G4VA75_SCHMA Loading...

Ubiquitin-like domain-containing protein

AlphaFold DB , UniProt , Accession G4VA75, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 111 aa.

						>G4VA75_SCHMA|G4VA75
MDGQQSVGGKLSQSLHFSDGVFDLANEHNEECSDSSKSNNILLRVIDWCGEKLAWSFGISSPKYYYIIENAKMRASERDFIDLGDMDDPHVAILQSSVPNNYTHPSVLSSG
					

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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	50	Low	44.6	Very low	239 Å²	239	141.3 Å²	141.3	100%	1.177	83%	0.829	S	S	*	*				0	85.7	0	-82.6	-177.1	147.3	0	0	104.8
2	D	45.5	Very low	45.3	Very low	157 Å²	157	137.6 Å²	137.6	84%	0.84	82%	0.816	S	S	*	*			trans	-110.9	139.2	-157.7	-61.8	-91.2	0	0	0	110.1
3	G	46.9	Very low	46	Very low	71 Å²	71	138.2 Å²	138.2	73%	0.732	81%	0.806	S	S	*	*			trans	80.1	149.8	150.3	0	0	0	0	0	116.6
4	Q	52.3	Low	46.6	Very low	188 Å²	188	133.1 Å²	133.1	88%	0.879	78%	0.782	S	S	*	*			cis	-155.4	142.5	5.3	-69.3	-164	-57.9	0	0	109.4
5	Q	39.2	Very low	47.3	Very low	188 Å²	188	131.5 Å²	131.5	88%	0.879	77%	0.768	S	S	*	*			trans	-68.1	128.3	157.2	-70.2	175.5	9.4	0	0	108.1
6	S	42.3	Very low	47.4	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	76%	0.762	S	S	*	*			trans	-126	98.2	168.9	-173.6	0	0	0	0	109	G8	S6-G8 VanDerWaalsContact C-N 3.34Å; S6-G8 PolarHBondContact O-N 3.15Å
7	V	41.1	Very low	48.3	Very low	140 Å²	140	130.1 Å²	130.1	85%	0.848	74%	0.741	S	S	*	*			trans	-81.6	78.8	172.1	-77	0	0	0	0	108.8	G9	V7-G9 PolarHBondContact O-N 3.44Å
8	G	40.3	Very low	49.1	Very low	65 Å²	65	130.5 Å²	130.5	67%	0.67	75%	0.753	S	S	*	*			trans	-88.6	85.7	174.9	0	0	0	0	0	111.6	S6 K10	S6-G8 VanDerWaalsContact C-N 3.34Å; S6-G8 PolarHBondContact O-N 3.15Å; G8-K10 PolarHBondContact O-N 2.75Å; G8-K10 VanDerWaalsContact O-N 3.13Å
9	G	36.8	Very low	49.8	Very low	77 Å²	77	131.7 Å²	131.7	79%	0.794	76%	0.757	S	S	*	*			trans	-65.1	105.2	171.9	0	0	0	0	0	111.4	V7 L11	V7-G9 PolarHBondContact O-N 3.44Å; G9-L11 PolarHBondContact O-N 2.84Å
10	K	46.9	Very low	50	Low	169 Å²	169	127.2 Å²	127.2	74%	0.735	74%	0.74	S	S	*	*			trans	-74.4	102.4	169.6	-76.8	178.6	173.5	-178.1	0	108.8	G8 S12	G8-K10 PolarHBondContact O-N 2.75Å; G8-K10 VanDerWaalsContact O-N 3.13Å; K10-S12 PolarHBondContact O-N 3.04Å
11	L	49.1	Very low	50.6	Low	145 Å²	145	125.3 Å²	125.3	76%	0.759	73%	0.73	S	S	*	*			trans	-74.7	79.5	171.1	-117.7	149.8	0	0	0	108.4	G9 Q13	G9-L11 PolarHBondContact O-N 2.84Å; L11-Q13 HydrophobicContact CD2-CG 3.87Å; L11-Q13 PolarHBondContact O-N 3.33Å
12	S	53.6	Low	50.9	Low	97 Å²	97	119.1 Å²	119.1	68%	0.678	70%	0.697	S	S	*	*			trans	-69.5	92.5	170.8	-56.7	0	0	0	0	108.8	K10 S14	K10-S12 PolarHBondContact O-N 3.04Å; S12-S14 PolarHBondContact O-N 3.28Å
13	Q	54.6	Low	51.4	Low	145 Å²	145	116.7 Å²	116.7	68%	0.678	68%	0.684	S	S	*	*			trans	-89.5	88.4	173.3	-69.2	-173.3	-0.9	0	0	108.8	L11	L11-Q13 HydrophobicContact CD2-CG 3.87Å; L11-Q13 PolarHBondContact O-N 3.33Å
14	S	54.5	Low	51.9	Low	68 Å²	68	120.1 Å²	120.1	48%	0.476	69%	0.685	S	S	.	*			trans	-77.1	131.7	161.4	61.7	0	0	0	0	108.6	S12	S12-S14 PolarHBondContact O-N 3.28Å
15	L	56.4	Low	51.6	Low	108 Å²	108	113.8 Å²	113.8	57%	0.565	66%	0.664	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.7	103.5	174.5	-92.7	158.2	0	0	0	107.7	F17 F22	L15-F17 HydrophobicContact CB-CE2 3.98Å; L15-F17 HydrophobicContact CB-CZ 4.37Å; L15-F17 HydrophobicContact CD2-CZ 4.45Å; L15-F22 PolarHBondContact N-O 3.5Å; L15-F22 PolarHBondContact O-N 3.01Å
16	H	49.6	Very low	52	Low	146 Å²	146	112.2 Å²	112.2	68%	0.676	66%	0.662	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.9	109.8	179.3	-167	-84.7	0	0	0	109.5	V21	H16-V21 WeakPolarHBondContact CD2-CG2 3.14Å
17	F	61.3	Low	52.3	Low	94 Å²	94	115.9 Å²	115.9	41%	0.412	67%	0.666	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.4	157.4	169.5	-62.5	-79.3	0	0	0	110	L15 D19 G20 W48	L15-F17 HydrophobicContact CB-CE2 3.98Å; L15-F17 HydrophobicContact CB-CZ 4.37Å; L15-F17 HydrophobicContact CD2-CZ 4.45Å; F17-D19 PolarHBondContact O-N 2.66Å; F17-G20 PolarHBondContact N-O 3.38Å; F17-G20 PolarHBondContact O-N 3.36Å; F17-W48 HydrophobicContact CE2-CH2 4Å; F17-W48 HydrophobicContact CZ-CH2 4.29Å
