A0A087WRX4_MOUSE Loading...

Torsin family 3, member A

AlphaFold DB , UniProt , Accession A0A087WRX4, Species MOUSE (Mus musculus, Mouse), Gene Tor3a, Length 115 aa.

						>A0A087WRX4_MOUSE|A0A087WRX4|Tor3a
MFLGALWLLLLLPLRPPGAQGQEADEPTPWPSVKGLKEQLRKAGALSKRYWELFSCTLWPDHCEDQETPVPPLGWSLPLWGRRSLDVLTAWLCRFQDCCSGGGDCRISNNLTGWS
					

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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	M	55.3	Low	64.5	Low	220 Å²	220	124.6 Å²	124.6	100%	1.084	64%	0.641	S	S	*	*				0	-35.1	0	-63.3	179.5	83.4	0	0	113.2
2	F	57.9	Low	64.1	Low	185 Å²	185	123.8 Å²	123.8	81%	0.811	64%	0.638	S	S	*	*	H	α-helix	trans	-71.2	-30.1	-179	-69.1	-78.6	0	0	0	116	G4 A5 L6	F2-G4 VanDerWaalsContact C-N 3.32Å; F2-G4 PolarHBondContact O-N 2.93Å; F2-A5 PolarHBondContact O-N 3.38Å; F2-L6 WeakPolarHBondContact O-CB 3.37Å; F2-L6 PolarHBondContact O-N 3.01Å
3	L	62.4	Low	63.7	Low	142 Å²	142	122.5 Å²	122.5	74%	0.743	64%	0.642	S	S	*	*	H	α-helix	trans	-64.6	-35.6	178	-89.2	86.4	0	0	0	112.8	L6 W7	L3-L6 PolarHBondContact O-N 3.18Å; L3-W7 WeakPolarHBondContact O-CB 3.47Å; L3-W7 PolarHBondContact O-N 3.1Å
4	G	70.3	Confident	63	Low	40 Å²	40	122.8 Å²	122.8	41%	0.412	64%	0.644	S	S	.	*	H	α-helix	trans	-68.4	-41.1	178.3	0	0	0	0	0	112.2	F2 W7 L8	F2-G4 VanDerWaalsContact C-N 3.32Å; F2-G4 PolarHBondContact O-N 2.93Å; G4-W7 PolarHBondContact O-N 3.01Å; G4-L8 WeakPolarHBondContact O-CB 3.46Å; G4-L8 WeakPolarHBondContact O-CD1 3.49Å; G4-L8 PolarHBondContact O-N 3.44Å
5	A	68.9	Low	62.2	Low	48 Å²	48	129.3 Å²	129.3	40%	0.397	66%	0.656	S	S	.	*	H	α-helix	trans	-66.7	-38	176.2	0	0	0	0	0	112.2	F2 L8 L9	F2-A5 PolarHBondContact O-N 3.38Å; A5-L8 PolarHBondContact O-N 3.35Å; A5-L9 WeakPolarHBondContact O-CB 3.4Å; A5-L9 PolarHBondContact O-N 3.46Å
6	L	67.6	Low	61.6	Low	118 Å²	118	126.9 Å²	126.9	62%	0.618	65%	0.652	S	S	*	*	H	α-helix	trans	-64.7	-41.3	174.4	-170.8	71.3	0	0	0	111.6	F2 L3 L9 L10	F2-L6 WeakPolarHBondContact O-CB 3.37Å; F2-L6 PolarHBondContact O-N 3.01Å; L3-L6 PolarHBondContact O-N 3.18Å; L6-L9 PolarHBondContact O-N 3Å; L6-L10 PolarHBondContact O-N 3.42Å
7	W	63.9	Low	60.5	Low	170 Å²	170	127.1 Å²	127.1	64%	0.644	66%	0.664	S	S	*	*	H	α-helix	trans	-63.5	-42.3	174.3	-114.4	87.5	0	0	0	112.4	L3 G4 L10 L11	L3-W7 WeakPolarHBondContact O-CB 3.47Å; L3-W7 PolarHBondContact O-N 3.1Å; G4-W7 PolarHBondContact O-N 3.01Å; W7-L10 WeakPolarHBondContact O-CB 3.04Å; W7-L10 PolarHBondContact O-N 3.4Å; W7-L11 HydrophobicContact CE3-CD1 3.66Å; W7-L11 HydrophobicContact CE3-CG 4.05Å; W7-L11 HydrophobicContact CZ3-CD1 3.94Å; W7-L11 HydrophobicContact CZ3-CD2 4.21Å; W7-L11 HydrophobicContact CZ3-CG 4.24Å; W7-L11 WeakPolarHBondContact O-CG 3.36Å; W7-L11 PolarHBondContact O-N 3Å; W7-L11 VanDerWaalsContact O-N 3.13Å
8	L	65.3	Low	59.7	Low	110 Å²	110	124.4 Å²	124.4	58%	0.576	67%	0.672	S	S	*	*	H	α-helix	trans	-62.6	-45	175.1	-89	148.8	0	0	0	111.7	G4 A5 L10 L11 L12	G4-L8 WeakPolarHBondContact O-CB 3.46Å; G4-L8 WeakPolarHBondContact O-CD1 3.49Å; G4-L8 PolarHBondContact O-N 3.44Å; A5-L8 PolarHBondContact O-N 3.35Å; L8-L10 VanDerWaalsContact C-N 3.26Å; L8-L10 PolarHBondContact O-N 3.15Å; L8-L11 PolarHBondContact O-N 3.29Å; L8-L11 VanDerWaalsContact O-N 3.1Å; L8-L12 WeakPolarHBondContact O-CD1 3.13Å; L8-L12 PolarHBondContact O-N 3.27Å
