775-T777 VanDerWaalsContact C-N 3.32Å; V775-T777 PolarHBondContact O-N 3.22Å; T777-A781 WeakPolarHBondContact O-CB 3.28Å; T777-A781 PolarHBondContact O-N 3.05Å; T777-A781 VanDerWaalsContact O-N 3.09Å; T777-T815 HydrophobicContact CG2-CG2 4.43Å; T777-L819 HydrophobicContact CG2-CD1 4.24Å; T777-L819 HydrophobicContact CG2-CD2 4.46Å
778	F	91.4	Very high	91.2	Very high	39 Å²	39	49.3 Å²	49.3	17%	0.171	24%	0.238	C	C	.	.	H	α-helix	trans	-62.9	-49.2	174.1	-178.1	-88	0	0	0	111.8	P774 V775 L780 A781 F782 F816 L819 A831	P774-F778 VanDerWaalsContact O-CB 3.28Å; P774-F778 WeakPolarHBondContact O-CB 3.23Å; P774-F778 PolarHBondContact O-N 3.4Å; V775-F778 PolarHBondContact O-N 2.92Å; F778-L780 VanDerWaalsContact C-N 3.33Å; F778-L780 PolarHBondContact O-N 3.3Å; F778-A781 PolarHBondContact O-N 2.91Å; F778-F782 WeakPolarHBondContact O-CB 3.24Å; F778-F782 PolarHBondContact O-N 3.03Å; F778-F816 HydrophobicContact CD2-CD1 4.08Å; F778-F816 AromaticContact CD2-CE1 3.77Å; F778-F816 HydrophobicContact CD2-CE1 3.77Å; F778-F816 HydrophobicContact CE2-CD1 4.13Å; F778-F816 AromaticContact CE2-CE1 3.73Å; F778-F816 HydrophobicContact CE2-CE1 3.73Å; F778-F816 HydrophobicContact CG-CE1 4.37Å; F778-F816 HydrophobicContact CZ-CE1 4.29Å; F778-L819 HydrophobicContact CB-CD1 3.88Å; F778-L819 HydrophobicContact CD2-CD1 4.19Å; F778-A831 HydrophobicContact CD2-CB 4.46Å; F778-A831 HydrophobicContact CE2-CB 4.29Å
779	N	91.9	Very high	91.1	Very high	55 Å²	55	43.1 Å²	43.1	29%	0.294	21%	0.211	S	C	.	.	H	α-helix	trans	-61.5	-41	180	-72.5	-22.6	0	0	0	111.7	L763 V775 F782 V783	L763-N779 HydrophobicContact CD1-CB 4.13Å; L763-N779 HydrophobicContact CD2-CB 4.03Å; V775-N779 VanDerWaalsContact O-CB 3.32Å; V775-N779 WeakPolarHBondContact O-CB 3.41Å; V775-N779 PolarHBondContact O-N 3.37Å; V775-N779 PolarHBondContact O-ND2 3.41Å; N779-F782 PolarHBondContact O-N 2.92Å; N779-V783 WeakPolarHBondContact O-CG2 3.01Å; N779-V783 PolarHBondContact O-N 3.16Å
780	L	93.2	Very high	91.1	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-46.1	176.5	-179.5	63.6	0	0	0	111.7	K760 L763 L764 L776 F778 F782 V783 Q784	K760-L780 HydrophobicContact CG-CD1 4.07Å; L763-L780 HydrophobicContact CB-CB 4.44Å; L763-L780 HydrophobicContact CB-CD1 4.09Å; L764-L780 HydrophobicContact CD2-CD1 4.09Å; L764-L780 HydrophobicContact CD2-CD2 3.75Å; L764-L780 HydrophobicContact CG-CD1 3.96Å; L764-L780 HydrophobicContact CG-CD2 4.46Å; L776-L780 VanDerWaalsContact O-CB 3.28Å; L776-L780 WeakPolarHBondContact O-CB 3.33Å; L776-L780 PolarHBondContact O-N 3.01Å; F778-L780 VanDerWaalsContact C-N 3.33Å; F778-L780 PolarHBondContact O-N 3.3Å; L780-F782 VanDerWaalsContact C-N 3.32Å; L780-F782 PolarHBondContact O-N 3.15Å; L780-V783 PolarHBondContact O-N 3.18Å; L780-Q784 WeakPolarHBondContact O-CG 3.39Å; L780-Q784 PolarHBondContact O-N 3.16Å
781	A	92.6	Very high	91.1	Very high	1 Å²	1	42 Å²	42	1%	0.008	21%	0.21	C	C	.	.	H	α-helix	trans	-60.7	-40.3	176.9	0	0	0	0	0	112.2	T777 F778 Q784 K785 A812 T815 F816	T777-A781 WeakPolarHBondContact O-CB 3.28Å; T777-A781 PolarHBondContact O-N 3.05Å; T777-A781 VanDerWaalsContact O-N 3.09Å; F778-A781 PolarHBondContact O-N 2.91Å; A781-Q784 PolarHBondContact O-N 2.85Å; A781-K785 PolarHBondContact O-N 2.83Å; A781-A812 HydrophobicContact CB-CB 4.44Å; A781-A812 WeakPolarHBondContact O-CB 3.49Å; A781-T815 VanDerWaalsContact CB-OG1 3.28Å; A781-T815 WeakPolarHBondContact CB-OG1 3.45Å; A781-F816 HydrophobicContact CB-CD1 4.19Å; A781-F816 HydrophobicContact CB-CD2 4.33Å; A781-F816 HydrophobicContact CB-CE1 3.81Å; A781-F816 HydrophobicContact CB-CE2 3.96Å; A781-F816 HydrophobicContact CB-CG 4.44Å; A781-F816 HydrophobicContact CB-CZ 3.7Å
782	F	92.9	Very high	91.1	Very high	71 Å²	71	39 Å²	39	31%	0.311	19%	0.19	S	C	.	.	H	α-helix	trans	-66.9	-39	177.4	-168.6	-109.2	0	0	0	112.7	F751 F778 N779 L780 R786 F816 E834	F751-F782 HydrophobicContact CE2-CD1 4.34Å; F751-F782 HydrophobicContact CE2-CE1 4.31Å; F751-F782 HydrophobicContact CZ-CD1 4.25Å; F751-F782 AromaticContact CZ-CE1 3.79Å; F751-F782 HydrophobicContact CZ-CE1 3.79Å; F778-F782 WeakPolarHBondContact O-CB 3.24Å; F778-F782 PolarHBondContact O-N 3.03Å; N779-F782 PolarHBondContact O-N 2.92Å; L780-F782 VanDerWaalsContact C-N 3.32Å; L780-F782 PolarHBondContact O-N 3.15Å; F782-R786 WeakPolarHBondContact O-CB 3.46Å; F782-R786 PolarHBondContact O-N 3.49Å; F782-F816 HydrophobicContact CB-CZ 4.06Å; F782-F816 HydrophobicContact CD2-CZ 4.35Å; F782-E834 HydrophobicContact CD2-CG 4.46Å; F782-E834 WeakPolarHBondContact CD2-OE2 3.41Å
783	V	94.1	Very high	91.1	Very high	5 Å²	5	36 Å²	36	3%	0.03	18%	0.184	C	C	.	.	H	α-helix	trans	-70.2	-38.8	173.6	173.9	0	0	0	0	111.5	F751 C759 K760 L763 N779 L780 R786 L787	F751-V783 HydrophobicContact CD2-CG2 3.94Å; F751-V783 HydrophobicContact CE2-CG2 4.18Å; C759-V783 HydrophobicContact CB-CG1 4.37Å; K760-V783 HydrophobicContact CB-CG1 4.01Å; L763-V783 HydrophobicContact CD1-CB 4.23Å; L763-V783 HydrophobicContact CD1-CG2 3.73Å; N779-V783 WeakPolarHBondContact O-CG2 3.01Å; N779-V783 PolarHBondContact O-N 3.16Å; L780-V783 PolarHBondContact O-N 3.18Å; V783-R786 PolarHBondContact O-N 2.98Å; V783-L787 VanDerWaalsContact O-CB 3.28Å; V783-L787 WeakPolarHBondContact O-CB 3.32Å; V783-L787 PolarHBondContact O-N 2.85Å
784	Q	93.4	Very high	91	Very high	9 Å²	9	37.3 Å²	37.3	4%	0.042	19%	0.191	C	C	.	.	H	α-helix	trans	-59.9	-47.2	171.9	-75.9	176.6	-78.3	0	0	111.6	K760 L780 A781 R786 L787 A788 D808 M811 A812	K760-Q784 HydrophobicContact CD-CG 4.39Å; L780-Q784 WeakPolarHBondContact O-CG 3.39Å; L780-Q784 PolarHBondContact O-N 3.16Å; A781-Q784 PolarHBondContact O-N 2.85Å; Q784-R786 PolarHBondContact O-N 3.32Å; Q784-L787 PolarHBondContact O-N 2.94Å; Q784-A788 WeakPolarHBondContact O-CB 3.37Å; Q784-A788 PolarHBondContact O-N 3.23Å; Q784-D808 HydrophobicContact CB-CB 4.45Å; Q784-D808 PolarHBondContact NE2-OD1 2.74Å; Q784-M811 PolarHBondContact NE2-SD 2.97Å; Q784-A812 HydrophobicContact CB-CB 4.32Å
785	K	93.5	Very high	90.6	Very high	22 Å²	22	41.9 Å²	41.9	10%	0.096	21%	0.209	C	C	.	.	H	α-helix	trans	-54.9	-52.8	172.9	176	-167.6	178.2	-173.7	0	111.2	A781 L787 A788 V789 L809 A812 E834 L841	A781-K785 PolarHBondContact O-N 2.83Å; K785-L787 VanDerWaalsContact C-N 3.34Å; K785-L787 PolarHBondContact O-N 3.27Å; K785-A788 PolarHBondContact O-N 3.23Å; K785-V789 WeakPolarHBondContact O-CG2 3.15Å; K785-V789 PolarHBondContact O-N 2.96Å; K785-L809 HydrophobicContact CB-CD1 4.43Å; K785-L809 HydrophobicContact CG-CD1 4.18Å; K785-A812 HydrophobicContact CB-CB 4.38Å; K785-E834 WeakPolarHBondContact CD-OE2 3.39Å; K785-E834 WeakPolarHBondContact CE-OE2 3.08Å; K785-E834 IonicContact NZ-OE1 3.61Å; K785-E834 PolarHBondContact NZ-OE1 2.7Å; K785-E834 IonicContact NZ-OE2 2.78Å; K785-E834 PolarHBondContact NZ-OE2 2.93Å; K785-L841 HydrophobicContact CG-CD1 4.31Å
786	R	93.3	Very high	90.4	Very high	101 Å²	101	43.3 Å²	43.3	38%	0.381	22%	0.218	S	C	.	.	H	α-helix	trans	-63.1	-40.6	-176.3	-167.6	179.9	174.7	-165.7	-4.2	111.9	F751 L756 F782 V783 Q784 V789 T790	F751-R786 VanDerWaalsContact CE2-NH1 3.3Å; L756-R786 HydrophobicContact CD1-CB 4.31Å; L756-R786 HydrophobicContact CD1-CG 3.76Å; F782-R786 WeakPolarHBondContact O-CB 3.46Å; F782-R786 PolarHBondContact O-N 3.49Å; V783-R786 PolarHBondContact O-N 2.98Å; Q784-R786 PolarHBondContact O-N 3.32Å; R786-V789 PolarHBondContact O-N 2.92Å; R786-T790 PolarHBondContact O-N 2.89Å; R786-T790 VanDerWaalsContact O-N 3.11Å; R786-T790 PolarHBondContact O-OG1 3.03Å
787	L	92.8	Very high	89.9	Confident	25 Å²	25	44.5 Å²	44.5	13%	0.131	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-47.3	176	-171.7	156	0	0	0	111.1	K757 K760 V783 Q784 K785 V789 T790 V791	K757-L787 HydrophobicContact CG-CD1 4.12Å; K760-L787 HydrophobicContact CD-CD1 4.27Å; V783-L787 VanDerWaalsContact O-CB 3.28Å; V783-L787 WeakPolarHBondContact O-CB 3.32Å; V783-L787 PolarHBondContact O-N 2.85Å; Q784-L787 PolarHBondContact O-N 2.94Å; K785-L787 VanDerWaalsContact C-N 3.34Å; K785-L787 PolarHBondContact O-N 3.27Å; L787-V789 VanDerWaalsContact C-N 3.34Å; L787-V789 PolarHBondContact O-N 3.04Å; L787-T790 WeakPolarHBondContact CA-OG1 3.45Å; L787-T790 PolarHBondContact O-N 2.98Å; L787-T790 VanDerWaalsContact O-N 3.16Å; L787-T790 PolarHBondContact O-OG1 3.47Å; L787-V791 HydrophobicContact CD2-CG2 4.24Å; L787-V791 PolarHBondContact O-N 3.17Å; L787-V791 VanDerWaalsContact O-N 3.09Å
788	A	92	Very high	89.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-42.4	176.5	0	0	0	0	0	112.2	Q784 K785 T790 V791 L792 A805 L809	Q784-A788 WeakPolarHBondContact O-CB 3.37Å; Q784-A788 PolarHBondContact O-N 3.23Å; K785-A788 PolarHBondContact O-N 3.23Å; A788-T790 PolarHBondContact O-N 3.13Å; A788-V791 PolarHBondContact O-N 3.1Å; A788-L792 WeakPolarHBondContact O-CB 3.44Å; A788-L792 VanDerWaalsContact O-CG 3.28Å; A788-L792 WeakPolarHBondContact O-CG 3.47Å; A788-L792 PolarHBondContact O-N 2.9Å; A788-A805 HydrophobicContact CB-CB 4.09Å; A788-A805 WeakPolarHBondContact CB-O 3.48Å; A788-L809 HydrophobicContact CB-CB 3.92Å; A788-L809 HydrophobicContact CB-CD1 4.5Å
789	V	91.3	Very high	89.3	Confident	29 Å²	29	47.2 Å²	47.2	18%	0.176	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-44.5	174.3	170.3	0	0	0	0	111.4	K785 R786 L787 V791 L792 Q793 L841	K785-V789 WeakPolarHBondContact O-CG2 3.15Å; K785-V789 PolarHBondContact O-N 2.96Å; R786-V789 PolarHBondContact O-N 2.92Å; L787-V789 VanDerWaalsContact C-N 3.34Å; L787-V789 PolarHBondContact O-N 3.04Å; V789-V791 VanDerWaalsContact C-N 3.32Å; V789-V791 PolarHBondContact O-N 3.12Å; V789-L792 PolarHBondContact O-N 2.79Å; V789-Q793 HydrophobicContact CG1-CG 4.29Å; V789-Q793 WeakPolarHBondContact O-CB 3.49Å; V789-Q793 WeakPolarHBondContact O-CG 3.29Å; V789-Q793 PolarHBondContact O-N 2.67Å; V789-L841 HydrophobicContact CG2-CD1 3.56Å; V789-L841 HydrophobicContact CG2-CD2 4.04Å; V789-L841 HydrophobicContact CG2-CG 4.43Å
790	T	90.6	Very high	89.2	Confident	67 Å²	67	47.7 Å²	47.7	41%	0.411	25%	0.251	S	S	.	.	H	α-helix	trans	-64.3	-33.6	177.7	49.2	0	0	0	0	113.6	L756 R786 L787 A788 D794	L756-T790 HydrophobicContact CD1-CG2 4.45Å; R786-T790 PolarHBondContact O-N 2.89Å; R786-T790 VanDerWaalsContact O-N 3.11Å; R786-T790 PolarHBondContact O-OG1 3.03Å; L787-T790 WeakPolarHBondContact CA-OG1 3.45Å; L787-T790 PolarHBondContact O-N 2.98Å; L787-T790 VanDerWaalsContact O-N 3.16Å; L787-T790 PolarHBondContact O-OG1 3.47Å; A788-T790 PolarHBondContact O-N 3.13Å; T790-D794 PolarHBondContact O-N 3.22Å
791	V	89.9	Confident	89	Confident	29 Å²	29	49.4 Å²	49.4	18%	0.176	26%	0.264	C	S	.	.	H	α-helix	trans	-77.2	-31.6	176.6	177.2	0	0	0	0	112.4	L787 A788 V789 S801 A805	L787-V791 HydrophobicContact CD2-CG2 4.24Å; L787-V791 PolarHBondContact O-N 3.17Å; L787-V791 VanDerWaalsContact O-N 3.09Å; A788-V791 PolarHBondContact O-N 3.1Å; V789-V791 VanDerWaalsContact C-N 3.32Å; V789-V791 PolarHBondContact O-N 3.12Å; V791-S801 WeakPolarHBondContact CG1-O 3.28Å; V791-A805 HydrophobicContact CB-CB 3.96Å; V791-A805 HydrophobicContact CG1-CB 3.9Å
792	L	88.2	Confident	88.9	Confident	8 Å²	8	49.5 Å²	49.5	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-71.8	-40.7	174.5	-70	166.2	0	0	0	111.6	A788 V789 V802 I806 L809 A845 H848 R851	A788-L792 WeakPolarHBondContact O-CB 3.44Å; A788-L792 VanDerWaalsContact O-CG 3.28Å; A788-L792 WeakPolarHBondContact O-CG 3.47Å; A788-L792 PolarHBondContact O-N 2.9Å; V789-L792 PolarHBondContact O-N 2.79Å; L792-V802 HydrophobicContact CD2-CG1 4.18Å; L792-I806 HydrophobicContact CD2-CG1 4.31Å; L792-L809 HydrophobicContact CD1-CD2 4.14Å; L792-A845 HydrophobicContact CD1-CB 4.07Å; L792-A845 HydrophobicContact CD2-CB 3.96Å; L792-H848 HydrophobicContact CD2-CB 3.7Å; L792-H848 PolarHBondContact O-CE1 2.94Å; L792-H848 PolarHBondContact O-ND1 3.2Å; L792-R851 PolarHBondContact O-NH2 3.03Å; L792-R851 VanDerWaalsContact O-NH2 3.11Å
793	Q	86.7	Confident	88.8	Confident	134 Å²	134	48.3 Å²	48.3	63%	0.626	26%	0.264	S	S	*	.	H	α-helix	trans	-66.7	-36.8	179	-74.6	176.5	-22.4	0	0	112.7	V789 E795	V789-Q793 HydrophobicContact CG1-CG 4.29Å; V789-Q793 WeakPolarHBondContact O-CB 3.49Å; V789-Q793 WeakPolarHBondContact O-CG 3.29Å; V789-Q793 PolarHBondContact O-N 2.67Å; Q793-E795 PolarHBondContact O-N 3Å
794	D	86.3	Confident	88.6	Confident	54 Å²	54	53.6 Å²	53.6	29%	0.289	29%	0.288	S	S	.	.			trans	-61.4	131.2	174.7	171.6	36.5	0	0	0	112.3	T790 T796 S797 R851	T790-D794 PolarHBondContact O-N 3.22Å; D794-T796 VanDerWaalsContact CG-OG1 3.27Å; D794-T796 WeakPolarHBondContact OD1-CB 3.37Å; D794-T796 PolarHBondContact OD1-N 3.06Å; D794-T796 PolarHBondContact OD1-OG1 2.95Å; D794-T796 PolarHBondContact OD2-OG1 3.43Å; D794-T796 VanDerWaalsContact OD2-OG1 3.08Å; D794-S797 WeakPolarHBondContact OD2-CA 3.49Å; D794-S797 VanDerWaalsContact OD2-CB 3.23Å; D794-S797 WeakPolarHBondContact OD2-CB 3.41Å; D794-S797 PolarHBondContact OD2-N 3.28Å; D794-S797 PolarHBondContact OD2-OG 2.76Å; D794-R851 PolarHBondContact O-NH2 2.74Å
795	E	79.1	Confident	88.5	Confident	136 Å²	136	53.3 Å²	53.3	64%	0.636	29%	0.288	S	S	*	.	S	Bend	trans	-88.1	-17.5	177.8	-47.5	-146.1	106.7	0	0	112.6	Q793 R851 R855	Q793-E795 PolarHBondContact O-N 3Å; E795-R851 IonicContact OE1-CZ 2.77Å; E795-R851 IonicContact OE1-NH1 3.68Å; E795-R851 PolarHBondContact OE1-NH1 2.83Å; E795-R855 PolarHBondContact O-NH1 3.44Å
796	T	82.2	Confident	88.4	Confident	105 Å²	105	53.8 Å²	53.8	64%	0.644	29%	0.291	S	S	*	.	S	Bend	trans	-85	-19.6	-177	71.4	0	0	0	0	113.3	D794 R855	D794-T796 VanDerWaalsContact CG-OG1 3.27Å; D794-T796 WeakPolarHBondContact OD1-CB 3.37Å; D794-T796 PolarHBondContact OD1-N 3.06Å; D794-T796 PolarHBondContact OD1-OG1 2.95Å; D794-T796 PolarHBondContact OD2-OG1 3.43Å; D794-T796 VanDerWaalsContact OD2-OG1 3.08Å; T796-R855 VanDerWaalsContact C-NH1 3.26Å; T796-R855 PolarHBondContact O-NH1 3.39Å
797	S	81.4	Confident	88.4	Confident	24 Å²	24	51.9 Å²	51.9	17%	0.168	30%	0.297	C	S	.	.			trans	-57	145.7	-177.5	-86.7	0	0	0	0	115.4	D794	D794-S797 WeakPolarHBondContact OD2-CA 3.49Å; D794-S797 VanDerWaalsContact OD2-CB 3.23Å; D794-S797 WeakPolarHBondContact OD2-CB 3.41Å; D794-S797 PolarHBondContact OD2-N 3.28Å; D794-S797 PolarHBondContact OD2-OG 2.76Å
798	S	84.3	Confident	88.4	Confident	56 Å²	56	51.8 Å²	51.8	39%	0.392	30%	0.296	S	S	.	.			trans	-77.5	160.5	-178.9	82.5	0	0	0	0	113	S800 S801 V802	S798-S800 VanDerWaalsContact C-N 3.31Å; S798-S800 PolarHBondContact O-N 2.83Å; S798-S800 PolarHBondContact OG-N 2.91Å; S798-S801 WeakPolarHBondContact O-CB 3.48Å; S798-S801 PolarHBondContact O-N 2.74Å; S798-S801 VanDerWaalsContact O-N 3.15Å; S798-S801 PolarHBondContact OG-N 3.14Å; S798-S801 VanDerWaalsContact OG-N 3.09Å; S798-S801 PolarHBondContact OG-OG 3Å; S798-V802 WeakPolarHBondContact O-CG2 3.48Å; S798-V802 PolarHBondContact O-N 3.41Å