18	S	64.1	Low	52.4	Low	137 Å²	137	117.2 Å²	117.2	96%	0.958	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-4.5	177.6	-165.9	0	0	0	0	114.2
19	D	62.4	Low	52.7	Low	154 Å²	154	121.2 Å²	121.2	82%	0.824	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	15.4	-174.3	-159.1	21.7	0	0	0	112.4	F17	F17-D19 PolarHBondContact O-N 2.66Å
20	G	54	Low	53.2	Low	40 Å²	40	124.9 Å²	124.9	41%	0.412	67%	0.666	S	S	.	*	E	Extended strand (participates in β ladder)	trans	149.8	154.5	177.1	0	0	0	0	0	114.5	F17	F17-G20 PolarHBondContact N-O 3.38Å; F17-G20 PolarHBondContact O-N 3.36Å
21	V	60.8	Low	52.8	Low	88 Å²	88	126 Å²	126	53%	0.533	67%	0.673	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.5	127	177	171	0	0	0	0	109.3	H16 D23	H16-V21 WeakPolarHBondContact CD2-CG2 3.14Å; V21-D23 HydrophobicContact CG1-CB 4.48Å
22	F	56.9	Low	52.2	Low	110 Å²	110	124 Å²	124	48%	0.482	67%	0.671	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.9	113.3	164.2	-168.5	-97.2	0	0	0	108.5	L15 L24	L15-F22 PolarHBondContact N-O 3.5Å; L15-F22 PolarHBondContact O-N 3.01Å; F22-L24 HydrophobicContact CE1-CD1 4Å
23	D	55.4	Low	51.3	Low	106 Å²	106	123.8 Å²	123.8	57%	0.567	67%	0.669	S	S	*	*			trans	-100.2	116.6	-179.7	-153.2	-4.9	0	0	0	109.9	V21 A25	V21-D23 HydrophobicContact CG1-CB 4.48Å; D23-A25 PolarHBondContact O-N 2.85Å
24	L	58.2	Low	50.9	Low	143 Å²	143	123.1 Å²	123.1	75%	0.749	67%	0.67	S	S	*	*			trans	-89.8	24.6	178.3	-162.2	72.5	0	0	0	111.5	F22	F22-L24 HydrophobicContact CE1-CD1 4Å
25	A	46.2	Very low	50.4	Low	55 Å²	55	124.8 Å²	124.8	46%	0.455	68%	0.681	S	S	.	*			trans	-132.3	75.6	-169.2	0	0	0	0	0	113.2	D23	D23-A25 PolarHBondContact O-N 2.85Å
26	N	47.1	Very low	50	Low	154 Å²	154	123.2 Å²	123.2	82%	0.824	68%	0.68	S	S	*	*			trans	-166.6	99.3	146.7	-141	8.6	0	0	0	112.8
27	E	50	Low	49.9	Very low	192 Å²	192	123.4 Å²	123.4	90%	0.897	68%	0.679	S	S	*	*			trans	-172.7	98.6	132.6	-102.5	-179.5	139.9	0	0	108.4
28	H	42.5	Very low	49.5	Very low	168 Å²	168	122 Å²	122	78%	0.778	68%	0.68	S	S	*	*			trans	-99.7	70	175.8	-159	-76.5	0	0	0	108.2
29	N	45.8	Very low	49	Very low	149 Å²	149	119.1 Å²	119.1	80%	0.797	65%	0.654	S	S	*	*			trans	-167.9	154.6	162.8	-137.9	-27.6	0	0	0	108.9
30	E	48.4	Very low	49.2	Very low	155 Å²	155	116.2 Å²	116.2	72%	0.724	64%	0.639	S	S	*	*			trans	90.1	77.2	178.3	-42.9	-150.6	151.1	0	0	115.9
31	E	38.7	Very low	50.3	Low	191 Å²	191	119.7 Å²	119.7	89%	0.893	65%	0.647	S	S	*	*				-4.3	143.4	119.5	-139.7	160.8	103.7	0	0	116.2
32	C	35.7	Very low	51	Low	105 Å²	105	120.5 Å²	120.5	71%	0.709	65%	0.647	S	S	*	*			trans	88.6	105.2	159.6	-148.2	0	0	0	0	117.4
33	S	35.6	Very low	51.9	Low	91 Å²	91	120 Å²	120	64%	0.636	65%	0.649	S	S	*	*			trans	57.2	149.5	132.9	-61.4	0	0	0	0	121.2
34	D	44.5	Very low	52.9	Low	132 Å²	132	124 Å²	124	71%	0.706	66%	0.656	S	S	*	*			trans	86.3	112	160.2	-52.7	-32.6	0	0	0	116.8	S36	D34-S36 PolarHBondContact O-N 3.29Å
35	S	45.4	Very low	53.8	Low	102 Å²	102	120.5 Å²	120.5	71%	0.713	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	27.8	170.4	68.2	0	0	0	0	114.6	S38 N39	S35-S38 PolarHBondContact O-OG 2.89Å; S35-N39 PolarHBondContact O-OD1 3.45Å; S35-N39 VanDerWaalsContact O-OD1 3.13Å
36	S	48	Very low	55.5	Low	76 Å²	76	122.5 Å²	122.5	53%	0.531	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109	-17	-174.4	-68	0	0	0	0	113.2	D34 N39	D34-S36 PolarHBondContact O-N 3.29Å; S36-N39 PolarHBondContact O-ND2 3.48Å; S36-N39 VanDerWaalsContact O-ND2 3.09Å
37	K	46.7	Very low	57	Low	149 Å²	149	120.2 Å²	120.2	65%	0.648	63%	0.631	S	S	*	*	S	Bend	trans	-83.1	-25.5	175.3	-83.9	174.4	176.5	170.7	0	113.5	N39	K37-N39 VanDerWaalsContact C-N 3.28Å; K37-N39 PolarHBondContact O-N 2.73Å
38	S	52.7	Low	58.4	Low	64 Å²	64	116.7 Å²	116.7	45%	0.448	61%	0.609	S	S	.	*	H	α-helix	trans	-65.7	-28.2	179.5	43.9	0	0	0	0	114	S35 N40 I41 L42	S35-S38 PolarHBondContact O-OG 2.89Å; S38-N40 VanDerWaalsContact C-N 3.29Å; S38-N40 PolarHBondContact O-N 2.96Å; S38-I41 PolarHBondContact O-N 3.18Å; S38-L42 PolarHBondContact O-N 2.78Å; S38-L42 VanDerWaalsContact O-N 3.09Å
