G4VN09_SCHMA Loading...

Hypotheticial protein

AlphaFold DB , UniProt , Accession G4VN09, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 82 aa.

						>G4VN09_SCHMA|G4VN09
MNQFMVTSVLIFVIVSFCWYNPVKSQFPPNFRTFDLEDDYPEIPGRYSPSMHKDHTTHFNYKDRFRWSKRVPPYITGGIRYR
					

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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	65.5	Low	86.2	Confident	214 Å²	214	122.3 Å²	122.3	100%	1.054	64%	0.637	S	S	*	*				0	-29.7	0	-70.2	172.9	115.1	0	0	113.2	Q3	M1-Q3 PolarHBondContact O-N 3.48Å
2	N	82.7	Confident	86.6	Confident	129 Å²	129	125.1 Å²	125.1	69%	0.69	64%	0.641	S	S	*	*	H	α-helix	trans	-67.5	-36.9	-174.3	-69	19.2	0	0	0	115.6	F4 M5 V6	N2-F4 VanDerWaalsContact C-N 3.33Å; N2-F4 PolarHBondContact O-N 3.13Å; N2-M5 PolarHBondContact O-N 3Å; N2-V6 WeakPolarHBondContact O-CG2 3.47Å; N2-V6 PolarHBondContact O-N 3.31Å
3	Q	84.6	Confident	86.8	Confident	163 Å²	163	122.5 Å²	122.5	76%	0.762	64%	0.635	S	S	*	*	H	α-helix	trans	-64	-38	-174.2	-167.2	173.9	-6.2	0	0	112.7	M1 V6 T7	M1-Q3 PolarHBondContact O-N 3.48Å; Q3-V6 PolarHBondContact O-N 3.02Å; Q3-T7 WeakPolarHBondContact O-CG2 3.35Å; Q3-T7 PolarHBondContact O-N 3.27Å; Q3-T7 PolarHBondContact O-OG1 3.35Å; Q3-T7 VanDerWaalsContact O-OG1 3.13Å
4	F	84.1	Confident	87	Confident	178 Å²	178	120.3 Å²	120.3	78%	0.781	62%	0.623	S	S	*	*	H	α-helix	trans	-67.2	-38.3	179.2	-139.7	-85.3	0	0	0	112.2	N2 T7 S8	N2-F4 VanDerWaalsContact C-N 3.33Å; N2-F4 PolarHBondContact O-N 3.13Å; F4-T7 WeakPolarHBondContact CA-OG1 3.28Å; F4-T7 PolarHBondContact O-OG1 3.11Å; F4-S8 PolarHBondContact O-N 2.91Å; F4-S8 VanDerWaalsContact O-N 3.11Å; F4-S8 PolarHBondContact O-OG 3Å
5	M	87.3	Confident	87	Confident	141 Å²	141	117.9 Å²	117.9	70%	0.695	62%	0.616	S	S	*	*	H	α-helix	trans	-67.3	-38.8	174	-76	-165	165.3	0	0	112.1	N2 S8 V9	N2-M5 PolarHBondContact O-N 3Å; M5-S8 PolarHBondContact O-OG 3.1Å; M5-V9 VanDerWaalsContact O-CG2 3.27Å; M5-V9 WeakPolarHBondContact O-CG2 3.49Å; M5-V9 PolarHBondContact O-N 3.47Å
6	V	89.3	Confident	86.9	Confident	92 Å²	92	113.4 Å²	113.4	56%	0.558	60%	0.597	S	S	*	*	H	α-helix	trans	-65.7	-44.4	177.3	174.8	0	0	0	0	110.7	N2 Q3 S8 V9 L10	N2-V6 WeakPolarHBondContact O-CG2 3.47Å; N2-V6 PolarHBondContact O-N 3.31Å; Q3-V6 PolarHBondContact O-N 3.02Å; V6-S8 PolarHBondContact O-N 3.27Å; V6-V9 PolarHBondContact O-N 3.48Å; V6-L10 WeakPolarHBondContact O-CB 3.27Å; V6-L10 PolarHBondContact O-N 3.09Å; V6-L10 VanDerWaalsContact O-N 3.09Å
7	T	90.3	Very high	86.7	Confident	66 Å²	66	114.6 Å²	114.6	41%	0.405	60%	0.596	S	S	.	*	H	α-helix	trans	-65.4	-38.9	179.8	48.6	0	0	0	0	112.8	Q3 F4 L10 I11	Q3-T7 WeakPolarHBondContact O-CG2 3.35Å; Q3-T7 PolarHBondContact O-N 3.27Å; Q3-T7 PolarHBondContact O-OG1 3.35Å; Q3-T7 VanDerWaalsContact O-OG1 3.13Å; F4-T7 WeakPolarHBondContact CA-OG1 3.28Å; F4-T7 PolarHBondContact O-OG1 3.11Å; T7-L10 PolarHBondContact O-N 3.48Å; T7-I11 WeakPolarHBondContact O-CD1 3.45Å; T7-I11 VanDerWaalsContact O-CG1 3.28Å; T7-I11 WeakPolarHBondContact O-CG1 3.43Å; T7-I11 PolarHBondContact O-N 3.34Å; T7-I11 VanDerWaalsContact O-N 3.1Å
8	S	89.3	Confident	86.3	Confident	60 Å²	60	113 Å²	113	42%	0.42	60%	0.595	S	S	.	*	H	α-helix	trans	-67.8	-41	180	61.7	0	0	0	0	111.9	F4 M5 V6 I11 F12	F4-S8 PolarHBondContact O-N 2.91Å; F4-S8 VanDerWaalsContact O-N 3.11Å; F4-S8 PolarHBondContact O-OG 3Å; M5-S8 PolarHBondContact O-OG 3.1Å; V6-S8 PolarHBondContact O-N 3.27Å; S8-I11 PolarHBondContact O-N 3.48Å; S8-F12 PolarHBondContact O-N 3.21Å; S8-F12 VanDerWaalsContact O-N 3.08Å