799	F	86.2	Confident	88.4	Confident	57 Å²	57	51.8 Å²	51.8	25%	0.25	30%	0.296	C	S	.	.	H	α-helix	trans	-59.7	-38.1	175.1	-179.8	-106.8	0	0	0	112.8	V802 C803 L849 A852 K853 E856	F799-V802 PolarHBondContact O-N 2.93Å; F799-C803 VanDerWaalsContact CZ-SG 3.56Å; F799-C803 WeakPolarHBondContact O-CB 3.33Å; F799-C803 PolarHBondContact O-N 2.99Å; F799-C803 PolarHBondContact O-SG 3.05Å; F799-L849 HydrophobicContact CD2-CD1 4.35Å; F799-L849 HydrophobicContact CE2-CD1 3.55Å; F799-L849 HydrophobicContact CE2-CG 4.21Å; F799-L849 HydrophobicContact CZ-CD1 4.17Å; F799-A852 HydrophobicContact CB-CB 4.44Å; F799-A852 HydrophobicContact CD2-CB 4.17Å; F799-K853 HydrophobicContact CD2-CB 4Å; F799-K853 HydrophobicContact CE2-CB 3.83Å; F799-K853 HydrophobicContact CE2-CG 4.35Å; F799-E856 HydrophobicContact CB-CB 4.22Å; F799-E856 WeakPolarHBondContact CB-OE2 3.43Å; F799-E856 VanDerWaalsContact CD1-OE2 3.22Å; F799-E856 WeakPolarHBondContact CD1-OE2 3.25Å; F799-E856 WeakPolarHBondContact CG-OE2 3.44Å
800	S	88.3	Confident	88.5	Confident	64 Å²	64	53 Å²	53	45%	0.448	30%	0.302	S	S	.	.	H	α-helix	trans	-61	-48.8	172.1	-165	0	0	0	0	111.3	S798 V802 C803 E804	S798-S800 VanDerWaalsContact C-N 3.31Å; S798-S800 PolarHBondContact O-N 2.83Å; S798-S800 PolarHBondContact OG-N 2.91Å; S800-V802 VanDerWaalsContact C-N 3.29Å; S800-V802 PolarHBondContact O-N 3.5Å; S800-C803 PolarHBondContact O-N 3.09Å; S800-C803 VanDerWaalsContact O-N 3.12Å; S800-E804 WeakPolarHBondContact O-CB 3.38Å; S800-E804 VanDerWaalsContact O-CG 3.32Å; S800-E804 WeakPolarHBondContact O-CG 3.39Å; S800-E804 PolarHBondContact O-N 3Å; S800-E804 PolarHBondContact OG-OE1 2.85Å
801	S	89.7	Confident	88.7	Confident	41 Å²	41	54.8 Å²	54.8	29%	0.287	31%	0.307	S	S	.	.	H	α-helix	trans	-57.7	-40.4	178.3	-50.8	0	0	0	0	112.4	V791 S798 A805	V791-S801 WeakPolarHBondContact CG1-O 3.28Å; S798-S801 WeakPolarHBondContact O-CB 3.48Å; S798-S801 PolarHBondContact O-N 2.74Å; S798-S801 VanDerWaalsContact O-N 3.15Å; S798-S801 PolarHBondContact OG-N 3.14Å; S798-S801 VanDerWaalsContact OG-N 3.09Å; S798-S801 PolarHBondContact OG-OG 3Å; S801-A805 WeakPolarHBondContact O-CB 3.39Å; S801-A805 PolarHBondContact O-N 2.96Å
802	V	90.1	Very high	88.8	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-70	-40.3	177	171.8	0	0	0	0	111.5	L792 S798 F799 S800 A805 I806 L849 A852	L792-V802 HydrophobicContact CD2-CG1 4.18Å; S798-V802 WeakPolarHBondContact O-CG2 3.48Å; S798-V802 PolarHBondContact O-N 3.41Å; F799-V802 PolarHBondContact O-N 2.93Å; S800-V802 VanDerWaalsContact C-N 3.29Å; S800-V802 PolarHBondContact O-N 3.5Å; V802-A805 PolarHBondContact O-N 2.74Å; V802-I806 HydrophobicContact CG1-CD1 3.92Å; V802-I806 VanDerWaalsContact O-CG1 3.28Å; V802-I806 WeakPolarHBondContact O-CG1 3.22Å; V802-I806 PolarHBondContact O-N 2.94Å; V802-L849 HydrophobicContact CG1-CD1 4.49Å; V802-A852 HydrophobicContact CB-CB 4.25Å; V802-A852 HydrophobicContact CG1-CB 4.43Å; V802-A852 HydrophobicContact CG2-CB 4.02Å
803	C	90.6	Very high	89.1	Confident	46 Å²	46	55.9 Å²	55.9	31%	0.311	31%	0.307	S	S	.	.	H	α-helix	trans	-63.4	-43.2	173.6	-69.4	0	0	0	0	112.2	F799 S800 I806 A807	F799-C803 VanDerWaalsContact CZ-SG 3.56Å; F799-C803 WeakPolarHBondContact O-CB 3.33Å; F799-C803 PolarHBondContact O-N 2.99Å; F799-C803 PolarHBondContact O-SG 3.05Å; S800-C803 PolarHBondContact O-N 3.09Å; S800-C803 VanDerWaalsContact O-N 3.12Å; C803-I806 PolarHBondContact O-N 3.37Å; C803-A807 PolarHBondContact O-N 3.14Å
804	E	91.1	Very high	89.4	Confident	116 Å²	116	52.7 Å²	52.7	54%	0.542	30%	0.299	S	S	.	.	H	α-helix	trans	-61.5	-43.8	174.6	-72.1	162.9	-127.9	0	0	111.4	S800 I806 A807 D808	S800-E804 WeakPolarHBondContact O-CB 3.38Å; S800-E804 VanDerWaalsContact O-CG 3.32Å; S800-E804 WeakPolarHBondContact O-CG 3.39Å; S800-E804 PolarHBondContact O-N 3Å; S800-E804 PolarHBondContact OG-OE1 2.85Å; E804-I806 VanDerWaalsContact C-N 3.35Å; E804-I806 PolarHBondContact O-N 3.11Å; E804-A807 WeakPolarHBondContact O-CB 3.31Å; E804-A807 PolarHBondContact O-N 3.21Å; E804-D808 PolarHBondContact O-N 3.08Å
805	A	91.7	Very high	89.7	Confident	3 Å²	3	51.3 Å²	51.3	3%	0.025	29%	0.293	C	S	.	.	H	α-helix	trans	-61.8	-39.8	175.1	0	0	0	0	0	112.5	A788 V791 S801 V802 A807 D808 L809	A788-A805 HydrophobicContact CB-CB 4.09Å; A788-A805 WeakPolarHBondContact CB-O 3.48Å; V791-A805 HydrophobicContact CB-CB 3.96Å; V791-A805 HydrophobicContact CG1-CB 3.9Å; S801-A805 WeakPolarHBondContact O-CB 3.39Å; S801-A805 PolarHBondContact O-N 2.96Å; V802-A805 PolarHBondContact O-N 2.74Å; A805-A807 VanDerWaalsContact C-N 3.34Å; A805-D808 PolarHBondContact O-N 3.48Å; A805-L809 WeakPolarHBondContact O-CB 3.43Å; A805-L809 PolarHBondContact O-N 2.99Å
806	I	91.5	Very high	90.3	Very high	33 Å²	33	44.9 Å²	44.9	17%	0.169	26%	0.263	C	S	.	.	H	α-helix	trans	-68.2	-33	175.9	-70.7	166.5	0	0	0	111.7	L792 V802 C803 E804 N810 L842 A845 L849	L792-I806 HydrophobicContact CD2-CG1 4.31Å; V802-I806 HydrophobicContact CG1-CD1 3.92Å; V802-I806 VanDerWaalsContact O-CG1 3.28Å; V802-I806 WeakPolarHBondContact O-CG1 3.22Å; V802-I806 PolarHBondContact O-N 2.94Å; C803-I806 PolarHBondContact O-N 3.37Å; E804-I806 VanDerWaalsContact C-N 3.35Å; E804-I806 PolarHBondContact O-N 3.11Å; I806-N810 WeakPolarHBondContact O-CB 3.19Å; I806-N810 PolarHBondContact O-N 3.19Å; I806-N810 PolarHBondContact O-ND2 3.05Å; I806-L842 HydrophobicContact CG2-CD2 4.2Å; I806-A845 HydrophobicContact CD1-CB 4.03Å; I806-A845 HydrophobicContact CG1-CB 3.81Å; I806-L849 HydrophobicContact CD1-CB 4.05Å; I806-L849 HydrophobicContact CD1-CD1 4.02Å
807	A	92.4	Very high	90.8	Very high	60 Å²	60	42.8 Å²	42.8	50%	0.496	25%	0.247	S	C	.	.	H	α-helix	trans	-70.6	-46.8	173.1	0	0	0	0	0	111.9	C803 E804 A805 L809 N810 M811	C803-A807 PolarHBondContact O-N 3.14Å; E804-A807 WeakPolarHBondContact O-CB 3.31Å; E804-A807 PolarHBondContact O-N 3.21Å; A805-A807 VanDerWaalsContact C-N 3.34Å; A807-L809 VanDerWaalsContact C-N 3.32Å; A807-L809 PolarHBondContact O-N 3.09Å; A807-N810 PolarHBondContact O-N 3.43Å; A807-M811 PolarHBondContact O-N 3.29Å
808	D	92	Very high	91.1	Very high	23 Å²	23	47 Å²	47	12%	0.123	27%	0.265	C	S	.	.	H	α-helix	trans	-57.4	-43.7	173.8	-112.4	-1	0	0	0	111.2	K760 Q784 E804 A805 M811 A812	K760-D808 IonicContact NZ-OD1 3.36Å; K760-D808 PolarHBondContact NZ-OD1 3.13Å; K760-D808 IonicContact NZ-OD2 2.94Å; K760-D808 PolarHBondContact NZ-OD2 2.92Å; Q784-D808 HydrophobicContact CB-CB 4.45Å; Q784-D808 PolarHBondContact NE2-OD1 2.74Å; E804-D808 PolarHBondContact O-N 3.08Å; A805-D808 PolarHBondContact O-N 3.48Å; D808-M811 PolarHBondContact O-N 3.33Å; D808-A812 WeakPolarHBondContact O-CB 3.47Å; D808-A812 PolarHBondContact O-N 3.12Å
809	L	93.7	Very high	91.2	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-70.2	-35.1	180	-173.5	64.1	0	0	0	112.7	K785 A788 L792 A805 A807 R813 C838 L841 L842	K785-L809 HydrophobicContact CB-CD1 4.43Å; K785-L809 HydrophobicContact CG-CD1 4.18Å; A788-L809 HydrophobicContact CB-CB 3.92Å; A788-L809 HydrophobicContact CB-CD1 4.5Å; L792-L809 HydrophobicContact CD1-CD2 4.14Å; A805-L809 WeakPolarHBondContact O-CB 3.43Å; A805-L809 PolarHBondContact O-N 2.99Å; A807-L809 VanDerWaalsContact C-N 3.32Å; A807-L809 PolarHBondContact O-N 3.09Å; L809-R813 WeakPolarHBondContact O-CB 3.42Å; L809-R813 PolarHBondContact O-N 2.93Å; L809-C838 HydrophobicContact CD1-CB 4.11Å; L809-L841 HydrophobicContact CD1-CB 4.44Å; L809-L841 HydrophobicContact CD1-CD1 4.31Å; L809-L841 HydrophobicContact CD2-CB 3.73Å; L809-L842 HydrophobicContact CB-CD2 4.13Å; L809-L842 HydrophobicContact CD2-CD2 3.77Å; L809-L842 HydrophobicContact CD2-CG 3.75Å; L809-L842 HydrophobicContact CG-CD1 4.49Å; L809-L842 HydrophobicContact CG-CD2 3.94Å; L809-L842 HydrophobicContact CG-CG 3.85Å
810	N	93.5	Very high	91.3	Very high	55 Å²	55	43.2 Å²	43.2	29%	0.294	24%	0.244	S	C	.	.	H	α-helix	trans	-65.9	-40.6	169.1	-92.5	-69.6	0	0	0	112	I806 A807 R813 C814 L842	I806-N810 WeakPolarHBondContact O-CB 3.19Å; I806-N810 PolarHBondContact O-N 3.19Å; I806-N810 PolarHBondContact O-ND2 3.05Å; A807-N810 PolarHBondContact O-N 3.43Å; N810-R813 PolarHBondContact O-N 3.17Å; N810-R813 PolarHBondContact OD1-NH2 3.2Å; N810-R813 VanDerWaalsContact OD1-NH2 3.1Å; N810-C814 WeakPolarHBondContact O-CB 3.35Å; N810-C814 PolarHBondContact O-N 2.98Å; N810-C814 PolarHBondContact O-SG 2.64Å; N810-C814 VanDerWaalsContact O-SG 3.35Å; N810-L842 VanDerWaalsContact ND2-CD2 3.27Å; N810-L842 WeakPolarHBondContact ND2-CD2 3.4Å; N810-L842 WeakPolarHBondContact OD1-CD1 3.49Å
811	M	92.9	Very high	91.2	Very high	105 Å²	105	47.8 Å²	47.8	52%	0.517	26%	0.256	S	S	.	.	H	α-helix	trans	-64	-41.1	175.5	-174	174.1	-71.7	0	0	111.5	Q784 A807 D808 C814 T815	Q784-M811 PolarHBondContact NE2-SD 2.97Å; A807-M811 PolarHBondContact O-N 3.29Å; D808-M811 PolarHBondContact O-N 3.33Å; M811-C814 PolarHBondContact O-N 3.32Å; M811-T815 WeakPolarHBondContact O-CB 3.42Å; M811-T815 WeakPolarHBondContact O-CG2 3.49Å; M811-T815 PolarHBondContact O-N 2.91Å; M811-T815 PolarHBondContact O-OG1 3.21Å
812	A	93.8	Very high	90.8	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-49.6	172	0	0	0	0	0	111.3	A781 Q784 K785 D808 C814 T815 F816	A781-A812 HydrophobicContact CB-CB 4.44Å; A781-A812 WeakPolarHBondContact O-CB 3.49Å; Q784-A812 HydrophobicContact CB-CB 4.32Å; K785-A812 HydrophobicContact CB-CB 4.38Å; D808-A812 WeakPolarHBondContact O-CB 3.47Å; D808-A812 PolarHBondContact O-N 3.12Å; A812-C814 VanDerWaalsContact C-N 3.33Å; A812-C814 PolarHBondContact O-N 3.26Å; A812-T815 WeakPolarHBondContact CA-OG1 3.11Å; A812-T815 PolarHBondContact O-N 3.05Å; A812-T815 PolarHBondContact O-OG1 3.15Å; A812-F816 HydrophobicContact CB-CD2 4.38Å; A812-F816 HydrophobicContact CB-CE2 4.2Å; A812-F816 WeakPolarHBondContact O-CB 3.45Å; A812-F816 WeakPolarHBondContact O-CD2 3.4Å; A812-F816 WeakPolarHBondContact O-CG 3.37Å; A812-F816 PolarHBondContact O-N 3.25Å
813	R	94	Very high	89.7	Confident	59 Å²	59	56.3 Å²	56.3	22%	0.223	30%	0.298	C	S	.	.	H	α-helix	trans	-56.6	-44.8	175.6	-173.3	-175.7	55.1	75.4	7	112.3	L809 N810 N817 C838 L842	L809-R813 WeakPolarHBondContact O-CB 3.42Å; L809-R813 PolarHBondContact O-N 2.93Å; N810-R813 PolarHBondContact O-N 3.17Å; N810-R813 PolarHBondContact OD1-NH2 3.2Å; N810-R813 VanDerWaalsContact OD1-NH2 3.1Å; R813-N817 WeakPolarHBondContact O-CB 3.39Å; R813-N817 PolarHBondContact O-N 2.89Å; R813-N817 PolarHBondContact O-ND2 3.39Å; R813-C838 HydrophobicContact CB-CB 3.8Å; R813-C838 HydrophobicContact CG-CB 4.24Å; R813-L842 HydrophobicContact CB-CD1 4.22Å
814	C	93.2	Very high	88.5	Confident	68 Å²	68	62.6 Å²	62.6	46%	0.459	32%	0.323	S	S	.	.	H	α-helix	trans	-68.3	-39.1	-179.4	-73.1	0	0	0	0	112.5	N810 M811 A812 H818	N810-C814 WeakPolarHBondContact O-CB 3.35Å; N810-C814 PolarHBondContact O-N 2.98Å; N810-C814 PolarHBondContact O-SG 2.64Å; N810-C814 VanDerWaalsContact O-SG 3.35Å; M811-C814 PolarHBondContact O-N 3.32Å; A812-C814 VanDerWaalsContact C-N 3.33Å; A812-C814 PolarHBondContact O-N 3.26Å; C814-H818 PolarHBondContact O-N 3.24Å; C814-H818 VanDerWaalsContact O-N 3.13Å
815	T	91.5	Very high	87.2	Confident	25 Å²	25	57.9 Å²	57.9	15%	0.153	30%	0.302	C	S	.	.	H	α-helix	trans	-70.6	-41.4	176.8	45	0	0	0	0	112.1	T777 A781 M811 A812 N817 H818 L819	T777-T815 HydrophobicContact CG2-CG2 4.43Å; A781-T815 VanDerWaalsContact CB-OG1 3.28Å; A781-T815 WeakPolarHBondContact CB-OG1 3.45Å; M811-T815 WeakPolarHBondContact O-CB 3.42Å; M811-T815 WeakPolarHBondContact O-CG2 3.49Å; M811-T815 PolarHBondContact O-N 2.91Å; M811-T815 PolarHBondContact O-OG1 3.21Å; A812-T815 WeakPolarHBondContact CA-OG1 3.11Å; A812-T815 PolarHBondContact O-N 3.05Å; A812-T815 PolarHBondContact O-OG1 3.15Å; T815-N817 PolarHBondContact O-N 2.92Å; T815-H818 WeakPolarHBondContact O-CB 3.41Å; T815-H818 PolarHBondContact O-N 3.38Å; T815-H818 VanDerWaalsContact O-N 3.1Å; T815-L819 WeakPolarHBondContact O-CG 3.32Å; T815-L819 PolarHBondContact O-N 3.49Å
816	F	92.8	Very high	85.7	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-61.3	-41.9	172.2	-72	-50.5	0	0	0	112.7	F778 A781 F782 A812 H818 L819 S820 E834 A835	F778-F816 HydrophobicContact CD2-CD1 4.08Å; F778-F816 AromaticContact CD2-CE1 3.77Å; F778-F816 HydrophobicContact CD2-CE1 3.77Å; F778-F816 HydrophobicContact CE2-CD1 4.13Å; F778-F816 AromaticContact CE2-CE1 3.73Å; F778-F816 HydrophobicContact CE2-CE1 3.73Å; F778-F816 HydrophobicContact CG-CE1 4.37Å; F778-F816 HydrophobicContact CZ-CE1 4.29Å; A781-F816 HydrophobicContact CB-CD1 4.19Å; A781-F816 HydrophobicContact CB-CD2 4.33Å; A781-F816 HydrophobicContact CB-CE1 3.81Å; A781-F816 HydrophobicContact CB-CE2 3.96Å; A781-F816 HydrophobicContact CB-CG 4.44Å; A781-F816 HydrophobicContact CB-CZ 3.7Å; F782-F816 HydrophobicContact CB-CZ 4.06Å; F782-F816 HydrophobicContact CD2-CZ 4.35Å; A812-F816 HydrophobicContact CB-CD2 4.38Å; A812-F816 HydrophobicContact CB-CE2 4.2Å; A812-F816 WeakPolarHBondContact O-CB 3.45Å; A812-F816 WeakPolarHBondContact O-CD2 3.4Å; A812-F816 WeakPolarHBondContact O-CG 3.37Å; A812-F816 PolarHBondContact O-N 3.25Å; F816-H818 PolarHBondContact O-N 2.85Å; F816-L819 HydrophobicContact CD1-CD1 4.45Å; F816-L819 PolarHBondContact O-N 3.19Å; F816-S820 PolarHBondContact O-N 2.86Å; F816-S820 PolarHBondContact O-OG 3.43Å; F816-E834 HydrophobicContact CD1-CB 3.89Å; F816-E834 HydrophobicContact CD2-CB 3.84Å; F816-E834 HydrophobicContact CE1-CB 3.85Å; F816-E834 HydrophobicContact CE1-CG 4.24Å; F816-E834 HydrophobicContact CE2-CB 3.81Å; F816-E834 HydrophobicContact CG-CB 3.89Å; F816-E834 HydrophobicContact CZ-CB 3.8Å; F816-E834 HydrophobicContact CZ-CG 4.14Å; F816-A835 HydrophobicContact CB-CB 3.8Å
817	N	91.2	Very high	84.7	Confident	61 Å²	61	67.7 Å²	67.7	33%	0.326	35%	0.354	S	S	.	.	H	α-helix	trans	-69.2	-12.2	173.9	-83.4	-72.2	0	0	0	114.8	R813 T815 K821 A835	R813-N817 WeakPolarHBondContact O-CB 3.39Å; R813-N817 PolarHBondContact O-N 2.89Å; R813-N817 PolarHBondContact O-ND2 3.39Å; T815-N817 PolarHBondContact O-N 2.92Å; N817-K821 WeakPolarHBondContact O-CD 3.38Å; N817-K821 WeakPolarHBondContact O-CE 3.46Å; N817-A835 WeakPolarHBondContact ND2-CB 3.26Å
818	H	88.6	Confident	84	Confident	114 Å²	114	68.5 Å²	68.5	53%	0.528	35%	0.347	S	S	.	.	H	α-helix	trans	-89.9	-46	170.8	-179.3	59.9	0	0	0	110.3	C814 T815 F816 S820 K821 L822	C814-H818 PolarHBondContact O-N 3.24Å; C814-H818 VanDerWaalsContact O-N 3.13Å; T815-H818 WeakPolarHBondContact O-CB 3.41Å; T815-H818 PolarHBondContact O-N 3.38Å; T815-H818 VanDerWaalsContact O-N 3.1Å; F816-H818 PolarHBondContact O-N 2.85Å; H818-S820 VanDerWaalsContact C-N 3.32Å; H818-S820 PolarHBondContact O-N 3.48Å; H818-K821 PolarHBondContact O-N 3.11Å; H818-L822 PolarHBondContact O-N 2.97Å
819	L	87.6	Confident	83.6	Confident	2 Å²	2	70.7 Å²	70.7	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-60.8	-36.8	176.5	-70.3	163.9	0	0	0	112.8	P774 T777 F778 T815 F816 K821 L822 V825 A831	P774-L819 HydrophobicContact CB-CD2 3.84Å; T777-L819 HydrophobicContact CG2-CD1 4.24Å; T777-L819 HydrophobicContact CG2-CD2 4.46Å; F778-L819 HydrophobicContact CB-CD1 3.88Å; F778-L819 HydrophobicContact CD2-CD1 4.19Å; T815-L819 WeakPolarHBondContact O-CG 3.32Å; T815-L819 PolarHBondContact O-N 3.49Å; F816-L819 HydrophobicContact CD1-CD1 4.45Å; F816-L819 PolarHBondContact O-N 3.19Å; L819-K821 PolarHBondContact O-N 3.31Å; L819-L822 HydrophobicContact CD2-CD1 4.41Å; L819-L822 PolarHBondContact O-N 3.36Å; L819-V825 HydrophobicContact CB-CG2 4.38Å; L819-V825 HydrophobicContact CD2-CG2 3.9Å; L819-V825 WeakPolarHBondContact O-CG2 3.5Å; L819-A831 HydrophobicContact CB-CB 4.04Å