9	L	67.9	Low	58.6	Low	121 Å²	121	123.5 Å²	123.5	63%	0.634	68%	0.683	S	S	*	*	H	α-helix	trans	-59.8	-35.3	174.4	-86.6	155.6	0	0	0	112.7	A5 L6 L11 P13	A5-L9 WeakPolarHBondContact O-CB 3.4Å; A5-L9 PolarHBondContact O-N 3.46Å; L6-L9 PolarHBondContact O-N 3Å; L9-L11 VanDerWaalsContact C-N 3.33Å; L9-P13 WeakPolarHBondContact O-CD 3.48Å
10	L	66.8	Low	57.6	Low	131 Å²	131	127 Å²	127	69%	0.686	69%	0.694	S	S	*	*	H	α-helix	trans	-70.5	-28.9	176.3	-142.2	90.8	0	0	0	112.9	L6 W7 L8 P13	L6-L10 PolarHBondContact O-N 3.42Å; W7-L10 WeakPolarHBondContact O-CB 3.04Å; W7-L10 PolarHBondContact O-N 3.4Å; L8-L10 VanDerWaalsContact C-N 3.26Å; L8-L10 PolarHBondContact O-N 3.15Å; L10-P13 WeakPolarHBondContact O-CD 3.38Å; L10-P13 WeakPolarHBondContact O-CG 3.48Å
11	L	63	Low	57	Low	86 Å²	86	124.3 Å²	124.3	45%	0.45	70%	0.696	S	S	.	*	H	α-helix	trans	-89.5	-19.9	-179	-70.5	172.7	0	0	0	114	W7 L8 L9 P13 L14	W7-L11 HydrophobicContact CE3-CD1 3.66Å; W7-L11 HydrophobicContact CE3-CG 4.05Å; W7-L11 HydrophobicContact CZ3-CD1 3.94Å; W7-L11 HydrophobicContact CZ3-CD2 4.21Å; W7-L11 HydrophobicContact CZ3-CG 4.24Å; W7-L11 WeakPolarHBondContact O-CG 3.36Å; W7-L11 PolarHBondContact O-N 3Å; W7-L11 VanDerWaalsContact O-N 3.13Å; L8-L11 PolarHBondContact O-N 3.29Å; L8-L11 VanDerWaalsContact O-N 3.1Å; L9-L11 VanDerWaalsContact C-N 3.33Å; L11-P13 VanDerWaalsContact C-CD 3.45Å; L11-L14 WeakPolarHBondContact O-CB 3.39Å; L11-L14 PolarHBondContact O-N 2.85Å
12	L	59.8	Low	56.1	Low	115 Å²	115	123.3 Å²	123.3	60%	0.602	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-53.9	-40	177.1	-106.2	78.8	0	0	0	115.1	L8 L14 R15	L8-L12 WeakPolarHBondContact O-CD1 3.13Å; L8-L12 PolarHBondContact O-N 3.27Å; L12-L14 PolarHBondContact O-N 3.35Å; L12-R15 PolarHBondContact O-N 2.74Å
13	P	59.4	Low	55.6	Low	107 Å²	107	124 Å²	124	70%	0.695	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-69.5	-7.8	176.3	26.3	-34.5	0	0	0	114	L9 L10 L11	L9-P13 WeakPolarHBondContact O-CD 3.48Å; L10-P13 WeakPolarHBondContact O-CD 3.38Å; L10-P13 WeakPolarHBondContact O-CG 3.48Å; L11-P13 VanDerWaalsContact C-CD 3.45Å
14	L	54.2	Low	54.5	Low	126 Å²	126	121.7 Å²	121.7	66%	0.66	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-95.8	0.2	-179.6	-116.7	74.2	0	0	0	113.9	L11 L12 P16	L11-L14 WeakPolarHBondContact O-CB 3.39Å; L11-L14 PolarHBondContact O-N 2.85Å; L12-L14 PolarHBondContact O-N 3.35Å; L14-P16 WeakPolarHBondContact O-CD 3.49Å
15	R	50.4	Low	53.6	Low	220 Å²	220	127.9 Å²	127.9	83%	0.83	72%	0.719	S	S	*	*			trans	-82.4	108	179.9	-166.6	91.6	178.9	171.7	1.9	109.7	L12	L12-R15 PolarHBondContact O-N 2.74Å
16	P	52	Low	52.7	Low	92 Å²	92	132.6 Å²	132.6	60%	0.597	73%	0.733	S	S	*	*			trans	-69.7	136.2	174.7	29.2	-33.3	0	0	0	109.9	L14	L14-P16 WeakPolarHBondContact O-CD 3.49Å
17	P	43.8	Very low	51.8	Low	130 Å²	130	132.4 Å²	132.4	84%	0.844	74%	0.739	S	S	*	*	S	Bend	trans	-79.5	124	172.9	30.8	-29.2	0	0	0	109.4
18	G	44.9	Very low	51.3	Low	78 Å²	78	129.1 Å²	129.1	80%	0.804	74%	0.738	S	S	*	*			trans	96.5	91.1	162.6	0	0	0	0	0	115.5
19	A	38.8	Very low	51	Low	107 Å²	107	127.9 Å²	127.9	88%	0.884	74%	0.737	S	S	*	*			trans	-110.7	89.4	153.6	0	0	0	0	0	107.4
20	Q	39.1	Very low	50.5	Low	194 Å²	194	131.3 Å²	131.3	91%	0.907	74%	0.741	S	S	*	*			trans	-117.1	123.8	157.2	-72.9	-165.8	-2.2	0	0	106.4
21	G	45	Very low	50.4	Low	71 Å²	71	130.3 Å²	130.3	73%	0.732	74%	0.742	S	S	*	*			trans	-70.2	145.8	-165.4	0	0	0	0	0	113.2
22	Q	36.7	Very low	50.7	Low	198 Å²	198	129.2 Å²	129.2	93%	0.925	74%	0.742	S	S	*	*			trans	-155.3	132.1	142.6	-128.5	142.9	-30.3	0	0	110.5