9	V	91	Very high	85.7	Confident	93 Å²	93	118.5 Å²	118.5	56%	0.564	61%	0.607	S	S	*	*	H	α-helix	trans	-62.9	-43.5	175.5	173	0	0	0	0	111	M5 V6 I11 F12 V13	M5-V9 VanDerWaalsContact O-CG2 3.27Å; M5-V9 WeakPolarHBondContact O-CG2 3.49Å; M5-V9 PolarHBondContact O-N 3.47Å; V6-V9 PolarHBondContact O-N 3.48Å; V9-I11 PolarHBondContact O-N 3.03Å; V9-F12 PolarHBondContact O-N 3.49Å; V9-V13 WeakPolarHBondContact O-CG2 3.37Å; V9-V13 PolarHBondContact O-N 3.42Å
10	L	92.1	Very high	85.2	Confident	102 Å²	102	122.4 Å²	122.4	53%	0.534	62%	0.615	S	S	.	*	H	α-helix	trans	-63.7	-42.8	-178.8	-146.1	160.9	0	0	0	111.6	V6 T7 F12 V13 I14	V6-L10 WeakPolarHBondContact O-CB 3.27Å; V6-L10 PolarHBondContact O-N 3.09Å; V6-L10 VanDerWaalsContact O-N 3.09Å; T7-L10 PolarHBondContact O-N 3.48Å; L10-F12 VanDerWaalsContact C-N 3.35Å; L10-F12 PolarHBondContact O-N 3.22Å; L10-V13 PolarHBondContact O-N 3.08Å; L10-I14 HydrophobicContact CD2-CD1 3.51Å; L10-I14 HydrophobicContact CD2-CG1 4.12Å; L10-I14 WeakPolarHBondContact O-CG1 3.41Å; L10-I14 PolarHBondContact O-N 3.06Å
11	I	92.3	Very high	84	Confident	107 Å²	107	120.5 Å²	120.5	55%	0.549	61%	0.607	S	S	.	*	H	α-helix	trans	-61.8	-43.5	174.8	-67.1	165.7	0	0	0	110.7	T7 S8 V9 V13 I14 V15	T7-I11 WeakPolarHBondContact O-CD1 3.45Å; T7-I11 VanDerWaalsContact O-CG1 3.28Å; T7-I11 WeakPolarHBondContact O-CG1 3.43Å; T7-I11 PolarHBondContact O-N 3.34Å; T7-I11 VanDerWaalsContact O-N 3.1Å; S8-I11 PolarHBondContact O-N 3.48Å; V9-I11 PolarHBondContact O-N 3.03Å; I11-V13 VanDerWaalsContact C-N 3.3Å; I11-V13 PolarHBondContact O-N 2.98Å; I11-I14 PolarHBondContact O-N 3.19Å; I11-V15 HydrophobicContact CG2-CG2 4.31Å; I11-V15 WeakPolarHBondContact O-CG2 3.5Å; I11-V15 PolarHBondContact O-N 3.06Å
12	F	90.1	Very high	83.7	Confident	156 Å²	156	114.8 Å²	114.8	68%	0.684	59%	0.586	S	S	*	*	H	α-helix	trans	-61.9	-37.9	179.6	-135.5	-86.1	0	0	0	112.5	S8 V9 L10 S16	S8-F12 PolarHBondContact O-N 3.21Å; S8-F12 VanDerWaalsContact O-N 3.08Å; V9-F12 PolarHBondContact O-N 3.49Å; L10-F12 VanDerWaalsContact C-N 3.35Å; L10-F12 PolarHBondContact O-N 3.22Å; F12-S16 VanDerWaalsContact O-CB 3.32Å; F12-S16 WeakPolarHBondContact O-CB 3.36Å; F12-S16 PolarHBondContact O-N 2.88Å; F12-S16 PolarHBondContact O-OG 3.02Å
13	V	90.1	Very high	82.4	Confident	92 Å²	92	114.5 Å²	114.5	56%	0.558	59%	0.589	S	S	*	*	H	α-helix	trans	-67.5	-44.5	175.8	172.2	0	0	0	0	111.3	V9 L10 I11 S16 F17	V9-V13 WeakPolarHBondContact O-CG2 3.37Å; V9-V13 PolarHBondContact O-N 3.42Å; L10-V13 PolarHBondContact O-N 3.08Å; I11-V13 VanDerWaalsContact C-N 3.3Å; I11-V13 PolarHBondContact O-N 2.98Å; V13-S16 PolarHBondContact O-N 3.38Å; V13-F17 WeakPolarHBondContact O-CB 3.38Å; V13-F17 PolarHBondContact O-N 2.86Å
14	I	89.5	Confident	80.8	Confident	91 Å²	91	115.9 Å²	115.9	47%	0.467	59%	0.592	S	S	.	*	H	α-helix	trans	-61.8	-49.4	178.8	-67.3	166.1	0	0	0	110.5	L10 I11 S16 F17 C18	L10-I14 HydrophobicContact CD2-CD1 3.51Å; L10-I14 HydrophobicContact CD2-CG1 4.12Å; L10-I14 WeakPolarHBondContact O-CG1 3.41Å; L10-I14 PolarHBondContact O-N 3.06Å; I11-I14 PolarHBondContact O-N 3.19Å; I14-S16 VanDerWaalsContact C-N 3.3Å; I14-S16 PolarHBondContact O-N 3.28Å; I14-F17 PolarHBondContact O-N 3.39Å; I14-C18 WeakPolarHBondContact O-CB 3.42Å; I14-C18 PolarHBondContact O-N 2.74Å; I14-C18 PolarHBondContact O-SG 3.38Å