820	S	87.1	Confident	83.3	Confident	30 Å²	30	75.7 Å²	75.7	21%	0.21	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-10.9	175.5	63.7	0	0	0	0	114.5	F816 H818	F816-S820 PolarHBondContact O-N 2.86Å; F816-S820 PolarHBondContact O-OG 3.43Å; H818-S820 VanDerWaalsContact C-N 3.32Å; H818-S820 PolarHBondContact O-N 3.48Å
821	K	86.1	Confident	83	Confident	161 Å²	161	73.1 Å²	73.1	70%	0.7	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-6.2	176.7	-61.9	179.3	-177.6	-177.9	0	113.7	N817 H818 L819	N817-K821 WeakPolarHBondContact O-CD 3.38Å; N817-K821 WeakPolarHBondContact O-CE 3.46Å; H818-K821 PolarHBondContact O-N 3.11Å; L819-K821 PolarHBondContact O-N 3.31Å
822	L	81.1	Confident	82.8	Confident	67 Å²	67	70 Å²	70	35%	0.351	37%	0.37	S	S	.	.			trans	-91.1	123.1	-179.8	-75.3	170	0	0	0	109.7	H818 L819 E824 V825 Q828	H818-L822 PolarHBondContact O-N 2.97Å; L819-L822 HydrophobicContact CD2-CD1 4.41Å; L819-L822 PolarHBondContact O-N 3.36Å; L822-E824 PolarHBondContact O-N 3.21Å; L822-E824 VanDerWaalsContact O-N 3.1Å; L822-V825 HydrophobicContact CB-CG2 3.69Å; L822-V825 HydrophobicContact CD1-CG2 4.45Å; L822-V825 PolarHBondContact O-N 2.95Å; L822-Q828 PolarHBondContact O-NE2 3.47Å
823	N	67.4	Low	82.7	Confident	154 Å²	154	73 Å²	73	82%	0.824	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-16.6	-176.6	-76.2	-7.8	0	0	0	114.5
824	E	65.9	Low	82.6	Confident	178 Å²	178	71.4 Å²	71.4	83%	0.832	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.7	-171	-58.7	178.3	156.5	0	0	113.4	L822 L826	L822-E824 PolarHBondContact O-N 3.21Å; L822-E824 VanDerWaalsContact O-N 3.1Å; E824-L826 PolarHBondContact O-N 3.02Å
825	V	63.5	Low	82.5	Confident	17 Å²	17	68.3 Å²	68.3	10%	0.103	36%	0.361	C	S	.	.			trans	-82.9	116.6	-178	-176.2	0	0	0	0	110.4	P774 L819 L822 N827 Q828	P774-V825 HydrophobicContact CB-CG2 3.91Å; L819-V825 HydrophobicContact CB-CG2 4.38Å; L819-V825 HydrophobicContact CD2-CG2 3.9Å; L819-V825 WeakPolarHBondContact O-CG2 3.5Å; L822-V825 HydrophobicContact CB-CG2 3.69Å; L822-V825 HydrophobicContact CD1-CG2 4.45Å; L822-V825 PolarHBondContact O-N 2.95Å; V825-N827 PolarHBondContact O-N 3Å; V825-Q828 HydrophobicContact CB-CG 4.47Å; V825-Q828 PolarHBondContact O-N 3.19Å
826	L	60.6	Low	82.6	Confident	163 Å²	163	75 Å²	75	85%	0.853	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-30.5	-172.8	-149.7	83	0	0	0	115.1	E824	E824-L826 PolarHBondContact O-N 3.02Å
827	N	69.2	Low	82.6	Confident	79 Å²	79	78.3 Å²	78.3	42%	0.422	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-131.7	60.3	-178.3	-65.5	-44.5	0	0	0	112.2	V825 A829 M830 A831	V825-N827 PolarHBondContact O-N 3Å; N827-A829 PolarHBondContact O-N 2.76Å; N827-A829 VanDerWaalsContact O-N 3.17Å; N827-M830 HydrophobicContact CB-CB 3.92Å; N827-M830 HydrophobicContact CB-CG 3.97Å; N827-M830 HydrophobicContact CB-SD 3.86Å; N827-M830 PolarHBondContact O-N 2.94Å; N827-A831 PolarHBondContact O-N 3.49Å; N827-A831 VanDerWaalsContact O-N 3.11Å
828	Q	79.4	Confident	82.6	Confident	78 Å²	78	75.4 Å²	75.4	36%	0.364	39%	0.385	S	S	.	.	H	α-helix	trans	-47.5	-41.8	174.8	-70.3	-178.3	-23.2	0	0	113.5	L822 V825 A831 A832	L822-Q828 PolarHBondContact O-NE2 3.47Å; V825-Q828 HydrophobicContact CB-CG 4.47Å; V825-Q828 PolarHBondContact O-N 3.19Å; Q828-A831 PolarHBondContact O-N 3.4Å; Q828-A832 PolarHBondContact O-N 3.37Å
829	A	83.4	Confident	82.8	Confident	69 Å²	69	74.6 Å²	74.6	57%	0.57	38%	0.381	S	S	*	.	H	α-helix	trans	-60.6	-46.6	178.1	0	0	0	0	0	112.2	N827 A831 A832 D833	N827-A829 PolarHBondContact O-N 2.76Å; N827-A829 VanDerWaalsContact O-N 3.17Å; A829-A831 VanDerWaalsContact C-N 3.3Å; A829-A831 PolarHBondContact O-N 2.9Å; A829-A832 WeakPolarHBondContact O-CB 3.24Å; A829-A832 PolarHBondContact O-N 3.18Å; A829-A832 VanDerWaalsContact O-N 3.12Å; A829-D833 PolarHBondContact O-N 3.16Å
830	M	86	Confident	83	Confident	105 Å²	105	78.9 Å²	78.9	52%	0.517	40%	0.404	S	S	.	.	H	α-helix	trans	-63.3	-36.5	175.9	-66.2	-178.5	170.8	0	0	111.9	N827 A832 D833 E834	N827-M830 HydrophobicContact CB-CB 3.92Å; N827-M830 HydrophobicContact CB-CG 3.97Å; N827-M830 HydrophobicContact CB-SD 3.86Å; N827-M830 PolarHBondContact O-N 2.94Å; M830-A832 VanDerWaalsContact C-N 3.35Å; M830-D833 PolarHBondContact O-N 3.07Å; M830-E834 VanDerWaalsContact O-CB 3.25Å; M830-E834 WeakPolarHBondContact O-CB 3.39Å; M830-E834 VanDerWaalsContact O-CG 3.27Å; M830-E834 WeakPolarHBondContact O-CG 3.38Å; M830-E834 PolarHBondContact O-N 2.9Å
831	A	87.4	Confident	83.3	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-65.9	-36.7	174.2	0	0	0	0	0	112.1	F778 L819 N827 Q828 A829 A835	F778-A831 HydrophobicContact CD2-CB 4.46Å; F778-A831 HydrophobicContact CE2-CB 4.29Å; L819-A831 HydrophobicContact CB-CB 4.04Å; N827-A831 PolarHBondContact O-N 3.49Å; N827-A831 VanDerWaalsContact O-N 3.11Å; Q828-A831 PolarHBondContact O-N 3.4Å; A829-A831 VanDerWaalsContact C-N 3.3Å; A829-A831 PolarHBondContact O-N 2.9Å; A831-A835 VanDerWaalsContact O-CB 3.27Å; A831-A835 WeakPolarHBondContact O-CB 3.43Å; A831-A835 PolarHBondContact O-N 3.33Å
832	A	89.2	Confident	83.5	Confident	39 Å²	39	72.3 Å²	72.3	32%	0.322	37%	0.374	S	S	.	.	H	α-helix	trans	-68	-40.7	173.5	0	0	0	0	0	112.3	Q828 A829 M830 A835 R836	Q828-A832 PolarHBondContact O-N 3.37Å; A829-A832 WeakPolarHBondContact O-CB 3.24Å; A829-A832 PolarHBondContact O-N 3.18Å; A829-A832 VanDerWaalsContact O-N 3.12Å; M830-A832 VanDerWaalsContact C-N 3.35Å; A832-A835 WeakPolarHBondContact O-CB 3.15Å; A832-A835 PolarHBondContact O-N 3.37Å; A832-R836 WeakPolarHBondContact O-CG 3.29Å; A832-R836 PolarHBondContact O-N 2.97Å
833	D	91.4	Very high	83.9	Confident	65 Å²	65	72.5 Å²	72.5	35%	0.348	38%	0.381	S	S	.	.	H	α-helix	trans	-67.1	-44.6	177.2	-68.1	-24	0	0	0	112.1	A829 M830 A835 R836 I837	A829-D833 PolarHBondContact O-N 3.16Å; M830-D833 PolarHBondContact O-N 3.07Å; D833-A835 VanDerWaalsContact C-N 3.32Å; D833-A835 PolarHBondContact O-N 3.5Å; D833-R836 WeakPolarHBondContact O-CB 3.49Å; D833-R836 PolarHBondContact O-N 3.15Å; D833-R836 VanDerWaalsContact O-N 3.12Å; D833-R836 IonicContact OD1-CZ 2.68Å; D833-R836 IonicContact OD1-NE 2.56Å; D833-R836 IonicContact OD1-NH2 3.93Å; D833-R836 PolarHBondContact OD1-NH2 2.78Å; D833-I837 WeakPolarHBondContact O-CG1 3.39Å; D833-I837 PolarHBondContact O-N 3.07Å
834	E	92.2	Very high	84.8	Confident	24 Å²	24	70.3 Å²	70.3	11%	0.112	37%	0.366	C	S	.	.	H	α-helix	trans	-61.2	-39.8	173.7	-77.7	-67.6	126.4	0	0	112.1	F782 K785 F816 M830 R836 I837 C838	F782-E834 HydrophobicContact CD2-CG 4.46Å; F782-E834 WeakPolarHBondContact CD2-OE2 3.41Å; K785-E834 WeakPolarHBondContact CD-OE2 3.39Å; K785-E834 WeakPolarHBondContact CE-OE2 3.08Å; K785-E834 IonicContact NZ-OE1 3.61Å; K785-E834 PolarHBondContact NZ-OE1 2.7Å; K785-E834 IonicContact NZ-OE2 2.78Å; K785-E834 PolarHBondContact NZ-OE2 2.93Å; F816-E834 HydrophobicContact CD1-CB 3.89Å; F816-E834 HydrophobicContact CD2-CB 3.84Å; F816-E834 HydrophobicContact CE1-CB 3.85Å; F816-E834 HydrophobicContact CE1-CG 4.24Å; F816-E834 HydrophobicContact CE2-CB 3.81Å; F816-E834 HydrophobicContact CG-CB 3.89Å; F816-E834 HydrophobicContact CZ-CB 3.8Å; F816-E834 HydrophobicContact CZ-CG 4.14Å; M830-E834 VanDerWaalsContact O-CB 3.25Å; M830-E834 WeakPolarHBondContact O-CB 3.39Å; M830-E834 VanDerWaalsContact O-CG 3.27Å; M830-E834 WeakPolarHBondContact O-CG 3.38Å; M830-E834 PolarHBondContact O-N 2.9Å; E834-R836 VanDerWaalsContact C-N 3.34Å; E834-R836 PolarHBondContact O-N 2.56Å; E834-I837 PolarHBondContact O-N 3.15Å; E834-C838 WeakPolarHBondContact O-CB 3.36Å; E834-C838 PolarHBondContact O-N 3.01Å; E834-C838 PolarHBondContact O-SG 3.38Å; E834-C838 VanDerWaalsContact O-SG 3.41Å
835	A	91.6	Very high	85.8	Confident	4 Å²	4	62 Å²	62	3%	0.033	33%	0.327	C	S	.	.	H	α-helix	trans	-60.4	-38.8	172	0	0	0	0	0	113.2	F816 N817 A831 A832 D833 Q839	F816-A835 HydrophobicContact CB-CB 3.8Å; N817-A835 WeakPolarHBondContact ND2-CB 3.26Å; A831-A835 VanDerWaalsContact O-CB 3.27Å; A831-A835 WeakPolarHBondContact O-CB 3.43Å; A831-A835 PolarHBondContact O-N 3.33Å; A832-A835 WeakPolarHBondContact O-CB 3.15Å; A832-A835 PolarHBondContact O-N 3.37Å; D833-A835 VanDerWaalsContact C-N 3.32Å; D833-A835 PolarHBondContact O-N 3.5Å; A835-Q839 PolarHBondContact O-N 3.31Å; A835-Q839 VanDerWaalsContact O-N 3.14Å
836	R	92.7	Very high	86.8	Confident	164 Å²	164	68 Å²	68	62%	0.619	35%	0.352	S	S	*	.	H	α-helix	trans	-66	-50.5	174.2	-69.1	-169.3	-67.6	155.4	-5.6	111.1	A832 D833 E834 C838 Q839 D840	A832-R836 WeakPolarHBondContact O-CG 3.29Å; A832-R836 PolarHBondContact O-N 2.97Å; D833-R836 WeakPolarHBondContact O-CB 3.49Å; D833-R836 PolarHBondContact O-N 3.15Å; D833-R836 VanDerWaalsContact O-N 3.12Å; D833-R836 IonicContact OD1-CZ 2.68Å; D833-R836 IonicContact OD1-NE 2.56Å; D833-R836 IonicContact OD1-NH2 3.93Å; D833-R836 PolarHBondContact OD1-NH2 2.78Å; E834-R836 VanDerWaalsContact C-N 3.34Å; E834-R836 PolarHBondContact O-N 2.56Å; R836-C838 VanDerWaalsContact C-N 3.28Å; R836-C838 PolarHBondContact O-N 2.81Å; R836-Q839 WeakPolarHBondContact O-CA 3.37Å; R836-Q839 WeakPolarHBondContact O-CB 3.13Å; R836-Q839 PolarHBondContact O-N 3.13Å; R836-D840 PolarHBondContact O-N 3.32Å
837	I	92.9	Very high	88.1	Confident	71 Å²	71	67.7 Å²	67.7	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-60.3	-38.2	179.7	-59.7	160.3	0	0	0	111.1	D833 E834 D840 L841	D833-I837 WeakPolarHBondContact O-CG1 3.39Å; D833-I837 PolarHBondContact O-N 3.07Å; E834-I837 PolarHBondContact O-N 3.15Å; I837-D840 PolarHBondContact O-N 3.33Å; I837-L841 HydrophobicContact CG2-CD1 3.96Å; I837-L841 HydrophobicContact CG2-CG 4.37Å; I837-L841 WeakPolarHBondContact O-CB 3.24Å; I837-L841 WeakPolarHBondContact O-CD1 3.5Å; I837-L841 VanDerWaalsContact O-CG 3.24Å; I837-L841 WeakPolarHBondContact O-CG 3.44Å; I837-L841 PolarHBondContact O-N 3.32Å
838	C	92	Very high	88.9	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-65.7	-34.4	173.1	-73.7	0	0	0	0	113.3	L809 R813 E834 R836 L842	L809-C838 HydrophobicContact CD1-CB 4.11Å; R813-C838 HydrophobicContact CB-CB 3.8Å; R813-C838 HydrophobicContact CG-CB 4.24Å; E834-C838 WeakPolarHBondContact O-CB 3.36Å; E834-C838 PolarHBondContact O-N 3.01Å; E834-C838 PolarHBondContact O-SG 3.38Å; E834-C838 VanDerWaalsContact O-SG 3.41Å; R836-C838 VanDerWaalsContact C-N 3.28Å; R836-C838 PolarHBondContact O-N 2.81Å; C838-L842 WeakPolarHBondContact O-CB 3.28Å; C838-L842 WeakPolarHBondContact O-CD1 3.4Å; C838-L842 WeakPolarHBondContact O-CG 3.39Å; C838-L842 PolarHBondContact O-N 2.8Å
839	Q	92.6	Very high	89.3	Confident	97 Å²	97	64.4 Å²	64.4	45%	0.453	32%	0.324	S	S	.	.	H	α-helix	trans	-66.4	-41.4	173.7	179.9	63.5	33.6	0	0	111.5	A835 R836 L842 S843	A835-Q839 PolarHBondContact O-N 3.31Å; A835-Q839 VanDerWaalsContact O-N 3.14Å; R836-Q839 WeakPolarHBondContact O-CA 3.37Å; R836-Q839 WeakPolarHBondContact O-CB 3.13Å; R836-Q839 PolarHBondContact O-N 3.13Å; Q839-L842 PolarHBondContact O-N 3.43Å; Q839-S843 PolarHBondContact O-N 2.89Å; Q839-S843 VanDerWaalsContact O-N 3.15Å
840	D	92.3	Very high	89.5	Confident	92 Å²	92	65.4 Å²	65.4	49%	0.492	32%	0.32	S	S	.	.	H	α-helix	trans	-66.4	-45.7	178	-61.2	-31.3	0	0	0	111.2	R836 I837 L842 S843 Q844	R836-D840 PolarHBondContact O-N 3.32Å; I837-D840 PolarHBondContact O-N 3.33Å; D840-L842 VanDerWaalsContact C-N 3.29Å; D840-L842 PolarHBondContact O-N 2.94Å; D840-S843 WeakPolarHBondContact O-CB 3.13Å; D840-S843 PolarHBondContact O-N 3.03Å; D840-S843 PolarHBondContact O-OG 3.1Å; D840-Q844 PolarHBondContact O-N 3.36Å
841	L	92.1	Very high	89.5	Confident	30 Å²	30	63.4 Å²	63.4	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-60.2	-35.9	174.2	-72	167	0	0	0	112.5	K785 V789 L809 I837 S843 Q844 A845	K785-L841 HydrophobicContact CG-CD1 4.31Å; V789-L841 HydrophobicContact CG2-CD1 3.56Å; V789-L841 HydrophobicContact CG2-CD2 4.04Å; V789-L841 HydrophobicContact CG2-CG 4.43Å; L809-L841 HydrophobicContact CD1-CB 4.44Å; L809-L841 HydrophobicContact CD1-CD1 4.31Å; L809-L841 HydrophobicContact CD2-CB 3.73Å; I837-L841 HydrophobicContact CG2-CD1 3.96Å; I837-L841 HydrophobicContact CG2-CG 4.37Å; I837-L841 WeakPolarHBondContact O-CB 3.24Å; I837-L841 WeakPolarHBondContact O-CD1 3.5Å; I837-L841 VanDerWaalsContact O-CG 3.24Å; I837-L841 WeakPolarHBondContact O-CG 3.44Å; I837-L841 PolarHBondContact O-N 3.32Å; L841-S843 VanDerWaalsContact C-N 3.3Å; L841-S843 PolarHBondContact O-N 3.02Å; L841-Q844 PolarHBondContact O-N 3.47Å; L841-A845 WeakPolarHBondContact O-CB 3.47Å; L841-A845 PolarHBondContact O-N 2.86Å
842	L	90.7	Very high	89.5	Confident	22 Å²	22	63.8 Å²	63.8	12%	0.115	31%	0.31	C	S	.	.	H	α-helix	trans	-68.5	-27.3	173.9	-77	166.6	0	0	0	113.1	I806 L809 N810 R813 C838 Q839 D840	I806-L842 HydrophobicContact CG2-CD2 4.2Å; L809-L842 HydrophobicContact CB-CD2 4.13Å; L809-L842 HydrophobicContact CD2-CD2 3.77Å; L809-L842 HydrophobicContact CD2-CG 3.75Å; L809-L842 HydrophobicContact CG-CD1 4.49Å; L809-L842 HydrophobicContact CG-CD2 3.94Å; L809-L842 HydrophobicContact CG-CG 3.85Å; N810-L842 VanDerWaalsContact ND2-CD2 3.27Å; N810-L842 WeakPolarHBondContact ND2-CD2 3.4Å; N810-L842 WeakPolarHBondContact OD1-CD1 3.49Å; R813-L842 HydrophobicContact CB-CD1 4.22Å; C838-L842 WeakPolarHBondContact O-CB 3.28Å; C838-L842 WeakPolarHBondContact O-CD1 3.4Å; C838-L842 WeakPolarHBondContact O-CG 3.39Å; C838-L842 PolarHBondContact O-N 2.8Å; Q839-L842 PolarHBondContact O-N 3.43Å; D840-L842 VanDerWaalsContact C-N 3.29Å; D840-L842 PolarHBondContact O-N 2.94Å
843	S	88.6	Confident	89.4	Confident	72 Å²	72	67.9 Å²	67.9	50%	0.503	32%	0.321	S	S	.	.	H	α-helix	trans	-69.2	-41.4	172.1	81.9	0	0	0	0	111.3	Q839 D840 L841	Q839-S843 PolarHBondContact O-N 2.89Å; Q839-S843 VanDerWaalsContact O-N 3.15Å; D840-S843 WeakPolarHBondContact O-CB 3.13Å; D840-S843 PolarHBondContact O-N 3.03Å; D840-S843 PolarHBondContact O-OG 3.1Å; L841-S843 VanDerWaalsContact C-N 3.3Å; L841-S843 PolarHBondContact O-N 3.02Å
844	Q	87.4	Confident	89.1	Confident	108 Å²	108	68.2 Å²	68.2	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-69	-37	176.7	-64.5	172.5	2.4	0	0	111.8	D840 L841 K846 Y847 H848	D840-Q844 PolarHBondContact O-N 3.36Å; L841-Q844 PolarHBondContact O-N 3.47Å; Q844-K846 PolarHBondContact O-N 3.24Å; Q844-Y847 WeakPolarHBondContact O-CB 3.32Å; Q844-Y847 PolarHBondContact O-N 3.46Å; Q844-H848 PolarHBondContact O-CD2 3Å
845	A	87.2	Confident	88.8	Confident	2 Å²	2	71.6 Å²	71.6	2%	0.017	34%	0.34	C	S	.	.	H	α-helix	trans	-58.8	-19	-177	0	0	0	0	0	114.7	L792 I806 L841 Y847 H848 L849	L792-A845 HydrophobicContact CD1-CB 4.07Å; L792-A845 HydrophobicContact CD2-CB 3.96Å; I806-A845 HydrophobicContact CD1-CB 4.03Å; I806-A845 HydrophobicContact CG1-CB 3.81Å; L841-A845 WeakPolarHBondContact O-CB 3.47Å; L841-A845 PolarHBondContact O-N 2.86Å; A845-Y847 PolarHBondContact O-N 3.03Å; A845-H848 PolarHBondContact O-N 3.09Å; A845-L849 WeakPolarHBondContact O-CB 3.27Å; A845-L849 PolarHBondContact O-N 3.1Å
