A0A077Z105_TRITR Loading...

Putative vacuolar ATP synthase subunit S1

AlphaFold DB , UniProt , Accession A0A077Z105, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 81 aa.

						>A0A077Z105_TRITR|A0A077Z105
VLPSFIYACVCFIQPFRSGYGFTDQVDDCSEFFSAAAWMAIFSVACVFVITVFGVAMISSLTTMDRFDDPKGKPLVINVKE
					

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(Predicted Aligned Error values between residue pairs)

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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	V	46.6	Very low	56.1	Low	161 Å²	161	96.6 Å²	96.6	98%	0.976	53%	0.534	S	S	*	.				0	-49.5	0	-167.5	0	0	0	0	112	P3 F5	V1-P3 VanDerWaalsContact C-CD 3.47Å; V1-F5 PolarHBondContact O-N 2.93Å
2	L	52.1	Low	56	Low	141 Å²	141	103.8 Å²	103.8	74%	0.738	56%	0.556	S	S	*	*	H	α-helix	trans	-57.2	-38.8	173.3	-104.5	78.4	0	0	0	115.9	F5 I6	L2-F5 PolarHBondContact O-N 2.96Å; L2-I6 PolarHBondContact O-N 3.29Å
3	P	56.3	Low	56.3	Low	77 Å²	77	105.1 Å²	105.1	50%	0.5	56%	0.561	S	S	.	*	H	α-helix	trans	-65.6	-46.6	-177.6	-20.3	31.2	0	0	0	112.1	V1 F5 I6 Y7	V1-P3 VanDerWaalsContact C-CD 3.47Å; P3-F5 VanDerWaalsContact C-N 3.29Å; P3-F5 PolarHBondContact O-N 2.94Å; P3-I6 PolarHBondContact O-N 2.99Å; P3-I6 VanDerWaalsContact O-N 3.14Å; P3-Y7 HydrophobicContact CB-CE2 4.42Å; P3-Y7 WeakPolarHBondContact O-CD2 3.34Å; P3-Y7 PolarHBondContact O-N 2.96Å
4	S	60.4	Low	56.1	Low	69 Å²	69	104.1 Å²	104.1	48%	0.483	55%	0.551	S	S	.	*	H	α-helix	trans	-62.5	-35.8	-179.5	-43.2	0	0	0	0	112.4	Y7 A8	S4-Y7 PolarHBondContact O-N 3.45Å; S4-A8 WeakPolarHBondContact O-CB 2.98Å; S4-A8 PolarHBondContact O-N 2.93Å
5	F	55.1	Low	55.8	Low	143 Å²	143	103.7 Å²	103.7	63%	0.627	56%	0.557	S	S	*	*	H	α-helix	trans	-64	-40.7	175.5	-175.5	-101.7	0	0	0	112.1	V1 L2 P3 C9	V1-F5 PolarHBondContact O-N 2.93Å; L2-F5 PolarHBondContact O-N 2.96Å; P3-F5 VanDerWaalsContact C-N 3.29Å; P3-F5 PolarHBondContact O-N 2.94Å; F5-C9 WeakPolarHBondContact O-CB 3.33Å; F5-C9 PolarHBondContact O-N 2.96Å
6	I	60.2	Low	55.4	Low	102 Å²	102	108.1 Å²	108.1	52%	0.523	57%	0.57	S	S	.	*	H	α-helix	trans	-68.3	-43.8	176.5	-64.1	171	0	0	0	110.4	L2 P3 C9 V10	L2-I6 PolarHBondContact O-N 3.29Å; P3-I6 PolarHBondContact O-N 2.99Å; P3-I6 VanDerWaalsContact O-N 3.14Å; I6-C9 PolarHBondContact O-N 3Å; I6-V10 HydrophobicContact CG2-CG2 4.15Å; I6-V10 VanDerWaalsContact O-CB 3.27Å; I6-V10 WeakPolarHBondContact O-CB 3.17Å; I6-V10 WeakPolarHBondContact O-CG2 3.29Å; I6-V10 PolarHBondContact O-N 3.38Å
7	Y	60.8	Low	55.2	Low	169 Å²	169	114 Å²	114	66%	0.663	58%	0.583	S	S	*	*	H	α-helix	trans	-64.4	-43.8	179.6	-75.6	-70.5	0	0	0	113.1	P3 S4 V10 C11	P3-Y7 HydrophobicContact CB-CE2 4.42Å; P3-Y7 WeakPolarHBondContact O-CD2 3.34Å; P3-Y7 PolarHBondContact O-N 2.96Å; S4-Y7 PolarHBondContact O-N 3.45Å; Y7-V10 PolarHBondContact O-N 2.88Å; Y7-C11 PolarHBondContact O-N 3.28Å
8	A	57.7	Low	55	Low	35 Å²	35	114.4 Å²	114.4	29%	0.289	60%	0.597	S	S	.	*	H	α-helix	trans	-65.9	-40.8	175.8	0	0	0	0	0	112.4	S4 V10 C11 F12	S4-A8 WeakPolarHBondContact O-CB 2.98Å; S4-A8 PolarHBondContact O-N 2.93Å; A8-V10 VanDerWaalsContact C-N 3.35Å; A8-C11 PolarHBondContact O-N 3.09Å; A8-F12 PolarHBondContact O-N 3.06Å
9	C	54.8	Low	55.2	Low	57 Å²	57	111.2 Å²	111.2	39%	0.385	60%	0.595	S	S	.	*	H	α-helix	trans	-65.5	-39.5	175.8	-167.3	0	0	0	0	111.4	F5 I6 F12 I13	F5-C9 WeakPolarHBondContact O-CB 3.33Å; F5-C9 PolarHBondContact O-N 2.96Å; I6-C9 PolarHBondContact O-N 3Å; C9-F12 PolarHBondContact O-N 3.29Å; C9-I13 WeakPolarHBondContact O-CB 3.39Å; C9-I13 VanDerWaalsContact O-CG1 3.31Å; C9-I13 WeakPolarHBondContact O-CG1 3.39Å; C9-I13 PolarHBondContact O-N 3.02Å