15	V	87	Confident	79.3	Confident	85 Å²	85	111 Å²	111	52%	0.515	58%	0.58	S	S	.	*	H	α-helix	trans	-61	-42.3	-179.9	173.6	0	0	0	0	110.8	I11 C18 W19	I11-V15 HydrophobicContact CG2-CG2 4.31Å; I11-V15 WeakPolarHBondContact O-CG2 3.5Å; I11-V15 PolarHBondContact O-N 3.06Å; V15-C18 PolarHBondContact O-N 3.47Å; V15-W19 WeakPolarHBondContact O-CB 3.32Å; V15-W19 PolarHBondContact O-N 3.25Å
16	S	85.2	Confident	77.5	Confident	45 Å²	45	112.9 Å²	112.9	32%	0.315	59%	0.587	S	S	.	*	H	α-helix	trans	-61.4	-47.3	175.7	-60.1	0	0	0	0	111.2	F12 V13 I14 C18 W19 Y20	F12-S16 VanDerWaalsContact O-CB 3.32Å; F12-S16 WeakPolarHBondContact O-CB 3.36Å; F12-S16 PolarHBondContact O-N 2.88Å; F12-S16 PolarHBondContact O-OG 3.02Å; V13-S16 PolarHBondContact O-N 3.38Å; I14-S16 VanDerWaalsContact C-N 3.3Å; I14-S16 PolarHBondContact O-N 3.28Å; S16-C18 PolarHBondContact O-N 2.98Å; S16-W19 PolarHBondContact O-N 3.25Å; S16-W19 VanDerWaalsContact O-N 3.16Å; S16-Y20 WeakPolarHBondContact O-CB 3.35Å; S16-Y20 WeakPolarHBondContact O-CD2 3.48Å; S16-Y20 PolarHBondContact O-N 2.91Å
17	F	82.9	Confident	75.3	Confident	135 Å²	135	117 Å²	117	59%	0.592	60%	0.598	S	S	*	*	H	α-helix	trans	-64	-40.4	179.5	-171.7	-97.8	0	0	0	112.6	V13 I14 W19 Y20 N21	V13-F17 WeakPolarHBondContact O-CB 3.38Å; V13-F17 PolarHBondContact O-N 2.86Å; I14-F17 PolarHBondContact O-N 3.39Å; F17-W19 VanDerWaalsContact C-N 3.27Å; F17-W19 PolarHBondContact O-N 2.89Å; F17-Y20 PolarHBondContact O-N 3.43Å; F17-N21 VanDerWaalsContact CE1-ND2 3.26Å; F17-N21 WeakPolarHBondContact CE1-ND2 3.39Å; F17-N21 WeakPolarHBondContact CE2-ND2 3.49Å; F17-N21 WeakPolarHBondContact CZ-ND2 3.14Å; F17-N21 WeakPolarHBondContact O-CB 3.26Å; F17-N21 PolarHBondContact O-N 3.33Å
18	C	80.4	Confident	73.2	Confident	85 Å²	85	118.8 Å²	118.8	57%	0.574	61%	0.611	S	S	*	*	H	α-helix	trans	-65.7	-29.2	175.5	-70.4	0	0	0	0	112.6	I14 V15 S16 N21	I14-C18 WeakPolarHBondContact O-CB 3.42Å; I14-C18 PolarHBondContact O-N 2.74Å; I14-C18 PolarHBondContact O-SG 3.38Å; V15-C18 PolarHBondContact O-N 3.47Å; S16-C18 PolarHBondContact O-N 2.98Å; C18-N21 VanDerWaalsContact O-O 3.05Å
19	W	75.2	Confident	71.2	Confident	218 Å²	218	121.1 Å²	121.1	83%	0.826	62%	0.624	S	S	*	*	H	α-helix	trans	-81.2	-38.7	175	-155.3	-72	0	0	0	112.3	V15 S16 F17	V15-W19 WeakPolarHBondContact O-CB 3.32Å; V15-W19 PolarHBondContact O-N 3.25Å; S16-W19 PolarHBondContact O-N 3.25Å; S16-W19 VanDerWaalsContact O-N 3.16Å; F17-W19 VanDerWaalsContact C-N 3.27Å; F17-W19 PolarHBondContact O-N 2.89Å
20	Y	74.4	Confident	69	Low	195 Å²	195	124.1 Å²	124.1	77%	0.765	64%	0.637	S	S	*	*	H	α-helix	trans	-75	-26.4	179	-83.8	-68.5	0	0	0	114	S16 F17 P22	S16-Y20 WeakPolarHBondContact O-CB 3.35Å; S16-Y20 WeakPolarHBondContact O-CD2 3.48Å; S16-Y20 PolarHBondContact O-N 2.91Å; F17-Y20 PolarHBondContact O-N 3.43Å; Y20-P22 WeakPolarHBondContact O-CD 3.03Å
21	N	61.3	Low	67	Low	83 Å²	83	128.5 Å²	128.5	44%	0.444	65%	0.652	S	S	.	*	S	Bend	trans	-90.2	87.5	160.8	-86.2	-66.3	0	0	0	107.3	F17 C18 V23	F17-N21 VanDerWaalsContact CE1-ND2 3.26Å; F17-N21 WeakPolarHBondContact CE1-ND2 3.39Å; F17-N21 WeakPolarHBondContact CE2-ND2 3.49Å; F17-N21 WeakPolarHBondContact CZ-ND2 3.14Å; F17-N21 WeakPolarHBondContact O-CB 3.26Å; F17-N21 PolarHBondContact O-N 3.33Å; C18-N21 VanDerWaalsContact O-O 3.05Å; N21-V23 PolarHBondContact O-N 3.24Å