23	E	47.5	Very low	51.4	Low	199 Å²	199	128 Å²	128	93%	0.93	74%	0.739	S	S	*	*			trans	-71.7	117	177.9	-165.7	166.9	-171.6	0	0	109
24	A	39.5	Very low	52.4	Low	95 Å²	95	129.1 Å²	129.1	79%	0.785	73%	0.733	S	S	*	*			trans	-162.6	128	162	0	0	0	0	0	110.1
25	D	51.3	Low	53.6	Low	169 Å²	169	125 Å²	125	90%	0.904	72%	0.721	S	S	*	*			trans	-58.5	117.8	178.4	-172.6	33	0	0	0	113
26	E	49.2	Very low	55.1	Low	147 Å²	147	119.2 Å²	119.2	69%	0.687	71%	0.706	S	S	*	*	S	Bend	trans	176.3	144.1	157.2	-104.8	-90	121.3	0	0	108	T28	E26-T28 PolarHBondContact O-N 3.47Å; E26-T28 PolarHBondContact O-OG1 3Å
27	P	49.2	Very low	56.5	Low	114 Å²	114	122 Å²	122	74%	0.74	71%	0.709	S	S	*	*			trans	-74.9	75.1	179.1	32.3	-31.9	0	0	0	109.6	P29	P27-P29 WeakPolarHBondContact O-CD 3.48Å
28	T	53.9	Low	58.6	Low	102 Å²	102	120.2 Å²	120.2	63%	0.626	69%	0.689	S	S	*	*			trans	-74.4	122.2	179.8	13.3	0	0	0	0	109.4	E26 W30	E26-T28 PolarHBondContact O-N 3.47Å; E26-T28 PolarHBondContact O-OG1 3Å; T28-W30 PolarHBondContact O-N 3.27Å
29	P	59.8	Low	60.3	Low	84 Å²	84	122.3 Å²	122.3	55%	0.545	68%	0.678	S	S	.	*			trans	-73.1	101	173	9.4	1.8	0	0	0	107.9	P27	P27-P29 WeakPolarHBondContact O-CD 3.48Å
30	W	55.6	Low	62.8	Low	193 Å²	193	122.5 Å²	122.5	73%	0.731	66%	0.664	S	S	*	*			trans	-27.6	116.4	179.4	-64.4	67.9	0	0	0	112.9	T28 S32 V33 K34	T28-W30 PolarHBondContact O-N 3.27Å; W30-S32 PolarHBondContact O-N 3.04Å; W30-S32 VanDerWaalsContact O-N 3.15Å; W30-V33 HydrophobicContact CB-CB 4.39Å; W30-V33 HydrophobicContact CB-CG2 3.85Å; W30-V33 WeakPolarHBondContact O-CB 3.36Å; W30-V33 PolarHBondContact O-N 3.39Å; W30-K34 PolarHBondContact O-N 3.42Å
31	P	66.4	Low	65.1	Low	109 Å²	109	122 Å²	122	71%	0.708	65%	0.653	S	S	*	*	H	α-helix	trans	-55.9	-32.9	-177.5	-26.1	32.8	0	0	0	113.8	V33 K34 G35	P31-V33 VanDerWaalsContact C-N 3.34Å; P31-V33 PolarHBondContact O-N 3.05Å; P31-K34 PolarHBondContact O-N 3.42Å; P31-G35 PolarHBondContact O-N 3.49Å
32	S	67.7	Low	67.1	Low	64 Å²	64	124 Å²	124	45%	0.448	64%	0.642	S	S	.	*	H	α-helix	trans	-61.9	-38.2	176.3	53.3	0	0	0	0	112.8	W30 G35 L36	W30-S32 PolarHBondContact O-N 3.04Å; W30-S32 VanDerWaalsContact O-N 3.15Å; S32-G35 PolarHBondContact O-N 2.86Å; S32-L36 WeakPolarHBondContact O-CB 3.46Å; S32-L36 PolarHBondContact O-N 3.49Å
33	V	75.9	Confident	69.5	Low	90 Å²	90	117.1 Å²	117.1	55%	0.545	62%	0.619	S	S	.	*	H	α-helix	trans	-70.3	-37.6	178.2	-179.8	0	0	0	0	110.6	W30 P31 K37	W30-V33 HydrophobicContact CB-CB 4.39Å; W30-V33 HydrophobicContact CB-CG2 3.85Å; W30-V33 WeakPolarHBondContact O-CB 3.36Å; W30-V33 PolarHBondContact O-N 3.39Å; P31-V33 VanDerWaalsContact C-N 3.34Å; P31-V33 PolarHBondContact O-N 3.05Å; V33-K37 VanDerWaalsContact O-CB 3.25Å; V33-K37 WeakPolarHBondContact O-CB 3.46Å; V33-K37 PolarHBondContact O-N 3.41Å
34	K	80	Confident	71.5	Confident	130 Å²	130	109.2 Å²	109.2	57%	0.565	59%	0.591	S	S	*	*	H	α-helix	trans	-64.4	-45.4	174	-70	-177.6	-178.7	176.5	0	111.6	W30 P31 K37 E38	W30-K34 PolarHBondContact O-N 3.42Å; P31-K34 PolarHBondContact O-N 3.42Å; K34-K37 PolarHBondContact O-N 3.27Å; K34-E38 PolarHBondContact O-N 3.26Å
35	G	80	Confident	73.8	Confident	40 Å²	40	107.4 Å²	107.4	41%	0.412	58%	0.576	S	S	.	*	H	α-helix	trans	-62.1	-44.5	176.7	0	0	0	0	0	112.8	P31 S32 E38 Q39	P31-G35 PolarHBondContact O-N 3.49Å; S32-G35 PolarHBondContact O-N 2.86Å; G35-E38 PolarHBondContact O-N 3.05Å; G35-Q39 WeakPolarHBondContact O-CG 3.34Å; G35-Q39 PolarHBondContact O-N 2.9Å