10	V	57.8	Low	54.8	Low	66 Å²	66	116.9 Å²	116.9	40%	0.4	61%	0.609	S	S	.	*	H	α-helix	trans	-62.2	-42	172.6	165.7	0	0	0	0	110.2	I6 Y7 A8 F12 I13 Q14	I6-V10 HydrophobicContact CG2-CG2 4.15Å; I6-V10 VanDerWaalsContact O-CB 3.27Å; I6-V10 WeakPolarHBondContact O-CB 3.17Å; I6-V10 WeakPolarHBondContact O-CG2 3.29Å; I6-V10 PolarHBondContact O-N 3.38Å; Y7-V10 PolarHBondContact O-N 2.88Å; A8-V10 VanDerWaalsContact C-N 3.35Å; V10-F12 PolarHBondContact O-N 3.24Å; V10-I13 PolarHBondContact O-N 3.45Å; V10-Q14 HydrophobicContact CG1-CG 4.41Å; V10-Q14 WeakPolarHBondContact O-CG 3.49Å; V10-Q14 PolarHBondContact O-N 3.45Å
11	C	55.5	Low	54.8	Low	43 Å²	43	114.1 Å²	114.1	29%	0.291	61%	0.609	S	S	.	*	H	α-helix	trans	-63.3	-39.7	176.2	-177.5	0	0	0	0	112.9	Y7 A8 I13 Q14 C29	Y7-C11 PolarHBondContact O-N 3.28Å; A8-C11 PolarHBondContact O-N 3.09Å; C11-I13 VanDerWaalsContact C-N 3.31Å; C11-I13 PolarHBondContact O-N 3.32Å; C11-Q14 PolarHBondContact O-N 2.96Å; C11-C29 HydrophobicContact CB-CB 4.46Å; C11-C29 WeakPolarHBondContact CB-SG 3.35Å; C11-C29 WeakPolarHBondContact SG-CB 3.42Å; C11-C29 CovalentContact SG-SG 2.05Å; C11-C29 PolarHBondContact SG-SG 2.9Å
12	F	54.7	Low	55.2	Low	183 Å²	183	115.5 Å²	115.5	80%	0.803	60%	0.603	S	S	*	*	H	α-helix	trans	-67.8	-30	174	-169.8	-96.8	0	0	0	113	A8 C9 V10	A8-F12 PolarHBondContact O-N 3.06Å; C9-F12 PolarHBondContact O-N 3.29Å; V10-F12 PolarHBondContact O-N 3.24Å
13	I	59.3	Low	55.5	Low	120 Å²	120	115.1 Å²	115.1	62%	0.615	61%	0.607	S	S	*	*	H	α-helix	trans	-84.1	-3.8	-180	-68	179.4	0	0	0	113.3	C9 V10 C11 P15	C9-I13 WeakPolarHBondContact O-CB 3.39Å; C9-I13 VanDerWaalsContact O-CG1 3.31Å; C9-I13 WeakPolarHBondContact O-CG1 3.39Å; C9-I13 PolarHBondContact O-N 3.02Å; V10-I13 PolarHBondContact O-N 3.45Å; C11-I13 VanDerWaalsContact C-N 3.31Å; C11-I13 PolarHBondContact O-N 3.32Å; I13-P15 WeakPolarHBondContact O-CD 3.49Å
14	Q	54.2	Low	55.3	Low	91 Å²	91	117.5 Å²	117.5	43%	0.425	62%	0.615	S	S	.	*			trans	-99.6	85	171.5	-0.1	176.8	-32.3	0	0	111.7	V10 C11 F16	V10-Q14 HydrophobicContact CG1-CG 4.41Å; V10-Q14 WeakPolarHBondContact O-CG 3.49Å; V10-Q14 PolarHBondContact O-N 3.45Å; C11-Q14 PolarHBondContact O-N 2.96Å; Q14-F16 VanDerWaalsContact C-N 3.28Å
15	P	52.1	Low	55	Low	98 Å²	98	120.2 Å²	120.2	64%	0.636	62%	0.62	S	S	*	*	S	Bend	trans	-75.5	-24	146.5	28	-23.7	0	0	0	110.5	I13	I13-P15 WeakPolarHBondContact O-CD 3.49Å
16	F	49.2	Very low	55	Low	174 Å²	174	118.5 Å²	118.5	76%	0.763	62%	0.621	S	S	*	*			trans	-155.2	96.9	179.1	-64	-80.5	0	0	0	111.6	Q14 S18	Q14-F16 VanDerWaalsContact C-N 3.28Å; F16-S18 PolarHBondContact O-N 3.06Å
17	R	52	Low	54.7	Low	209 Å²	209	120.7 Å²	120.7	79%	0.789	63%	0.634	S	S	*	*			trans	-80.9	117.4	161.5	-175.4	132.2	175.7	-102.1	-0.5	108.2	G19	R17-G19 PolarHBondContact O-N 3.13Å
18	S	51.1	Low	54.5	Low	121 Å²	121	118.1 Å²	118.1	85%	0.846	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.6	119.9	178.4	-167.9	0	0	0	0	112.5	F16	F16-S18 PolarHBondContact O-N 3.06Å
19	G	58.1	Low	54.6	Low	54 Å²	54	118.7 Å²	118.7	56%	0.557	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	132.6	-32.7	149.4	0	0	0	0	0	119.1	R17	R17-G19 PolarHBondContact O-N 3.13Å
20	Y	48.1	Very low	54.8	Low	224 Å²	224	120.5 Å²	120.5	88%	0.878	65%	0.646	S	S	*	*	S	Bend	trans	-144.1	140.6	-173	-59.1	-78.4	0	0	0	110.6
21	G	53.8	Low	54.8	Low	59 Å²	59	121.4 Å²	121.4	61%	0.608	65%	0.646	S	S	*	*			trans	-58.1	-178.9	-162.5	0	0	0	0	0	117.3	T23	G21-T23 PolarHBondContact O-N 3.06Å
22	F	56.8	Low	55	Low	190 Å²	190	127.7 Å²	127.7	83%	0.833	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	20.2	-173.2	-59.8	-73.7	0	0	0	116.5	V26	F22-V26 WeakPolarHBondContact O-CG2 3.35Å
23	T	56.5	Low	55.6	Low	134 Å²	134	127 Å²	127	82%	0.822	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.5	-5.5	-170.1	64.5	0	0	0	0	114.9	G21	G21-T23 PolarHBondContact O-N 3.06Å