22	P	57.7	Low	64.7	Low	94 Å²	94	133.4 Å²	133.4	61%	0.61	66%	0.664	S	S	*	*			trans	-56	111.6	151.1	27.7	-29	0	0	0	102.6	Y20 K24	Y20-P22 WeakPolarHBondContact O-CD 3.03Å; P22-K24 PolarHBondContact O-N 3.39Å
23	V	55.7	Low	62.6	Low	123 Å²	123	131.8 Å²	131.8	75%	0.745	67%	0.667	S	S	*	*			trans	-43	105.6	158.6	173.7	0	0	0	0	101.9	N21 S25	N21-V23 PolarHBondContact O-N 3.24Å; V23-S25 PolarHBondContact O-N 3.37Å
24	K	52.2	Low	60.4	Low	193 Å²	193	135.7 Å²	135.7	84%	0.839	68%	0.676	S	S	*	*			trans	-60.4	81.4	162.1	-78.1	177.5	177.9	176.4	0	100.8	P22 Q26	P22-K24 PolarHBondContact O-N 3.39Å; K24-Q26 PolarHBondContact O-N 3.44Å
25	S	52.7	Low	58.3	Low	74 Å²	74	137.9 Å²	137.9	52%	0.517	69%	0.689	S	S	.	*			trans	-58	90.4	163.1	56.8	0	0	0	0	100.5	V23 F27	V23-S25 PolarHBondContact O-N 3.37Å; S25-F27 WeakPolarHBondContact O-CD2 3.39Å; S25-F27 PolarHBondContact O-N 3.46Å
26	Q	47.8	Very low	56.4	Low	181 Å²	181	139.1 Å²	139.1	85%	0.846	69%	0.692	S	S	*	*				17.5	54.3	126.9	-70.8	170	-27.1	0	0	112.6	K24	K24-Q26 PolarHBondContact O-N 3.44Å
27	F	44	Very low	54.5	Low	180 Å²	180	145 Å²	145	79%	0.789	72%	0.715	S	S	*	*			trans	-55.5	116.6	136.7	-76.5	-76.7	0	0	0	102.5	S25 P29	S25-F27 WeakPolarHBondContact O-CD2 3.39Å; S25-F27 PolarHBondContact O-N 3.46Å; F27-P29 VanDerWaalsContact O-N 3.14Å
28	P	46.9	Very low	52.8	Low	103 Å²	103	143.8 Å²	143.8	67%	0.669	71%	0.714	S	S	*	*			trans	-49.3	131.4	-178.7	22.2	-32.2	0	0	0	105.7	N30	P28-N30 PolarHBondContact O-N 2.89Å
29	P	46.9	Very low	51.2	Low	109 Å²	109	147.2 Å²	147.2	71%	0.708	73%	0.727	S	S	*	*			trans	-49.4	114.4	-178.8	21.4	-31.4	0	0	0	104.6	F27 F31	F27-P29 VanDerWaalsContact O-N 3.14Å; P29-F31 WeakPolarHBondContact O-CA 3.47Å; P29-F31 PolarHBondContact O-N 3.43Å
30	N	45.4	Very low	49.6	Very low	156 Å²	156	147 Å²	147	83%	0.834	73%	0.728	S	S	*	*			trans	-46.8	104.5	172.9	-116.8	-17.5	0	0	0	102.3	P28 R32	P28-N30 PolarHBondContact O-N 2.89Å; N30-R32 PolarHBondContact O-N 3.41Å
31	F	48.9	Very low	48.4	Very low	193 Å²	193	142.7 Å²	142.7	85%	0.846	72%	0.724	S	S	*	*			trans	-64.2	95.6	-177.1	-139.2	-92.9	0	0	0	100	P29 T33	P29-F31 WeakPolarHBondContact O-CA 3.47Å; P29-F31 PolarHBondContact O-N 3.43Å; F31-T33 VanDerWaalsContact C-N 3.3Å; F31-T33 PolarHBondContact O-N 3.16Å
32	R	44.6	Very low	47.9	Very low	211 Å²	211	147.8 Å²	147.8	80%	0.796	75%	0.745	S	S	*	*			trans	-50.6	113.9	171.5	-75.6	-173.9	174.2	-176.7	-2.5	101.4	N30 F34	N30-R32 PolarHBondContact O-N 3.41Å; R32-F34 PolarHBondContact O-N 2.87Å
33	T	45.3	Very low	47.8	Very low	121 Å²	121	150.4 Å²	150.4	74%	0.742	75%	0.752	S	S	*	*			trans	-42.2	94.3	159.7	33.4	0	0	0	0	104.8	F31 D35	F31-T33 VanDerWaalsContact C-N 3.3Å; F31-T33 PolarHBondContact O-N 3.16Å; T33-D35 PolarHBondContact O-N 3.37Å
34	F	45.4	Very low	47.2	Very low	174 Å²	174	150.9 Å²	150.9	76%	0.763	76%	0.757	S	S	*	*			trans	-64.5	84	154.6	-98.5	-93.5	0	0	0	101.8	R32 L36	R32-F34 PolarHBondContact O-N 2.87Å; F34-L36 HydrophobicContact CD1-CD1 3.95Å; F34-L36 HydrophobicContact CE1-CD1 4.43Å; F34-L36 PolarHBondContact O-N 3.01Å
35	D	44.2	Very low	46.9	Very low	137 Å²	137	144.3 Å²	144.3	73%	0.733	75%	0.745	S	S	*	*			trans	-61.1	64	148.9	-89.8	-30.8	0	0	0	106.1	T33 E37	T33-D35 PolarHBondContact O-N 3.37Å; D35-E37 PolarHBondContact O-N 3.3Å