846	K	84.9	Confident	88.5	Confident	145 Å²	145	75.9 Å²	75.9	63%	0.63	36%	0.359	S	S	*	.	H	α-helix	trans	-56.6	-46.2	169.2	-68.6	-179	176.2	-177.6	0	112.3	Q844 H848 L849 D850	Q844-K846 PolarHBondContact O-N 3.24Å; K846-H848 VanDerWaalsContact C-N 3.3Å; K846-H848 PolarHBondContact O-N 2.91Å; K846-L849 WeakPolarHBondContact O-CB 3.43Å; K846-L849 PolarHBondContact O-N 3.48Å; K846-D850 PolarHBondContact O-N 2.97Å
847	Y	87	Confident	88.1	Confident	155 Å²	155	71.9 Å²	71.9	61%	0.608	35%	0.347	S	S	*	.	H	α-helix	trans	-59.5	-42.2	177.1	169.7	-99.7	0	0	0	111.6	Q844 A845 R851	Q844-Y847 WeakPolarHBondContact O-CB 3.32Å; Q844-Y847 PolarHBondContact O-N 3.46Å; A845-Y847 PolarHBondContact O-N 3.03Å; Y847-R851 VanDerWaalsContact O-CB 3.25Å; Y847-R851 WeakPolarHBondContact O-CB 3.34Å; Y847-R851 PolarHBondContact O-N 3.32Å
848	H	86.6	Confident	87.8	Confident	33 Å²	33	74.5 Å²	74.5	15%	0.153	36%	0.358	C	S	.	.	H	α-helix	trans	-70	-35.3	178.3	-61.5	-89.5	0	0	0	112.6	L792 Q844 A845 K846 R851 A852	L792-H848 HydrophobicContact CD2-CB 3.7Å; L792-H848 PolarHBondContact O-CE1 2.94Å; L792-H848 PolarHBondContact O-ND1 3.2Å; Q844-H848 PolarHBondContact O-CD2 3Å; A845-H848 PolarHBondContact O-N 3.09Å; K846-H848 VanDerWaalsContact C-N 3.3Å; K846-H848 PolarHBondContact O-N 2.91Å; H848-R851 PolarHBondContact ND1-NH2 3.37Å; H848-A852 VanDerWaalsContact O-CB 3.29Å; H848-A852 WeakPolarHBondContact O-CB 3.26Å; H848-A852 PolarHBondContact O-N 2.96Å
849	L	87	Confident	87.4	Confident	55 Å²	55	77.6 Å²	77.6	29%	0.288	37%	0.373	S	S	.	.	H	α-helix	trans	-63.3	-49.5	173.2	-175.3	76.3	0	0	0	111.3	F799 V802 I806 A845 K846 A852 K853	F799-L849 HydrophobicContact CD2-CD1 4.35Å; F799-L849 HydrophobicContact CE2-CD1 3.55Å; F799-L849 HydrophobicContact CE2-CG 4.21Å; F799-L849 HydrophobicContact CZ-CD1 4.17Å; V802-L849 HydrophobicContact CG1-CD1 4.49Å; I806-L849 HydrophobicContact CD1-CB 4.05Å; I806-L849 HydrophobicContact CD1-CD1 4.02Å; A845-L849 WeakPolarHBondContact O-CB 3.27Å; A845-L849 PolarHBondContact O-N 3.1Å; K846-L849 WeakPolarHBondContact O-CB 3.43Å; K846-L849 PolarHBondContact O-N 3.48Å; L849-A852 PolarHBondContact O-N 2.97Å; L849-K853 VanDerWaalsContact O-CB 3.27Å; L849-K853 WeakPolarHBondContact O-CB 3.34Å; L849-K853 PolarHBondContact O-N 3.36Å
850	D	87	Confident	87.1	Confident	91 Å²	91	79.1 Å²	79.1	49%	0.487	37%	0.374	S	S	.	.	H	α-helix	trans	-65.5	-41.3	179	-70.4	-37.6	0	0	0	111	K846 A852 K853 S854	K846-D850 PolarHBondContact O-N 2.97Å; D850-A852 PolarHBondContact O-N 2.78Å; D850-K853 PolarHBondContact O-N 3.18Å; D850-S854 WeakPolarHBondContact O-CB 3.49Å; D850-S854 PolarHBondContact O-N 2.68Å; D850-S854 PolarHBondContact O-OG 2.98Å; D850-S854 VanDerWaalsContact O-OG 3.06Å
851	R	86.7	Confident	86.9	Confident	62 Å²	62	78.6 Å²	78.6	23%	0.234	37%	0.374	C	S	.	.	H	α-helix	trans	-55.4	-51.3	171.5	-175.6	-179.6	73.7	172	-1.1	111.8	L792 D794 E795 Y847 H848 S854 R855	L792-R851 PolarHBondContact O-NH2 3.03Å; L792-R851 VanDerWaalsContact O-NH2 3.11Å; D794-R851 PolarHBondContact O-NH2 2.74Å; E795-R851 IonicContact OE1-CZ 2.77Å; E795-R851 IonicContact OE1-NH1 3.68Å; E795-R851 PolarHBondContact OE1-NH1 2.83Å; Y847-R851 VanDerWaalsContact O-CB 3.25Å; Y847-R851 WeakPolarHBondContact O-CB 3.34Å; Y847-R851 PolarHBondContact O-N 3.32Å; H848-R851 PolarHBondContact ND1-NH2 3.37Å; R851-S854 PolarHBondContact O-N 3.03Å; R851-R855 PolarHBondContact O-N 3.42Å; R851-R855 VanDerWaalsContact O-N 3.1Å
852	A	86.7	Confident	86.6	Confident	9 Å²	9	80.8 Å²	80.8	7%	0.074	39%	0.389	C	S	.	.	H	α-helix	trans	-66.9	-40.2	-178.3	0	0	0	0	0	112.3	F799 V802 H848 L849 D850 R855 E856	F799-A852 HydrophobicContact CB-CB 4.44Å; F799-A852 HydrophobicContact CD2-CB 4.17Å; V802-A852 HydrophobicContact CB-CB 4.25Å; V802-A852 HydrophobicContact CG1-CB 4.43Å; V802-A852 HydrophobicContact CG2-CB 4.02Å; H848-A852 VanDerWaalsContact O-CB 3.29Å; H848-A852 WeakPolarHBondContact O-CB 3.26Å; H848-A852 PolarHBondContact O-N 2.96Å; L849-A852 PolarHBondContact O-N 2.97Å; D850-A852 PolarHBondContact O-N 2.78Å; A852-R855 PolarHBondContact O-N 3.42Å; A852-E856 PolarHBondContact O-N 3.12Å
853	K	87.3	Confident	86.3	Confident	124 Å²	124	85.9 Å²	85.9	54%	0.539	41%	0.406	S	S	.	.	H	α-helix	trans	-64.3	-43.7	175.9	-175.4	-174.4	176.8	-171.8	0	112.1	F799 L849 D850 R855 E856 E857	F799-K853 HydrophobicContact CD2-CB 4Å; F799-K853 HydrophobicContact CE2-CB 3.83Å; F799-K853 HydrophobicContact CE2-CG 4.35Å; L849-K853 VanDerWaalsContact O-CB 3.27Å; L849-K853 WeakPolarHBondContact O-CB 3.34Å; L849-K853 PolarHBondContact O-N 3.36Å; D850-K853 PolarHBondContact O-N 3.18Å; K853-R855 VanDerWaalsContact C-N 3.3Å; K853-R855 PolarHBondContact O-N 3.25Å; K853-E856 PolarHBondContact O-N 2.82Å; K853-E857 PolarHBondContact O-N 3.25Å
854	S	86.5	Confident	86.1	Confident	72 Å²	72	86.8 Å²	86.8	50%	0.503	40%	0.401	S	S	.	.	H	α-helix	trans	-60.3	-41	175.1	-68.7	0	0	0	0	111.6	D850 R851 Q858	D850-S854 WeakPolarHBondContact O-CB 3.49Å; D850-S854 PolarHBondContact O-N 2.68Å; D850-S854 PolarHBondContact O-OG 2.98Å; D850-S854 VanDerWaalsContact O-OG 3.06Å; R851-S854 PolarHBondContact O-N 3.03Å; S854-Q858 WeakPolarHBondContact O-CB 3.28Å; S854-Q858 VanDerWaalsContact O-CG 3.25Å; S854-Q858 WeakPolarHBondContact O-CG 3.3Å; S854-Q858 PolarHBondContact O-N 2.93Å
855	R	85.3	Confident	86.1	Confident	95 Å²	95	89.2 Å²	89.2	36%	0.358	41%	0.406	S	S	.	.	H	α-helix	trans	-68.7	-42.6	175.8	-178.3	177.3	156.6	-148.1	-16.6	112.7	E795 T796 R851 A852 K853 E857 Q858 E859	E795-R855 PolarHBondContact O-NH1 3.44Å; T796-R855 VanDerWaalsContact C-NH1 3.26Å; T796-R855 PolarHBondContact O-NH1 3.39Å; R851-R855 PolarHBondContact O-N 3.42Å; R851-R855 VanDerWaalsContact O-N 3.1Å; A852-R855 PolarHBondContact O-N 3.42Å; K853-R855 VanDerWaalsContact C-N 3.3Å; K853-R855 PolarHBondContact O-N 3.25Å; R855-E857 PolarHBondContact O-N 2.99Å; R855-Q858 WeakPolarHBondContact O-CB 3.26Å; R855-Q858 PolarHBondContact O-N 3.22Å; R855-E859 IonicContact CZ-OE1 2.81Å; R855-E859 VanDerWaalsContact CZ-OE1 3.29Å; R855-E859 IonicContact NE-OE1 2.76Å; R855-E859 PolarHBondContact NE-OE1 2.74Å; R855-E859 IonicContact NH2-OE1 3.66Å; R855-E859 PolarHBondContact NH2-OE1 2.86Å; R855-E859 WeakPolarHBondContact O-CG 3.15Å; R855-E859 PolarHBondContact O-N 3.23Å
856	E	84.9	Confident	85.8	Confident	94 Å²	94	93.8 Å²	93.8	44%	0.439	43%	0.427	S	S	.	.	H	α-helix	trans	-64.1	-40	178.3	-174.5	170.8	-122.4	0	0	111.8	F799 A852 K853 E859 R860	F799-E856 HydrophobicContact CB-CB 4.22Å; F799-E856 WeakPolarHBondContact CB-OE2 3.43Å; F799-E856 VanDerWaalsContact CD1-OE2 3.22Å; F799-E856 WeakPolarHBondContact CD1-OE2 3.25Å; F799-E856 WeakPolarHBondContact CG-OE2 3.44Å; A852-E856 PolarHBondContact O-N 3.12Å; K853-E856 PolarHBondContact O-N 2.82Å; E856-E859 PolarHBondContact O-N 3.04Å; E856-R860 VanDerWaalsContact O-CB 3.25Å; E856-R860 WeakPolarHBondContact O-CB 3.32Å; E856-R860 PolarHBondContact O-N 3.24Å
857	E	85.3	Confident	85.7	Confident	80 Å²	80	91.8 Å²	91.8	37%	0.374	42%	0.42	S	S	.	.	H	α-helix	trans	-70.8	-32.8	174.5	-168.2	62.4	-146.4	0	0	111.9	K853 R855 R860 V861	K853-E857 PolarHBondContact O-N 3.25Å; R855-E857 PolarHBondContact O-N 2.99Å; E857-R860 PolarHBondContact O-N 3.09Å; E857-R860 IonicContact OE1-NH1 2.74Å; E857-R860 WeakPolarHBondContact OE2-CD 3.36Å; E857-R860 IonicContact OE2-CZ 3.99Å; E857-R860 IonicContact OE2-NE 2.6Å; E857-R860 IonicContact OE2-NH1 3.18Å; E857-R860 PolarHBondContact OE2-NH1 3.49Å; E857-V861 HydrophobicContact CG-CG2 4.47Å; E857-V861 WeakPolarHBondContact O-CB 3.17Å; E857-V861 VanDerWaalsContact O-CG2 3.27Å; E857-V861 WeakPolarHBondContact O-CG2 3.19Å; E857-V861 PolarHBondContact O-N 3.03Å
858	Q	85.1	Confident	85.7	Confident	127 Å²	127	90.5 Å²	90.5	59%	0.593	42%	0.419	S	S	*	.	H	α-helix	trans	-60.5	-50	168.8	-77.4	170	0.8	0	0	111.6	S854 R855 R860 V861 V862	S854-Q858 WeakPolarHBondContact O-CB 3.28Å; S854-Q858 VanDerWaalsContact O-CG 3.25Å; S854-Q858 WeakPolarHBondContact O-CG 3.3Å; S854-Q858 PolarHBondContact O-N 2.93Å; R855-Q858 WeakPolarHBondContact O-CB 3.26Å; R855-Q858 PolarHBondContact O-N 3.22Å; Q858-R860 VanDerWaalsContact C-N 3.27Å; Q858-R860 PolarHBondContact O-N 3.16Å; Q858-V861 PolarHBondContact O-N 3.44Å; Q858-V862 WeakPolarHBondContact O-CG2 3.49Å; Q858-V862 PolarHBondContact O-N 2.73Å
859	E	84.4	Confident	85.6	Confident	64 Å²	64	92.9 Å²	92.9	30%	0.299	43%	0.43	S	S	.	.	H	α-helix	trans	-60.3	-37.6	175.9	-72.8	-173.5	-155.5	0	0	111.5	R855 E856 V862 R863	R855-E859 IonicContact CZ-OE1 2.81Å; R855-E859 VanDerWaalsContact CZ-OE1 3.29Å; R855-E859 IonicContact NE-OE1 2.76Å; R855-E859 PolarHBondContact NE-OE1 2.74Å; R855-E859 IonicContact NH2-OE1 3.66Å; R855-E859 PolarHBondContact NH2-OE1 2.86Å; R855-E859 WeakPolarHBondContact O-CG 3.15Å; R855-E859 PolarHBondContact O-N 3.23Å; E856-E859 PolarHBondContact O-N 3.04Å; E859-V862 PolarHBondContact O-N 2.65Å; E859-R863 WeakPolarHBondContact O-CB 3.46Å; E859-R863 WeakPolarHBondContact O-CG 3.16Å; E859-R863 PolarHBondContact O-N 2.75Å; E859-R863 IonicContact OE2-CZ 2.67Å; E859-R863 IonicContact OE2-NH2 2.73Å; E859-R863 PolarHBondContact OE2-NH2 2.88Å
860	R	85.6	Confident	85.4	Confident	130 Å²	130	97 Å²	97	49%	0.491	44%	0.442	S	S	.	.	H	α-helix	trans	-69.1	-40.9	177	-170.6	-168.9	-171.3	-166.5	6.4	112.8	E856 E857 Q858 R863 K864	E856-R860 VanDerWaalsContact O-CB 3.25Å; E856-R860 WeakPolarHBondContact O-CB 3.32Å; E856-R860 PolarHBondContact O-N 3.24Å; E857-R860 PolarHBondContact O-N 3.09Å; E857-R860 IonicContact OE1-NH1 2.74Å; E857-R860 WeakPolarHBondContact OE2-CD 3.36Å; E857-R860 IonicContact OE2-CZ 3.99Å; E857-R860 IonicContact OE2-NE 2.6Å; E857-R860 IonicContact OE2-NH1 3.18Å; E857-R860 PolarHBondContact OE2-NH1 3.49Å; Q858-R860 VanDerWaalsContact C-N 3.27Å; Q858-R860 PolarHBondContact O-N 3.16Å; R860-R863 PolarHBondContact O-N 3.26Å; R860-K864 WeakPolarHBondContact O-CB 3.47Å; R860-K864 WeakPolarHBondContact O-CG 3.4Å; R860-K864 PolarHBondContact O-N 3.03Å
861	V	88.5	Confident	85.2	Confident	80 Å²	80	98 Å²	98	49%	0.485	44%	0.444	S	S	.	.	H	α-helix	trans	-64.9	-41	174.2	166.9	0	0	0	0	110.3	E857 Q858 R865	E857-V861 HydrophobicContact CG-CG2 4.47Å; E857-V861 WeakPolarHBondContact O-CB 3.17Å; E857-V861 VanDerWaalsContact O-CG2 3.27Å; E857-V861 WeakPolarHBondContact O-CG2 3.19Å; E857-V861 PolarHBondContact O-N 3.03Å; Q858-V861 PolarHBondContact O-N 3.44Å; V861-R865 VanDerWaalsContact O-CB 3.27Å; V861-R865 WeakPolarHBondContact O-CB 3.4Å; V861-R865 PolarHBondContact O-N 3.22Å
862	V	85.4	Confident	85.3	Confident	77 Å²	77	97 Å²	97	47%	0.467	45%	0.448	S	S	.	.	H	α-helix	trans	-63.4	-45.9	173.5	170.9	0	0	0	0	111.3	Q858 E859 R865 Q866	Q858-V862 WeakPolarHBondContact O-CG2 3.49Å; Q858-V862 PolarHBondContact O-N 2.73Å; E859-V862 PolarHBondContact O-N 2.65Å; V862-R865 PolarHBondContact O-N 2.8Å; V862-Q866 WeakPolarHBondContact O-CB 3.44Å; V862-Q866 VanDerWaalsContact O-CG 3.28Å; V862-Q866 WeakPolarHBondContact O-CG 3.5Å; V862-Q866 PolarHBondContact O-N 2.86Å
863	R	84.9	Confident	85	Confident	129 Å²	129	102.3 Å²	102.3	49%	0.487	47%	0.472	S	S	.	.	H	α-helix	trans	-61.4	-48	176.3	-72.2	173	-144.5	178.8	7.7	111.9	E859 R860 R865 Q866 E867	E859-R863 WeakPolarHBondContact O-CB 3.46Å; E859-R863 WeakPolarHBondContact O-CG 3.16Å; E859-R863 PolarHBondContact O-N 2.75Å; E859-R863 IonicContact OE2-CZ 2.67Å; E859-R863 IonicContact OE2-NH2 2.73Å; E859-R863 PolarHBondContact OE2-NH2 2.88Å; R860-R863 PolarHBondContact O-N 3.26Å; R863-R865 PolarHBondContact O-N 3.32Å; R863-Q866 CarbonylContact O-C 3.4Å; R863-Q866 WeakPolarHBondContact O-CB 3.09Å; R863-Q866 PolarHBondContact O-N 2.91Å; R863-E867 VanDerWaalsContact O-CG 3.32Å; R863-E867 WeakPolarHBondContact O-CG 3.15Å; R863-E867 PolarHBondContact O-N 3.08Å
864	K	85.5	Confident	84.8	Confident	91 Å²	91	105.6 Å²	105.6	40%	0.396	48%	0.481	S	S	.	.	H	α-helix	trans	-56.1	-48.4	174.3	-82.3	-176.9	173.3	-177.3	0	111.8	R860 Q866 E867 E868	R860-K864 WeakPolarHBondContact O-CB 3.47Å; R860-K864 WeakPolarHBondContact O-CG 3.4Å; R860-K864 PolarHBondContact O-N 3.03Å; K864-Q866 VanDerWaalsContact C-N 3.31Å; K864-Q866 PolarHBondContact O-N 3.04Å; K864-E867 CarbonylContact O-C 3.6Å; K864-E867 WeakPolarHBondContact O-CA 3.5Å; K864-E867 WeakPolarHBondContact O-CB 3.15Å; K864-E867 PolarHBondContact O-N 3.44Å; K864-E868 WeakPolarHBondContact O-CB 3.47Å; K864-E868 WeakPolarHBondContact O-CG 3.37Å; K864-E868 PolarHBondContact O-N 3.23Å
865	R	85.7	Confident	84.8	Confident	158 Å²	158	107.8 Å²	107.8	60%	0.596	48%	0.481	S	S	*	.	H	α-helix	trans	-60.2	-41.8	177.8	-179	174.7	173.5	165.1	2.3	111.7	V861 V862 R863 E867 E868 E869	V861-R865 VanDerWaalsContact O-CB 3.27Å; V861-R865 WeakPolarHBondContact O-CB 3.4Å; V861-R865 PolarHBondContact O-N 3.22Å; V862-R865 PolarHBondContact O-N 2.8Å; R863-R865 PolarHBondContact O-N 3.32Å; R865-E867 VanDerWaalsContact C-N 3.3Å; R865-E867 PolarHBondContact O-N 3.48Å; R865-E868 PolarHBondContact O-N 3.49Å; R865-E869 HydrophobicContact CG-CG 4.35Å; R865-E869 WeakPolarHBondContact CG-OE1 3.38Å; R865-E869 IonicContact CZ-OE1 3.35Å; R865-E869 IonicContact NE-OE1 3.81Å; R865-E869 PolarHBondContact NE-OE1 3.4Å; R865-E869 IonicContact NH2-OE1 2.66Å; R865-E869 PolarHBondContact NH2-OE1 3.03Å; R865-E869 VanDerWaalsContact O-CB 3.25Å; R865-E869 WeakPolarHBondContact O-CB 3.47Å; R865-E869 VanDerWaalsContact O-CG 3.25Å; R865-E869 WeakPolarHBondContact O-CG 3.48Å; R865-E869 PolarHBondContact O-N 2.91Å
866	Q	81.8	Confident	84.7	Confident	98 Å²	98	111.4 Å²	111.4	46%	0.458	50%	0.495	S	S	.	.	H	α-helix	trans	-66.4	-28.8	173.5	-71.3	170.6	-6.2	0	0	112.9	V862 R863 K864 R870	V862-Q866 WeakPolarHBondContact O-CB 3.44Å; V862-Q866 VanDerWaalsContact O-CG 3.28Å; V862-Q866 WeakPolarHBondContact O-CG 3.5Å; V862-Q866 PolarHBondContact O-N 2.86Å; R863-Q866 CarbonylContact O-C 3.4Å; R863-Q866 WeakPolarHBondContact O-CB 3.09Å; R863-Q866 PolarHBondContact O-N 2.91Å; K864-Q866 VanDerWaalsContact C-N 3.31Å; K864-Q866 PolarHBondContact O-N 3.04Å; Q866-R870 WeakPolarHBondContact O-CB 3.47Å; Q866-R870 VanDerWaalsContact O-CG 3.23Å; Q866-R870 WeakPolarHBondContact O-CG 3.33Å; Q866-R870 PolarHBondContact O-N 3.19Å; Q866-R870 PolarHBondContact O-NE 3Å
867	E	82.6	Confident	84.4	Confident	104 Å²	104	112.9 Å²	112.9	49%	0.486	50%	0.502	S	S	.	.	H	α-helix	trans	-75	-46.4	173.8	-71.9	167.4	174.2	0	0	111.3	R863 K864 R865 R870 E871	R863-E867 VanDerWaalsContact O-CG 3.32Å; R863-E867 WeakPolarHBondContact O-CG 3.15Å; R863-E867 PolarHBondContact O-N 3.08Å; K864-E867 CarbonylContact O-C 3.6Å; K864-E867 WeakPolarHBondContact O-CA 3.5Å; K864-E867 WeakPolarHBondContact O-CB 3.15Å; K864-E867 PolarHBondContact O-N 3.44Å; R865-E867 VanDerWaalsContact C-N 3.3Å; R865-E867 PolarHBondContact O-N 3.48Å; E867-R870 PolarHBondContact O-N 3.04Å; E867-E871 WeakPolarHBondContact O-CB 3.37Å; E867-E871 PolarHBondContact O-N 3.28Å
868	E	87.5	Confident	84.4	Confident	127 Å²	127	113.5 Å²	113.5	59%	0.593	51%	0.507	S	S	*	.	H	α-helix	trans	-62.1	-43.1	174.9	-71.3	168	-166.5	0	0	111.9	K864 R865 E871 A872	K864-E868 WeakPolarHBondContact O-CB 3.47Å; K864-E868 WeakPolarHBondContact O-CG 3.37Å; K864-E868 PolarHBondContact O-N 3.23Å; R865-E868 PolarHBondContact O-N 3.49Å; E868-E871 PolarHBondContact O-N 2.79Å; E868-A872 WeakPolarHBondContact O-CB 3.28Å; E868-A872 PolarHBondContact O-N 3.38Å