24	D	52.3	Low	56.3	Low	127 Å²	127	122.8 Å²	122.8	68%	0.679	65%	0.647	S	S	*	*	S	Bend	trans	-94.3	107.1	177.3	-155.8	49.6	0	0	0	109.8	V26	D24-V26 PolarHBondContact O-N 3.31Å
25	Q	54.2	Low	57.6	Low	126 Å²	126	122.1 Å²	122.1	59%	0.589	66%	0.657	S	S	*	*			trans	53.1	56	165.7	-61.6	176.2	-87.5	0	0	116	D27 D28	Q25-D27 VanDerWaalsContact C-N 3.28Å; Q25-D28 PolarHBondContact NE2-OD2 3.41Å
26	V	55.9	Low	58.8	Low	107 Å²	107	120 Å²	120	65%	0.648	65%	0.648	S	S	*	*	S	Bend	trans	-72.7	-23.5	170.3	-140.7	0	0	0	0	112.1	F22 D24	F22-V26 WeakPolarHBondContact O-CG2 3.35Å; D24-V26 PolarHBondContact O-N 3.31Å
27	D	54.6	Low	60.3	Low	148 Å²	148	113.4 Å²	113.4	79%	0.791	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-87.1	-16	-172.5	-76	-41.7	0	0	0	115.1	Q25 C29	Q25-D27 VanDerWaalsContact C-N 3.28Å; D27-C29 PolarHBondContact O-N 2.89Å
28	D	54.9	Low	61.9	Low	114 Å²	114	109.1 Å²	109.1	61%	0.61	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-75.9	-5.6	-179.8	-74.6	-34.6	0	0	0	112.9	Q25 S30	Q25-D28 PolarHBondContact NE2-OD2 3.41Å; D28-S30 VanDerWaalsContact C-N 3.35Å; D28-S30 PolarHBondContact O-N 3.25Å
29	C	60.9	Low	63.5	Low	47 Å²	47	109.8 Å²	109.8	32%	0.318	60%	0.6	S	S	.	*	G	3₁₀ helix	trans	-91.2	19.5	177.6	-77.8	0	0	0	0	114.2	C11 D27 E31	C11-C29 HydrophobicContact CB-CB 4.46Å; C11-C29 WeakPolarHBondContact CB-SG 3.35Å; C11-C29 WeakPolarHBondContact SG-CB 3.42Å; C11-C29 CovalentContact SG-SG 2.05Å; C11-C29 PolarHBondContact SG-SG 2.9Å; D27-C29 PolarHBondContact O-N 2.89Å; C29-E31 PolarHBondContact O-N 3.3Å
30	S	58.5	Low	64.9	Low	95 Å²	95	109.7 Å²	109.7	66%	0.664	60%	0.595	S	S	*	*			trans	-73.5	40.3	170	-163.8	0	0	0	0	112.8	D28 F32	D28-S30 VanDerWaalsContact C-N 3.35Å; D28-S30 PolarHBondContact O-N 3.25Å; S30-F32 VanDerWaalsContact C-N 3.33Å
31	E	58.4	Low	66.9	Low	85 Å²	85	103.9 Å²	103.9	40%	0.397	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-94.1	16.2	176	-76.8	-167.1	159.9	0	0	112.4	C29 F33 S34	C29-E31 PolarHBondContact O-N 3.3Å; E31-F33 PolarHBondContact O-N 3.5Å; E31-S34 WeakPolarHBondContact O-CB 3.44Å; E31-S34 PolarHBondContact O-N 3.01Å
32	F	59.5	Low	68.7	Low	175 Å²	175	107.1 Å²	107.1	77%	0.768	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-52.6	-28.5	168.2	-74.4	-78.6	0	0	0	112.1	S30	S30-F32 VanDerWaalsContact C-N 3.33Å
33	F	66.5	Low	70.5	Confident	168 Å²	168	101.2 Å²	101.2	74%	0.737	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-97.2	14.1	175.4	-66	-81.2	0	0	0	114.3	E31	E31-F33 PolarHBondContact O-N 3.5Å
34	S	75.2	Confident	72.3	Confident	32 Å²	32	99.7 Å²	99.7	22%	0.224	55%	0.548	C	S	.	.			trans	-65.3	140.1	175.5	-179	0	0	0	0	110.6	E31 A36 A37 W38	E31-S34 WeakPolarHBondContact O-CB 3.44Å; E31-S34 PolarHBondContact O-N 3.01Å; S34-A36 PolarHBondContact O-N 3.39Å; S34-A36 VanDerWaalsContact O-N 3.08Å; S34-A37 WeakPolarHBondContact O-CB 3.35Å; S34-A37 PolarHBondContact O-N 2.9Å; S34-W38 PolarHBondContact O-N 3.46Å
35	A	79.9	Confident	74.3	Confident	78 Å²	78	95.9 Å²	95.9	65%	0.645	53%	0.534	S	S	*	.	H	α-helix	trans	-53.2	-33.5	-179.9	0	0	0	0	0	112.3	W38 M39	A35-W38 PolarHBondContact O-N 2.89Å; A35-M39 WeakPolarHBondContact O-CG 3.38Å; A35-M39 PolarHBondContact O-N 3.34Å; A35-M39 VanDerWaalsContact O-N 3.09Å
36	A	77.9	Confident	76.3	Confident	54 Å²	54	93.4 Å²	93.4	45%	0.446	53%	0.53	S	S	.	.	H	α-helix	trans	-64.6	-41.7	177.9	0	0	0	0	0	113	S34 W38 M39 A40	S34-A36 PolarHBondContact O-N 3.39Å; S34-A36 VanDerWaalsContact O-N 3.08Å; A36-W38 VanDerWaalsContact C-N 3.33Å; A36-W38 PolarHBondContact O-N 3.47Å; A36-M39 PolarHBondContact O-N 2.77Å; A36-A40 PolarHBondContact O-N 3.32Å