36	L	81.2	Confident	75.3	Confident	97 Å²	97	105.2 Å²	105.2	51%	0.508	56%	0.563	S	S	.	*	H	α-helix	trans	-63	-43.2	175.9	-178.3	65.9	0	0	0	111.9	S32 E38 Q39 L40	S32-L36 WeakPolarHBondContact O-CB 3.46Å; S32-L36 PolarHBondContact O-N 3.49Å; L36-E38 VanDerWaalsContact C-N 3.28Å; L36-E38 PolarHBondContact O-N 3.39Å; L36-Q39 PolarHBondContact O-N 3.01Å; L36-L40 HydrophobicContact CD1-CD1 4.46Å; L36-L40 HydrophobicContact CG-CD1 4.03Å; L36-L40 WeakPolarHBondContact O-CB 3.25Å; L36-L40 WeakPolarHBondContact O-CG 3.4Å; L36-L40 PolarHBondContact O-N 3.34Å
37	K	81.1	Confident	77	Confident	152 Å²	152	101.5 Å²	101.5	66%	0.661	55%	0.554	S	S	*	*	H	α-helix	trans	-60	-39.9	176.8	-177.2	175.5	-179.9	174.2	0	111.6	V33 K34 L40 R41	V33-K37 VanDerWaalsContact O-CB 3.25Å; V33-K37 WeakPolarHBondContact O-CB 3.46Å; V33-K37 PolarHBondContact O-N 3.41Å; K34-K37 PolarHBondContact O-N 3.27Å; K37-L40 PolarHBondContact O-N 3.13Å; K37-R41 WeakPolarHBondContact O-CB 3.36Å; K37-R41 PolarHBondContact O-N 3.04Å
38	E	87.3	Confident	78.8	Confident	91 Å²	91	102.4 Å²	102.4	43%	0.425	55%	0.546	S	S	.	.	H	α-helix	trans	-68.9	-41	178	-172.3	56.7	-156.2	0	0	111.9	K34 G35 L36 R41 K42	K34-E38 PolarHBondContact O-N 3.26Å; G35-E38 PolarHBondContact O-N 3.05Å; L36-E38 VanDerWaalsContact C-N 3.28Å; L36-E38 PolarHBondContact O-N 3.39Å; E38-R41 PolarHBondContact O-N 3.31Å; E38-K42 WeakPolarHBondContact O-CG 3.49Å; E38-K42 PolarHBondContact O-N 3.27Å; E38-K42 WeakPolarHBondContact OE1-CE 3.35Å
39	Q	82.2	Confident	80.2	Confident	123 Å²	123	106.3 Å²	106.3	58%	0.575	55%	0.55	S	S	*	.	H	α-helix	trans	-62.9	-44.1	173.5	-70	-66.9	-26.3	0	0	111.8	G35 L36 R41 K42 A43	G35-Q39 WeakPolarHBondContact O-CG 3.34Å; G35-Q39 PolarHBondContact O-N 2.9Å; L36-Q39 PolarHBondContact O-N 3.01Å; Q39-R41 VanDerWaalsContact C-N 3.29Å; Q39-R41 PolarHBondContact O-N 2.93Å; Q39-K42 PolarHBondContact O-N 3.37Å; Q39-A43 WeakPolarHBondContact O-CB 3.37Å; Q39-A43 PolarHBondContact O-N 2.95Å
40	L	89.9	Confident	81.4	Confident	110 Å²	110	109.5 Å²	109.5	58%	0.576	55%	0.552	S	S	*	*	H	α-helix	trans	-63	-35.2	174.6	-78.9	166.9	0	0	0	112.2	L36 K37 G44	L36-L40 HydrophobicContact CD1-CD1 4.46Å; L36-L40 HydrophobicContact CG-CD1 4.03Å; L36-L40 WeakPolarHBondContact O-CB 3.25Å; L36-L40 WeakPolarHBondContact O-CG 3.4Å; L36-L40 PolarHBondContact O-N 3.34Å; K37-L40 PolarHBondContact O-N 3.13Å; L40-G44 WeakPolarHBondContact O-CA 3.39Å; L40-G44 PolarHBondContact O-N 3.39Å
41	R	87	Confident	82.7	Confident	184 Å²	184	108 Å²	108	69%	0.694	55%	0.546	S	S	*	.	H	α-helix	trans	-67.7	-42.1	176.4	-164.2	-177.5	-176.8	143	4.2	111.3	K37 E38 Q39 G44 A45	K37-R41 WeakPolarHBondContact O-CB 3.36Å; K37-R41 PolarHBondContact O-N 3.04Å; E38-R41 PolarHBondContact O-N 3.31Å; Q39-R41 VanDerWaalsContact C-N 3.29Å; Q39-R41 PolarHBondContact O-N 2.93Å; R41-G44 PolarHBondContact O-N 3.44Å; R41-A45 WeakPolarHBondContact O-CB 3.44Å; R41-A45 PolarHBondContact O-N 3.23Å
42	K	87.9	Confident	83.6	Confident	112 Å²	112	107.8 Å²	107.8	49%	0.487	54%	0.535	S	S	.	.	H	α-helix	trans	-65	-48.8	175.3	-71	175	-177.8	178.4	0	111.6	E38 Q39 G44 A45 L46	E38-K42 WeakPolarHBondContact O-CG 3.49Å; E38-K42 PolarHBondContact O-N 3.27Å; E38-K42 WeakPolarHBondContact OE1-CE 3.35Å; Q39-K42 PolarHBondContact O-N 3.37Å; K42-G44 VanDerWaalsContact C-N 3.33Å; K42-G44 PolarHBondContact O-N 2.91Å; K42-A45 PolarHBondContact O-N 2.93Å; K42-L46 PolarHBondContact O-N 2.99Å