869	E	83.3	Confident	84.4	Confident	84 Å²	84	112.5 Å²	112.5	39%	0.393	50%	0.502	S	S	.	.	H	α-helix	trans	-65.2	-39.3	175.1	-74.1	172.3	179.9	0	0	111.3	R865 Q873	R865-E869 HydrophobicContact CG-CG 4.35Å; R865-E869 WeakPolarHBondContact CG-OE1 3.38Å; R865-E869 IonicContact CZ-OE1 3.35Å; R865-E869 IonicContact NE-OE1 3.81Å; R865-E869 PolarHBondContact NE-OE1 3.4Å; R865-E869 IonicContact NH2-OE1 2.66Å; R865-E869 PolarHBondContact NH2-OE1 3.03Å; R865-E869 VanDerWaalsContact O-CB 3.25Å; R865-E869 WeakPolarHBondContact O-CB 3.47Å; R865-E869 VanDerWaalsContact O-CG 3.25Å; R865-E869 WeakPolarHBondContact O-CG 3.48Å; R865-E869 PolarHBondContact O-N 2.91Å; E869-Q873 WeakPolarHBondContact O-CB 3.45Å; E869-Q873 WeakPolarHBondContact O-CG 3.42Å; E869-Q873 PolarHBondContact O-N 3Å
870	R	83.2	Confident	84.3	Confident	141 Å²	141	114.9 Å²	114.9	53%	0.532	52%	0.517	S	S	.	.	H	α-helix	trans	-67.8	-41	173.1	-80.1	178.4	-70.3	165.5	-1	112.8	Q866 E867 R874	Q866-R870 WeakPolarHBondContact O-CB 3.47Å; Q866-R870 VanDerWaalsContact O-CG 3.23Å; Q866-R870 WeakPolarHBondContact O-CG 3.33Å; Q866-R870 PolarHBondContact O-N 3.19Å; Q866-R870 PolarHBondContact O-NE 3Å; E867-R870 PolarHBondContact O-N 3.04Å; R870-R874 WeakPolarHBondContact O-CB 3.34Å; R870-R874 PolarHBondContact O-N 2.98Å
871	E	83.8	Confident	83.9	Confident	113 Å²	113	114.6 Å²	114.6	53%	0.528	52%	0.521	S	S	.	.	H	α-helix	trans	-66.7	-40.8	175.1	-83.1	-149.2	-179.1	0	0	112.3	E867 E868 R874 K875	E867-E871 WeakPolarHBondContact O-CB 3.37Å; E867-E871 PolarHBondContact O-N 3.28Å; E868-E871 PolarHBondContact O-N 2.79Å; E871-R874 PolarHBondContact O-N 3.21Å; E871-K875 WeakPolarHBondContact O-CB 3.35Å; E871-K875 WeakPolarHBondContact O-CG 3.37Å; E871-K875 PolarHBondContact O-N 2.67Å; E871-K875 IonicContact OE2-NZ 2.7Å; E871-K875 PolarHBondContact OE2-NZ 2.85Å
872	A	87.5	Confident	83.6	Confident	39 Å²	39	115.4 Å²	115.4	32%	0.322	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-40.9	176.7	0	0	0	0	0	111.3	E868 R876	E868-A872 WeakPolarHBondContact O-CB 3.28Å; E868-A872 PolarHBondContact O-N 3.38Å; A872-R876 WeakPolarHBondContact O-CB 3.29Å; A872-R876 VanDerWaalsContact O-CG 3.25Å; A872-R876 WeakPolarHBondContact O-CG 3.23Å; A872-R876 PolarHBondContact O-N 2.81Å
873	Q	81.3	Confident	83.4	Confident	121 Å²	121	117.3 Å²	117.3	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-60.4	-45.8	170.6	-74.5	171.6	11.1	0	0	111.5	E869 R876 Q877	E869-Q873 WeakPolarHBondContact O-CB 3.45Å; E869-Q873 WeakPolarHBondContact O-CG 3.42Å; E869-Q873 PolarHBondContact O-N 3Å; Q873-R876 PolarHBondContact O-N 3.45Å; Q873-Q877 WeakPolarHBondContact O-CG 3.34Å; Q873-Q877 PolarHBondContact O-N 3.29Å
874	R	83.8	Confident	83.1	Confident	194 Å²	194	114.2 Å²	114.2	73%	0.732	53%	0.525	S	S	*	.	H	α-helix	trans	-65.1	-40.8	179.3	-168.8	178.7	-176.6	-168.5	1	112.9	R870 E871 Q877 L878	R870-R874 WeakPolarHBondContact O-CB 3.34Å; R870-R874 PolarHBondContact O-N 2.98Å; E871-R874 PolarHBondContact O-N 3.21Å; R874-Q877 PolarHBondContact O-N 3.39Å; R874-L878 WeakPolarHBondContact O-CB 3.46Å; R874-L878 PolarHBondContact O-N 3.05Å
875	K	85	Confident	82.8	Confident	117 Å²	117	115.5 Å²	115.5	51%	0.509	53%	0.533	S	S	.	.	H	α-helix	trans	-65.2	-47.1	175	-76.3	169.2	-179	149.7	0	111	E871 Q877 L878 E879	E871-K875 WeakPolarHBondContact O-CB 3.35Å; E871-K875 WeakPolarHBondContact O-CG 3.37Å; E871-K875 PolarHBondContact O-N 2.67Å; E871-K875 IonicContact OE2-NZ 2.7Å; E871-K875 PolarHBondContact OE2-NZ 2.85Å; K875-Q877 VanDerWaalsContact C-N 3.33Å; K875-Q877 PolarHBondContact O-N 3.29Å; K875-L878 PolarHBondContact O-N 3.03Å; K875-L878 VanDerWaalsContact O-N 3.09Å; K875-E879 WeakPolarHBondContact O-CB 3.41Å; K875-E879 WeakPolarHBondContact O-CG 3.28Å; K875-E879 PolarHBondContact O-N 3.37Å
876	R	84.6	Confident	82.5	Confident	171 Å²	171	114 Å²	114	65%	0.645	53%	0.533	S	S	*	.	H	α-helix	trans	-59.3	-40.7	174.7	-73.2	172.9	-178.7	177.6	1.9	112.6	A872 Q873 L880	A872-R876 WeakPolarHBondContact O-CB 3.29Å; A872-R876 VanDerWaalsContact O-CG 3.25Å; A872-R876 WeakPolarHBondContact O-CG 3.23Å; A872-R876 PolarHBondContact O-N 2.81Å; Q873-R876 PolarHBondContact O-N 3.45Å; R876-L880 VanDerWaalsContact O-CB 3.32Å; R876-L880 WeakPolarHBondContact O-CB 3.44Å; R876-L880 WeakPolarHBondContact O-CD1 3.37Å; R876-L880 VanDerWaalsContact O-CG 3.23Å; R876-L880 WeakPolarHBondContact O-CG 3.47Å; R876-L880 PolarHBondContact O-N 3.01Å
877	Q	77.7	Confident	82.4	Confident	126 Å²	126	116 Å²	116	59%	0.589	54%	0.544	S	S	*	.	H	α-helix	trans	-63.1	-42.4	173.2	-78.3	-176.5	-10.9	0	0	112.2	Q873 R874 K875 Q881	Q873-Q877 WeakPolarHBondContact O-CG 3.34Å; Q873-Q877 PolarHBondContact O-N 3.29Å; R874-Q877 PolarHBondContact O-N 3.39Å; K875-Q877 VanDerWaalsContact C-N 3.33Å; K875-Q877 PolarHBondContact O-N 3.29Å; Q877-Q881 WeakPolarHBondContact O-CB 3.37Å; Q877-Q881 VanDerWaalsContact O-CG 3.26Å; Q877-Q881 WeakPolarHBondContact O-CG 3.48Å; Q877-Q881 PolarHBondContact O-N 2.74Å
878	L	85.3	Confident	82.1	Confident	92 Å²	92	118 Å²	118	48%	0.482	55%	0.547	S	S	.	.	H	α-helix	trans	-67.1	-41.9	178.5	-159.5	92.7	0	0	0	112	R874 K875 Q881 Q882	R874-L878 WeakPolarHBondContact O-CB 3.46Å; R874-L878 PolarHBondContact O-N 3.05Å; K875-L878 PolarHBondContact O-N 3.03Å; K875-L878 VanDerWaalsContact O-N 3.09Å; L878-Q881 PolarHBondContact O-N 3.28Å; L878-Q882 WeakPolarHBondContact O-CB 3.34Å; L878-Q882 WeakPolarHBondContact O-CG 3.48Å; L878-Q882 PolarHBondContact O-N 3.46Å
879	E	84.5	Confident	81.8	Confident	106 Å²	106	116.3 Å²	116.3	50%	0.495	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-43.4	175.8	-73.1	168.7	176.9	0	0	111.3	K875 Q881 Q882 Q883	K875-E879 WeakPolarHBondContact O-CB 3.41Å; K875-E879 WeakPolarHBondContact O-CG 3.28Å; K875-E879 PolarHBondContact O-N 3.37Å; E879-Q881 VanDerWaalsContact C-N 3.33Å; E879-Q881 PolarHBondContact O-N 3.3Å; E879-Q882 PolarHBondContact O-N 3.46Å; E879-Q883 WeakPolarHBondContact O-CB 3.28Å; E879-Q883 VanDerWaalsContact O-CG 3.28Å; E879-Q883 WeakPolarHBondContact O-CG 3.47Å; E879-Q883 PolarHBondContact O-N 3.2Å
880	L	83.5	Confident	81.7	Confident	115 Å²	115	115.7 Å²	115.7	60%	0.602	54%	0.541	S	S	*	.	H	α-helix	trans	-63.1	-38.1	173.7	-75.7	166.9	0	0	0	112.1	R876 A884	R876-L880 VanDerWaalsContact O-CB 3.32Å; R876-L880 WeakPolarHBondContact O-CB 3.44Å; R876-L880 WeakPolarHBondContact O-CD1 3.37Å; R876-L880 VanDerWaalsContact O-CG 3.23Å; R876-L880 WeakPolarHBondContact O-CG 3.47Å; R876-L880 PolarHBondContact O-N 3.01Å; L880-A884 VanDerWaalsContact O-CB 3.24Å; L880-A884 WeakPolarHBondContact O-CB 3.3Å; L880-A884 PolarHBondContact O-N 3.21Å
881	Q	77	Confident	81.3	Confident	123 Å²	123	117.8 Å²	117.8	58%	0.575	55%	0.549	S	S	*	.	H	α-helix	trans	-65.5	-47.1	173.7	-76.4	171.4	1.1	0	0	111.7	Q877 L878 E879 A884 E885	Q877-Q881 WeakPolarHBondContact O-CB 3.37Å; Q877-Q881 VanDerWaalsContact O-CG 3.26Å; Q877-Q881 WeakPolarHBondContact O-CG 3.48Å; Q877-Q881 PolarHBondContact O-N 2.74Å; L878-Q881 PolarHBondContact O-N 3.28Å; E879-Q881 VanDerWaalsContact C-N 3.33Å; E879-Q881 PolarHBondContact O-N 3.3Å; Q881-A884 PolarHBondContact O-N 3.03Å; Q881-E885 WeakPolarHBondContact O-CB 3.4Å; Q881-E885 PolarHBondContact O-N 3.46Å
882	Q	81.6	Confident	80.9	Confident	98 Å²	98	115.9 Å²	115.9	46%	0.458	54%	0.54	S	S	.	.	H	α-helix	trans	-64.9	-39.5	178.1	-74.3	179.4	-3.3	0	0	112.4	L878 E879 E885 Q886	L878-Q882 WeakPolarHBondContact O-CB 3.34Å; L878-Q882 WeakPolarHBondContact O-CG 3.48Å; L878-Q882 PolarHBondContact O-N 3.46Å; E879-Q882 PolarHBondContact O-N 3.46Å; Q882-E885 PolarHBondContact O-N 3.23Å; Q882-Q886 WeakPolarHBondContact O-CB 3.49Å; Q882-Q886 VanDerWaalsContact O-CG 3.29Å; Q882-Q886 WeakPolarHBondContact O-CG 3.49Å; Q882-Q886 PolarHBondContact O-N 3.23Å
883	Q	80.9	Confident	80.4	Confident	116 Å²	116	122 Å²	122	54%	0.542	55%	0.554	S	S	.	*	H	α-helix	trans	-66.9	-40.6	174.4	-73.1	176.1	13	0	0	111.6	E879 M887	E879-Q883 WeakPolarHBondContact O-CB 3.28Å; E879-Q883 VanDerWaalsContact O-CG 3.28Å; E879-Q883 WeakPolarHBondContact O-CG 3.47Å; E879-Q883 PolarHBondContact O-N 3.2Å; Q883-M887 WeakPolarHBondContact O-CB 3.42Å; Q883-M887 WeakPolarHBondContact O-CG 3.17Å; Q883-M887 PolarHBondContact O-N 3.3Å
884	A	80.1	Confident	80.3	Confident	64 Å²	64	123.1 Å²	123.1	53%	0.529	55%	0.553	S	S	.	*	H	α-helix	trans	-65	-38.4	174.4	0	0	0	0	0	112.2	L880 Q881 R888	L880-A884 VanDerWaalsContact O-CB 3.24Å; L880-A884 WeakPolarHBondContact O-CB 3.3Å; L880-A884 PolarHBondContact O-N 3.21Å; Q881-A884 PolarHBondContact O-N 3.03Å; A884-R888 WeakPolarHBondContact O-CB 3.41Å; A884-R888 PolarHBondContact O-N 3.47Å
885	E	78	Confident	79.6	Confident	118 Å²	118	118.1 Å²	118.1	55%	0.551	54%	0.541	S	S	*	.	H	α-helix	trans	-71.4	-42.8	177.3	-172.9	164.5	-130.9	0	0	112.1	Q881 Q882 R888 L889	Q881-E885 WeakPolarHBondContact O-CB 3.4Å; Q881-E885 PolarHBondContact O-N 3.46Å; Q882-E885 PolarHBondContact O-N 3.23Å; E885-R888 WeakPolarHBondContact O-CB 3.49Å; E885-R888 PolarHBondContact O-N 3.12Å; E885-L889 HydrophobicContact CG-CD1 4.16Å; E885-L889 WeakPolarHBondContact O-CB 3.44Å; E885-L889 WeakPolarHBondContact O-CG 3.33Å; E885-L889 PolarHBondContact O-N 2.86Å
886	Q	80.2	Confident	78.9	Confident	128 Å²	128	118.6 Å²	118.6	60%	0.598	55%	0.545	S	S	*	.	H	α-helix	trans	-63.1	-48.7	172.4	-75.2	178.3	-1.6	0	0	111.5	Q882 R888 L889 D890	Q882-Q886 WeakPolarHBondContact O-CB 3.49Å; Q882-Q886 VanDerWaalsContact O-CG 3.29Å; Q882-Q886 WeakPolarHBondContact O-CG 3.49Å; Q882-Q886 PolarHBondContact O-N 3.23Å; Q886-R888 PolarHBondContact O-N 3.41Å; Q886-L889 PolarHBondContact O-N 2.85Å; Q886-L889 VanDerWaalsContact O-N 3.14Å; Q886-D890 WeakPolarHBondContact O-CB 3.39Å; Q886-D890 PolarHBondContact O-N 3.12Å
887	M	78.5	Confident	78.5	Confident	140 Å²	140	115.6 Å²	115.6	69%	0.69	54%	0.538	S	S	*	.	H	α-helix	trans	-60.9	-30	176.2	-75	-73	-73.5	0	0	112.4	Q883 R891	Q883-M887 WeakPolarHBondContact O-CB 3.42Å; Q883-M887 WeakPolarHBondContact O-CG 3.17Å; Q883-M887 PolarHBondContact O-N 3.3Å; M887-R891 WeakPolarHBondContact O-CB 3.39Å; M887-R891 PolarHBondContact O-N 3.26Å
888	R	77.7	Confident	78.2	Confident	145 Å²	145	114.9 Å²	114.9	55%	0.547	54%	0.535	S	S	.	.	H	α-helix	trans	-71.9	-48.8	171.8	177.5	179.1	163.7	-129	-27.9	111.7	A884 E885 Q886 R891 E892	A884-R888 WeakPolarHBondContact O-CB 3.41Å; A884-R888 PolarHBondContact O-N 3.47Å; E885-R888 WeakPolarHBondContact O-CB 3.49Å; E885-R888 PolarHBondContact O-N 3.12Å; Q886-R888 PolarHBondContact O-N 3.41Å; R888-R891 PolarHBondContact O-N 3.46Å; R888-E892 HydrophobicContact CG-CG 4.47Å; R888-E892 WeakPolarHBondContact CG-OE1 3.47Å; R888-E892 IonicContact CZ-OE1 2.76Å; R888-E892 VanDerWaalsContact CZ-OE1 3.24Å; R888-E892 IonicContact NE-OE1 2.63Å; R888-E892 PolarHBondContact NE-OE1 2.78Å; R888-E892 IonicContact NH2-OE1 3.73Å; R888-E892 PolarHBondContact NH2-OE1 3.43Å; R888-E892 IonicContact NH2-OE2 3.63Å; R888-E892 WeakPolarHBondContact O-CB 3.39Å; R888-E892 WeakPolarHBondContact O-CG 3.27Å; R888-E892 PolarHBondContact O-N 3.09Å
889	L	81.6	Confident	76.9	Confident	91 Å²	91	118.9 Å²	118.9	48%	0.476	54%	0.543	S	S	.	.	H	α-helix	trans	-64.5	-38.9	179.4	-74	167.7	0	0	0	112.6	E885 Q886 R891 E892 R893	E885-L889 HydrophobicContact CG-CD1 4.16Å; E885-L889 WeakPolarHBondContact O-CB 3.44Å; E885-L889 WeakPolarHBondContact O-CG 3.33Å; E885-L889 PolarHBondContact O-N 2.86Å; Q886-L889 PolarHBondContact O-N 2.85Å; Q886-L889 VanDerWaalsContact O-N 3.14Å; L889-R891 VanDerWaalsContact C-N 3.34Å; L889-E892 PolarHBondContact O-N 3.24Å; L889-R893 WeakPolarHBondContact O-CB 3.24Å; L889-R893 PolarHBondContact O-N 2.73Å
890	D	80.1	Confident	76.2	Confident	72 Å²	72	115.3 Å²	115.3	39%	0.385	54%	0.535	S	S	.	.	H	α-helix	trans	-66.6	-36.1	173.6	-109.8	37.3	0	0	0	111.6	Q886 R894	Q886-D890 WeakPolarHBondContact O-CB 3.39Å; Q886-D890 PolarHBondContact O-N 3.12Å; D890-R894 WeakPolarHBondContact O-CB 3.24Å; D890-R894 VanDerWaalsContact O-CG 3.22Å; D890-R894 WeakPolarHBondContact O-CG 3.41Å; D890-R894 PolarHBondContact O-N 3Å; D890-R894 IonicContact OD2-CZ 2.72Å; D890-R894 IonicContact OD2-NE 3.74Å; D890-R894 IonicContact OD2-NH2 3.04Å; D890-R894 PolarHBondContact OD2-NH2 3.24Å
891	R	75.4	Confident	75.3	Confident	185 Å²	185	117.3 Å²	117.3	70%	0.698	54%	0.535	S	S	*	.	H	α-helix	trans	-70.6	-41	174.6	-172.8	178.4	-172.9	-173.6	2.7	111.6	M887 R888 L889 L895	M887-R891 WeakPolarHBondContact O-CB 3.39Å; M887-R891 PolarHBondContact O-N 3.26Å; R888-R891 PolarHBondContact O-N 3.46Å; L889-R891 VanDerWaalsContact C-N 3.34Å; R891-L895 HydrophobicContact CG-CD1 4.14Å; R891-L895 WeakPolarHBondContact O-CB 3.35Å; R891-L895 WeakPolarHBondContact O-CD1 3.36Å; R891-L895 WeakPolarHBondContact O-CG 3.24Å; R891-L895 PolarHBondContact O-N 3.3Å
892	E	74.5	Confident	74.5	Confident	73 Å²	73	119 Å²	119	34%	0.341	54%	0.54	S	S	.	.	H	α-helix	trans	-61.2	-50.1	173.3	-74.3	171	-178.5	0	0	109.9	R888 L889 R894 L895 E896	R888-E892 HydrophobicContact CG-CG 4.47Å; R888-E892 WeakPolarHBondContact CG-OE1 3.47Å; R888-E892 IonicContact CZ-OE1 2.76Å; R888-E892 VanDerWaalsContact CZ-OE1 3.24Å; R888-E892 IonicContact NE-OE1 2.63Å; R888-E892 PolarHBondContact NE-OE1 2.78Å; R888-E892 IonicContact NH2-OE1 3.73Å; R888-E892 PolarHBondContact NH2-OE1 3.43Å; R888-E892 IonicContact NH2-OE2 3.63Å; R888-E892 WeakPolarHBondContact O-CB 3.39Å; R888-E892 WeakPolarHBondContact O-CG 3.27Å; R888-E892 PolarHBondContact O-N 3.09Å; L889-E892 PolarHBondContact O-N 3.24Å; E892-R894 PolarHBondContact O-N 3.35Å; E892-L895 PolarHBondContact O-N 3.17Å; E892-E896 WeakPolarHBondContact O-CG 3.43Å; E892-E896 PolarHBondContact O-N 3.21Å
893	R	78.1	Confident	73.3	Confident	167 Å²	167	119.4 Å²	119.4	63%	0.63	55%	0.546	S	S	*	.	H	α-helix	trans	-59.4	-46.4	175.4	-82.9	-173.2	169.1	-167	-2.5	114.3	L889 L895 E896 E897	L889-R893 WeakPolarHBondContact O-CB 3.24Å; L889-R893 PolarHBondContact O-N 2.73Å; R893-L895 VanDerWaalsContact C-N 3.32Å; R893-L895 PolarHBondContact O-N 3.07Å; R893-E896 CarbonylContact O-C 3.56Å; R893-E896 PolarHBondContact O-N 3.18Å; R893-E896 VanDerWaalsContact O-N 3.09Å; R893-E897 PolarHBondContact O-N 3.11Å
894	R	77.8	Confident	72.2	Confident	145 Å²	145	120.9 Å²	120.9	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-63.1	-40.8	178.6	-72.5	173.3	-155.2	-177.7	9.7	111.1	D890 E892 E896 E897 E898	D890-R894 WeakPolarHBondContact O-CB 3.24Å; D890-R894 VanDerWaalsContact O-CG 3.22Å; D890-R894 WeakPolarHBondContact O-CG 3.41Å; D890-R894 PolarHBondContact O-N 3Å; D890-R894 IonicContact OD2-CZ 2.72Å; D890-R894 IonicContact OD2-NE 3.74Å; D890-R894 IonicContact OD2-NH2 3.04Å; D890-R894 PolarHBondContact OD2-NH2 3.24Å; E892-R894 PolarHBondContact O-N 3.35Å; R894-E896 VanDerWaalsContact C-N 3.28Å; R894-E896 PolarHBondContact O-N 3.25Å; R894-E897 PolarHBondContact O-N 3.27Å; R894-E898 VanDerWaalsContact O-CB 3.23Å; R894-E898 WeakPolarHBondContact O-CB 3.43Å; R894-E898 VanDerWaalsContact O-CG 3.23Å; R894-E898 WeakPolarHBondContact O-CG 3.38Å; R894-E898 PolarHBondContact O-N 3Å