37	A	81.6	Confident	78.2	Confident	34 Å²	34	92.7 Å²	92.7	28%	0.281	53%	0.526	S	S	.	.	H	α-helix	trans	-63.2	-41.3	178.9	0	0	0	0	0	111.1	S34 A40 I41	S34-A37 WeakPolarHBondContact O-CB 3.35Å; S34-A37 PolarHBondContact O-N 2.9Å; A37-A40 PolarHBondContact O-N 3.39Å; A37-I41 VanDerWaalsContact O-CG1 3.29Å; A37-I41 WeakPolarHBondContact O-CG1 3.21Å; A37-I41 PolarHBondContact O-N 3.3Å
38	W	85	Confident	80.2	Confident	120 Å²	120	92.3 Å²	92.3	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-43.5	175.5	-80.4	89	0	0	0	112.5	S34 A35 A36 A40 I41 F42	S34-W38 PolarHBondContact O-N 3.46Å; A35-W38 PolarHBondContact O-N 2.89Å; A36-W38 VanDerWaalsContact C-N 3.33Å; A36-W38 PolarHBondContact O-N 3.47Å; W38-A40 VanDerWaalsContact C-N 3.28Å; W38-A40 PolarHBondContact O-N 3.15Å; W38-I41 PolarHBondContact O-N 3.48Å; W38-F42 HydrophobicContact CB-CD2 4.37Å; W38-F42 HydrophobicContact CB-CE2 4.36Å; W38-F42 HydrophobicContact CD2-CE2 4.47Å; W38-F42 HydrophobicContact CE3-CD2 4.27Å; W38-F42 AromaticContact CE3-CE2 3.54Å; W38-F42 HydrophobicContact CE3-CE2 3.54Å; W38-F42 AromaticContact CE3-CZ 3.94Å; W38-F42 HydrophobicContact CE3-CZ 3.94Å; W38-F42 HydrophobicContact CZ3-CE2 4.24Å; W38-F42 HydrophobicContact CZ3-CZ 4.18Å; W38-F42 WeakPolarHBondContact O-CB 3.32Å; W38-F42 WeakPolarHBondContact O-CD2 3.42Å; W38-F42 PolarHBondContact O-N 3.44Å
39	M	85.6	Confident	82.2	Confident	134 Å²	134	91.3 Å²	91.3	66%	0.66	52%	0.515	S	S	*	.	H	α-helix	trans	-61.5	-38.2	176.2	-65.2	-52	-64.7	0	0	112	A35 A36 S43	A35-M39 WeakPolarHBondContact O-CG 3.38Å; A35-M39 PolarHBondContact O-N 3.34Å; A35-M39 VanDerWaalsContact O-N 3.09Å; A36-M39 PolarHBondContact O-N 2.77Å; M39-S43 WeakPolarHBondContact O-CB 3.48Å; M39-S43 PolarHBondContact O-N 2.99Å; M39-S43 VanDerWaalsContact O-N 3.07Å; M39-S43 PolarHBondContact O-OG 3Å
40	A	86.7	Confident	83.8	Confident	53 Å²	53	94.3 Å²	94.3	44%	0.438	53%	0.527	S	S	.	.	H	α-helix	trans	-64.3	-50	174	0	0	0	0	0	111.4	A36 A37 W38 F42 S43 V44	A36-A40 PolarHBondContact O-N 3.32Å; A37-A40 PolarHBondContact O-N 3.39Å; W38-A40 VanDerWaalsContact C-N 3.28Å; W38-A40 PolarHBondContact O-N 3.15Å; A40-F42 PolarHBondContact O-N 3.43Å; A40-S43 PolarHBondContact O-N 3.34Å; A40-S43 PolarHBondContact O-OG 3.15Å; A40-V44 WeakPolarHBondContact O-CG2 3.08Å; A40-V44 PolarHBondContact O-N 3.21Å
41	I	89.8	Confident	85.6	Confident	102 Å²	102	93.8 Å²	93.8	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-58.8	-46	178.3	-69.9	168	0	0	0	111.1	A37 W38 S43 V44 A45	A37-I41 VanDerWaalsContact O-CG1 3.29Å; A37-I41 WeakPolarHBondContact O-CG1 3.21Å; A37-I41 PolarHBondContact O-N 3.3Å; W38-I41 PolarHBondContact O-N 3.48Å; I41-S43 VanDerWaalsContact C-N 3.34Å; I41-S43 PolarHBondContact O-N 2.97Å; I41-V44 PolarHBondContact O-N 3.43Å; I41-A45 WeakPolarHBondContact O-CB 3.44Å; I41-A45 PolarHBondContact O-N 3.07Å
42	F	92.8	Very high	87.4	Confident	126 Å²	126	93.4 Å²	93.4	55%	0.553	52%	0.523	S	S	*	.	H	α-helix	trans	-60.7	-42.6	177.7	-83.2	-63.2	0	0	0	112.2	W38 A40 C46	W38-F42 HydrophobicContact CB-CD2 4.37Å; W38-F42 HydrophobicContact CB-CE2 4.36Å; W38-F42 HydrophobicContact CD2-CE2 4.47Å; W38-F42 HydrophobicContact CE3-CD2 4.27Å; W38-F42 AromaticContact CE3-CE2 3.54Å; W38-F42 HydrophobicContact CE3-CE2 3.54Å; W38-F42 AromaticContact CE3-CZ 3.94Å; W38-F42 HydrophobicContact CE3-CZ 3.94Å; W38-F42 HydrophobicContact CZ3-CE2 4.24Å; W38-F42 HydrophobicContact CZ3-CZ 4.18Å; W38-F42 WeakPolarHBondContact O-CB 3.32Å; W38-F42 WeakPolarHBondContact O-CD2 3.42Å; W38-F42 PolarHBondContact O-N 3.44Å; A40-F42 PolarHBondContact O-N 3.43Å; F42-C46 WeakPolarHBondContact O-CB 3.49Å; F42-C46 PolarHBondContact O-N 3.41Å