36	L	46.4	Very low	46.3	Very low	111 Å²	111	152 Å²	152	58%	0.581	76%	0.763	S	S	*	*			trans	-77.7	69.7	161.8	-150.8	90.9	0	0	0	104.3	F34 D38	F34-L36 HydrophobicContact CD1-CD1 3.95Å; F34-L36 HydrophobicContact CE1-CD1 4.43Å; F34-L36 PolarHBondContact O-N 3.01Å; L36-D38 WeakPolarHBondContact CD1-OD2 3.34Å; L36-D38 HydrophobicContact CD2-CB 3.92Å; L36-D38 WeakPolarHBondContact CD2-OD2 2.99Å; L36-D38 HydrophobicContact CG-CB 3.81Å; L36-D38 VanDerWaalsContact CG-OD2 3.29Å; L36-D38 WeakPolarHBondContact CG-OD2 2.88Å; L36-D38 PolarHBondContact O-N 2.88Å
37	E	45.8	Very low	46.1	Very low	169 Å²	169	154.1 Å²	154.1	79%	0.79	76%	0.764	S	S	*	*			trans	-62.6	45	150.1	-69.8	-121.8	132.1	0	0	109.1	D35 D39	D35-E37 PolarHBondContact O-N 3.3Å; E37-D39 PolarHBondContact O-N 3.44Å
38	D	48.3	Very low	46.3	Very low	109 Å²	109	150.2 Å²	150.2	58%	0.583	76%	0.76	S	S	*	*			trans	-78.4	83.4	163.5	-84.5	-20.7	0	0	0	105.4	L36 Y40	L36-D38 WeakPolarHBondContact CD1-OD2 3.34Å; L36-D38 HydrophobicContact CD2-CB 3.92Å; L36-D38 WeakPolarHBondContact CD2-OD2 2.99Å; L36-D38 HydrophobicContact CG-CB 3.81Å; L36-D38 VanDerWaalsContact CG-OD2 3.29Å; L36-D38 WeakPolarHBondContact CG-OD2 2.88Å; L36-D38 PolarHBondContact O-N 2.88Å; D38-Y40 VanDerWaalsContact C-N 3.29Å; D38-Y40 PolarHBondContact O-N 3.09Å
39	D	46.1	Very low	46.5	Very low	158 Å²	158	151.8 Å²	151.8	85%	0.845	77%	0.77	S	S	*	*				20.8	70.7	129.2	-83.3	-40.5	0	0	0	113.4	E37	E37-D39 PolarHBondContact O-N 3.44Å
40	Y	41.7	Very low	46.5	Very low	214 Å²	214	150.9 Å²	150.9	84%	0.839	77%	0.766	S	S	*	*			trans	-77.7	121.8	168.8	-132.2	-94.8	0	0	0	107	D38 E42	D38-Y40 VanDerWaalsContact C-N 3.29Å; D38-Y40 PolarHBondContact O-N 3.09Å; Y40-E42 PolarHBondContact O-N 3.04Å; Y40-E42 VanDerWaalsContact O-N 3.16Å
41	P	48.7	Very low	46.6	Very low	104 Å²	104	151.5 Å²	151.5	68%	0.675	77%	0.766	S	S	*	*			trans	-60.6	122.8	-173	21.3	-31.4	0	0	0	110.6	I43	P41-I43 PolarHBondContact O-N 2.9Å; P41-I43 VanDerWaalsContact O-N 3.13Å
42	E	51.4	Low	46.5	Very low	189 Å²	189	150 Å²	150	88%	0.883	76%	0.761	S	S	*	*			trans	-55.8	115.9	177.7	-67	-172.9	165.9	0	0	110.2	Y40 P44	Y40-E42 PolarHBondContact O-N 3.04Å; Y40-E42 VanDerWaalsContact O-N 3.16Å; E42-P44 WeakPolarHBondContact O-CD 3.42Å
43	I	55.7	Low	46.7	Very low	150 Å²	150	149.4 Å²	149.4	77%	0.769	76%	0.764	S	S	*	*			trans	-75.1	118.6	178.1	-59.7	167.4	0	0	0	107.8	P41 G45	P41-I43 PolarHBondContact O-N 2.9Å; P41-I43 VanDerWaalsContact O-N 3.13Å; I43-G45 PolarHBondContact O-N 2.61Å
44	P	42.5	Very low	46.9	Very low	132 Å²	132	150.2 Å²	150.2	86%	0.857	76%	0.764	S	S	*	*	S	Bend	trans	-76.4	94.3	-176.2	29.6	-31.8	0	0	0	109.5	E42	E42-P44 WeakPolarHBondContact O-CD 3.42Å
45	G	46.2	Very low	47.1	Very low	56 Å²	56	148.8 Å²	148.8	58%	0.577	76%	0.759	S	S	*	*	S	Bend	trans	168.7	64.3	-177.5	0	0	0	0	0	114.2	I43 Y47	I43-G45 PolarHBondContact O-N 2.61Å; G45-Y47 PolarHBondContact O-N 2.67Å
46	R	41	Very low	47.3	Very low	235 Å²	235	148.1 Å²	148.1	89%	0.887	76%	0.76	S	S	*	*			trans	13	105.7	153.4	-78.6	-177.7	167.6	-174.8	-2.8	116.5
47	Y	43.3	Very low	47.7	Very low	225 Å²	225	148.5 Å²	148.5	88%	0.882	77%	0.768	S	S	*	*				-122.6	113.9	126.3	-71.6	-79.9	0	0	0	107.4	G45 P49	G45-Y47 PolarHBondContact O-N 2.67Å; Y47-P49 WeakPolarHBondContact O-CD 3.5Å
48	S	47.9	Very low	48.2	Very low	99 Å²	99	148.7 Å²	148.7	69%	0.692	77%	0.768	S	S	*	*			trans	-55.7	125.5	168.8	-89.2	0	0	0	0	108.7	S50	S48-S50 PolarHBondContact O-N 2.8Å
49	P	49.9	Very low	48.6	Very low	136 Å²	136	150.2 Å²	150.2	88%	0.883	77%	0.77	S	S	*	*			trans	-80.4	68	173.5	33.2	-31.4	0	0	0	108.7	Y47	Y47-P49 WeakPolarHBondContact O-CD 3.5Å