895	L	69.7	Low	71.1	Confident	89 Å²	89	125.3 Å²	125.3	47%	0.466	56%	0.56	S	S	.	*	H	α-helix	trans	-64.6	-30.6	173.4	-71.5	168.9	0	0	0	112.5	R891 E892 R893 R899	R891-L895 HydrophobicContact CG-CD1 4.14Å; R891-L895 WeakPolarHBondContact O-CB 3.35Å; R891-L895 WeakPolarHBondContact O-CD1 3.36Å; R891-L895 WeakPolarHBondContact O-CG 3.24Å; R891-L895 PolarHBondContact O-N 3.3Å; E892-L895 PolarHBondContact O-N 3.17Å; R893-L895 VanDerWaalsContact C-N 3.32Å; R893-L895 PolarHBondContact O-N 3.07Å; L895-R899 WeakPolarHBondContact O-CB 3.46Å; L895-R899 WeakPolarHBondContact O-CD 3.49Å; L895-R899 WeakPolarHBondContact O-CG 3.26Å; L895-R899 PolarHBondContact O-N 2.84Å
896	E	71	Confident	69.7	Low	126 Å²	126	122.4 Å²	122.4	59%	0.589	56%	0.556	S	S	*	*	H	α-helix	trans	-75.7	-42	174.2	-73.3	178.5	155.9	0	0	113.1	E892 R893 R894 R899 G900	E892-E896 WeakPolarHBondContact O-CG 3.43Å; E892-E896 PolarHBondContact O-N 3.21Å; R893-E896 CarbonylContact O-C 3.56Å; R893-E896 PolarHBondContact O-N 3.18Å; R893-E896 VanDerWaalsContact O-N 3.09Å; R894-E896 VanDerWaalsContact C-N 3.28Å; R894-E896 PolarHBondContact O-N 3.25Å; E896-R899 PolarHBondContact O-N 3.09Å; E896-G900 PolarHBondContact O-N 3.19Å
897	E	74.7	Confident	68.4	Low	108 Å²	108	125 Å²	125	51%	0.505	57%	0.565	S	S	.	*	H	α-helix	trans	-66.5	-41.3	174.2	-73.1	-175.9	-157.5	0	0	112.1	R893 R894 G900 R901	R893-E897 PolarHBondContact O-N 3.11Å; R894-E897 PolarHBondContact O-N 3.27Å; E897-G900 PolarHBondContact O-N 3.39Å; E897-R901 WeakPolarHBondContact O-CG 3.47Å; E897-R901 PolarHBondContact O-N 2.85Å
898	E	71.9	Confident	67.1	Low	112 Å²	112	126.6 Å²	126.6	52%	0.523	57%	0.571	S	S	.	*	H	α-helix	trans	-65	-42.2	173.4	-73.3	173	-179.4	0	0	111	R894 R901 F902	R894-E898 VanDerWaalsContact O-CB 3.23Å; R894-E898 WeakPolarHBondContact O-CB 3.43Å; R894-E898 VanDerWaalsContact O-CG 3.23Å; R894-E898 WeakPolarHBondContact O-CG 3.38Å; R894-E898 PolarHBondContact O-N 3Å; E898-R901 PolarHBondContact O-N 3.01Å; E898-F902 WeakPolarHBondContact O-CB 3.31Å; E898-F902 PolarHBondContact O-N 3.29Å
899	R	58.8	Low	65.5	Low	175 Å²	175	126 Å²	126	66%	0.66	58%	0.577	S	S	*	*	H	α-helix	trans	-60.2	-44	171.1	-85.9	170.9	163.4	-179.6	-5.1	112.4	L895 E896 F902 L903	L895-R899 WeakPolarHBondContact O-CB 3.46Å; L895-R899 WeakPolarHBondContact O-CD 3.49Å; L895-R899 WeakPolarHBondContact O-CG 3.26Å; L895-R899 PolarHBondContact O-N 2.84Å; E896-R899 PolarHBondContact O-N 3.09Å; R899-F902 PolarHBondContact O-N 2.9Å; R899-L903 WeakPolarHBondContact O-CB 3.18Å; R899-L903 WeakPolarHBondContact O-CD1 3.37Å; R899-L903 VanDerWaalsContact O-CG 3.25Å; R899-L903 WeakPolarHBondContact O-CG 3.29Å; R899-L903 PolarHBondContact O-N 3.49Å
900	G	68.2	Low	63.1	Low	32 Å²	32	128.2 Å²	128.2	33%	0.33	59%	0.588	S	S	.	*	H	α-helix	trans	-58.1	-50.2	177	0	0	0	0	0	111.6	E896 E897 F902 L903 E904	E896-G900 PolarHBondContact O-N 3.19Å; E897-G900 PolarHBondContact O-N 3.39Å; G900-F902 VanDerWaalsContact C-N 3.34Å; G900-F902 PolarHBondContact O-N 3.02Å; G900-L903 PolarHBondContact O-N 3.49Å; G900-L903 VanDerWaalsContact O-N 3.15Å; G900-E904 PolarHBondContact O-N 3.25Å
901	R	66.6	Low	60.8	Low	156 Å²	156	131.7 Å²	131.7	59%	0.589	61%	0.605	S	S	*	*	H	α-helix	trans	-66.6	-31.5	177.7	-69.3	173	179.4	162.6	7.2	113.2	E897 E898 K905	E897-R901 WeakPolarHBondContact O-CG 3.47Å; E897-R901 PolarHBondContact O-N 2.85Å; E898-R901 PolarHBondContact O-N 3.01Å; R901-K905 WeakPolarHBondContact O-CB 3.24Å; R901-K905 WeakPolarHBondContact O-CG 3.5Å; R901-K905 PolarHBondContact O-N 3.47Å
902	F	58.8	Low	58.6	Low	158 Å²	158	131.1 Å²	131.1	69%	0.693	61%	0.61	S	S	*	*	H	α-helix	trans	-71	-38.5	170.5	-104.1	-86.1	0	0	0	112.2	E898 R899 G900 K905 A906	E898-F902 WeakPolarHBondContact O-CB 3.31Å; E898-F902 PolarHBondContact O-N 3.29Å; R899-F902 PolarHBondContact O-N 2.9Å; G900-F902 VanDerWaalsContact C-N 3.34Å; G900-F902 PolarHBondContact O-N 3.02Å; F902-K905 PolarHBondContact O-N 3.38Å; F902-A906 WeakPolarHBondContact O-CB 3.39Å; F902-A906 PolarHBondContact O-N 2.99Å
903	L	55.9	Low	56.8	Low	108 Å²	108	132.7 Å²	132.7	57%	0.565	63%	0.627	S	S	*	*	H	α-helix	trans	-67.6	-34.9	177.7	-77.4	163.8	0	0	0	112.5	R899 G900 K907	R899-L903 WeakPolarHBondContact O-CB 3.18Å; R899-L903 WeakPolarHBondContact O-CD1 3.37Å; R899-L903 VanDerWaalsContact O-CG 3.25Å; R899-L903 WeakPolarHBondContact O-CG 3.29Å; R899-L903 PolarHBondContact O-N 3.49Å; G900-L903 PolarHBondContact O-N 3.49Å; G900-L903 VanDerWaalsContact O-N 3.15Å; L903-K907 WeakPolarHBondContact O-CB 3.32Å; L903-K907 VanDerWaalsContact O-CG 3.27Å; L903-K907 WeakPolarHBondContact O-CG 3.47Å; L903-K907 PolarHBondContact O-N 3.38Å
904	E	58.2	Low	54.5	Low	147 Å²	147	130.4 Å²	130.4	69%	0.687	63%	0.631	S	S	*	*	H	α-helix	trans	-68.7	-43.6	171.8	-70.6	-175.8	140.2	0	0	112	G900	G900-E904 PolarHBondContact O-N 3.25Å
905	K	57.7	Low	52.3	Low	157 Å²	157	128.9 Å²	128.9	68%	0.683	64%	0.638	S	S	*	*	H	α-helix	trans	-70.1	-40.8	178.8	-73	177	176.7	-177.4	0	113.2	R901 F902 K907 Q908	R901-K905 WeakPolarHBondContact O-CB 3.24Å; R901-K905 WeakPolarHBondContact O-CG 3.5Å; R901-K905 PolarHBondContact O-N 3.47Å; F902-K905 PolarHBondContact O-N 3.38Å; K905-K907 VanDerWaalsContact C-N 3.31Å; K905-K907 PolarHBondContact O-N 2.85Å; K905-Q908 PolarHBondContact O-N 3.36Å
906	A	47.6	Very low	50.5	Low	57 Å²	57	130.8 Å²	130.8	47%	0.471	64%	0.644	S	S	.	*	H	α-helix	trans	-68.7	-28.4	179.5	0	0	0	0	0	112.6	F902 Q908 I909	F902-A906 WeakPolarHBondContact O-CB 3.39Å; F902-A906 PolarHBondContact O-N 2.99Å; A906-Q908 PolarHBondContact O-N 2.95Å; A906-I909 CarbonylContact O-C 3.55Å; A906-I909 PolarHBondContact O-N 3.3Å
907	K	54	Low	48.7	Very low	181 Å²	181	130 Å²	130	79%	0.787	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-6.2	174.3	-83.1	176.6	178.1	179.3	0	114.8	L903 K905	L903-K907 WeakPolarHBondContact O-CB 3.32Å; L903-K907 VanDerWaalsContact O-CG 3.27Å; L903-K907 WeakPolarHBondContact O-CG 3.47Å; L903-K907 PolarHBondContact O-N 3.38Å; K905-K907 VanDerWaalsContact C-N 3.31Å; K905-K907 PolarHBondContact O-N 2.85Å
908	Q	51.5	Low	46.6	Very low	175 Å²	175	131.8 Å²	131.8	82%	0.818	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-6.6	170	-67.3	-173.5	-12.6	0	0	113.9	K905 A906	K905-Q908 PolarHBondContact O-N 3.36Å; A906-Q908 PolarHBondContact O-N 2.95Å
909	I	43.4	Very low	44.7	Very low	132 Å²	132	133.5 Å²	133.5	68%	0.677	65%	0.652	S	S	*	*	S	Bend	trans	-135	83.4	178.4	-53	-178.6	0	0	0	109.9	A906	A906-I909 CarbonylContact O-C 3.55Å; A906-I909 PolarHBondContact O-N 3.3Å
910	I	32	Very low	43.4	Very low	138 Å²	138	130.3 Å²	130.3	71%	0.708	66%	0.657	S	S	*	*			trans	26.4	137.3	151.3	-50.9	-168.7	0	0	0	121
911	I	32	Very low	41.8	Very low	144 Å²	144	139 Å²	139	74%	0.738	68%	0.68	S	S	*	*			trans	73.7	108.8	147.2	-65.4	158.8	0	0	0	118.1
912	E	28.7	Very low	40.3	Very low	174 Å²	174	141.7 Å²	141.7	81%	0.813	69%	0.69	S	S	*	*				14.7	163.2	123.5	-74.3	-171.9	147.8	0	0	122.1
913	P	36	Very low	39.2	Very low	105 Å²	105	139.4 Å²	139.4	68%	0.682	69%	0.693	S	S	*	*			cis	-138.9	-147.8	-26.5	34.4	-11.8	0	0	0	111.5
914	V	30.2	Very low	38.1	Very low	120 Å²	120	138.2 Å²	138.2	73%	0.727	71%	0.707	S	S	*	*			trans	77.8	110.6	156.6	160.8	0	0	0	0	116.5
915	V	32.4	Very low	36.9	Very low	112 Å²	112	135.2 Å²	135.2	68%	0.679	72%	0.716	S	S	*	*				77.4	133.4	70.4	159	0	0	0	0	111.2
916	E	31.6	Very low	35.7	Very low	130 Å²	130	131.7 Å²	131.7	61%	0.607	72%	0.724	S	S	*	*			cis	-157.2	158	-4.8	-119.2	174.1	-166.9	0	0	112.1	K918	E916-K918 IonicContact OE2-NZ 2.83Å; E916-K918 PolarHBondContact OE2-NZ 3.4Å
917	E	32.1	Very low	34.8	Very low	108 Å²	108	136.5 Å²	136.5	51%	0.505	74%	0.742	S	S	.	*				6.5	135.2	124.9	-152.7	-158.9	-111.9	0	0	119.3	K919	E917-K919 VanDerWaalsContact OE1-CE 3.28Å; E917-K919 WeakPolarHBondContact OE1-CE 3.38Å; E917-K919 IonicContact OE1-NZ 3.71Å; E917-K919 PolarHBondContact OE1-NZ 3Å; E917-K919 WeakPolarHBondContact OE2-CD 3.17Å; E917-K919 VanDerWaalsContact OE2-CE 3.27Å; E917-K919 WeakPolarHBondContact OE2-CE 3.32Å; E917-K919 IonicContact OE2-NZ 3.39Å; E917-K919 PolarHBondContact OE2-NZ 3.41Å
918	K	30.9	Very low	33.6	Very low	146 Å²	146	139.2 Å²	139.2	64%	0.635	75%	0.748	S	S	*	*				176.5	110.8	116.1	-91.6	144.8	-165.1	158.3	0	117.1	E916	E916-K918 IonicContact OE2-NZ 2.83Å; E916-K918 PolarHBondContact OE2-NZ 3.4Å
919	K	32.9	Very low	32.6	Very low	149 Å²	149	140.3 Å²	140.3	65%	0.648	75%	0.75	S	S	*	*				21.7	121	113.3	-55.7	162.2	-175.3	158.5	0	119	E917	E917-K919 VanDerWaalsContact OE1-CE 3.28Å; E917-K919 WeakPolarHBondContact OE1-CE 3.38Å; E917-K919 IonicContact OE1-NZ 3.71Å; E917-K919 PolarHBondContact OE1-NZ 3Å; E917-K919 WeakPolarHBondContact OE2-CD 3.17Å; E917-K919 VanDerWaalsContact OE2-CE 3.27Å; E917-K919 WeakPolarHBondContact OE2-CE 3.32Å; E917-K919 IonicContact OE2-NZ 3.39Å; E917-K919 PolarHBondContact OE2-NZ 3.41Å
920	S	31.4	Very low	32.1	Very low	108 Å²	108	144.4 Å²	144.4	76%	0.755	76%	0.756	S	S	*	*			trans	-160.7	128.2	130.8	17.7	0	0	0	0	109.1
921	R	33.4	Very low	32.1	Very low	215 Å²	215	144.4 Å²	144.4	81%	0.811	76%	0.758	S	S	*	*				71	140.9	67.5	-69.5	172.9	169.5	171.7	-4.2	111.4
922	R	34.7	Very low	32.4	Very low	211 Å²	211	145 Å²	145	80%	0.796	76%	0.763	S	S	*	*			cis	-162.4	158.7	25.5	-139	167.4	-173.2	165.3	-3.7	112
923	S	36.5	Very low	32.7	Very low	110 Å²	110	145.5 Å²	145.5	77%	0.769	76%	0.762	S	S	*	*			trans	21	142	147.2	57.4	0	0	0	0	121.6
924	G	32.9	Very low	32.4	Very low	83 Å²	83	146.8 Å²	146.8	86%	0.856	76%	0.762	S	S	*	*			cis	152.7	167.5	3.3	0	0	0	0	0	112.2
925	G	32.7	Very low	32.3	Very low	85 Å²	85	145.5 Å²	145.5	88%	0.876	76%	0.764	S	S	*	*			trans	137.3	120.6	-176.4	0	0	0	0	0	109.9
926	G	32.6	Very low	32.4	Very low	83 Å²	83	146.3 Å²	146.3	86%	0.856	78%	0.775	S	S	*	*			trans	-118.8	115.7	-173.2	0	0	0	0	0	112.4
927	N	29	Very low	32.5	Very low	157 Å²	157	143 Å²	143	84%	0.84	78%	0.775	S	S	*	*			trans	-157.7	155.9	156.3	-148.2	-19.2	0	0	0	111.2
928	R	28.2	Very low	32.6	Very low	239 Å²	239	145.2 Å²	145.2	90%	0.902	79%	0.791	S	S	*	*			trans	66.6	157.9	-175.5	-54.7	-179.8	178	173.3	-0.7	114.3
929	K	31.5	Very low	32.7	Very low	198 Å²	198	146.2 Å²	146.2	86%	0.861	80%	0.798	S	S	*	*			trans	-131.7	120.3	-174.8	-91.6	-175.2	174.1	176.7	0	111
930	R	32.7	Very low	32.6	Very low	217 Å²	217	147.2 Å²	147.2	82%	0.819	81%	0.805	S	S	*	*			trans	72.8	102.8	161.3	-67.1	179.1	171.3	173.8	-4.5	116.4
931	D	32.3	Very low	32.4	Very low	138 Å²	138	146.6 Å²	146.6	74%	0.738	80%	0.8	S	S	*	*				70.6	98.4	58.6	-48.1	-45	0	0	0	110.9
932	D	37.9	Very low	32.1	Very low	158 Å²	158	140.8 Å²	140.8	85%	0.845	79%	0.793	S	S	*	*			cis	111.7	134.2	5.2	-62.3	-54.6	0	0	0	116.7
933	F	34.1	Very low	31.8	Very low	183 Å²	183	139.2 Å²	139.2	80%	0.803	79%	0.794	S	S	*	*			trans	-158.2	112.2	-180	-174	-87.5	0	0	0	114.4
934	I	30.5	Very low	31.3	Very low	133 Å²	133	138.9 Å²	138.9	68%	0.682	79%	0.792	S	S	*	*			trans	40.5	144	139.2	-42	-175.8	0	0	0	121
935	A	28	Very low	31.1	Very low	93 Å²	93	139.5 Å²	139.5	77%	0.769	78%	0.783	S	S	*	*			cis	156.1	113.3	-43.7	0	0	0	0	0	112.5
936	S	34.3	Very low	31	Very low	128 Å²	128	141.4 Å²	141.4	90%	0.895	77%	0.773	S	S	*	*			trans	-179.2	137.9	158.6	58.1	0	0	0	0	109.6
937	G	33.8	Very low	30.9	Very low	60 Å²	60	145.5 Å²	145.5	62%	0.619	77%	0.77	S	S	*	*			cis	-166.8	-174.3	-2.4	0	0	0	0	0	110.3
938	D	35	Very low	31.1	Very low	155 Å²	155	142.1 Å²	142.1	83%	0.829	76%	0.764	S	S	*	*			trans	67	143	162.8	-44.5	-12.3	0	0	0	117.3
939	E	33.2	Very low	31.5	Very low	168 Å²	168	135.8 Å²	135.8	79%	0.785	76%	0.763	S	S	*	*			cis	-156.9	-166.8	-25.2	-129.6	173.7	-166.1	0	0	110.1
940	E	30	Very low	31.7	Very low	170 Å²	170	131.3 Å²	131.3	79%	0.794	76%	0.763	S	S	*	*			trans	-31.4	164	170.5	-61.1	-174.9	166.8	0	0	118.9
941	S	27.6	Very low	32	Very low	95 Å²	95	124.8 Å²	124.8	66%	0.664	76%	0.763	S	S	*	*			cis	-175.3	-174.6	-22.4	65.3	0	0	0	0	108.5
942	S	27.1	Very low	32.2	Very low	93 Å²	93	124.2 Å²	124.2	65%	0.65	76%	0.76	S	S	*	*			trans	49.7	123.4	157.6	64	0	0	0	0	123.1
943	E	27.1	Very low	32.1	Very low	177 Å²	177	126.4 Å²	126.4	83%	0.827	76%	0.756	S	S	*	*				69.2	99.1	127.1	-61.9	-177.2	172	0	0	123.3
944	S	27.1	Very low	32.2	Very low	104 Å²	104	122.7 Å²	122.7	73%	0.727	75%	0.753	S	S	*	*				92.7	149.2	110.3	82	0	0	0	0	123.1
945	S	29.3	Very low	32.4	Very low	96 Å²	96	124.2 Å²	124.2	67%	0.671	76%	0.757	S	S	*	*			trans	88	102.3	146.1	72.7	0	0	0	0	122.3
946	N	29.7	Very low	32.6	Very low	124 Å²	124	126.3 Å²	126.3	66%	0.663	76%	0.755	S	S	*	*				85.8	113.6	118.4	-69.8	33.9	0	0	0	123.8
947	E	30.9	Very low	32.4	Very low	170 Å²	170	126.3 Å²	126.3	79%	0.794	75%	0.75	S	S	*	*				73	145.5	118.9	-65.1	172.9	151.8	0	0	121.3
948	A	33.6	Very low	32.3	Very low	86 Å²	86	130.5 Å²	130.5	71%	0.711	76%	0.758	S	S	*	*			cis	-167.6	157.8	-16.3	0	0	0	0	0	112.4
949	A	35	Very low	32.2	Very low	105 Å²	105	128.4 Å²	128.4	87%	0.868	76%	0.755	S	S	*	*			trans	63.4	153.3	154.2	0	0	0	0	0	118.7
950	A	37.3	Very low	32	Very low	105 Å²	105	127.4 Å²	127.4	87%	0.868	76%	0.761	S	S	*	*			cis	-154.3	176.1	-6.4	0	0	0	0	0	109.2
951	G	37.6	Very low	32.1	Very low	79 Å²	79	122.8 Å²	122.8	81%	0.814	76%	0.758	S	S	*	*			trans	148.4	31.3	160.4	0	0	0	0	0	123.5
952	D	37.3	Very low	32.2	Very low	126 Å²	126	126.3 Å²	126.3	67%	0.674	76%	0.764	S	S	*	*			trans	39.7	105.7	155	-123.2	36.7	0	0	0	123.7
953	R	35.1	Very low	32.2	Very low	204 Å²	204	128.9 Å²	128.9	77%	0.77	77%	0.766	S	S	*	*				71.3	134.6	118.4	-78.3	-175.3	-178.5	131.8	-7.6	126.9
954	S	35.7	Very low	32.4	Very low	106 Å²	106	129.3 Å²	129.3	74%	0.741	77%	0.765	S	S	*	*			trans	92.4	137.7	133.2	73.1	0	0	0	0	121
955	E	34.8	Very low	32.5	Very low	165 Å²	165	133.2 Å²	133.2	77%	0.771	77%	0.772	S	S	*	*			cis	-155.4	139	-17.4	-119.8	-171.5	-147.3	0	0	114.2
956	N	32.8	Very low	32.6	Very low	136 Å²	136	138 Å²	138	73%	0.727	78%	0.781	S	S	*	*			trans	65.8	157.7	146.9	-65.1	-30.8	0	0	0	123
957	V	30.6	Very low	32.4	Very low	128 Å²	128	141.6 Å²	141.6	78%	0.776	79%	0.791	S	S	*	*			trans	-143.6	-174	-160.6	-167.5	0	0	0	0	109.4
958	D	32.2	Very low	32.4	Very low	148 Å²	148	142 Å²	142	79%	0.791	80%	0.796	S	S	*	*			trans	89.5	148.3	159.6	-65.2	-33.4	0	0	0	119.1
959	S	31.8	Very low	32.2	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	80%	0.795	S	S	*	*			cis	-163.9	-170.5	-20.2	57.1	0	0	0	0	110.8
960	V	29.2	Very low	31.8	Very low	148 Å²	148	144 Å²	144	90%	0.897	80%	0.796	S	S	*	*			trans	-91.2	141.6	-172.5	176.3	0	0	0	0	113.2
961	G	31.4	Very low	31.5	Very low	72 Å²	72	149.1 Å²	149.1	74%	0.742	80%	0.799	S	S	*	*			trans	-159.3	137.1	168.9	0	0	0	0	0	115.4
962	Q	29.7	Very low	30.9	Very low	170 Å²	170	156 Å²	156	79%	0.794	80%	0.8	S	S	*	*			trans	-118.3	159.1	171.8	-69.5	-171.4	-5.3	0	0	111.7
963	Q	28.5	Very low	30.6	Very low	146 Å²	146	159.8 Å²	159.8	68%	0.682	81%	0.814	S	S	*	*			trans	68.2	139.6	171.6	-49.6	-177.9	11.8	0	0	114.2
964	K	31.7	Very low	30.1	Very low	187 Å²	187	154 Å²	154	81%	0.813	81%	0.805	S	S	*	*			cis	-160.6	169.4	41.2	-124.7	130.3	-169.2	161.2	0	112.2
965	Q	28.6	Very low	29.6	Very low	185 Å²	185	153.9 Å²	153.9	86%	0.864	80%	0.804	S	S	*	*			trans	-76.1	140.4	172.8	-62.7	171	-16.1	0	0	113.7