39	N	54.8	Low	60.1	Low	78 Å²	78	111.4 Å²	111.4	42%	0.417	59%	0.591	S	S	.	*	H	α-helix	trans	-60.7	-41.1	-171.9	-40	-17.5	0	0	0	111.1	S35 S36 K37 L42 L43	S35-N39 PolarHBondContact O-OD1 3.45Å; S35-N39 VanDerWaalsContact O-OD1 3.13Å; S36-N39 PolarHBondContact O-ND2 3.48Å; S36-N39 VanDerWaalsContact O-ND2 3.09Å; K37-N39 VanDerWaalsContact C-N 3.28Å; K37-N39 PolarHBondContact O-N 2.73Å; N39-L42 PolarHBondContact O-N 3.09Å; N39-L43 VanDerWaalsContact O-CG 3.26Å; N39-L43 WeakPolarHBondContact O-CG 3.12Å; N39-L43 PolarHBondContact O-N 3.41Å
40	N	66.6	Low	61.7	Low	93 Å²	93	106.1 Å²	106.1	50%	0.497	57%	0.571	S	S	.	*	H	α-helix	trans	-72.7	-36.3	-175.9	-64.8	-64.8	0	0	0	112.6	S38 R44	S38-N40 VanDerWaalsContact C-N 3.29Å; S38-N40 PolarHBondContact O-N 2.96Å; N40-R44 WeakPolarHBondContact O-CG 3.44Å; N40-R44 PolarHBondContact O-N 3.26Å; N40-R44 VanDerWaalsContact O-N 3.16Å
41	I	76.4	Confident	62.8	Low	113 Å²	113	104.9 Å²	104.9	58%	0.579	57%	0.565	S	S	*	*	H	α-helix	trans	-68.3	-43.9	175	-80.9	86.6	0	0	0	109.9	S38 L43 R44 V45	S38-I41 PolarHBondContact O-N 3.18Å; I41-L43 PolarHBondContact O-N 3.32Å; I41-R44 PolarHBondContact O-N 3.46Å; I41-V45 HydrophobicContact CG2-CG2 4.26Å; I41-V45 WeakPolarHBondContact O-CG2 3.12Å; I41-V45 PolarHBondContact O-N 2.85Å
42	L	74.8	Confident	64.6	Low	104 Å²	104	100.5 Å²	100.5	55%	0.545	54%	0.544	S	S	.	.	H	α-helix	trans	-61.1	-44.5	-179.9	-120.2	165.8	0	0	0	111.5	S38 N39 V45 I46	S38-L42 PolarHBondContact O-N 2.78Å; S38-L42 VanDerWaalsContact O-N 3.09Å; N39-L42 PolarHBondContact O-N 3.09Å; L42-V45 PolarHBondContact O-N 3.16Å; L42-I46 HydrophobicContact CD2-CD1 3.79Å; L42-I46 HydrophobicContact CD2-CG1 4.21Å; L42-I46 WeakPolarHBondContact O-CB 3.43Å; L42-I46 WeakPolarHBondContact O-CD1 3.29Å; L42-I46 WeakPolarHBondContact O-CG1 3.16Å; L42-I46 PolarHBondContact O-N 3.5Å
43	L	77.5	Confident	66.3	Low	99 Å²	99	99.3 Å²	99.3	52%	0.518	53%	0.529	S	S	.	.	H	α-helix	trans	-59.4	-45.8	174.2	-70.3	170.5	0	0	0	111.7	N39 I41 V45 I46 D47	N39-L43 VanDerWaalsContact O-CG 3.26Å; N39-L43 WeakPolarHBondContact O-CG 3.12Å; N39-L43 PolarHBondContact O-N 3.41Å; I41-L43 PolarHBondContact O-N 3.32Å; L43-V45 PolarHBondContact O-N 2.74Å; L43-I46 PolarHBondContact O-N 2.96Å; L43-D47 WeakPolarHBondContact O-CB 3.42Å; L43-D47 VanDerWaalsContact O-CG 3.29Å; L43-D47 PolarHBondContact O-N 2.83Å
44	R	75.4	Confident	67.8	Low	190 Å²	190	96.5 Å²	96.5	72%	0.717	51%	0.512	S	S	*	.	H	α-helix	trans	-62.7	-39.3	176.7	-74.8	-174.5	-158.3	-178.7	6.5	113.5	N40 I41 D47 W48	N40-R44 WeakPolarHBondContact O-CG 3.44Å; N40-R44 PolarHBondContact O-N 3.26Å; N40-R44 VanDerWaalsContact O-N 3.16Å; I41-R44 PolarHBondContact O-N 3.46Å; R44-D47 PolarHBondContact O-N 3.02Å; R44-W48 WeakPolarHBondContact O-CB 3.24Å; R44-W48 PolarHBondContact O-N 2.96Å
45	V	77.8	Confident	68.7	Low	71 Å²	71	99.7 Å²	99.7	43%	0.43	51%	0.514	S	S	.	.	H	α-helix	trans	-68.8	-40	177.4	172.5	0	0	0	0	110.5	I41 L42 L43 W48 C49	I41-V45 HydrophobicContact CG2-CG2 4.26Å; I41-V45 WeakPolarHBondContact O-CG2 3.12Å; I41-V45 PolarHBondContact O-N 2.85Å; L42-V45 PolarHBondContact O-N 3.16Å; L43-V45 PolarHBondContact O-N 2.74Å; V45-W48 PolarHBondContact O-N 2.84Å; V45-C49 WeakPolarHBondContact O-CB 3.32Å; V45-C49 PolarHBondContact O-N 3.26Å
46	I	80.7	Confident	69.6	Low	97 Å²	97	99.1 Å²	99.1	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-44.1	174.3	-70.5	165.4	0	0	0	110.4	L42 L43 C49 G50	L42-I46 HydrophobicContact CD2-CD1 3.79Å; L42-I46 HydrophobicContact CD2-CG1 4.21Å; L42-I46 WeakPolarHBondContact O-CB 3.43Å; L42-I46 WeakPolarHBondContact O-CD1 3.29Å; L42-I46 WeakPolarHBondContact O-CG1 3.16Å; L42-I46 PolarHBondContact O-N 3.5Å; L43-I46 PolarHBondContact O-N 2.96Å; I46-C49 PolarHBondContact O-N 3.1Å; I46-G50 PolarHBondContact O-N 2.79Å
47	D	79.1	Confident	70.4	Confident	106 Å²	106	102.8 Å²	102.8	57%	0.567	52%	0.517	S	S	*	.	H	α-helix	trans	-60.5	-47.9	176.8	-73.8	-23.1	0	0	0	111.1	L43 R44 C49 G50 E51	L43-D47 WeakPolarHBondContact O-CB 3.42Å; L43-D47 VanDerWaalsContact O-CG 3.29Å; L43-D47 PolarHBondContact O-N 2.83Å; R44-D47 PolarHBondContact O-N 3.02Å; D47-C49 PolarHBondContact O-N 3.38Å; D47-G50 PolarHBondContact O-N 2.77Å; D47-E51 PolarHBondContact O-N 3.19Å