50	S	48.5	Very low	49.2	Very low	89 Å²	89	146 Å²	146	62%	0.622	75%	0.748	S	S	*	*			trans	-96.1	132.5	152.1	56.1	0	0	0	0	106.4	S48	S48-S50 PolarHBondContact O-N 2.8Å
51	M	47.8	Very low	50.2	Low	170 Å²	170	143.3 Å²	143.3	84%	0.837	74%	0.737	S	S	*	*	S	Bend	trans	91	60	-179.6	-44	-72	-178.8	0	0	116.9
52	H	46	Very low	50.6	Low	162 Å²	162	144.8 Å²	144.8	75%	0.75	73%	0.733	S	S	*	*			trans	-156.7	55.8	138.3	-89.9	-38	0	0	0	110.2	H55	H52-H55 AromaticContact ND1-CD2 3.72Å
53	K	47.8	Very low	51.1	Low	198 Å²	198	140.2 Å²	140.2	86%	0.861	71%	0.714	S	S	*	*			trans	-82.7	135.7	153.7	-75.2	-178.6	177.4	179.7	0	106.3
54	D	49.5	Very low	51.2	Low	138 Å²	138	141.3 Å²	141.3	74%	0.738	71%	0.709	S	S	*	*			trans	94.1	24.3	168.9	-45.5	-22.5	0	0	0	118.6	T56	D54-T56 VanDerWaalsContact C-N 3.28Å
55	H	50.8	Low	51.8	Low	143 Å²	143	142.3 Å²	142.3	66%	0.662	70%	0.7	S	S	*	*			trans	-98.5	49	145	-63.3	-54.3	0	0	0	110.6	H52 T57	H52-H55 AromaticContact ND1-CD2 3.72Å; H55-T57 PolarHBondContact O-N 2.6Å
56	T	48.1	Very low	52.1	Low	123 Å²	123	144.4 Å²	144.4	76%	0.755	69%	0.69	S	S	*	*			trans	-63	78.8	146.1	11.4	0	0	0	0	105.9	D54 H58	D54-T56 VanDerWaalsContact C-N 3.28Å; T56-H58 PolarHBondContact O-N 2.69Å
57	T	55.9	Low	52.6	Low	119 Å²	119	142.3 Å²	142.3	73%	0.73	68%	0.682	S	S	*	*			trans	-57.7	97.1	160	46.3	0	0	0	0	104.3	H55 F59	H55-T57 PolarHBondContact O-N 2.6Å; T57-F59 VanDerWaalsContact C-N 3.34Å; T57-F59 PolarHBondContact O-N 3.4Å
58	H	55.6	Low	53.1	Low	174 Å²	174	133.5 Å²	133.5	81%	0.806	65%	0.654	S	S	*	*			trans	-50	106	179.9	-166.5	-75.5	0	0	0	105.6	T56 N60	T56-H58 PolarHBondContact O-N 2.69Å; H58-N60 VanDerWaalsContact C-N 3.3Å; H58-N60 PolarHBondContact O-N 2.92Å
59	F	55.5	Low	53.6	Low	141 Å²	141	135.8 Å²	135.8	62%	0.618	65%	0.651	S	S	*	*			trans	-62.1	98.3	-172.8	173.5	-96.4	0	0	0	107.1	T57 Y61 R64	T57-F59 VanDerWaalsContact C-N 3.34Å; T57-F59 PolarHBondContact O-N 3.4Å; F59-Y61 PolarHBondContact O-N 3.2Å; F59-R64 HydrophobicContact CZ-CG 4.49Å
60	N	58.8	Low	53.9	Low	70 Å²	70	138.9 Å²	138.9	37%	0.374	65%	0.646	S	S	.	*			trans	-85.9	101.7	-175.4	-170.4	-6.4	0	0	0	107.6	H58 K62 D63	H58-N60 VanDerWaalsContact C-N 3.3Å; H58-N60 PolarHBondContact O-N 2.92Å; N60-K62 PolarHBondContact O-N 3.32Å; N60-K62 VanDerWaalsContact OD1-CB 3.26Å; N60-K62 WeakPolarHBondContact OD1-CB 3.44Å; N60-K62 WeakPolarHBondContact OD1-CG 3.26Å; N60-K62 PolarHBondContact OD1-N 3.12Å; N60-K62 VanDerWaalsContact OD1-N 3.12Å; N60-D63 WeakPolarHBondContact O-CB 3.49Å; N60-D63 PolarHBondContact O-N 2.76Å
61	Y	63.8	Low	54.3	Low	156 Å²	156	136.8 Å²	136.8	61%	0.612	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-55.9	-22.9	177.5	69.4	-88.9	0	0	0	112.7	F59 D63 R64	F59-Y61 PolarHBondContact O-N 3.2Å; Y61-D63 PolarHBondContact O-N 3.03Å; Y61-R64 WeakPolarHBondContact O-CB 3.5Å; Y61-R64 PolarHBondContact O-N 2.74Å
62	K	57.8	Low	54.9	Low	136 Å²	136	130.6 Å²	130.6	59%	0.591	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-64.1	-25.5	174.9	-61.2	-176.6	177.1	-179.2	0	112.7	N60	N60-K62 PolarHBondContact O-N 3.32Å; N60-K62 VanDerWaalsContact OD1-CB 3.26Å; N60-K62 WeakPolarHBondContact OD1-CB 3.44Å; N60-K62 WeakPolarHBondContact OD1-CG 3.26Å; N60-K62 PolarHBondContact OD1-N 3.12Å; N60-K62 VanDerWaalsContact OD1-N 3.12Å