43	S	92.7	Very high	89.1	Confident	67 Å²	67	91.1 Å²	91.1	47%	0.469	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-45	179.7	73.1	0	0	0	0	112.3	M39 A40 I41 C46 V47	M39-S43 WeakPolarHBondContact O-CB 3.48Å; M39-S43 PolarHBondContact O-N 2.99Å; M39-S43 VanDerWaalsContact O-N 3.07Å; M39-S43 PolarHBondContact O-OG 3Å; A40-S43 PolarHBondContact O-N 3.34Å; A40-S43 PolarHBondContact O-OG 3.15Å; I41-S43 VanDerWaalsContact C-N 3.34Å; I41-S43 PolarHBondContact O-N 2.97Å; S43-C46 WeakPolarHBondContact O-CB 3.29Å; S43-C46 PolarHBondContact O-N 2.9Å; S43-V47 WeakPolarHBondContact O-CG2 3.43Å; S43-V47 PolarHBondContact O-N 3.34Å; S43-V47 VanDerWaalsContact O-N 3.15Å
44	V	94.7	Very high	90.4	Very high	102 Å²	102	84.5 Å²	84.5	62%	0.618	49%	0.492	S	S	*	.	H	α-helix	trans	-66.3	-42.7	177.3	175.7	0	0	0	0	111.1	A40 I41 C46 V47 F48	A40-V44 WeakPolarHBondContact O-CG2 3.08Å; A40-V44 PolarHBondContact O-N 3.21Å; I41-V44 PolarHBondContact O-N 3.43Å; V44-C46 VanDerWaalsContact C-N 3.31Å; V44-C46 PolarHBondContact O-N 2.83Å; V44-V47 PolarHBondContact O-N 3.38Å; V44-F48 WeakPolarHBondContact O-CB 3.16Å; V44-F48 PolarHBondContact O-N 3.02Å
45	A	95	Very high	91.3	Very high	46 Å²	46	87.5 Å²	87.5	38%	0.38	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-40.1	175.9	0	0	0	0	0	111.8	I41 F48 V49	I41-A45 WeakPolarHBondContact O-CB 3.44Å; I41-A45 PolarHBondContact O-N 3.07Å; A45-F48 PolarHBondContact O-N 2.97Å; A45-V49 WeakPolarHBondContact O-CG2 3.34Å; A45-V49 PolarHBondContact O-N 3.36Å
46	C	95.9	Very high	91.9	Very high	74 Å²	74	86.1 Å²	86.1	50%	0.5	50%	0.498	S	S	.	.	H	α-helix	trans	-62.4	-49.1	177	-170.3	0	0	0	0	111.9	F42 S43 V44 F48 V49 I50	F42-C46 WeakPolarHBondContact O-CB 3.49Å; F42-C46 PolarHBondContact O-N 3.41Å; S43-C46 WeakPolarHBondContact O-CB 3.29Å; S43-C46 PolarHBondContact O-N 2.9Å; V44-C46 VanDerWaalsContact C-N 3.31Å; V44-C46 PolarHBondContact O-N 2.83Å; C46-F48 VanDerWaalsContact C-N 3.29Å; C46-F48 PolarHBondContact O-N 3.42Å; C46-V49 PolarHBondContact O-N 3.26Å; C46-I50 WeakPolarHBondContact O-CG1 3.13Å; C46-I50 PolarHBondContact O-N 3.4Å; C46-I50 VanDerWaalsContact O-N 3.15Å
47	V	95.8	Very high	92.5	Very high	93 Å²	93	88.7 Å²	88.7	56%	0.564	50%	0.502	S	S	*	.	H	α-helix	trans	-61.7	-39	176.5	175.3	0	0	0	0	111.3	S43 V44 I50 T51	S43-V47 WeakPolarHBondContact O-CG2 3.43Å; S43-V47 PolarHBondContact O-N 3.34Å; S43-V47 VanDerWaalsContact O-N 3.15Å; V44-V47 PolarHBondContact O-N 3.38Å; V47-I50 PolarHBondContact O-N 3.46Å; V47-T51 WeakPolarHBondContact O-CB 3.4Å; V47-T51 PolarHBondContact O-N 2.86Å; V47-T51 PolarHBondContact O-OG1 3.42Å
48	F	96.3	Very high	92.9	Very high	139 Å²	139	92.7 Å²	92.7	61%	0.61	52%	0.517	S	S	*	.	H	α-helix	trans	-61.9	-46.8	177.6	-176.7	-100.8	0	0	0	112	V44 A45 C46 I50 T51 V52	V44-F48 WeakPolarHBondContact O-CB 3.16Å; V44-F48 PolarHBondContact O-N 3.02Å; A45-F48 PolarHBondContact O-N 2.97Å; C46-F48 VanDerWaalsContact C-N 3.29Å; C46-F48 PolarHBondContact O-N 3.42Å; F48-I50 PolarHBondContact O-N 3Å; F48-T51 PolarHBondContact O-N 3.09Å; F48-V52 HydrophobicContact CD1-CG2 4.34Å; F48-V52 HydrophobicContact CE1-CG2 3.98Å; F48-V52 HydrophobicContact CE2-CG2 4.3Å; F48-V52 HydrophobicContact CZ-CG2 3.96Å; F48-V52 WeakPolarHBondContact O-CG2 3.42Å; F48-V52 PolarHBondContact O-N 3.4Å
49	V	96.6	Very high	93	Very high	94 Å²	94	91.9 Å²	91.9	57%	0.57	53%	0.53	S	S	*	.	H	α-helix	trans	-61.4	-45.4	178.3	170.8	0	0	0	0	111.5	A45 C46 T51 V52 F53	A45-V49 WeakPolarHBondContact O-CG2 3.34Å; A45-V49 PolarHBondContact O-N 3.36Å; C46-V49 PolarHBondContact O-N 3.26Å; V49-T51 VanDerWaalsContact C-N 3.31Å; V49-T51 PolarHBondContact O-N 2.9Å; V49-V52 PolarHBondContact O-N 2.75Å; V49-F53 VanDerWaalsContact O-CB 3.29Å; V49-F53 WeakPolarHBondContact O-CB 3.01Å; V49-F53 PolarHBondContact O-N 3.45Å