43	A	88	Confident	84.3	Confident	55 Å²	55	110.4 Å²	110.4	46%	0.455	54%	0.544	S	S	.	.	H	α-helix	trans	-62	-41.2	176.1	0	0	0	0	0	111.6	Q39 A45 L46 S47	Q39-A43 WeakPolarHBondContact O-CB 3.37Å; Q39-A43 PolarHBondContact O-N 2.95Å; A43-A45 PolarHBondContact O-N 3.33Å; A43-L46 PolarHBondContact O-N 3.05Å; A43-S47 WeakPolarHBondContact O-CB 3.43Å; A43-S47 PolarHBondContact O-N 3.38Å; A43-S47 PolarHBondContact O-OG 2.8Å
44	G	88.3	Confident	84.4	Confident	32 Å²	32	109.2 Å²	109.2	33%	0.33	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-36.6	177.7	0	0	0	0	0	113.4	L40 R41 K42 S47 K48	L40-G44 WeakPolarHBondContact O-CA 3.39Å; L40-G44 PolarHBondContact O-N 3.39Å; R41-G44 PolarHBondContact O-N 3.44Å; K42-G44 VanDerWaalsContact C-N 3.33Å; K42-G44 PolarHBondContact O-N 2.91Å; G44-S47 WeakPolarHBondContact CA-OG 3.35Å; G44-S47 PolarHBondContact O-OG 3.3Å; G44-S47 VanDerWaalsContact O-OG 3.05Å; G44-K48 WeakPolarHBondContact O-CB 3.29Å; G44-K48 PolarHBondContact O-N 2.9Å
45	A	88.4	Confident	84.3	Confident	57 Å²	57	105.2 Å²	105.2	47%	0.471	52%	0.52	S	S	.	.	H	α-helix	trans	-67	-41.1	174.9	0	0	0	0	0	112	R41 K42 A43 R49	R41-A45 WeakPolarHBondContact O-CB 3.44Å; R41-A45 PolarHBondContact O-N 3.23Å; K42-A45 PolarHBondContact O-N 2.93Å; A43-A45 PolarHBondContact O-N 3.33Å; A45-R49 PolarHBondContact O-N 3.49Å
46	L	81.9	Confident	84.3	Confident	123 Å²	123	105.2 Å²	105.2	64%	0.644	51%	0.513	S	S	*	.	H	α-helix	trans	-69.1	-44	175.6	-70	171.7	0	0	0	111.6	K42 A43 K48 R49 Y50	K42-L46 PolarHBondContact O-N 2.99Å; A43-L46 PolarHBondContact O-N 3.05Å; L46-K48 VanDerWaalsContact C-N 3.31Å; L46-K48 PolarHBondContact O-N 2.75Å; L46-R49 PolarHBondContact O-N 3.49Å; L46-Y50 PolarHBondContact O-N 3.48Å; L46-Y50 VanDerWaalsContact O-N 3.1Å
47	S	85.9	Confident	84	Confident	69 Å²	69	104.9 Å²	104.9	48%	0.483	52%	0.515	S	S	.	.	H	α-helix	trans	-64	-38.9	178.7	74.4	0	0	0	0	111.1	A43 G44 Y50 W51	A43-S47 WeakPolarHBondContact O-CB 3.43Å; A43-S47 PolarHBondContact O-N 3.38Å; A43-S47 PolarHBondContact O-OG 2.8Å; G44-S47 WeakPolarHBondContact CA-OG 3.35Å; G44-S47 PolarHBondContact O-OG 3.3Å; G44-S47 VanDerWaalsContact O-OG 3.05Å; S47-Y50 PolarHBondContact O-N 3.33Å; S47-W51 WeakPolarHBondContact O-CB 3.21Å; S47-W51 PolarHBondContact O-N 3.2Å
48	K	86.6	Confident	83.7	Confident	134 Å²	134	100.1 Å²	100.1	58%	0.583	50%	0.497	S	S	*	.	H	α-helix	trans	-62.4	-45.8	178.3	-172.2	178.8	178.3	-175.2	0	111.8	G44 L46 Y50 W51 E52	G44-K48 WeakPolarHBondContact O-CB 3.29Å; G44-K48 PolarHBondContact O-N 2.9Å; L46-K48 VanDerWaalsContact C-N 3.31Å; L46-K48 PolarHBondContact O-N 2.75Å; K48-Y50 PolarHBondContact O-N 3.46Å; K48-W51 PolarHBondContact O-N 2.79Å; K48-E52 VanDerWaalsContact CE-OE1 3.29Å; K48-E52 WeakPolarHBondContact CE-OE1 3.35Å; K48-E52 WeakPolarHBondContact O-CG 3.29Å; K48-E52 PolarHBondContact O-N 2.91Å
49	R	83.6	Confident	83	Confident	184 Å²	184	103.9 Å²	103.9	69%	0.694	51%	0.507	S	S	*	.	H	α-helix	trans	-61.9	-43.2	176.8	-73.7	-177.5	179.2	-176.4	-0.5	112.4	A45 L46 W51 L53	A45-R49 PolarHBondContact O-N 3.49Å; L46-R49 PolarHBondContact O-N 3.49Å; R49-W51 VanDerWaalsContact C-N 3.33Å; R49-L53 PolarHBondContact O-N 2.81Å
50	Y	84.4	Confident	82	Confident	150 Å²	150	102.1 Å²	102.1	59%	0.588	51%	0.506	S	S	*	.	H	α-helix	trans	-63.2	-43.6	174.6	176.1	-92.5	0	0	0	111.2	L46 S47 K48 E52 L53 F54	L46-Y50 PolarHBondContact O-N 3.48Å; L46-Y50 VanDerWaalsContact O-N 3.1Å; S47-Y50 PolarHBondContact O-N 3.33Å; K48-Y50 PolarHBondContact O-N 3.46Å; Y50-E52 PolarHBondContact O-N 3.48Å; Y50-L53 PolarHBondContact O-N 3.38Å; Y50-F54 HydrophobicContact CD1-CB 4.4Å; Y50-F54 HydrophobicContact CE1-CB 4.02Å; Y50-F54 HydrophobicContact CE1-CD2 4.48Å; Y50-F54 HydrophobicContact CE1-CG 4.2Å; Y50-F54 VanDerWaalsContact O-CB 3.29Å; Y50-F54 WeakPolarHBondContact O-CB 3.19Å; Y50-F54 PolarHBondContact O-N 3.1Å