48	W	78.6	Confident	70.9	Confident	117 Å²	117	97.5 Å²	97.5	44%	0.443	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-40.2	177.8	-177.6	76.8	0	0	0	113	F17 R44 V45 K52	F17-W48 HydrophobicContact CE2-CH2 4Å; F17-W48 HydrophobicContact CZ-CH2 4.29Å; R44-W48 WeakPolarHBondContact O-CB 3.24Å; R44-W48 PolarHBondContact O-N 2.96Å; V45-W48 PolarHBondContact O-N 2.84Å; W48-K52 HydrophobicContact CD2-CD 4.32Å; W48-K52 HydrophobicContact CE3-CD 4.46Å; W48-K52 HydrophobicContact CH2-CD 4.02Å; W48-K52 HydrophobicContact CZ2-CD 3.87Å; W48-K52 HydrophobicContact CZ3-CD 4.3Å; W48-K52 PolarHBondContact O-N 3.25Å; W48-K52 VanDerWaalsContact O-N 3.08Å
49	C	79.2	Confident	71.2	Confident	58 Å²	58	101.2 Å²	101.2	39%	0.392	52%	0.518	S	S	.	.	H	α-helix	trans	-66.5	-43.1	174.7	-170.5	0	0	0	0	110.7	V45 I46 D47 E51 K52 L53	V45-C49 WeakPolarHBondContact O-CB 3.32Å; V45-C49 PolarHBondContact O-N 3.26Å; I46-C49 PolarHBondContact O-N 3.1Å; D47-C49 PolarHBondContact O-N 3.38Å; C49-E51 PolarHBondContact O-N 3.07Å; C49-K52 PolarHBondContact O-N 3.42Å; C49-L53 VanDerWaalsContact O-CB 3.26Å; C49-L53 WeakPolarHBondContact O-CB 3.48Å; C49-L53 WeakPolarHBondContact O-CG 3.07Å; C49-L53 PolarHBondContact O-N 3.02Å
50	G	79	Confident	71.3	Confident	37 Å²	37	100.3 Å²	100.3	38%	0.381	52%	0.518	S	S	.	.	H	α-helix	trans	-60.4	-43.1	177.2	0	0	0	0	0	112.2	I46 D47 L53 A54	I46-G50 PolarHBondContact O-N 2.79Å; D47-G50 PolarHBondContact O-N 2.77Å; G50-L53 PolarHBondContact O-N 2.8Å; G50-A54 WeakPolarHBondContact O-CB 3.18Å; G50-A54 PolarHBondContact O-N 3.45Å
51	E	72.1	Confident	70.3	Confident	129 Å²	129	99.2 Å²	99.2	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-61.4	-54.2	171.8	-74.1	-167.3	126.4	0	0	110.7	D47 C49 L53 A54 W55	D47-E51 PolarHBondContact O-N 3.19Å; C49-E51 PolarHBondContact O-N 3.07Å; E51-L53 PolarHBondContact O-N 2.65Å; E51-A54 WeakPolarHBondContact O-CB 3.26Å; E51-A54 PolarHBondContact O-N 3.49Å; E51-W55 PolarHBondContact O-N 2.77Å
52	K	75.3	Confident	69.3	Low	100 Å²	100	98.7 Å²	98.7	44%	0.435	52%	0.522	S	S	.	.	H	α-helix	trans	-59.9	-32.9	178.7	-74.4	-170.3	179.9	-66.6	0	113.5	W48 C49 S56	W48-K52 HydrophobicContact CD2-CD 4.32Å; W48-K52 HydrophobicContact CE3-CD 4.46Å; W48-K52 HydrophobicContact CH2-CD 4.02Å; W48-K52 HydrophobicContact CZ2-CD 3.87Å; W48-K52 HydrophobicContact CZ3-CD 4.3Å; W48-K52 PolarHBondContact O-N 3.25Å; W48-K52 VanDerWaalsContact O-N 3.08Å; C49-K52 PolarHBondContact O-N 3.42Å; K52-S56 WeakPolarHBondContact O-CB 3.29Å; K52-S56 PolarHBondContact O-N 2.96Å; K52-S56 PolarHBondContact O-OG 3.23Å
53	L	72.6	Confident	68.2	Low	79 Å²	79	101.8 Å²	101.8	41%	0.414	53%	0.531	S	S	.	.	H	α-helix	trans	-70.1	-40.2	174	-73.3	172.7	0	0	0	111.5	C49 G50 E51 W55 S56 F57	C49-L53 VanDerWaalsContact O-CB 3.26Å; C49-L53 WeakPolarHBondContact O-CB 3.48Å; C49-L53 WeakPolarHBondContact O-CG 3.07Å; C49-L53 PolarHBondContact O-N 3.02Å; G50-L53 PolarHBondContact O-N 2.8Å; E51-L53 PolarHBondContact O-N 2.65Å; L53-W55 VanDerWaalsContact C-N 3.27Å; L53-W55 PolarHBondContact O-N 3.36Å; L53-S56 VanDerWaalsContact CA-OG 3.29Å; L53-S56 WeakPolarHBondContact CA-OG 3.3Å; L53-S56 PolarHBondContact O-N 2.75Å; L53-S56 PolarHBondContact O-OG 2.9Å; L53-F57 HydrophobicContact CB-CD2 4.45Å; L53-F57 HydrophobicContact CD2-CD2 4.17Å; L53-F57 HydrophobicContact CD2-CE2 3.97Å; L53-F57 VanDerWaalsContact O-CB 3.3Å; L53-F57 WeakPolarHBondContact O-CB 3.43Å; L53-F57 PolarHBondContact O-N 3.26Å
54	A	67.1	Low	67	Low	33 Å²	33	104 Å²	104	27%	0.273	53%	0.533	S	S	.	.	H	α-helix	trans	-62.2	-36.2	174.6	0	0	0	0	0	112.3	G50 E51 G58 I59 S60	G50-A54 WeakPolarHBondContact O-CB 3.18Å; G50-A54 PolarHBondContact O-N 3.45Å; E51-A54 WeakPolarHBondContact O-CB 3.26Å; E51-A54 PolarHBondContact O-N 3.49Å; A54-G58 PolarHBondContact O-N 3.08Å; A54-I59 PolarHBondContact O-N 2.82Å; A54-I59 VanDerWaalsContact O-N 3.16Å; A54-S60 PolarHBondContact O-N 2.89Å
55	W	62.9	Low	65.8	Low	198 Å²	198	102.4 Å²	102.4	75%	0.75	53%	0.528	S	S	*	.	H	α-helix	trans	-71.2	-42.8	174	-75.2	67.2	0	0	0	112.2	E51 L53 G58	E51-W55 PolarHBondContact O-N 2.77Å; L53-W55 VanDerWaalsContact C-N 3.27Å; L53-W55 PolarHBondContact O-N 3.36Å; W55-G58 PolarHBondContact O-N 3.02Å