50	I	96.3	Very high	93	Very high	110 Å²	110	89.8 Å²	89.8	56%	0.564	53%	0.529	S	S	*	.	H	α-helix	trans	-63.7	-40.2	179.4	-64.3	165.4	0	0	0	110.7	C46 V47 F48 F53 G54	C46-I50 WeakPolarHBondContact O-CG1 3.13Å; C46-I50 PolarHBondContact O-N 3.4Å; C46-I50 VanDerWaalsContact O-N 3.15Å; V47-I50 PolarHBondContact O-N 3.46Å; F48-I50 PolarHBondContact O-N 3Å; I50-F53 PolarHBondContact O-N 3.08Å; I50-G54 PolarHBondContact O-N 3.06Å
51	T	95.5	Very high	92.8	Very high	83 Å²	83	93.5 Å²	93.5	51%	0.509	54%	0.54	S	S	.	.	H	α-helix	trans	-64	-47.6	178	-54.9	0	0	0	0	111.3	V47 F48 V49 F53 G54 V55	V47-T51 WeakPolarHBondContact O-CB 3.4Å; V47-T51 PolarHBondContact O-N 2.86Å; V47-T51 PolarHBondContact O-OG1 3.42Å; F48-T51 PolarHBondContact O-N 3.09Å; V49-T51 VanDerWaalsContact C-N 3.31Å; V49-T51 PolarHBondContact O-N 2.9Å; T51-F53 VanDerWaalsContact C-N 3.33Å; T51-F53 PolarHBondContact O-N 3.03Å; T51-G54 PolarHBondContact O-N 2.85Å; T51-V55 WeakPolarHBondContact O-CG2 3.17Å; T51-V55 PolarHBondContact O-N 3.41Å
52	V	95.7	Very high	92.4	Very high	77 Å²	77	94.9 Å²	94.9	47%	0.467	55%	0.554	S	S	.	*	H	α-helix	trans	-62.8	-41.4	177.4	172.9	0	0	0	0	111.1	F48 V49 V55 A56	F48-V52 HydrophobicContact CD1-CG2 4.34Å; F48-V52 HydrophobicContact CE1-CG2 3.98Å; F48-V52 HydrophobicContact CE2-CG2 4.3Å; F48-V52 HydrophobicContact CZ-CG2 3.96Å; F48-V52 WeakPolarHBondContact O-CG2 3.42Å; F48-V52 PolarHBondContact O-N 3.4Å; V49-V52 PolarHBondContact O-N 2.75Å; V52-V55 PolarHBondContact O-N 3.35Å; V52-A56 WeakPolarHBondContact O-CB 3.09Å; V52-A56 PolarHBondContact O-N 3.31Å
53	F	94.8	Very high	91.7	Very high	127 Å²	127	94.6 Å²	94.6	56%	0.557	56%	0.562	S	S	*	*	H	α-helix	trans	-61.3	-43.7	175.3	-179	-101.8	0	0	0	112.1	V49 I50 T51 V55 A56 M57	V49-F53 VanDerWaalsContact O-CB 3.29Å; V49-F53 WeakPolarHBondContact O-CB 3.01Å; V49-F53 PolarHBondContact O-N 3.45Å; I50-F53 PolarHBondContact O-N 3.08Å; T51-F53 VanDerWaalsContact C-N 3.33Å; T51-F53 PolarHBondContact O-N 3.03Å; F53-V55 PolarHBondContact O-N 3.31Å; F53-A56 PolarHBondContact O-N 2.83Å; F53-M57 HydrophobicContact CD1-CG 4.37Å; F53-M57 HydrophobicContact CD2-CE 4.24Å; F53-M57 HydrophobicContact CE1-CE 3.98Å; F53-M57 HydrophobicContact CE1-CG 4.11Å; F53-M57 HydrophobicContact CE2-CE 3.33Å; F53-M57 HydrophobicContact CZ-CE 3.19Å; F53-M57 HydrophobicContact CZ-CG 4.24Å; F53-M57 WeakPolarHBondContact O-CG 3.17Å; F53-M57 PolarHBondContact O-N 3.42Å
54	G	95.1	Very high	90.7	Very high	30 Å²	30	97.9 Å²	97.9	31%	0.309	57%	0.572	S	S	.	*	H	α-helix	trans	-59.6	-45.6	175.1	0	0	0	0	0	112.5	I50 T51 M57 I58	I50-G54 PolarHBondContact O-N 3.06Å; T51-G54 PolarHBondContact O-N 2.85Å; G54-M57 PolarHBondContact O-N 3.06Å; G54-I58 WeakPolarHBondContact O-CG1 3.27Å; G54-I58 PolarHBondContact O-N 3.49Å
55	V	94.4	Very high	89.5	Confident	95 Å²	95	97.3 Å²	97.3	58%	0.576	57%	0.565	S	S	*	*	H	α-helix	trans	-64.2	-41	176.5	175	0	0	0	0	111.5	T51 V52 F53 M57 I58 S59	T51-V55 WeakPolarHBondContact O-CG2 3.17Å; T51-V55 PolarHBondContact O-N 3.41Å; V52-V55 PolarHBondContact O-N 3.35Å; F53-V55 PolarHBondContact O-N 3.31Å; V55-M57 VanDerWaalsContact C-N 3.32Å; V55-M57 PolarHBondContact O-N 3.42Å; V55-I58 PolarHBondContact O-N 3.35Å; V55-S59 WeakPolarHBondContact O-CB 2.84Å; V55-S59 PolarHBondContact O-N 3.48Å
56	A	92.3	Very high	88.2	Confident	49 Å²	49	103.1 Å²	103.1	41%	0.405	58%	0.577	S	S	.	*	H	α-helix	trans	-62.7	-38.8	176.8	0	0	0	0	0	112.4	V52 F53 S59 S60	V52-A56 WeakPolarHBondContact O-CB 3.09Å; V52-A56 PolarHBondContact O-N 3.31Å; F53-A56 PolarHBondContact O-N 2.83Å; A56-S59 PolarHBondContact O-N 3.47Å; A56-S60 PolarHBondContact O-N 2.98Å; A56-S60 PolarHBondContact O-OG 3.23Å; A56-S60 VanDerWaalsContact O-OG 3.06Å