51	W	82.8	Confident	80.6	Confident	162 Å²	162	103.8 Å²	103.8	61%	0.614	52%	0.516	S	S	*	.	H	α-helix	trans	-64.4	-39.4	-177.8	-166.5	-101.9	0	0	0	112.5	S47 K48 R49 F54 S55	S47-W51 WeakPolarHBondContact O-CB 3.21Å; S47-W51 PolarHBondContact O-N 3.2Å; K48-W51 PolarHBondContact O-N 2.79Å; R49-W51 VanDerWaalsContact C-N 3.33Å; W51-F54 HydrophobicContact CE3-CD1 4.03Å; W51-F54 HydrophobicContact CH2-CD1 4.34Å; W51-F54 HydrophobicContact CH2-CE1 4.33Å; W51-F54 AromaticContact CZ3-CD1 3.83Å; W51-F54 HydrophobicContact CZ3-CD1 3.83Å; W51-F54 HydrophobicContact CZ3-CE1 4.03Å; W51-F54 PolarHBondContact O-N 2.91Å; W51-S55 WeakPolarHBondContact O-CB 3.01Å; W51-S55 PolarHBondContact O-N 2.73Å; W51-S55 PolarHBondContact O-OG 3.37Å
52	E	86.1	Confident	79.6	Confident	104 Å²	104	102.6 Å²	102.6	49%	0.486	52%	0.518	S	S	.	.	H	α-helix	trans	-58.7	-47.5	174.8	-76.2	173.8	-176.8	0	0	111.7	K48 Y50 S55 C56	K48-E52 VanDerWaalsContact CE-OE1 3.29Å; K48-E52 WeakPolarHBondContact CE-OE1 3.35Å; K48-E52 WeakPolarHBondContact O-CG 3.29Å; K48-E52 PolarHBondContact O-N 2.91Å; Y50-E52 PolarHBondContact O-N 3.48Å; E52-S55 PolarHBondContact O-OG 2.94Å; E52-C56 PolarHBondContact O-N 3.14Å; E52-C56 PolarHBondContact O-SG 3.1Å; E52-C56 VanDerWaalsContact O-SG 3.35Å
53	L	80.9	Confident	78.7	Confident	120 Å²	120	99.5 Å²	99.5	63%	0.628	51%	0.51	S	S	*	.	H	α-helix	trans	-66.2	-42.9	177.1	-67.9	170.9	0	0	0	112.3	R49 Y50 C56 T57	R49-L53 PolarHBondContact O-N 2.81Å; Y50-L53 PolarHBondContact O-N 3.38Å; L53-C56 PolarHBondContact O-N 2.78Å; L53-T57 PolarHBondContact O-N 2.04Å; L53-T57 VanDerWaalsContact O-N 3.14Å; L53-T57 PolarHBondContact O-OG1 3.22Å
54	F	79.3	Confident	77.6	Confident	65 Å²	65	105.5 Å²	105.5	29%	0.285	53%	0.528	S	S	.	.	H	α-helix	trans	-65	-41.6	179.2	-178.3	-108.5	0	0	0	111.5	Y50 W51 C56 T57 L58	Y50-F54 HydrophobicContact CD1-CB 4.4Å; Y50-F54 HydrophobicContact CE1-CB 4.02Å; Y50-F54 HydrophobicContact CE1-CD2 4.48Å; Y50-F54 HydrophobicContact CE1-CG 4.2Å; Y50-F54 VanDerWaalsContact O-CB 3.29Å; Y50-F54 WeakPolarHBondContact O-CB 3.19Å; Y50-F54 PolarHBondContact O-N 3.1Å; W51-F54 HydrophobicContact CE3-CD1 4.03Å; W51-F54 HydrophobicContact CH2-CD1 4.34Å; W51-F54 HydrophobicContact CH2-CE1 4.33Å; W51-F54 AromaticContact CZ3-CD1 3.83Å; W51-F54 HydrophobicContact CZ3-CD1 3.83Å; W51-F54 HydrophobicContact CZ3-CE1 4.03Å; W51-F54 PolarHBondContact O-N 2.91Å; F54-C56 PolarHBondContact O-N 3.4Å; F54-T57 WeakPolarHBondContact O-CB 3.46Å; F54-T57 PolarHBondContact O-N 3.35Å; F54-T57 VanDerWaalsContact O-N 3.1Å; F54-L58 HydrophobicContact CD1-CD1 3.86Å; F54-L58 HydrophobicContact CD1-CG 4.37Å; F54-L58 HydrophobicContact CE1-CD1 3.29Å; F54-L58 HydrophobicContact CE1-CG 4Å; F54-L58 HydrophobicContact CE2-CD2 4.47Å; F54-L58 HydrophobicContact CE2-CG 4.41Å; F54-L58 HydrophobicContact CZ-CD1 3.67Å; F54-L58 HydrophobicContact CZ-CD2 4.12Å; F54-L58 HydrophobicContact CZ-CG 4.01Å; F54-L58 WeakPolarHBondContact O-CG 3.11Å; F54-L58 PolarHBondContact O-N 2.66Å