56	S	65.5	Low	64.7	Low	90 Å²	90	106.3 Å²	106.3	63%	0.629	54%	0.536	S	S	*	.	H	α-helix	trans	-78.2	-34.3	-177.7	51.5	0	0	0	0	114.5	K52 L53 G58	K52-S56 WeakPolarHBondContact O-CB 3.29Å; K52-S56 PolarHBondContact O-N 2.96Å; K52-S56 PolarHBondContact O-OG 3.23Å; L53-S56 VanDerWaalsContact CA-OG 3.29Å; L53-S56 WeakPolarHBondContact CA-OG 3.3Å; L53-S56 PolarHBondContact O-N 2.75Å; L53-S56 PolarHBondContact O-OG 2.9Å; S56-G58 PolarHBondContact O-N 3.25Å
57	F	63.7	Low	63.6	Low	154 Å²	154	105.1 Å²	105.1	68%	0.675	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-0.2	171	-86	-89.8	0	0	0	113.1	L53 I59	L53-F57 HydrophobicContact CB-CD2 4.45Å; L53-F57 HydrophobicContact CD2-CD2 4.17Å; L53-F57 HydrophobicContact CD2-CE2 3.97Å; L53-F57 VanDerWaalsContact O-CB 3.3Å; L53-F57 WeakPolarHBondContact O-CB 3.43Å; L53-F57 PolarHBondContact O-N 3.26Å; F57-I59 HydrophobicContact CB-CD1 3.97Å; F57-I59 HydrophobicContact CB-CG1 4Å; F57-I59 PolarHBondContact O-N 3.01Å; F57-I59 VanDerWaalsContact O-N 3.09Å
58	G	57	Low	62.8	Low	38 Å²	38	104.3 Å²	104.3	39%	0.392	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	12.5	178.5	0	0	0	0	0	114	A54 W55 S56 S60 S61	A54-G58 PolarHBondContact O-N 3.08Å; W55-G58 PolarHBondContact O-N 3.02Å; S56-G58 PolarHBondContact O-N 3.25Å; G58-S60 PolarHBondContact O-N 3.02Å; G58-S61 WeakPolarHBondContact O-CB 3.35Å; G58-S61 PolarHBondContact O-N 2.88Å
59	I	59.7	Low	61.8	Low	141 Å²	141	104 Å²	104	72%	0.723	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.4	172.1	-60.8	172.7	0	0	0	109.8	A54 F57	A54-I59 PolarHBondContact O-N 2.82Å; A54-I59 VanDerWaalsContact O-N 3.16Å; F57-I59 HydrophobicContact CB-CD1 3.97Å; F57-I59 HydrophobicContact CB-CG1 4Å; F57-I59 PolarHBondContact O-N 3.01Å; F57-I59 VanDerWaalsContact O-N 3.09Å
60	S	56.4	Low	60.7	Low	59 Å²	59	106.3 Å²	106.3	41%	0.413	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	3	170.3	-179.6	0	0	0	0	115.1	A54 G58 P62	A54-S60 PolarHBondContact O-N 2.89Å; G58-S60 PolarHBondContact O-N 3.02Å; S60-P62 VanDerWaalsContact O-CD 3.26Å; S60-P62 WeakPolarHBondContact O-CD 3.41Å
61	S	45.8	Very low	59.6	Low	70 Å²	70	106.8 Å²	106.8	49%	0.49	54%	0.537	S	S	.	.			trans	-88.1	112.4	174.1	-166.9	0	0	0	0	109.7	G58 K63	G58-S61 WeakPolarHBondContact O-CB 3.35Å; G58-S61 PolarHBondContact O-N 2.88Å; S61-K63 PolarHBondContact O-N 3.3Å
62	P	54.5	Low	58.8	Low	103 Å²	103	107.5 Å²	107.5	67%	0.669	54%	0.538	S	S	*	.			trans	-75.2	54.1	178.7	33.8	-35.1	0	0	0	110.6	S60 Y64	S60-P62 VanDerWaalsContact O-CD 3.26Å; S60-P62 WeakPolarHBondContact O-CD 3.41Å; P62-Y64 PolarHBondContact O-N 3.01Å
63	K	52.5	Low	57.9	Low	169 Å²	169	110.5 Å²	110.5	74%	0.735	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-11.3	173.3	-126.8	177.1	-176.7	174.7	0	112.4	S61	S61-K63 PolarHBondContact O-N 3.3Å
64	Y	51.8	Low	57	Low	144 Å²	144	115.9 Å²	115.9	57%	0.565	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	12.8	179.6	-62.2	-78.1	0	0	0	113.3	P62 Y66 I67 I68	P62-Y64 PolarHBondContact O-N 3.01Å; Y64-Y66 VanDerWaalsContact C-N 3.26Å; Y64-Y66 PolarHBondContact O-N 3.3Å; Y64-I67 HydrophobicContact CD1-CB 4.23Å; Y64-I67 HydrophobicContact CD1-CD1 3.56Å; Y64-I67 HydrophobicContact CD1-CG1 4.42Å; Y64-I67 HydrophobicContact CD1-CG2 4.47Å; Y64-I67 HydrophobicContact CE1-CD1 4.07Å; Y64-I67 CarbonylContact O-C 3.57Å; Y64-I67 PolarHBondContact O-N 2.96Å; Y64-I68 VanDerWaalsContact O-CB 3.29Å; Y64-I68 WeakPolarHBondContact O-CB 3.26Å; Y64-I68 WeakPolarHBondContact O-CD1 3.29Å; Y64-I68 WeakPolarHBondContact O-CG1 3.21Å; Y64-I68 PolarHBondContact O-N 2.82Å
65	Y	50.6	Low	56.4	Low	157 Å²	157	115.6 Å²	115.6	62%	0.616	57%	0.569	S	S	*	*	H	α-helix	trans	-52.3	-44.4	-177.9	-174.1	-93.1	0	0	0	112.3	I67 E69	Y65-I67 PolarHBondContact O-N 3.06Å; Y65-E69 VanDerWaalsContact O-CB 3.32Å; Y65-E69 WeakPolarHBondContact O-CB 3.2Å; Y65-E69 PolarHBondContact O-N 3.48Å
66	Y	55.1	Low	56	Low	154 Å²	154	111 Å²	111	60%	0.604	57%	0.566	S	S	*	*	H	α-helix	trans	-71.4	-29.3	178	99.8	-94.8	0	0	0	113.9	Y64 N70	Y64-Y66 VanDerWaalsContact C-N 3.26Å; Y64-Y66 PolarHBondContact O-N 3.3Å; Y66-N70 PolarHBondContact O-N 3.27Å; Y66-N70 PolarHBondContact O-ND2 3.42Å; Y66-N70 VanDerWaalsContact O-ND2 3.15Å