57	M	90.2	Very high	86.6	Confident	107 Å²	107	107.3 Å²	107.3	53%	0.527	59%	0.588	S	S	.	*	H	α-helix	trans	-66.1	-42.3	175.6	-72.7	-63.5	171.3	0	0	112	F53 G54 V55 S59 S60	F53-M57 HydrophobicContact CD1-CG 4.37Å; F53-M57 HydrophobicContact CD2-CE 4.24Å; F53-M57 HydrophobicContact CE1-CE 3.98Å; F53-M57 HydrophobicContact CE1-CG 4.11Å; F53-M57 HydrophobicContact CE2-CE 3.33Å; F53-M57 HydrophobicContact CZ-CE 3.19Å; F53-M57 HydrophobicContact CZ-CG 4.24Å; F53-M57 WeakPolarHBondContact O-CG 3.17Å; F53-M57 PolarHBondContact O-N 3.42Å; G54-M57 PolarHBondContact O-N 3.06Å; V55-M57 VanDerWaalsContact C-N 3.32Å; V55-M57 PolarHBondContact O-N 3.42Å; M57-S59 VanDerWaalsContact C-N 3.35Å; M57-S60 PolarHBondContact O-N 3.07Å
58	I	90	Very high	85.1	Confident	118 Å²	118	108.7 Å²	108.7	61%	0.605	59%	0.592	S	S	*	*	H	α-helix	trans	-65.7	-40	176.2	-64.2	164.9	0	0	0	110.8	G54 V55 S60 L61	G54-I58 WeakPolarHBondContact O-CG1 3.27Å; G54-I58 PolarHBondContact O-N 3.49Å; V55-I58 PolarHBondContact O-N 3.35Å; I58-S60 PolarHBondContact O-N 3.24Å; I58-S60 VanDerWaalsContact O-N 3.13Å; I58-L61 WeakPolarHBondContact O-CB 3.31Å; I58-L61 PolarHBondContact O-N 2.05Å
59	S	86.4	Confident	83.9	Confident	104 Å²	104	108.1 Å²	108.1	73%	0.727	60%	0.595	S	S	*	*	H	α-helix	trans	-61.9	-21.7	177.6	-174.7	0	0	0	0	113.5	V55 A56 M57	V55-S59 WeakPolarHBondContact O-CB 2.84Å; V55-S59 PolarHBondContact O-N 3.48Å; A56-S59 PolarHBondContact O-N 3.47Å; M57-S59 VanDerWaalsContact C-N 3.35Å
60	S	85.3	Confident	82.2	Confident	90 Å²	90	109.4 Å²	109.4	63%	0.629	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-1.2	179.6	-55	0	0	0	0	113	A56 M57 I58 T62	A56-S60 PolarHBondContact O-N 2.98Å; A56-S60 PolarHBondContact O-OG 3.23Å; A56-S60 VanDerWaalsContact O-OG 3.06Å; M57-S60 PolarHBondContact O-N 3.07Å; I58-S60 PolarHBondContact O-N 3.24Å; I58-S60 VanDerWaalsContact O-N 3.13Å; S60-T62 PolarHBondContact O-N 3.14Å
61	L	83.5	Confident	80.6	Confident	131 Å²	131	113.6 Å²	113.6	69%	0.686	62%	0.619	S	S	*	*			trans	-69.3	104.3	174.2	-87	162.3	0	0	0	109.4	I58 T63	I58-L61 WeakPolarHBondContact O-CB 3.31Å; I58-L61 PolarHBondContact O-N 2.05Å; L61-T63 PolarHBondContact O-N 3.31Å
62	T	80.9	Confident	78.9	Confident	131 Å²	131	113.5 Å²	113.5	80%	0.804	64%	0.635	S	S	*	*			trans	-74.3	119.1	165	49.9	0	0	0	0	108	S60 M64	S60-T62 PolarHBondContact O-N 3.14Å; T62-M64 PolarHBondContact O-N 2.81Å
63	T	77.9	Confident	77.5	Confident	119 Å²	119	118.2 Å²	118.2	73%	0.73	65%	0.649	S	S	*	*			trans	-70.2	123.2	169.7	50.9	0	0	0	0	107.3	L61 D65	L61-T63 PolarHBondContact O-N 3.31Å; T63-D65 VanDerWaalsContact C-N 3.34Å; T63-D65 PolarHBondContact O-N 3.01Å
64	M	71.3	Confident	76.1	Confident	137 Å²	137	117.4 Å²	117.4	68%	0.675	66%	0.657	S	S	*	*			trans	-73.4	93.4	179.7	-170.7	57.7	-81.5	0	0	109.9	T62 R66	T62-M64 PolarHBondContact O-N 2.81Å; M64-R66 HydrophobicContact CE-CB 4.25Å; M64-R66 HydrophobicContact CG-CB 4.39Å; M64-R66 HydrophobicContact CG-CG 4.12Å; M64-R66 PolarHBondContact O-N 3.35Å
65	D	70.4	Confident	74.9	Confident	89 Å²	89	123.4 Å²	123.4	48%	0.476	68%	0.681	S	S	.	*			trans	-65.3	4.4	-175.1	-152.7	35.9	0	0	0	115.6	T63 F67 D68	T63-D65 VanDerWaalsContact C-N 3.34Å; T63-D65 PolarHBondContact O-N 3.01Å; D65-F67 PolarHBondContact O-N 3.17Å; D65-D68 PolarHBondContact O-N 2.92Å; D65-D68 VanDerWaalsContact O-N 3.09Å; D65-D68 WeakPolarHBondContact OD1-CB 3.43Å
66	R	67	Low	73.8	Confident	168 Å²	168	125 Å²	125	63%	0.634	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-10.5	-170.2	76.7	179.7	-175.7	-176.3	-0.5	114.5	M64	M64-R66 HydrophobicContact CE-CB 4.25Å; M64-R66 HydrophobicContact CG-CB 4.39Å; M64-R66 HydrophobicContact CG-CG 4.12Å; M64-R66 PolarHBondContact O-N 3.35Å