55	S	78.5	Confident	76.3	Confident	45 Å²	45	110.9 Å²	110.9	32%	0.315	55%	0.55	S	S	.	.	H	α-helix	trans	-63.3	-39.3	177.3	54.5	0	0	0	0	112.4	W51 E52 T57 L58 W59	W51-S55 WeakPolarHBondContact O-CB 3.01Å; W51-S55 PolarHBondContact O-N 2.73Å; W51-S55 PolarHBondContact O-OG 3.37Å; E52-S55 PolarHBondContact O-OG 2.94Å; S55-T57 VanDerWaalsContact C-N 3.26Å; S55-T57 PolarHBondContact O-N 3.45Å; S55-L58 PolarHBondContact O-N 2.79Å; S55-L58 VanDerWaalsContact O-N 3.15Å; S55-W59 PolarHBondContact O-N 3.05Å
56	C	78.3	Confident	74.7	Confident	41 Å²	41	115.9 Å²	115.9	28%	0.277	56%	0.563	S	S	.	*	H	α-helix	trans	-65.8	-31	174	-64.6	0	0	0	0	112.6	E52 L53 F54 L58 W59 P60 C63	E52-C56 PolarHBondContact O-N 3.14Å; E52-C56 PolarHBondContact O-SG 3.1Å; E52-C56 VanDerWaalsContact O-SG 3.35Å; L53-C56 PolarHBondContact O-N 2.78Å; F54-C56 PolarHBondContact O-N 3.4Å; C56-L58 VanDerWaalsContact C-N 3.32Å; C56-W59 CarbonylContact O-C 3.57Å; C56-P60 WeakPolarHBondContact O-CA 3.32Å; C56-C63 WeakPolarHBondContact CA-SG 3.35Å; C56-C63 HydrophobicContact CB-CB 3.89Å; C56-C63 WeakPolarHBondContact CB-SG 3.48Å; C56-C63 WeakPolarHBondContact SG-CB 3.34Å; C56-C63 CovalentContact SG-SG 2.04Å; C56-C63 PolarHBondContact SG-SG 3.41Å
57	T	75	Confident	73.3	Confident	89 Å²	89	118.9 Å²	118.9	55%	0.546	57%	0.574	S	S	.	*	H	α-helix	trans	-69.6	-32.6	174.7	-52.1	0	0	0	0	111.5	L53 F54 S55	L53-T57 PolarHBondContact O-N 2.04Å; L53-T57 VanDerWaalsContact O-N 3.14Å; L53-T57 PolarHBondContact O-OG1 3.22Å; F54-T57 WeakPolarHBondContact O-CB 3.46Å; F54-T57 PolarHBondContact O-N 3.35Å; F54-T57 VanDerWaalsContact O-N 3.1Å; S55-T57 VanDerWaalsContact C-N 3.26Å; S55-T57 PolarHBondContact O-N 3.45Å
58	L	75.2	Confident	71.7	Confident	52 Å²	52	120.2 Å²	120.2	27%	0.272	58%	0.579	S	S	.	*	H	α-helix	trans	-83.2	-42.1	179.5	-67.9	-178.1	0	0	0	113.4	F54 S55 C56 L77	F54-L58 HydrophobicContact CD1-CD1 3.86Å; F54-L58 HydrophobicContact CD1-CG 4.37Å; F54-L58 HydrophobicContact CE1-CD1 3.29Å; F54-L58 HydrophobicContact CE1-CG 4Å; F54-L58 HydrophobicContact CE2-CD2 4.47Å; F54-L58 HydrophobicContact CE2-CG 4.41Å; F54-L58 HydrophobicContact CZ-CD1 3.67Å; F54-L58 HydrophobicContact CZ-CD2 4.12Å; F54-L58 HydrophobicContact CZ-CG 4.01Å; F54-L58 WeakPolarHBondContact O-CG 3.11Å; F54-L58 PolarHBondContact O-N 2.66Å; S55-L58 PolarHBondContact O-N 2.79Å; S55-L58 VanDerWaalsContact O-N 3.15Å; C56-L58 VanDerWaalsContact C-N 3.32Å; L58-L77 HydrophobicContact CD2-CD1 3.39Å; L58-L77 HydrophobicContact CD2-CD2 3.59Å; L58-L77 HydrophobicContact CD2-CG 4.14Å
59	W	72.2	Confident	70	Confident	170 Å²	170	120 Å²	120	64%	0.644	59%	0.592	S	S	*	*			trans	-126.6	80.5	-179	-102.3	-95	0	0	0	109.3	S55 C56 D61 H62	S55-W59 PolarHBondContact O-N 3.05Å; C56-W59 CarbonylContact O-C 3.57Å; W59-D61 PolarHBondContact O-N 3.37Å; W59-H62 PolarHBondContact O-N 2.86Å
60	P	62.7	Low	68.8	Low	86 Å²	86	116.3 Å²	116.3	56%	0.558	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-64.7	-27.9	-177	24.3	-32.5	0	0	0	112.7	C56 H62 C63	C56-P60 WeakPolarHBondContact O-CA 3.32Å; P60-H62 PolarHBondContact O-N 2.96Å; P60-H62 VanDerWaalsContact O-N 3.09Å; P60-C63 PolarHBondContact O-N 2.92Å
61	D	60.2	Low	67.2	Low	146 Å²	146	113.8 Å²	113.8	78%	0.781	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-70.3	-1.1	-178.7	-55.1	-46.1	0	0	0	114.7	W59	W59-D61 PolarHBondContact O-N 3.37Å
62	H	64.7	Low	65.9	Low	158 Å²	158	112 Å²	112	73%	0.731	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-116.5	5.1	-178.2	-78.8	10.6	0	0	0	113.7	W59 P60	W59-H62 PolarHBondContact O-N 2.86Å; P60-H62 PolarHBondContact O-N 2.96Å; P60-H62 VanDerWaalsContact O-N 3.09Å