63	D	60	Low	55.6	Low	92 Å²	92	126.6 Å²	126.6	49%	0.492	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-78.5	-15.2	177.4	-78.2	-36.1	0	0	0	113.7	N60 Y61 F65	N60-D63 WeakPolarHBondContact O-CB 3.49Å; N60-D63 PolarHBondContact O-N 2.76Å; Y61-D63 PolarHBondContact O-N 3.03Å; D63-F65 VanDerWaalsContact C-N 3.25Å; D63-F65 PolarHBondContact O-N 3.25Å
64	R	57.9	Low	56.5	Low	174 Å²	174	126.2 Å²	126.2	66%	0.657	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-63.7	-33.7	172.9	-82	-167.5	172.1	180	7	112.1	F59 Y61	F59-R64 HydrophobicContact CZ-CG 4.49Å; Y61-R64 WeakPolarHBondContact O-CB 3.5Å; Y61-R64 PolarHBondContact O-N 2.74Å
65	F	54.9	Low	57.1	Low	152 Å²	152	124.9 Å²	124.9	67%	0.667	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-101.7	18.2	-172.3	-66.5	-77.9	0	0	0	114	D63 W67	D63-F65 VanDerWaalsContact C-N 3.25Å; D63-F65 PolarHBondContact O-N 3.25Å; F65-W67 PolarHBondContact O-N 2.67Å
66	R	54.5	Low	57.6	Low	101 Å²	101	119.4 Å²	119.4	38%	0.381	55%	0.553	S	S	.	*			trans	-75.7	74.5	160	-87.9	-175.6	77.8	162.3	12	110	S68 K69	R66-S68 PolarHBondContact O-N 2.66Å; R66-K69 HydrophobicContact CB-CB 4.46Å; R66-K69 VanDerWaalsContact NH1-CE 3.3Å; R66-K69 PolarHBondContact O-N 2.79Å; R66-K69 VanDerWaalsContact O-N 3.09Å
67	W	50.6	Low	58.2	Low	190 Å²	190	117.1 Å²	117.1	72%	0.72	55%	0.553	S	S	*	*	H	α-helix	trans	-48.5	-27.3	163.7	-77.4	84.6	0	0	0	111.7	F65 K69 V71	F65-W67 PolarHBondContact O-N 2.67Å; W67-K69 PolarHBondContact O-N 2.74Å; W67-V71 HydrophobicContact CE3-CG2 4.49Å; W67-V71 WeakPolarHBondContact O-CG2 3.41Å
68	S	54.5	Low	58.6	Low	41 Å²	41	113.6 Å²	113.6	29%	0.287	54%	0.541	S	S	.	.	H	α-helix	trans	-68.3	-26.7	178.9	60.2	0	0	0	0	115.9	R66 Y81	R66-S68 PolarHBondContact O-N 2.66Å; S68-Y81 WeakPolarHBondContact CB-O 3.46Å
69	K	56.5	Low	58.7	Low	146 Å²	146	110.1 Å²	110.1	64%	0.635	53%	0.527	S	S	*	.	H	α-helix	trans	-98.4	-26.7	-173.7	-92.3	-173.4	168.2	170.2	0	114.7	R66 W67	R66-K69 HydrophobicContact CB-CB 4.46Å; R66-K69 VanDerWaalsContact NH1-CE 3.3Å; R66-K69 PolarHBondContact O-N 2.79Å; R66-K69 VanDerWaalsContact O-N 3.09Å; W67-K69 PolarHBondContact O-N 2.74Å
70	R	56.1	Low	59	Low	202 Å²	202	113.7 Å²	113.7	76%	0.762	54%	0.536	S	S	*	.	H	α-helix	trans	-105.4	-6.9	-167.6	-71.6	-171.2	-177.4	-149.4	0.4	115	P72	R70-P72 WeakPolarHBondContact O-CD 3.29Å
71	V	58	Low	59	Low	45 Å²	45	117.6 Å²	117.6	27%	0.273	55%	0.547	S	S	.	.	S	Bend	trans	-83.6	106.4	172.7	-168.3	0	0	0	0	107.5	W67 I75 T76	W67-V71 HydrophobicContact CE3-CG2 4.49Å; W67-V71 WeakPolarHBondContact O-CG2 3.41Å; V71-I75 HydrophobicContact CG1-CB 3.6Å; V71-I75 HydrophobicContact CG1-CG2 3.7Å; V71-T76 HydrophobicContact CB-CG2 3.6Å; V71-T76 HydrophobicContact CG1-CG2 3.27Å; V71-T76 HydrophobicContact CG2-CG2 4.49Å
72	P	59.8	Low	58.7	Low	40 Å²	40	124.7 Å²	124.7	26%	0.26	57%	0.573	S	S	.	*			trans	-61.3	145.5	176.1	26.3	-34.9	0	0	0	109.7	R70 Y74 I75	R70-P72 WeakPolarHBondContact O-CD 3.29Å; P72-Y74 HydrophobicContact CB-CD1 3.6Å; P72-Y74 HydrophobicContact CB-CE1 3.22Å; P72-Y74 HydrophobicContact CG-CD1 3.93Å; P72-Y74 HydrophobicContact CG-CE1 3.23Å; P72-Y74 HydrophobicContact CG-CE2 4.04Å; P72-Y74 WeakPolarHBondContact CG-OH 3.42Å; P72-Y74 PolarHBondContact O-N 2.79Å; P72-I75 HydrophobicContact CG-CD1 3.73Å; P72-I75 HydrophobicContact CG-CG1 4.04Å; P72-I75 PolarHBondContact O-N 2.84Å