67	I	58.2	Low	55.3	Low	72 Å²	72	114.7 Å²	114.7	37%	0.369	57%	0.574	S	S	.	*	H	α-helix	trans	-79.9	-37.5	179.7	-65.4	167	0	0	0	109.5	Y64 Y65 A71	Y64-I67 HydrophobicContact CD1-CB 4.23Å; Y64-I67 HydrophobicContact CD1-CD1 3.56Å; Y64-I67 HydrophobicContact CD1-CG1 4.42Å; Y64-I67 HydrophobicContact CD1-CG2 4.47Å; Y64-I67 HydrophobicContact CE1-CD1 4.07Å; Y64-I67 CarbonylContact O-C 3.57Å; Y64-I67 PolarHBondContact O-N 2.96Å; Y65-I67 PolarHBondContact O-N 3.06Å; I67-A71 WeakPolarHBondContact O-CB 3.31Å; I67-A71 PolarHBondContact O-N 3.06Å
68	I	60.7	Low	54.7	Low	88 Å²	88	116.5 Å²	116.5	45%	0.451	58%	0.576	S	S	.	*	H	α-helix	trans	-71.4	-35.9	175.7	-64.5	162.2	0	0	0	110	Y64 A71 K72	Y64-I68 VanDerWaalsContact O-CB 3.29Å; Y64-I68 WeakPolarHBondContact O-CB 3.26Å; Y64-I68 WeakPolarHBondContact O-CD1 3.29Å; Y64-I68 WeakPolarHBondContact O-CG1 3.21Å; Y64-I68 PolarHBondContact O-N 2.82Å; I68-A71 CarbonylContact O-C 3.58Å; I68-A71 PolarHBondContact O-N 3.46Å; I68-K72 HydrophobicContact CG2-CD 3.81Å; I68-K72 HydrophobicContact CG2-CG 4.01Å; I68-K72 WeakPolarHBondContact O-CA 3.42Å; I68-K72 WeakPolarHBondContact O-CB 3.07Å; I68-K72 VanDerWaalsContact O-CG 3.24Å; I68-K72 WeakPolarHBondContact O-CG 3.2Å; I68-K72 PolarHBondContact O-N 3.31Å
69	E	57.8	Low	54.3	Low	110 Å²	110	120.4 Å²	120.4	51%	0.514	59%	0.588	S	S	.	*	H	α-helix	trans	-67.8	-44.8	176.1	-166.5	171.8	-142.4	0	0	111.4	Y65 A71 K72 M73	Y65-E69 VanDerWaalsContact O-CB 3.32Å; Y65-E69 WeakPolarHBondContact O-CB 3.2Å; Y65-E69 PolarHBondContact O-N 3.48Å; E69-A71 VanDerWaalsContact C-N 3.32Å; E69-A71 PolarHBondContact O-N 2.88Å; E69-K72 PolarHBondContact O-N 3.49Å; E69-M73 PolarHBondContact O-N 2.91Å
70	N	56.7	Low	53.7	Low	107 Å²	107	121.1 Å²	121.1	57%	0.572	59%	0.586	S	S	*	*	H	α-helix	trans	-66.9	-30.6	172.6	-79.8	-41.6	0	0	0	113.2	Y66	Y66-N70 PolarHBondContact O-N 3.27Å; Y66-N70 PolarHBondContact O-ND2 3.42Å; Y66-N70 VanDerWaalsContact O-ND2 3.15Å
71	A	55.5	Low	53.5	Low	48 Å²	48	124.4 Å²	124.4	40%	0.397	60%	0.598	S	S	.	*	H	α-helix	trans	-78.4	-36.7	173.8	0	0	0	0	0	112.1	I67 I68 E69 M73 R74 A75	I67-A71 WeakPolarHBondContact O-CB 3.31Å; I67-A71 PolarHBondContact O-N 3.06Å; I68-A71 CarbonylContact O-C 3.58Å; I68-A71 PolarHBondContact O-N 3.46Å; E69-A71 VanDerWaalsContact C-N 3.32Å; E69-A71 PolarHBondContact O-N 2.88Å; A71-M73 VanDerWaalsContact C-N 3.34Å; A71-M73 PolarHBondContact O-N 3Å; A71-R74 CarbonylContact O-C 3.35Å; A71-R74 WeakPolarHBondContact O-CA 3.47Å; A71-R74 PolarHBondContact O-N 3.19Å; A71-A75 WeakPolarHBondContact O-CB 3.39Å; A71-A75 PolarHBondContact O-N 3.04Å
72	K	55.5	Low	53.7	Low	143 Å²	143	127 Å²	127	62%	0.622	61%	0.606	S	S	*	*	H	α-helix	trans	-65.4	-36.7	175.9	-86.7	177.2	73.6	179.8	0	110.9	I68 E69 R74 A75 S76	I68-K72 HydrophobicContact CG2-CD 3.81Å; I68-K72 HydrophobicContact CG2-CG 4.01Å; I68-K72 WeakPolarHBondContact O-CA 3.42Å; I68-K72 WeakPolarHBondContact O-CB 3.07Å; I68-K72 VanDerWaalsContact O-CG 3.24Å; I68-K72 WeakPolarHBondContact O-CG 3.2Å; I68-K72 PolarHBondContact O-N 3.31Å; E69-K72 PolarHBondContact O-N 3.49Å; K72-R74 PolarHBondContact O-N 3.32Å; K72-A75 PolarHBondContact O-N 3.25Å; K72-S76 WeakPolarHBondContact O-CB 3.47Å; K72-S76 PolarHBondContact O-N 2.95Å
73	M	56.8	Low	53.6	Low	163 Å²	163	128.3 Å²	128.3	80%	0.803	61%	0.607	S	S	*	*	H	α-helix	trans	-65.7	-22.7	173.3	-151.7	174.7	-175.3	0	0	112.6	E69 A71	E69-M73 PolarHBondContact O-N 2.91Å; A71-M73 VanDerWaalsContact C-N 3.34Å; A71-M73 PolarHBondContact O-N 3Å
74	R	52.9	Low	53.5	Low	193 Å²	193	121.8 Å²	121.8	73%	0.728	59%	0.587	S	S	*	*	H	α-helix	trans	-102	-9.9	175.9	-92.1	-176.7	179.3	156.1	0.8	115.3	A71 K72 R78	A71-R74 CarbonylContact O-C 3.35Å; A71-R74 WeakPolarHBondContact O-CA 3.47Å; A71-R74 PolarHBondContact O-N 3.19Å; K72-R74 PolarHBondContact O-N 3.32Å; R74-R78 PolarHBondContact O-NE 3.13Å
75	A	54.3	Low	53.7	Low	27 Å²	27	119.5 Å²	119.5	22%	0.223	59%	0.585	C	S	.	*	H	α-helix	trans	-111.7	-22.6	-178.2	0	0	0	0	0	111.8	A71 K72 E77 R78 D79	A71-A75 WeakPolarHBondContact O-CB 3.39Å; A71-A75 PolarHBondContact O-N 3.04Å; K72-A75 PolarHBondContact O-N 3.25Å; A75-E77 PolarHBondContact O-N 2.63Å; A75-E77 VanDerWaalsContact O-N 3.1Å; A75-R78 CarbonylContact O-C 3.52Å; A75-R78 PolarHBondContact O-N 3.49Å; A75-D79 PolarHBondContact O-N 3.09Å