966	K	30.4	Very low	29.1	Very low	198 Å²	198	154.2 Å²	154.2	86%	0.861	81%	0.805	S	S	*	*			trans	-174.3	118.7	143.7	-98.3	156.8	-175.1	-177.4	0	106.2
967	K	27	Very low	28.7	Very low	199 Å²	199	152.6 Å²	152.6	87%	0.865	81%	0.805	S	S	*	*				58.5	138.8	74.3	-85.9	-168.6	173.8	-177.8	0	114.1
968	I	29.8	Very low	28.7	Very low	179 Å²	179	156.6 Å²	156.6	92%	0.918	81%	0.812	S	S	*	*			trans	80.3	126.8	-169.8	-50.3	165.8	0	0	0	111.5
969	G	29.6	Very low	28.4	Very low	67 Å²	67	158.4 Å²	158.4	69%	0.691	82%	0.815	S	S	*	*			cis	-170.1	163	-3.7	0	0	0	0	0	114.2
970	N	26.8	Very low	28.2	Very low	165 Å²	165	156.7 Å²	156.7	88%	0.882	82%	0.815	S	S	*	*			trans	-61.5	144.9	-178.1	-62	-26.5	0	0	0	113.1
971	K	30	Very low	28	Very low	212 Å²	212	157.2 Å²	157.2	92%	0.922	81%	0.813	S	S	*	*			trans	-147.5	123	137.5	-117.7	171.1	-174.6	178.9	0	111.5
972	R	26.5	Very low	27.9	Very low	225 Å²	225	161.4 Å²	161.4	85%	0.849	82%	0.818	S	S	*	*			trans	-75.1	149.7	168.2	-62.8	169.3	173	163	-6.8	108.7
973	Q	30.3	Very low	27.9	Very low	204 Å²	204	160.9 Å²	160.9	95%	0.953	82%	0.819	S	S	*	*			trans	-127	124.7	145.5	-81.7	-171	-38.2	0	0	109.1
974	S	24	Very low	27.7	Very low	84 Å²	84	164.2 Å²	164.2	59%	0.587	83%	0.826	S	S	*	*			trans	-161.9	141.3	-176.4	54.4	0	0	0	0	105.2
975	S	25.5	Very low	27.6	Very low	102 Å²	102	165.4 Å²	165.4	71%	0.713	83%	0.831	S	S	*	*			trans	69.7	149.4	-162.6	91.7	0	0	0	0	112.5
976	E	25.4	Very low	27.4	Very low	172 Å²	172	164.6 Å²	164.6	80%	0.804	82%	0.824	S	S	*	*			cis	-157.1	167.8	-2.6	-132.3	151.3	-168.9	0	0	111.9
977	S	24.5	Very low	27.3	Very low	102 Å²	102	160.1 Å²	160.1	71%	0.713	82%	0.818	S	S	*	*			trans	-21.2	135.9	172.3	56	0	0	0	0	118.8
978	K	29.5	Very low	27.3	Very low	212 Å²	212	162.3 Å²	162.3	92%	0.922	82%	0.821	S	S	*	*			trans	-154.9	142.6	133.5	-114.7	153.7	-170.5	169.6	0	113.2
979	E	25.3	Very low	27.1	Very low	186 Å²	186	163 Å²	163	87%	0.869	82%	0.818	S	S	*	*			trans	-83.2	152.5	-174	-61	155.5	105.7	0	0	112
980	G	28.5	Very low	27.1	Very low	75 Å²	75	165 Å²	165	77%	0.773	82%	0.821	S	S	*	*			trans	-158.1	66	-177.1	0	0	0	0	0	112.6	L982	G980-L982 PolarHBondContact O-N 3.46Å
981	N	25.4	Very low	26.9	Very low	159 Å²	159	164.5 Å²	164.5	85%	0.85	82%	0.818	S	S	*	*			trans	-47.7	120.7	-174.4	-79.3	-61.9	0	0	0	115
982	L	29.4	Very low	26.8	Very low	161 Å²	161	158.5 Å²	158.5	84%	0.843	80%	0.803	S	S	*	*			trans	-139.7	77.8	157.8	-103.2	170.7	0	0	0	112.8	G980	G980-L982 PolarHBondContact O-N 3.46Å
983	L	29.8	Very low	27	Very low	158 Å²	158	159 Å²	159	83%	0.827	81%	0.805	S	S	*	*			trans	50.3	95.7	147.4	-63.6	171.1	0	0	0	119.8
984	R	23.8	Very low	27.1	Very low	217 Å²	217	155.6 Å²	155.6	82%	0.819	79%	0.793	S	S	*	*			trans	-46.7	136.7	158.5	-68.5	167.4	163.6	159.5	-3.6	113.2
985	K	29.1	Very low	27.8	Very low	211 Å²	211	158.9 Å²	158.9	92%	0.917	80%	0.804	S	S	*	*			trans	-117.9	115.2	141.1	-91.9	-174.6	175.8	177.2	0	109.2
986	K	25.1	Very low	28.8	Very low	168 Å²	168	155.6 Å²	155.6	73%	0.73	79%	0.787	S	S	*	*			trans	-87.3	106.7	175.3	-71.3	-178	171	-172.5	0	109.9
987	S	29	Very low	30.3	Very low	104 Å²	104	148.6 Å²	148.6	73%	0.727	75%	0.754	S	S	*	*			trans	-76.7	142.3	150.1	39.7	0	0	0	0	108.6
988	R	25.2	Very low	31.6	Very low	245 Å²	245	146.5 Å²	146.5	93%	0.925	74%	0.74	S	S	*	*			trans	-89.6	105.4	175.2	-72.5	173.8	171.7	153.1	-6	108.6
989	F	27.3	Very low	32.4	Very low	195 Å²	195	138.5 Å²	138.5	86%	0.855	71%	0.713	S	S	*	*			trans	-74.9	132.2	149.2	-87.3	-86.9	0	0	0	108.2
990	S	27.9	Very low	33.5	Very low	107 Å²	107	137.6 Å²	137.6	75%	0.748	71%	0.706	S	S	*	*			trans	-81.9	136	170.7	45.2	0	0	0	0	109.2	S992	S990-S992 PolarHBondContact O-N 3.07Å
991	N	24	Very low	34.8	Very low	156 Å²	156	136.9 Å²	136.9	83%	0.834	68%	0.683	S	S	*	*			trans	-62.4	103.6	173.2	-59.7	-8.8	0	0	0	110.4
992	S	28.3	Very low	36.3	Very low	86 Å²	86	132.4 Å²	132.4	60%	0.601	65%	0.654	S	S	*	*			trans	-88.6	135.7	130.4	45.9	0	0	0	0	107	S990	S990-S992 PolarHBondContact O-N 3.07Å
993	R	29.3	Very low	37.3	Very low	234 Å²	234	130.5 Å²	130.5	88%	0.883	64%	0.642	S	S	*	*			trans	-105.1	-1.2	168.6	-93.1	-177	164.4	-172.3	-8.7	112.1
994	D	32.3	Very low	38.6	Very low	134 Å²	134	129.7 Å²	129.7	72%	0.717	63%	0.628	S	S	*	*			trans	-109.1	114.5	177.2	-40	-72.3	0	0	0	106.5
995	D	39.8	Very low	40.3	Very low	153 Å²	153	119.9 Å²	119.9	82%	0.818	59%	0.592	S	S	*	*			trans	176.6	66	153.9	-90.8	-26.9	0	0	0	107.7
996	G	46.9	Very low	41.9	Very low	33 Å²	33	114.8 Å²	114.8	34%	0.34	58%	0.578	S	S	.	*	S	Bend	trans	-74.3	168	160	0	0	0	0	0	110.6	S998	G996-S998 PolarHBondContact O-N 2.96Å
997	L	55.4	Low	43.4	Very low	24 Å²	24	108.2 Å²	108.2	13%	0.126	55%	0.553	C	S	.	*			trans	-55.6	108.7	175.3	-68	171.6	0	0	0	110.1	E425 I428 A460 I463 Q1001 R1002 I1005	E425-L997 HydrophobicContact CG-CD2 3.98Å; I428-L997 HydrophobicContact CD1-CD1 4.35Å; A460-L997 HydrophobicContact CB-CD1 4.37Å; I463-L997 HydrophobicContact CD1-CD1 4.32Å; L997-Q1001 HydrophobicContact CB-CB 4.37Å; L997-Q1001 HydrophobicContact CD2-CB 4.07Å; L997-R1002 HydrophobicContact CB-CG 3.82Å; L997-R1002 WeakPolarHBondContact O-CG 3.49Å; L997-R1002 PolarHBondContact O-NH1 3.26Å; L997-I1005 HydrophobicContact CD1-CD1 3.95Å
998	S	51.8	Low	45.1	Very low	59 Å²	59	107.3 Å²	107.3	41%	0.413	54%	0.536	S	S	.	.			trans	-55.1	153.8	174.8	-176.8	0	0	0	0	110.2	G996 K1000 Q1001 R1002	G996-S998 PolarHBondContact O-N 2.96Å; S998-K1000 PolarHBondContact O-N 3.07Å; S998-Q1001 CarbonylContact O-C 3.35Å; S998-Q1001 WeakPolarHBondContact O-CA 3.47Å; S998-Q1001 WeakPolarHBondContact O-CB 3.44Å; S998-Q1001 PolarHBondContact O-N 2.96Å; S998-R1002 PolarHBondContact O-N 3.37Å
999	A	48	Very low	46.6	Very low	44 Å²	44	97.3 Å²	97.3	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-51.8	-34.2	173.5	0	0	0	0	0	112.4	Q1001 M1003	A999-Q1001 VanDerWaalsContact C-N 3.32Å; A999-Q1001 PolarHBondContact O-N 3.3Å; A999-M1003 HydrophobicContact CB-CE 4.37Å; A999-M1003 WeakPolarHBondContact O-CB 3.47Å; A999-M1003 VanDerWaalsContact O-CE 3.3Å; A999-M1003 WeakPolarHBondContact O-CE 3.28Å; A999-M1003 WeakPolarHBondContact O-CG 3.17Å; A999-M1003 PolarHBondContact O-N 2.94Å
1000	K	46.8	Very low	48.2	Very low	166 Å²	166	88.6 Å²	88.6	72%	0.722	47%	0.468	S	S	*	.	H	α-helix	trans	-69.5	-22.6	174.2	-68	-175.3	179.7	178.8	0	114.6	S998	S998-K1000 PolarHBondContact O-N 3.07Å
1001	Q	55.7	Low	49.4	Very low	60 Å²	60	87 Å²	87	28%	0.28	45%	0.453	S	S	.	.	H	α-helix	trans	-88.8	-42.6	174.2	-69	159	-57.2	0	0	110.2	E425 L997 S998 A999 M1003 R1004	E425-Q1001 WeakPolarHBondContact OE1-CG 3.33Å; E425-Q1001 PolarHBondContact OE1-NE2 3.24Å; L997-Q1001 HydrophobicContact CB-CB 4.37Å; L997-Q1001 HydrophobicContact CD2-CB 4.07Å; S998-Q1001 CarbonylContact O-C 3.35Å; S998-Q1001 WeakPolarHBondContact O-CA 3.47Å; S998-Q1001 WeakPolarHBondContact O-CB 3.44Å; S998-Q1001 PolarHBondContact O-N 2.96Å; A999-Q1001 VanDerWaalsContact C-N 3.32Å; A999-Q1001 PolarHBondContact O-N 3.3Å; Q1001-M1003 PolarHBondContact O-N 2.81Å; Q1001-R1004 WeakPolarHBondContact O-CB 3.47Å; Q1001-R1004 PolarHBondContact O-N 2.94Å
1002	R	57.1	Low	50.4	Low	66 Å²	66	80.7 Å²	80.7	25%	0.249	42%	0.422	C	S	.	.	H	α-helix	trans	-56.6	-47.3	173.9	-60.5	-158.5	-66.3	-109.8	28.2	111.9	E494 Y515 L997 S998 R1004 I1005	E494-R1002 IonicContact OE1-NH2 3.65Å; Y515-R1002 PolarHBondContact OH-NH2 3.29Å; L997-R1002 HydrophobicContact CB-CG 3.82Å; L997-R1002 WeakPolarHBondContact O-CG 3.49Å; L997-R1002 PolarHBondContact O-NH1 3.26Å; S998-R1002 PolarHBondContact O-N 3.37Å; R1002-R1004 PolarHBondContact O-N 3.03Å; R1002-I1005 WeakPolarHBondContact O-CB 3.32Å; R1002-I1005 PolarHBondContact O-N 2.87Å
1003	M	50.3	Low	50.5	Low	120 Å²	120	81.5 Å²	81.5	59%	0.591	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-7	175.9	-76.1	-172.7	-79.8	0	0	115.6	Y514 A999 Q1001	Y514-M1003 HydrophobicContact CD2-CG 4.24Å; Y514-M1003 HydrophobicContact CE2-CG 3.76Å; A999-M1003 HydrophobicContact CB-CE 4.37Å; A999-M1003 WeakPolarHBondContact O-CB 3.47Å; A999-M1003 VanDerWaalsContact O-CE 3.3Å; A999-M1003 WeakPolarHBondContact O-CE 3.28Å; A999-M1003 WeakPolarHBondContact O-CG 3.17Å; A999-M1003 PolarHBondContact O-N 2.94Å; Q1001-M1003 PolarHBondContact O-N 2.81Å
1004	R	58	Low	50.4	Low	142 Å²	142	71.9 Å²	71.9	54%	0.536	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-18	169.7	-65.3	177.8	177.2	-170.3	-2.1	113	Q1001 R1002 V1006	Q1001-R1004 WeakPolarHBondContact O-CB 3.47Å; Q1001-R1004 PolarHBondContact O-N 2.94Å; R1002-R1004 PolarHBondContact O-N 3.03Å; R1004-V1006 PolarHBondContact O-N 3.13Å; R1004-V1006 VanDerWaalsContact O-N 3.12Å
1005	I	58.5	Low	50.2	Low	10 Å²	10	68.9 Å²	68.9	5%	0.051	38%	0.377	C	S	.	.	S	Bend	trans	-82.9	92.1	-178.7	-51.3	179.3	0	0	0	108.2	I428 E462 I463 L997 R1002 S1007	I428-I1005 HydrophobicContact CD1-CD1 4.02Å; I428-I1005 HydrophobicContact CG2-CD1 4.23Å; I428-I1005 HydrophobicContact CG2-CG1 4.15Å; I428-I1005 HydrophobicContact CG2-CG2 4.38Å; E462-I1005 HydrophobicContact CB-CB 4.17Å; E462-I1005 HydrophobicContact CB-CG2 3.73Å; I463-I1005 HydrophobicContact CD1-CD1 4.09Å; I463-I1005 HydrophobicContact CG1-CD1 3.99Å; I463-I1005 HydrophobicContact CG1-CG2 4.24Å; L997-I1005 HydrophobicContact CD1-CD1 3.95Å; R1002-I1005 WeakPolarHBondContact O-CB 3.32Å; R1002-I1005 PolarHBondContact O-N 2.87Å; I1005-S1007 PolarHBondContact O-N 3.04Å
1006	V	62.9	Low	49.5	Very low	105 Å²	105	67 Å²	67	64%	0.636	37%	0.368	S	S	*	.			trans	-65.7	120.4	178.5	-176.5	0	0	0	0	109.8	N466 R1004 K1008	N466-V1006 PolarHBondContact ND2-O 3.26Å; R1004-V1006 PolarHBondContact O-N 3.13Å; R1004-V1006 VanDerWaalsContact O-N 3.12Å; V1006-K1008 PolarHBondContact O-N 2.88Å
1007	S	58	Low	48.4	Very low	29 Å²	29	67.9 Å²	67.9	20%	0.203	37%	0.369	C	S	.	.			trans	-72.9	114	172.7	57.3	0	0	0	0	110.6	N466 L518 I1005 A1009	N466-S1007 WeakPolarHBondContact OD1-CA 3.31Å; L518-S1007 WeakPolarHBondContact CD1-OG 3.18Å; I1005-S1007 PolarHBondContact O-N 3.04Å; S1007-A1009 PolarHBondContact O-N 3.17Å
1008	K	63.9	Low	47	Very low	86 Å²	86	68.8 Å²	68.8	37%	0.374	38%	0.377	S	S	.	.			trans	-73.2	122.5	-177.9	-161.9	165.7	-175.4	172.8	0	110.7	D435 N465 N466 N525 V1006	D435-K1008 IonicContact OD1-NZ 3.04Å; D435-K1008 PolarHBondContact OD1-NZ 2.98Å; N465-K1008 PolarHBondContact ND2-N 3.37Å; N465-K1008 PolarHBondContact ND2-O 3.36Å; N466-K1008 PolarHBondContact OD1-N 3.4Å; N525-K1008 PolarHBondContact ND2-O 3.45Å; V1006-K1008 PolarHBondContact O-N 2.88Å
1009	A	55.9	Low	45.7	Very low	34 Å²	34	71.6 Å²	71.6	28%	0.281	40%	0.396	S	S	.	.			trans	-87.1	143.5	169.6	0	0	0	0	0	110.3	T521 Y524 N525 S1007 V1011	T521-A1009 HydrophobicContact CG2-CB 4.1Å; Y524-A1009 HydrophobicContact CD1-CB 4.45Å; N525-A1009 WeakPolarHBondContact OD1-CA 3.45Å; S1007-A1009 PolarHBondContact O-N 3.17Å; A1009-V1011 HydrophobicContact CB-CG2 4Å; A1009-V1011 PolarHBondContact O-N 3.08Å
1010	I	61.8	Low	44.7	Very low	12 Å²	12	74.1 Å²	74.1	6%	0.062	41%	0.412	C	S	.	.			trans	-82.3	59.9	172.8	-51.8	167.9	0	0	0	108.9	A469 F472 F484 Y524 N525 R528 S1012	A469-I1010 HydrophobicContact CB-CG1 4.16Å; F472-I1010 HydrophobicContact CB-CD1 3.86Å; F472-I1010 HydrophobicContact CD1-CD1 3.76Å; F472-I1010 HydrophobicContact CD1-CG1 4.3Å; F472-I1010 HydrophobicContact CD1-CG2 3.68Å; F472-I1010 HydrophobicContact CD2-CD1 3.91Å; F472-I1010 HydrophobicContact CE1-CD1 4.31Å; F472-I1010 HydrophobicContact CE1-CG2 3.39Å; F472-I1010 HydrophobicContact CE2-CD1 4.41Å; F472-I1010 HydrophobicContact CG-CD1 3.56Å; F472-I1010 HydrophobicContact CZ-CG2 3.99Å; F484-I1010 HydrophobicContact CE2-CD1 4.02Å; F484-I1010 HydrophobicContact CZ-CD1 3.73Å; Y524-I1010 WeakPolarHBondContact CE1-O 3.41Å; Y524-I1010 PolarHBondContact OH-O 3.35Å; N525-I1010 HydrophobicContact CB-CD1 4.04Å; N525-I1010 HydrophobicContact CB-CG1 4.36Å; N525-I1010 PolarHBondContact OD1-N 2.95Å; R528-I1010 HydrophobicContact CB-CB 4.25Å; R528-I1010 HydrophobicContact CB-CD1 4.35Å; R528-I1010 HydrophobicContact CB-CG2 4.3Å; R528-I1010 HydrophobicContact CG-CB 4.25Å; R528-I1010 HydrophobicContact CG-CG2 4.48Å; R528-I1010 PolarHBondContact NE-O 3Å; I1010-S1012 PolarHBondContact O-N 3.22Å
1011	V	53.5	Low	43.8	Very low	73 Å²	73	69.1 Å²	69.1	44%	0.442	41%	0.407	S	S	.	.			trans	-75.4	115.2	165.7	179.6	0	0	0	0	106.6	Y524 E555 A1009 D1013	Y524-V1011 HydrophobicContact CE1-CG2 4.35Å; E555-V1011 HydrophobicContact CG-CG2 4.17Å; A1009-V1011 HydrophobicContact CB-CG2 4Å; A1009-V1011 PolarHBondContact O-N 3.08Å; V1011-D1013 PolarHBondContact O-N 2.96Å
1012	S	43.7	Very low	42.6	Very low	24 Å²	24	73.2 Å²	73.2	17%	0.168	43%	0.426	C	S	.	.			trans	-80.8	100.9	172.4	56.7	0	0	0	0	108	R559 I1010 D1016	R559-S1012 PolarHBondContact NH1-OG 3.42Å; I1010-S1012 PolarHBondContact O-N 3.22Å; S1012-D1016 WeakPolarHBondContact CA-OD2 3.5Å; S1012-D1016 WeakPolarHBondContact CB-OD2 3.47Å
1013	D	30.7	Very low	41.4	Very low	103 Å²	103	77.8 Å²	77.8	55%	0.551	46%	0.456	S	S	*	.			trans	-52	144.6	164.7	-162.9	-23.3	0	0	0	108.7	V1011 S1015 D1016	V1011-D1013 PolarHBondContact O-N 2.96Å; D1013-S1015 PolarHBondContact O-N 3.24Å; D1013-D1016 WeakPolarHBondContact O-CB 3.31Å; D1013-D1016 PolarHBondContact O-N 3.45Å
1014	S	27	Very low	40.5	Very low	33 Å²	33	76.2 Å²	76.2	23%	0.231	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-17	-170.1	59.3	0	0	0	0	114.5	D589 F625 D1016	D589-S1014 WeakPolarHBondContact OD1-CB 3.29Å; F625-S1014 WeakPolarHBondContact CB-OG 3.39Å; F625-S1014 VanDerWaalsContact CD2-O 3.28Å; F625-S1014 WeakPolarHBondContact CD2-O 3.41Å; F625-S1014 WeakPolarHBondContact CE2-O 3.39Å; F625-S1014 WeakPolarHBondContact CG-OG 3.43Å; S1014-D1016 VanDerWaalsContact C-N 3.35Å; S1014-D1016 PolarHBondContact O-N 2.84Å
1015	S	28.8	Very low	39.5	Very low	70 Å²	70	77.8 Å²	77.8	49%	0.49	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	4.2	172.6	56.3	0	0	0	0	117	D1013 S1017	D1013-S1015 PolarHBondContact O-N 3.24Å; S1015-S1017 VanDerWaalsContact C-N 3.27Å; S1015-S1017 PolarHBondContact O-N 2.88Å
1016	D	25.6	Very low	38.4	Very low	114 Å²	114	84.8 Å²	84.8	61%	0.61	49%	0.493	S	S	*	.			trans	-67.5	70.3	-167.8	-136.9	10.6	0	0	0	115.3	S1012 D1013 S1014	S1012-D1016 WeakPolarHBondContact CA-OD2 3.5Å; S1012-D1016 WeakPolarHBondContact CB-OD2 3.47Å; D1013-D1016 WeakPolarHBondContact O-CB 3.31Å; D1013-D1016 PolarHBondContact O-N 3.45Å; S1014-D1016 VanDerWaalsContact C-N 3.35Å; S1014-D1016 PolarHBondContact O-N 2.84Å
1017	S	23.8	Very low	37.2	Very low	52 Å²	52	84.5 Å²	84.5	36%	0.364	48%	0.484	S	S	.	.	S	Bend	trans	-144.4	103.2	165.3	174.7	0	0	0	0	108.7	S1015	S1015-S1017 VanDerWaalsContact C-N 3.27Å; S1015-S1017 PolarHBondContact O-N 2.88Å
1018	S	25.1	Very low	36.1	Very low	42 Å²	42	87.2 Å²	87.2	29%	0.294	49%	0.494	S	S	.	.			trans	57.2	99.7	168.8	57.6	0	0	0	0	117.5
1019	S	25.2	Very low	34.7	Very low	118 Å²	118	86.4 Å²	86.4	83%	0.825	50%	0.503	S	S	*	.			trans	-129.1	95	139.2	72.8	0	0	0	0	110.3
1020	S	25.7	Very low	33.9	Very low	98 Å²	98	92.9 Å²	92.9	69%	0.685	52%	0.52	S	S	*	.			trans	-132.4	82.9	171.6	57.2	0	0	0	0	107.8
1021	G	28.9	Very low	32.5	Very low	61 Å²	61	94.2 Å²	94.2	63%	0.629	53%	0.533	S	S	*	.			trans	-120.9	106.6	-174	0	0	0	0	0	111.3