67	F	63.5	Low	72.7	Confident	163 Å²	163	129.2 Å²	129.2	72%	0.715	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117	-5.2	-178.4	-60.7	-54.9	0	0	0	112.8	D65 D69	D65-F67 PolarHBondContact O-N 3.17Å; F67-D69 VanDerWaalsContact C-N 3.29Å
68	D	64.3	Low	71.9	Confident	122 Å²	122	129.9 Å²	129.9	65%	0.652	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-3.6	175.7	-93.7	-48.2	0	0	0	112.2	D65 P70	D65-D68 PolarHBondContact O-N 2.92Å; D65-D68 VanDerWaalsContact O-N 3.09Å; D65-D68 WeakPolarHBondContact OD1-CB 3.43Å; D68-P70 WeakPolarHBondContact O-CD 2.94Å
69	D	70.1	Confident	71	Confident	126 Å²	126	129.9 Å²	129.9	67%	0.674	72%	0.716	S	S	*	*	S	Bend	trans	-74.2	106.4	168.1	-74.6	-47.5	0	0	0	110.9	F67 K71	F67-D69 VanDerWaalsContact C-N 3.29Å; D69-K71 PolarHBondContact O-N 3.42Å
70	P	62.4	Low	70.1	Confident	121 Å²	121	132.8 Å²	132.8	79%	0.786	72%	0.716	S	S	*	*			trans	-68.8	102.4	174.5	29.3	-35.1	0	0	0	110.4	D68	D68-P70 WeakPolarHBondContact O-CD 2.94Å
71	K	61.4	Low	69	Low	198 Å²	198	140.8 Å²	140.8	86%	0.861	74%	0.743	S	S	*	*			trans	59.5	84.7	157	-72.4	175	173.3	167.9	0	116.3	D69 K73	D69-K71 PolarHBondContact O-N 3.42Å; K71-K73 PolarHBondContact O-N 3.18Å
72	G	60.2	Low	68.3	Low	82 Å²	82	141.3 Å²	141.3	85%	0.845	75%	0.746	S	S	*	*	S	Bend	trans	-74.9	103.1	154.3	0	0	0	0	0	111.5
73	K	66.3	Low	67.6	Low	175 Å²	175	141.8 Å²	141.8	76%	0.761	74%	0.743	S	S	*	*			trans	89.9	104.1	165.2	-153.6	157.6	-171.9	-126.5	0	116.7	K71 L75	K71-K73 PolarHBondContact O-N 3.18Å; K73-L75 PolarHBondContact O-N 3.02Å
74	P	65.9	Low	67	Low	110 Å²	110	143.1 Å²	143.1	71%	0.714	74%	0.743	S	S	*	*			trans	-52.6	127.5	160	-20	30.8	0	0	0	109.5	V76	P74-V76 PolarHBondContact O-N 3.43Å
75	L	69.8	Low	66.8	Low	157 Å²	157	143.4 Å²	143.4	82%	0.822	75%	0.747	S	S	*	*			trans	-62	106.8	164.5	-81.4	92.5	0	0	0	107.1	K73 I77	K73-L75 PolarHBondContact O-N 3.02Å; L75-I77 HydrophobicContact CB-CG1 4.34Å; L75-I77 PolarHBondContact O-N 2.84Å
76	V	70.4	Confident	66.6	Low	129 Å²	129	146.8 Å²	146.8	78%	0.782	76%	0.764	S	S	*	*			trans	-70	90.4	161.9	-68.7	0	0	0	0	106.5	P74 N78	P74-V76 PolarHBondContact O-N 3.43Å; V76-N78 PolarHBondContact O-N 3.43Å
77	I	70.3	Confident	66.5	Low	137 Å²	137	145.4 Å²	145.4	70%	0.703	77%	0.773	S	S	*	*			trans	-70.7	93.9	168.6	-51.5	160.4	0	0	0	104.7	L75 V79	L75-I77 HydrophobicContact CB-CG1 4.34Å; L75-I77 PolarHBondContact O-N 2.84Å; I77-V79 HydrophobicContact CG2-CG2 3.67Å; I77-V79 PolarHBondContact O-N 3.5Å
78	N	73.1	Confident	66.7	Low	121 Å²	121	144.1 Å²	144.1	65%	0.647	78%	0.777	S	S	*	*			trans	-74.1	86.6	165	-169.5	15.1	0	0	0	106.5	V76 K80	V76-N78 PolarHBondContact O-N 3.43Å; N78-K80 VanDerWaalsContact ND2-CE 3.34Å; N78-K80 WeakPolarHBondContact ND2-CE 3.47Å; N78-K80 PolarHBondContact O-N 2.77Å
79	V	70.3	Confident	66.9	Low	118 Å²	118	145.8 Å²	145.8	72%	0.715	79%	0.787	S	S	*	*			trans	-65.9	95.9	162.2	-178.7	0	0	0	0	105.1	I77 E81	I77-V79 HydrophobicContact CG2-CG2 3.67Å; I77-V79 PolarHBondContact O-N 3.5Å; V79-E81 PolarHBondContact O-N 3.29Å
80	K	67.2	Low	66.7	Low	165 Å²	165	147.5 Å²	147.5	72%	0.717	80%	0.796	S	S	*	*			trans	-76.5	114.9	158.3	-62.2	-175.5	-179	-176.4	0	105.3	N78	N78-K80 VanDerWaalsContact ND2-CE 3.34Å; N78-K80 WeakPolarHBondContact ND2-CE 3.47Å; N78-K80 PolarHBondContact O-N 2.77Å
81	E	62.9	Low	67.1	Low	257 Å²	257	149.9 Å²	149.9	100%	1.201	80%	0.797	S	S	*	*			trans	-41.5	0	160.4	53	-159.9	147.3	0	0	112.9	V79	V79-E81 PolarHBondContact O-N 3.29Å

Retrieved 81 of 81 residues in 35.1 ms (Link to these results)

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