76	S	54.3	Low	54.3	Low	101 Å²	101	119.3 Å²	119.3	71%	0.706	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-8.7	168.6	-167.9	0	0	0	0	113.1	K72	K72-S76 WeakPolarHBondContact O-CB 3.47Å; K72-S76 PolarHBondContact O-N 2.95Å
77	E	51.3	Low	54.7	Low	168 Å²	168	118.8 Å²	118.8	79%	0.785	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-11.2	169.3	-168	169.1	-165.8	0	0	112.5	A75	A75-E77 PolarHBondContact O-N 2.63Å; A75-E77 VanDerWaalsContact O-N 3.1Å
78	R	51.4	Low	55	Low	191 Å²	191	118.3 Å²	118.3	72%	0.721	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.4	-10.1	-174.2	-70.6	-170	-74.1	171.6	0.2	115.2	R74 A75	R74-R78 PolarHBondContact O-NE 3.13Å; A75-R78 CarbonylContact O-C 3.52Å; A75-R78 PolarHBondContact O-N 3.49Å
79	D	49	Very low	55.2	Low	121 Å²	121	119.3 Å²	119.3	65%	0.647	61%	0.61	S	S	*	*			trans	-102.6	18.6	172.7	-60.4	-19.6	0	0	0	112	A75 I81	A75-D79 PolarHBondContact O-N 3.09Å; D79-I81 PolarHBondContact O-N 3.36Å
80	F	47.2	Very low	55.6	Low	155 Å²	155	122.1 Å²	122.1	68%	0.68	62%	0.623	S	S	*	*			trans	-66.3	76.7	141.5	-167.2	-92.9	0	0	0	105.5	D82	F80-D82 VanDerWaalsContact C-N 3.31Å; F80-D82 PolarHBondContact O-N 3.48Å
81	I	52.6	Low	55.8	Low	128 Å²	128	121.3 Å²	121.3	66%	0.656	62%	0.621	S	S	*	*			trans	-46.8	115.7	151.5	-65.1	165.6	0	0	0	102.4	D79 L83	D79-I81 PolarHBondContact O-N 3.36Å; I81-L83 PolarHBondContact O-N 3.09Å
82	D	48.5	Very low	55.7	Low	124 Å²	124	122.9 Å²	122.9	66%	0.663	63%	0.634	S	S	*	*			trans	-50.3	90.3	160.6	-171	27.7	0	0	0	105	F80 G84	F80-D82 VanDerWaalsContact C-N 3.31Å; F80-D82 PolarHBondContact O-N 3.48Å; D82-G84 VanDerWaalsContact CG-N 3.25Å; D82-G84 WeakPolarHBondContact O-CA 3.36Å; D82-G84 PolarHBondContact O-N 3.33Å; D82-G84 PolarHBondContact OD1-N 3.31Å
83	L	54.1	Low	55.8	Low	132 Å²	132	122 Å²	122	69%	0.691	64%	0.635	S	S	*	*			trans	-63.3	61.7	137.7	-62.3	122.2	0	0	0	103	I81 D85	I81-L83 PolarHBondContact O-N 3.09Å; L83-D85 VanDerWaalsContact C-N 3.34Å
84	G	49.8	Very low	55.6	Low	31 Å²	31	122.5 Å²	122.5	32%	0.32	64%	0.64	S	S	.	*				55.3	69	65.9	0	0	0	0	0	103.1	D82 M86	D82-G84 VanDerWaalsContact CG-N 3.25Å; D82-G84 WeakPolarHBondContact O-CA 3.36Å; D82-G84 PolarHBondContact O-N 3.33Å; D82-G84 PolarHBondContact OD1-N 3.31Å; G84-M86 PolarHBondContact O-N 3.23Å
85	D	54.6	Low	55.4	Low	97 Å²	97	121.4 Å²	121.4	52%	0.519	64%	0.643	S	S	.	*			trans	-26	101.4	-165.1	-167.8	7.4	0	0	0	111.3	L83 D87 D88	L83-D85 VanDerWaalsContact C-N 3.34Å; D85-D87 PolarHBondContact O-N 3.16Å; D85-D87 WeakPolarHBondContact OD1-CB 3.43Å; D85-D87 PolarHBondContact OD1-N 3.2Å; D85-D88 HydrophobicContact CB-CB 4.25Å; D85-D88 VanDerWaalsContact O-CB 3.31Å; D85-D88 WeakPolarHBondContact O-CB 3.26Å; D85-D88 PolarHBondContact O-N 3.03Å
86	M	64.5	Low	55.2	Low	152 Å²	152	125 Å²	125	75%	0.749	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-8.9	-179.9	-132.7	-105.6	102.7	0	0	110.7	G84	G84-M86 PolarHBondContact O-N 3.23Å
87	D	64	Low	54.8	Low	144 Å²	144	125.8 Å²	125.8	77%	0.77	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	0.9	171.1	-59.6	-52.2	0	0	0	113.4	D85 P89	D85-D87 PolarHBondContact O-N 3.16Å; D85-D87 WeakPolarHBondContact OD1-CB 3.43Å; D85-D87 PolarHBondContact OD1-N 3.2Å; D87-P89 WeakPolarHBondContact O-CD 3.44Å
88	D	63.5	Low	54.8	Low	62 Å²	62	124.4 Å²	124.4	33%	0.332	68%	0.675	S	S	.	*			trans	-72.4	112	174.5	-172.3	-11.8	0	0	0	110.5	D85 H90 V91	D85-D88 HydrophobicContact CB-CB 4.25Å; D85-D88 VanDerWaalsContact O-CB 3.31Å; D85-D88 WeakPolarHBondContact O-CB 3.26Å; D85-D88 PolarHBondContact O-N 3.03Å; D88-H90 PolarHBondContact O-N 3.38Å; D88-H90 VanDerWaalsContact OD1-CB 3.29Å; D88-H90 WeakPolarHBondContact OD1-CB 3.37Å; D88-H90 IonicContact OD1-CD2 3.61Å; D88-H90 IonicContact OD1-CG 3.8Å; D88-H90 PolarHBondContact OD1-N 2.99Å; D88-V91 HydrophobicContact CB-CG2 4.11Å; D88-V91 PolarHBondContact O-N 2.72Å
89	P	65.8	Low	54.6	Low	109 Å²	109	120.3 Å²	120.3	71%	0.708	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-10.1	177.9	28.8	-36.2	0	0	0	113.4	D87	D87-P89 WeakPolarHBondContact O-CD 3.44Å