1022	E	29.5	Very low	31.7	Very low	145 Å²	145	92.3 Å²	92.3	68%	0.678	53%	0.525	S	S	*	.			trans	-84	152.4	165.7	-63.8	177.2	148	0	0	109	N439	N439-E1022 PolarHBondContact ND2-OE1 3.26Å
1023	D	31.7	Very low	31.6	Very low	163 Å²	163	93.9 Å²	93.9	87%	0.872	54%	0.539	S	S	*	.			trans	61.1	39.3	171.4	-63	-19.4	0	0	0	119.7	Q1025	D1023-Q1025 PolarHBondContact O-N 3.38Å
1024	E	32.8	Very low	31.9	Very low	87 Å²	87	91.1 Å²	91.1	41%	0.407	52%	0.524	S	S	.	.			trans	-86.7	92.5	167.6	-72.7	-161.9	171.4	0	0	114.6	Q1028	E1024-Q1028 HydrophobicContact CB-CG 4.11Å; E1024-Q1028 PolarHBondContact O-NE2 3.2Å; E1024-Q1028 PolarHBondContact OE2-NE2 2.79Å
1025	Q	36.3	Very low	32.4	Very low	175 Å²	175	90.9 Å²	90.9	82%	0.818	52%	0.524	S	S	*	.	S	Bend	trans	-131.8	-41.7	158.1	-70.9	-166	-0.3	0	0	114.7	D1023	D1023-Q1025 PolarHBondContact O-N 3.38Å
1026	E	35.5	Very low	33.3	Very low	157 Å²	157	96.1 Å²	96.1	73%	0.734	53%	0.534	S	S	*	.	H	α-helix	trans	-76.9	-32.2	176.9	-70.9	-158.4	110.2	0	0	113.7
1027	H	38.4	Very low	34.5	Very low	99 Å²	99	97.7 Å²	97.7	46%	0.458	54%	0.535	S	S	.	.	H	α-helix	trans	-71.2	-33.3	-176.3	-76.3	-104.8	0	0	0	113	E698 A1029 R1030 A1031	E698-H1027 IonicContact OE2-ND1 2.91Å; H1027-A1029 VanDerWaalsContact C-N 3.27Å; H1027-A1029 PolarHBondContact O-N 2.81Å; H1027-R1030 PolarHBondContact O-N 3.33Å; H1027-A1031 PolarHBondContact O-N 3.37Å; H1027-A1031 VanDerWaalsContact O-N 3.12Å
1028	Q	33.6	Very low	35.5	Very low	85 Å²	85	97.3 Å²	97.3	40%	0.397	53%	0.528	S	S	.	.	H	α-helix	trans	-59.6	-36.5	-178.8	-67.2	-179.6	-8.7	0	0	112.5	E1024 R1030 A1032	E1024-Q1028 HydrophobicContact CB-CG 4.11Å; E1024-Q1028 PolarHBondContact O-NE2 3.2Å; E1024-Q1028 PolarHBondContact OE2-NE2 2.79Å; Q1028-R1030 VanDerWaalsContact C-N 3.32Å; Q1028-R1030 PolarHBondContact O-N 3.11Å; Q1028-A1032 WeakPolarHBondContact O-CB 3.48Å; Q1028-A1032 PolarHBondContact O-N 2.8Å
1029	A	35.8	Very low	36.5	Very low	69 Å²	69	99.7 Å²	99.7	57%	0.57	54%	0.537	S	S	*	.	H	α-helix	trans	-63.5	-35.6	175.7	0	0	0	0	0	112.6	H1027 A1033	H1027-A1029 VanDerWaalsContact C-N 3.27Å; H1027-A1029 PolarHBondContact O-N 2.81Å; A1029-A1033 WeakPolarHBondContact O-CB 3.29Å; A1029-A1033 PolarHBondContact O-N 3.25Å
1030	R	37.9	Very low	37.4	Very low	170 Å²	170	97.7 Å²	97.7	64%	0.642	52%	0.523	S	S	*	.	H	α-helix	trans	-76.3	-41.2	-179.9	-65	-176.3	-178.6	168.2	5.1	112.2	H1027 Q1028 A1033 L1034	H1027-R1030 PolarHBondContact O-N 3.33Å; Q1028-R1030 VanDerWaalsContact C-N 3.32Å; Q1028-R1030 PolarHBondContact O-N 3.11Å; R1030-A1033 PolarHBondContact O-N 3.45Å; R1030-L1034 PolarHBondContact O-N 3.37Å
1031	A	32.4	Very low	38.4	Very low	40 Å²	40	97 Å²	97	33%	0.331	52%	0.518	S	S	.	.	H	α-helix	trans	-60.8	-47.2	173.1	0	0	0	0	0	111.2	H1027 A1033 L1034 A1035	H1027-A1031 PolarHBondContact O-N 3.37Å; H1027-A1031 VanDerWaalsContact O-N 3.12Å; A1031-A1033 VanDerWaalsContact C-N 3.27Å; A1031-A1033 PolarHBondContact O-N 3.47Å; A1031-L1034 PolarHBondContact O-N 3.22Å; A1031-A1035 WeakPolarHBondContact O-CB 3.48Å; A1031-A1035 PolarHBondContact O-N 3.15Å
1032	A	37.6	Very low	39.1	Very low	34 Å²	34	99.4 Å²	99.4	28%	0.281	52%	0.517	S	S	.	.	H	α-helix	trans	-64.7	-27.7	176.2	0	0	0	0	0	113.6	Q1028 R1036	Q1028-A1032 WeakPolarHBondContact O-CB 3.48Å; Q1028-A1032 PolarHBondContact O-N 2.8Å; A1032-R1036 WeakPolarHBondContact O-CG 3.34Å; A1032-R1036 PolarHBondContact O-N 2.82Å; A1032-R1036 PolarHBondContact O-NE 2.85Å
1033	A	42.2	Very low	39.6	Very low	56 Å²	56	99 Å²	99	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-74.8	-41.1	172.7	0	0	0	0	0	112.3	A1029 R1030 A1031 R1036 K1037	A1029-A1033 WeakPolarHBondContact O-CB 3.29Å; A1029-A1033 PolarHBondContact O-N 3.25Å; R1030-A1033 PolarHBondContact O-N 3.45Å; A1031-A1033 VanDerWaalsContact C-N 3.27Å; A1031-A1033 PolarHBondContact O-N 3.47Å; A1033-R1036 PolarHBondContact O-N 2.75Å; A1033-K1037 WeakPolarHBondContact O-CB 3.46Å; A1033-K1037 PolarHBondContact O-N 3.03Å
1034	L	36.1	Very low	39.8	Very low	45 Å²	45	98.8 Å²	98.8	24%	0.236	52%	0.518	C	S	.	.	H	α-helix	trans	-66.6	-41.6	174.8	-162	86.2	0	0	0	111.2	V692 R1030 A1031 R1036 K1037 I1038	V692-L1034 HydrophobicContact CG2-CD2 3.86Å; R1030-L1034 PolarHBondContact O-N 3.37Å; A1031-L1034 PolarHBondContact O-N 3.22Å; L1034-R1036 VanDerWaalsContact C-N 3.33Å; L1034-R1036 PolarHBondContact O-N 2.87Å; L1034-K1037 CarbonylContact O-C 3.37Å; L1034-K1037 PolarHBondContact O-N 3.08Å; L1034-I1038 HydrophobicContact CD2-CD1 3.76Å; L1034-I1038 HydrophobicContact CG-CD1 3.91Å; L1034-I1038 HydrophobicContact CG-CG1 4.4Å; L1034-I1038 WeakPolarHBondContact O-CG1 3.48Å; L1034-I1038 PolarHBondContact O-N 3.08Å
1035	A	37.9	Very low	40	Very low	28 Å²	28	103 Å²	103	23%	0.231	54%	0.544	C	S	.	.	H	α-helix	trans	-56.6	-46.5	174.5	0	0	0	0	0	111.4	A1031 K1037 I1038 L1039	A1031-A1035 WeakPolarHBondContact O-CB 3.48Å; A1031-A1035 PolarHBondContact O-N 3.15Å; A1035-K1037 PolarHBondContact O-N 2.8Å; A1035-I1038 PolarHBondContact O-N 2.85Å; A1035-L1039 WeakPolarHBondContact O-CB 3.46Å; A1035-L1039 WeakPolarHBondContact O-CD1 3.46Å; A1035-L1039 VanDerWaalsContact O-CG 3.26Å; A1035-L1039 WeakPolarHBondContact O-CG 3.37Å; A1035-L1039 PolarHBondContact O-N 3.16Å
1036	R	48.3	Very low	39.9	Very low	181 Å²	181	98 Å²	98	68%	0.683	54%	0.539	S	S	*	.	H	α-helix	trans	-61	-41.5	172.5	-75.9	-178.2	-122.8	-160	-2.4	112.6	A1032 A1033 L1034 I1038 L1039 S1040	A1032-R1036 WeakPolarHBondContact O-CG 3.34Å; A1032-R1036 PolarHBondContact O-N 2.82Å; A1032-R1036 PolarHBondContact O-NE 2.85Å; A1033-R1036 PolarHBondContact O-N 2.75Å; L1034-R1036 VanDerWaalsContact C-N 3.33Å; L1034-R1036 PolarHBondContact O-N 2.87Å; R1036-I1038 PolarHBondContact O-N 2.88Å; R1036-L1039 CarbonylContact O-C 3.46Å; R1036-L1039 PolarHBondContact O-N 3.14Å; R1036-L1039 VanDerWaalsContact O-N 3.17Å; R1036-S1040 WeakPolarHBondContact O-CB 3.47Å; R1036-S1040 PolarHBondContact O-N 3.01Å; R1036-S1040 PolarHBondContact O-OG 2.91Å
1037	K	49.2	Very low	39.8	Very low	147 Å²	147	96.3 Å²	96.3	64%	0.639	54%	0.544	S	S	*	.	H	α-helix	trans	-66.8	-34.7	179.2	-164.5	178.4	-178	-174.7	0	113.2	A1033 L1034 A1035 L1039 S1041	A1033-K1037 WeakPolarHBondContact O-CB 3.46Å; A1033-K1037 PolarHBondContact O-N 3.03Å; L1034-K1037 CarbonylContact O-C 3.37Å; L1034-K1037 PolarHBondContact O-N 3.08Å; A1035-K1037 PolarHBondContact O-N 2.8Å; K1037-L1039 VanDerWaalsContact C-N 3.33Å; K1037-S1041 WeakPolarHBondContact O-CB 3.34Å; K1037-S1041 PolarHBondContact O-N 3.09Å
1038	I	44.9	Very low	39.5	Very low	44 Å²	44	100.6 Å²	100.6	23%	0.226	57%	0.565	C	S	.	*	H	α-helix	trans	-74.1	-25.5	173.4	-68.3	166.7	0	0	0	111.5	V692 L1034 A1035 R1036	V692-I1038 HydrophobicContact CG2-CD1 4.29Å; L1034-I1038 HydrophobicContact CD2-CD1 3.76Å; L1034-I1038 HydrophobicContact CG-CD1 3.91Å; L1034-I1038 HydrophobicContact CG-CG1 4.4Å; L1034-I1038 WeakPolarHBondContact O-CG1 3.48Å; L1034-I1038 PolarHBondContact O-N 3.08Å; A1035-I1038 PolarHBondContact O-N 2.85Å; R1036-I1038 PolarHBondContact O-N 2.88Å
1039	L	46.5	Very low	39.6	Very low	91 Å²	91	102.7 Å²	102.7	48%	0.476	59%	0.589	S	S	.	*	H	α-helix	trans	-80.9	-26	173.2	-72.7	166.5	0	0	0	112.8	A1035 R1036 K1037	A1035-L1039 WeakPolarHBondContact O-CB 3.46Å; A1035-L1039 WeakPolarHBondContact O-CD1 3.46Å; A1035-L1039 VanDerWaalsContact O-CG 3.26Å; A1035-L1039 WeakPolarHBondContact O-CG 3.37Å; A1035-L1039 PolarHBondContact O-N 3.16Å; R1036-L1039 CarbonylContact O-C 3.46Å; R1036-L1039 PolarHBondContact O-N 3.14Å; R1036-L1039 VanDerWaalsContact O-N 3.17Å; K1037-L1039 VanDerWaalsContact C-N 3.33Å
1040	S	45.2	Very low	39.4	Very low	77 Å²	77	107.8 Å²	107.8	54%	0.538	60%	0.601	S	S	.	*	S	Bend	trans	-103.7	10.8	-176.8	75.8	0	0	0	0	114.8	R1036	R1036-S1040 WeakPolarHBondContact O-CB 3.47Å; R1036-S1040 PolarHBondContact O-N 3.01Å; R1036-S1040 PolarHBondContact O-OG 2.91Å
1041	S	44.9	Very low	39.3	Very low	83 Å²	83	107.3 Å²	107.3	58%	0.58	61%	0.611	S	S	*	*	S	Bend	trans	-101.6	8.3	-178.9	67.3	0	0	0	0	114.1	K1037	K1037-S1041 WeakPolarHBondContact O-CB 3.34Å; K1037-S1041 PolarHBondContact O-N 3.09Å
1042	D	43.7	Very low	39.4	Very low	112 Å²	112	112.9 Å²	112.9	60%	0.599	63%	0.63	S	S	*	*	S	Bend	trans	-108.3	1	-179.8	-71.2	-39.1	0	0	0	112.7	K660	K660-D1042 IonicContact NZ-OD2 2.65Å; K660-D1042 PolarHBondContact NZ-OD2 3.33Å
1043	D	40.4	Very low	39.2	Very low	135 Å²	135	116.9 Å²	116.9	72%	0.722	66%	0.656	S	S	*	*	S	Bend	trans	-102.9	-5.9	-170.4	-68.7	-47.6	0	0	0	115.7
1044	D	35.4	Very low	38.9	Very low	160 Å²	160	120 Å²	120	86%	0.856	67%	0.672	S	S	*	*			trans	-125.3	85	-175.9	-98	-44.4	0	0	0	112.3
1045	D	38.5	Very low	38.7	Very low	175 Å²	175	123.7 Å²	123.7	94%	0.936	70%	0.698	S	S	*	*			trans	-165.4	120.9	150.9	-121.9	-23	0	0	0	110
1046	G	32.8	Very low	38.7	Very low	70 Å²	70	130.4 Å²	130.4	72%	0.722	73%	0.727	S	S	*	*			trans	-99.2	166	-154.8	0	0	0	0	0	118.2
1047	S	35.3	Very low	38.1	Very low	121 Å²	121	127.9 Å²	127.9	85%	0.846	73%	0.732	S	S	*	*			trans	-170.1	114.5	133.1	17.2	0	0	0	0	113.6
1048	E	32	Very low	37.3	Very low	189 Å²	189	124.5 Å²	124.5	88%	0.883	74%	0.739	S	S	*	*			trans	22.3	109	145.2	-59.3	175.1	169	0	0	120.4
1049	S	35.1	Very low	36.7	Very low	129 Å²	129	134.2 Å²	134.2	90%	0.902	77%	0.773	S	S	*	*				-162	152.7	117.8	2.9	0	0	0	0	112.6
1050	E	31.8	Very low	36	Very low	177 Å²	177	137.9 Å²	137.9	83%	0.827	79%	0.788	S	S	*	*			trans	-66.8	140.9	-171.2	-54.2	166.7	125.5	0	0	114.4
1051	D	35	Very low	35.5	Very low	159 Å²	159	142.3 Å²	142.3	85%	0.85	80%	0.8	S	S	*	*				-155.9	167.8	111.4	-141.3	-27.2	0	0	0	111.7
1052	Q	34.9	Very low	34.9	Very low	157 Å²	157	146 Å²	146	73%	0.734	81%	0.808	S	S	*	*			trans	-115.5	139.3	-153.2	-52.8	177.6	9	0	0	115.5
1053	S	34	Very low	34.4	Very low	119 Å²	119	148.8 Å²	148.8	83%	0.832	82%	0.817	S	S	*	*				164.6	154.2	126.4	49.3	0	0	0	0	112.7
1054	P	35.5	Very low	34	Very low	122 Å²	122	147.2 Å²	147.2	79%	0.792	82%	0.817	S	S	*	*			trans	-110.3	160.8	-148.4	40	-34.8	0	0	0	117.1
1055	P	32.3	Very low	33.9	Very low	121 Å²	121	147.4 Å²	147.4	79%	0.786	82%	0.815	S	S	*	*			trans	-92.6	152.9	176.3	36.7	-34.8	0	0	0	113.9
1056	M	36.6	Very low	33.8	Very low	170 Å²	170	145.7 Å²	145.7	84%	0.837	81%	0.805	S	S	*	*			trans	-140.7	118.6	165.2	-95.6	-66.5	-179.9	0	0	113.2
1057	T	35.5	Very low	34	Very low	127 Å²	127	148.2 Å²	148.2	78%	0.779	81%	0.812	S	S	*	*			trans	27.8	123	139.5	57.4	0	0	0	0	120.3
1058	G	32.1	Very low	33.8	Very low	77 Å²	77	147.9 Å²	147.9	79%	0.794	81%	0.809	S	S	*	*			trans	-95.7	166.9	171.4	0	0	0	0	0	114.6
1059	R	33.3	Very low	34.3	Very low	247 Å²	247	145.2 Å²	145.2	93%	0.932	81%	0.808	S	S	*	*			trans	-152.3	163.2	161.6	-121.3	175.4	-177	176.2	1	111.7
1060	Q	31.9	Very low	34.2	Very low	169 Å²	169	143.6 Å²	143.6	79%	0.79	80%	0.797	S	S	*	*			trans	-77.8	144	179.8	-54.7	145.2	-39	0	0	110.6
1061	Q	34.2	Very low	34.5	Very low	170 Å²	170	141.9 Å²	141.9	79%	0.794	79%	0.794	S	S	*	*				168.8	130.4	113.2	-91.2	169.3	5.1	0	0	113.8
1062	Q	31.8	Very low	34.7	Very low	161 Å²	161	142.9 Å²	142.9	75%	0.752	80%	0.798	S	S	*	*			trans	32.5	135.7	135.1	-75	176.8	-20.2	0	0	123.3
1063	Q	33.4	Very low	34.7	Very low	169 Å²	169	140.5 Å²	140.5	79%	0.79	80%	0.799	S	S	*	*			trans	101.2	141.9	137.7	-78.2	169	17.5	0	0	122.7
1064	S	32.6	Very low	34.8	Very low	103 Å²	103	142.5 Å²	142.5	72%	0.72	80%	0.8	S	S	*	*			trans	73.9	107	151.6	49.3	0	0	0	0	123.3
1065	M	34.2	Very low	34.9	Very low	164 Å²	164	141.1 Å²	141.1	81%	0.808	79%	0.793	S	S	*	*				71.8	135.3	121.7	-56.6	-51.8	-154.8	0	0	122.9
1066	D	35.1	Very low	35.1	Very low	139 Å²	139	141.1 Å²	141.1	74%	0.743	80%	0.797	S	S	*	*			trans	50.1	113	141.3	-55.3	-16.4	0	0	0	121.6
1067	S	37	Very low	34.9	Very low	122 Å²	122	138 Å²	138	85%	0.853	79%	0.792	S	S	*	*				-179.8	157.4	92.8	39.9	0	0	0	0	113.1
1068	S	30.7	Very low	35.8	Very low	114 Å²	114	138 Å²	138	80%	0.797	79%	0.794	S	S	*	*			trans	-114	162.2	167.7	-47.2	0	0	0	0	109
1069	P	42.4	Very low	36.1	Very low	133 Å²	133	144 Å²	144	86%	0.864	79%	0.792	S	S	*	*				-147.6	-162.9	88.4	40.6	-22.6	0	0	0	114
1070	S	34	Very low	36.4	Very low	96 Å²	96	141.4 Å²	141.4	67%	0.671	78%	0.782	S	S	*	*			trans	-107.4	-167.9	-170.4	58	0	0	0	0	114.2
1071	D	38.2	Very low	36.8	Very low	140 Å²	140	140 Å²	140	75%	0.749	78%	0.775	S	S	*	*			trans	91.8	111.5	160.2	-54.4	-1.5	0	0	0	117.6
1072	L	39.3	Very low	37.1	Very low	180 Å²	180	137.9 Å²	137.9	94%	0.942	77%	0.77	S	S	*	*				-178.5	145.7	105.2	-93.9	170.1	0	0	0	111.1
1073	S	33.9	Very low	37.4	Very low	108 Å²	108	137.7 Å²	137.7	76%	0.755	77%	0.769	S	S	*	*			trans	-125.3	136.7	-179.9	59.7	0	0	0	0	111.7
1074	D	37.3	Very low	37.9	Very low	160 Å²	160	135.8 Å²	135.8	86%	0.856	76%	0.76	S	S	*	*			trans	-159.7	-169.3	142.5	-138.1	-46.6	0	0	0	111.9
1075	S	36.8	Very low	38.2	Very low	93 Å²	93	141.2 Å²	141.2	65%	0.65	76%	0.764	S	S	*	*			trans	-134.2	-174.3	-139.6	64.3	0	0	0	0	116.4
1076	S	36.9	Very low	38.6	Very low	122 Å²	122	138 Å²	138	85%	0.853	76%	0.758	S	S	*	*			trans	93	160.6	160.3	84.6	0	0	0	0	119.4
1077	S	32.1	Very low	39	Very low	105 Å²	105	140.3 Å²	140.3	73%	0.734	76%	0.761	S	S	*	*			trans	-154.7	150.1	-164.7	60.8	0	0	0	0	114.8
1078	P	55.1	Low	39.8	Very low	126 Å²	126	140.8 Å²	140.8	82%	0.818	76%	0.762	S	S	*	*			trans	-117.1	130.1	160.6	35.7	-24.6	0	0	0	111.2
1079	R	37.6	Very low	40.8	Very low	203 Å²	203	145.4 Å²	145.4	77%	0.766	76%	0.762	S	S	*	*			cis	85.7	102.2	48	-80.6	-165	167.8	-170.4	1	116.7
1080	R	39.2	Very low	41.2	Very low	192 Å²	192	149.5 Å²	149.5	73%	0.725	76%	0.76	S	S	*	*			trans	73.9	158.7	145.1	-51.7	176	173	-168	-2.1	116.5
1081	H	41	Very low	42.3	Very low	139 Å²	139	155.3 Å²	155.3	64%	0.644	79%	0.791	S	S	*	*			cis	-154.6	167.9	26.6	-130.9	-74.6	0	0	0	113.7
1082	N	40	Very low	42.5	Very low	126 Å²	126	156.1 Å²	156.1	67%	0.674	79%	0.793	S	S	*	*			trans	79.4	111	165.7	-57.9	-2	0	0	0	116.7
1083	E	39.6	Very low	42.6	Very low	157 Å²	157	154.8 Å²	154.8	73%	0.734	79%	0.785	S	S	*	*				85.9	132	66.3	-77.9	-168	159.1	0	0	112.8
1084	H	42.5	Very low	43.1	Very low	129 Å²	129	157.4 Å²	157.4	60%	0.597	79%	0.787	S	S	*	*			cis	-157.3	147.3	34.2	-131.4	35	0	0	0	113.2
1085	R	39.1	Very low	43.5	Very low	217 Å²	217	157.3 Å²	157.3	82%	0.819	78%	0.783	S	S	*	*			trans	65.3	143.4	157.6	-60.3	178.1	-176.4	-167.5	0.1	120
1086	S	43.3	Very low	43.9	Very low	96 Å²	96	161.3 Å²	161.3	67%	0.671	79%	0.791	S	S	*	*			cis	-168.1	128.7	-16	50.6	0	0	0	0	115.3
1087	K	43	Very low	44.3	Very low	188 Å²	188	163.9 Å²	163.9	82%	0.817	79%	0.787	S	S	*	*			trans	62.2	126.1	148.8	-62	172.8	-179.1	170.7	0	119.8
1088	P	54.3	Low	45.2	Very low	133 Å²	133	168.1 Å²	168.1	86%	0.864	79%	0.791	S	S	*	*				-104.4	-167.6	103	30.8	-35.4	0	0	0	112.4
1089	R	51.6	Low	44.4	Very low	211 Å²	211	171.4 Å²	171.4	80%	0.796	79%	0.789	S	S	*	*			trans	-150.6	134.1	-163.1	-157.4	-172.1	-171.2	-178	2.8	114.2
1090	R	51.2	Low	45	Very low	219 Å²	219	168.8 Å²	168.8	83%	0.826	79%	0.791	S	S	*	*			trans	72.3	143.8	179.1	-55.5	172	172.6	164.1	-5.8	114.1
1091	V	55.4	Low	45.5	Very low	218 Å²	218	166.6 Å²	166.6	100%	1.321	80%	0.797	S	S	*	*			cis	-83.2	0	-7.2	174.8	0	0	0	0	110.1

Retrieved 1,091 of 1,091 residues in 1924.7 ms (Link to these results)

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