73	P	61.9	Low	58.7	Low	77 Å²	77	124.1 Å²	124.1	50%	0.5	57%	0.572	S	S	.	*	H	α-helix	trans	-60.8	-22.8	-167.5	21.5	-32.9	0	0	0	113.9	I75 T76 G77 G78	P73-I75 PolarHBondContact O-N 2.86Å; P73-T76 PolarHBondContact O-N 2.68Å; P73-G77 CarbonylContact O-C 3.59Å; P73-G77 PolarHBondContact O-N 2.81Å; P73-G78 PolarHBondContact O-N 2.95Å
74	Y	64.9	Low	58.6	Low	191 Å²	191	125.8 Å²	125.8	75%	0.749	58%	0.576	S	S	*	*	H	α-helix	trans	-65.7	-21.5	174.7	65.9	-101	0	0	0	113.1	P72	P72-Y74 HydrophobicContact CB-CD1 3.6Å; P72-Y74 HydrophobicContact CB-CE1 3.22Å; P72-Y74 HydrophobicContact CG-CD1 3.93Å; P72-Y74 HydrophobicContact CG-CE1 3.23Å; P72-Y74 HydrophobicContact CG-CE2 4.04Å; P72-Y74 WeakPolarHBondContact CG-OH 3.42Å; P72-Y74 PolarHBondContact O-N 2.79Å
75	I	62.2	Low	58.7	Low	109 Å²	109	123.1 Å²	123.1	56%	0.559	57%	0.571	S	S	*	*	H	α-helix	trans	-90.5	-37.8	175.4	-55.1	-179.7	0	0	0	110.7	V71 P72 P73 G77	V71-I75 HydrophobicContact CG1-CB 3.6Å; V71-I75 HydrophobicContact CG1-CG2 3.7Å; P72-I75 HydrophobicContact CG-CD1 3.73Å; P72-I75 HydrophobicContact CG-CG1 4.04Å; P72-I75 PolarHBondContact O-N 2.84Å; P73-I75 PolarHBondContact O-N 2.86Å; I75-G77 VanDerWaalsContact C-N 3.3Å; I75-G77 PolarHBondContact O-N 2.88Å
76	T	62.3	Low	58.9	Low	29 Å²	29	121.4 Å²	121.4	18%	0.178	57%	0.566	C	S	.	*	H	α-helix	trans	-82	-2.8	177.8	61.5	0	0	0	0	114.5	V71 P73 G78 I79	V71-T76 HydrophobicContact CB-CG2 3.6Å; V71-T76 HydrophobicContact CG1-CG2 3.27Å; V71-T76 HydrophobicContact CG2-CG2 4.49Å; P73-T76 PolarHBondContact O-N 2.68Å; T76-G78 PolarHBondContact O-N 3.16Å; T76-G78 PolarHBondContact OG1-N 2.85Å; T76-I79 WeakPolarHBondContact CB-O 3.36Å; T76-I79 PolarHBondContact O-N 2.96Å; T76-I79 PolarHBondContact OG1-N 2.89Å; T76-I79 PolarHBondContact OG1-O 3.45Å
77	G	60.5	Low	59.2	Low	74 Å²	74	122.7 Å²	122.7	76%	0.763	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	63.4	25.4	-169.2	0	0	0	0	0	113.1	P73 I75	P73-G77 CarbonylContact O-C 3.59Å; P73-G77 PolarHBondContact O-N 2.81Å; I75-G77 VanDerWaalsContact C-N 3.3Å; I75-G77 PolarHBondContact O-N 2.88Å
78	G	63.5	Low	59.7	Low	46 Å²	46	118.2 Å²	118.2	47%	0.474	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	91.4	0.6	-179.8	0	0	0	0	0	115.7	P73 T76 R80	P73-G78 PolarHBondContact O-N 2.95Å; T76-G78 PolarHBondContact O-N 3.16Å; T76-G78 PolarHBondContact OG1-N 2.85Å; G78-R80 PolarHBondContact O-N 2.95Å
79	I	57.5	Low	60.1	Low	101 Å²	101	123.7 Å²	123.7	52%	0.518	59%	0.588	S	S	.	*			trans	-72	116.4	175.8	-58.5	172.8	0	0	0	109.1	T76 Y81	T76-I79 WeakPolarHBondContact CB-O 3.36Å; T76-I79 PolarHBondContact O-N 2.96Å; T76-I79 PolarHBondContact OG1-N 2.89Å; T76-I79 PolarHBondContact OG1-O 3.45Å; I79-Y81 HydrophobicContact CG2-CE1 4.34Å; I79-Y81 HydrophobicContact CG2-CE2 4.2Å
80	R	62.4	Low	60.4	Low	216 Å²	216	122 Å²	122	82%	0.815	58%	0.584	S	S	*	*			trans	-99.6	113.5	170.4	-63.4	-176.4	-178.4	-164.4	0.4	108.3	G78 R82	G78-R80 PolarHBondContact O-N 2.95Å; R80-R82 PolarHBondContact O-N 3.13Å
81	Y	58.8	Low	60.7	Low	151 Å²	151	115.3 Å²	115.3	59%	0.592	57%	0.569	S	S	*	*			trans	-72.7	119.5	171	-62.4	-84.2	0	0	0	108.4	S68 I79	S68-Y81 WeakPolarHBondContact CB-O 3.46Å; I79-Y81 HydrophobicContact CG2-CE1 4.34Å; I79-Y81 HydrophobicContact CG2-CE2 4.2Å
82	R	56.9	Low	61	Low	305 Å²	305	121.7 Å²	121.7	100%	1.151	60%	0.596	S	S	*	*			trans	-66.4	0	177.8	-81	-176.7	171.6	177.9	-2.5	111.6	R80	R80-R82 PolarHBondContact O-N 3.13Å

Retrieved 82 of 82 residues in 23.3 ms (Link to these results)

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