90	H	66.2	Low	54.6	Low	169 Å²	169	122.2 Å²	122.2	78%	0.782	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-12.5	174.7	-67.3	-67.6	0	0	0	114.2	D88 A92	D88-H90 PolarHBondContact O-N 3.38Å; D88-H90 VanDerWaalsContact OD1-CB 3.29Å; D88-H90 WeakPolarHBondContact OD1-CB 3.37Å; D88-H90 IonicContact OD1-CD2 3.61Å; D88-H90 IonicContact OD1-CG 3.8Å; D88-H90 PolarHBondContact OD1-N 2.99Å; H90-A92 PolarHBondContact O-N 3.35Å
91	V	61	Low	54.6	Low	89 Å²	89	122.1 Å²	122.1	54%	0.539	69%	0.69	S	S	.	*			trans	-91.8	47.3	170.4	-171.1	0	0	0	0	109.8	D88 I93	D88-V91 HydrophobicContact CB-CG2 4.11Å; D88-V91 PolarHBondContact O-N 2.72Å; V91-I93 PolarHBondContact O-N 3.21Å
92	A	52.1	Low	54.2	Low	81 Å²	81	126.5 Å²	126.5	67%	0.669	70%	0.7	S	S	*	*			trans	-72.4	96.7	168.8	0	0	0	0	0	108.7	H90 L94	H90-A92 PolarHBondContact O-N 3.35Å; A92-L94 PolarHBondContact O-N 3.36Å
93	I	58.4	Low	54.3	Low	125 Å²	125	126.8 Å²	126.8	64%	0.641	71%	0.706	S	S	*	*			trans	-49.3	131.9	154.8	-60.1	174.7	0	0	0	105.8	V91 Q95	V91-I93 PolarHBondContact O-N 3.21Å; I93-Q95 HydrophobicContact CG2-CG 4.12Å; I93-Q95 PolarHBondContact O-N 3.13Å
94	L	51.6	Low	54.2	Low	173 Å²	173	128.4 Å²	128.4	91%	0.906	71%	0.71	S	S	*	*	S	Bend	trans	-59.1	57.8	175.6	-85.3	139.2	0	0	0	112.6	A92	A92-L94 PolarHBondContact O-N 3.36Å
95	Q	49.5	Very low	54.1	Low	171 Å²	171	132.7 Å²	132.7	80%	0.799	73%	0.732	S	S	*	*			trans	-98.2	60.4	166.6	-74.4	-172.1	-72.2	0	0	108.6	I93	I93-Q95 HydrophobicContact CG2-CG 4.12Å; I93-Q95 PolarHBondContact O-N 3.13Å
96	S	49.1	Very low	54	Low	102 Å²	102	133.1 Å²	133.1	71%	0.713	74%	0.742	S	S	*	*			trans	-155.5	93.2	159.8	62	0	0	0	0	110.4
97	S	46.8	Very low	53.2	Low	118 Å²	118	132.9 Å²	132.9	83%	0.825	75%	0.749	S	S	*	*			trans	-171.2	59.7	146.4	45.7	0	0	0	0	110.7
98	V	52.2	Low	52.5	Low	139 Å²	139	133.3 Å²	133.3	84%	0.842	75%	0.75	S	S	*	*	S	Bend	trans	-134	133.3	159.7	-175.3	0	0	0	0	104.8
99	P	45.5	Very low	51.6	Low	104 Å²	104	135.9 Å²	135.9	68%	0.675	77%	0.773	S	S	*	*				-130.4	118.5	-69.2	32.4	-12.7	0	0	0	110.4
100	N	48.8	Very low	50.9	Low	161 Å²	161	135.9 Å²	135.9	86%	0.861	78%	0.776	S	S	*	*			trans	-117.9	87.5	177.1	-88.3	-15.8	0	0	0	111.6	Y102	N100-Y102 PolarHBondContact O-N 3.35Å; N100-Y102 VanDerWaalsContact O-N 3.12Å
101	N	48.5	Very low	50.2	Low	153 Å²	153	135.3 Å²	135.3	82%	0.818	82%	0.816	S	S	*	*			trans	-83.5	60.2	173.5	-151.9	10.5	0	0	0	110.5
102	Y	44.5	Very low	49.6	Very low	221 Å²	221	137.7 Å²	137.7	87%	0.867	83%	0.83	S	S	*	*			trans	-156.6	97.3	169.6	-73	-74.7	0	0	0	110.2	N100	N100-Y102 PolarHBondContact O-N 3.35Å; N100-Y102 VanDerWaalsContact O-N 3.12Å
103	T	49.5	Very low	49.5	Very low	130 Å²	130	140.6 Å²	140.6	80%	0.798	84%	0.838	S	S	*	*			trans	-147.6	102.4	158.5	-66.2	0	0	0	0	109.8
104	H	52.6	Low	49	Very low	166 Å²	166	141.5 Å²	141.5	77%	0.769	85%	0.849	S	S	*	*			trans	58.5	138.7	142.5	-83.2	-98.8	0	0	0	122.4	S106	H104-S106 PolarHBondContact O-N 3Å
105	P	47.7	Very low	48.9	Very low	121 Å²	121	139.6 Å²	139.6	79%	0.786	85%	0.846	S	S	*	*			trans	-76.5	119.4	-175.7	32.6	-31.6	0	0	0	110.2
106	S	51.3	Low	48.8	Very low	105 Å²	105	137.7 Å²	137.7	73%	0.734	85%	0.849	S	S	*	*			trans	-88.1	114.9	162	-31.8	0	0	0	0	107.9	H104 L108	H104-S106 PolarHBondContact O-N 3Å; S106-L108 PolarHBondContact O-N 3.12Å
107	V	49	Very low	48.8	Very low	147 Å²	147	140.1 Å²	140.1	89%	0.891	86%	0.858	S	S	*	*			trans	-47.3	104	164.1	-84	0	0	0	0	110.5
108	L	49.6	Very low	49	Very low	153 Å²	153	141.6 Å²	141.6	80%	0.801	86%	0.86	S	S	*	*			trans	-91.7	103.1	159.5	-116.5	88.8	0	0	0	107.7	S106 S110	S106-L108 PolarHBondContact O-N 3.12Å; L108-S110 PolarHBondContact O-N 3.35Å
109	S	43.5	Very low	48.7	Very low	117 Å²	117	141.8 Å²	141.8	82%	0.818	86%	0.862	S	S	*	*			trans	-62.7	111	155.6	178.8	0	0	0	0	108.2
110	S	52.4	Low	49	Very low	108 Å²	108	145 Å²	145	76%	0.755	88%	0.877	S	S	*	*			trans	-170.4	110.8	164	-79.6	0	0	0	0	108.9	L108	L108-S110 PolarHBondContact O-N 3.35Å
111	G	50.3	Low	49	Very low	158 Å²	158	143.5 Å²	143.5	100%	1.629	88%	0.879	S	S	*	*			trans	120.8	0	172.8	0	0	0	0	0	113.9

Retrieved 111 of 111 residues in 114.3 ms (Link to these results)

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