63	C	70.6	Confident	64.3	Low	47 Å²	47	112.7 Å²	112.7	32%	0.318	61%	0.607	S	S	.	*	S	Bend	trans	-111.1	121.1	176.6	-62.6	0	0	0	0	109.5	C56 P60 D65	C56-C63 WeakPolarHBondContact CA-SG 3.35Å; C56-C63 HydrophobicContact CB-CB 3.89Å; C56-C63 WeakPolarHBondContact CB-SG 3.48Å; C56-C63 WeakPolarHBondContact SG-CB 3.34Å; C56-C63 CovalentContact SG-SG 2.04Å; C56-C63 PolarHBondContact SG-SG 3.41Å; P60-C63 PolarHBondContact O-N 2.92Å; C63-D65 PolarHBondContact O-N 3.08Å; C63-D65 VanDerWaalsContact O-N 3.12Å
64	E	63.6	Low	62.9	Low	181 Å²	181	111 Å²	111	85%	0.846	62%	0.618	S	S	*	*			trans	-56.2	115	178.1	-64.3	-86.6	142	0	0	110	Q66	E64-Q66 PolarHBondContact O-N 3.12Å; E64-Q66 VanDerWaalsContact O-N 3.08Å
65	D	61.6	Low	61.6	Low	146 Å²	146	115.9 Å²	115.9	78%	0.781	64%	0.635	S	S	*	*			trans	16.7	74	161.1	-52.4	-22.6	0	0	0	116.6	C63	C63-D65 PolarHBondContact O-N 3.08Å; C63-D65 VanDerWaalsContact O-N 3.12Å
66	Q	55	Low	60.6	Low	162 Å²	162	117.4 Å²	117.4	76%	0.757	65%	0.645	S	S	*	*			trans	-87	101.1	153.2	-93.9	179.7	94.6	0	0	108.4	E64 T68	E64-Q66 PolarHBondContact O-N 3.12Å; E64-Q66 VanDerWaalsContact O-N 3.08Å; Q66-T68 PolarHBondContact O-N 2.74Å
67	E	53	Low	59.4	Low	186 Å²	186	118.6 Å²	118.6	87%	0.869	65%	0.649	S	S	*	*			trans	-63.9	75.1	166.9	-81.1	161	126.1	0	0	110.6
68	T	52	Low	58.7	Low	97 Å²	97	119.3 Å²	119.3	60%	0.595	65%	0.654	S	S	*	*			trans	-152.8	112.3	153.4	16.4	0	0	0	0	107.1	Q66 V70	Q66-T68 PolarHBondContact O-N 2.74Å; T68-V70 PolarHBondContact O-N 3.41Å
69	P	51.4	Low	58	Low	130 Å²	130	122.9 Å²	122.9	84%	0.844	67%	0.673	S	S	*	*			trans	-71.9	87.3	173	29.4	-29.8	0	0	0	107.2
70	V	56.8	Low	57.4	Low	105 Å²	105	123.1 Å²	123.1	64%	0.636	67%	0.674	S	S	*	*			trans	-62.5	120.9	161.7	179	0	0	0	0	104.9	T68 L73	T68-V70 PolarHBondContact O-N 3.41Å; V70-L73 HydrophobicContact CG1-CD1 4.44Å
71	P	50.8	Low	57.7	Low	98 Å²	98	120.5 Å²	120.5	64%	0.636	66%	0.663	S	S	*	*			trans	-55.3	139.2	-179.1	23.8	-32.3	0	0	0	107.5	L73	P71-L73 VanDerWaalsContact C-N 3.32Å; P71-L73 PolarHBondContact O-N 3.09Å
72	P	55.6	Low	58	Low	124 Å²	124	122.1 Å²	122.1	81%	0.805	66%	0.658	S	S	*	*			trans	-60.1	104.4	-178.5	25.9	-31.5	0	0	0	105.7	G74	P72-G74 PolarHBondContact O-N 3.31Å
73	L	52.8	Low	58.5	Low	119 Å²	119	123.4 Å²	123.4	62%	0.623	66%	0.657	S	S	*	*			trans	-53.1	117.7	166.4	-85.5	116.2	0	0	0	103.4	V70 P71 W75	V70-L73 HydrophobicContact CG1-CD1 4.44Å; P71-L73 VanDerWaalsContact C-N 3.32Å; P71-L73 PolarHBondContact O-N 3.09Å; L73-W75 VanDerWaalsContact O-CD1 3.24Å; L73-W75 PolarHBondContact O-N 3.38Å
74	G	52	Low	58.8	Low	83 Å²	83	123.4 Å²	123.4	86%	0.856	66%	0.657	S	S	*	*			trans	-67	62.1	-177.7	0	0	0	0	0	110.8	P72 S76	P72-G74 PolarHBondContact O-N 3.31Å; G74-S76 PolarHBondContact O-N 2.86Å
75	W	51.1	Low	59.5	Low	169 Å²	169	119.9 Å²	119.9	64%	0.64	64%	0.643	S	S	*	*			trans	-68.8	121.9	164.6	-66.9	83.9	0	0	0	105.3	L73 L77	L73-W75 VanDerWaalsContact O-CD1 3.24Å; L73-W75 PolarHBondContact O-N 3.38Å; W75-L77 HydrophobicContact CB-CD1 3.82Å; W75-L77 HydrophobicContact CB-CG 4.07Å; W75-L77 PolarHBondContact O-N 3.49Å
76	S	58.8	Low	60.2	Low	76 Å²	76	117.6 Å²	117.6	53%	0.531	63%	0.631	S	S	.	*			trans	-66.8	32.6	176.3	58.4	0	0	0	0	113	G74 P78 L79 W80	G74-S76 PolarHBondContact O-N 2.86Å; S76-P78 VanDerWaalsContact C-N 3.25Å; S76-L79 PolarHBondContact O-N 2.99Å; S76-W80 PolarHBondContact O-N 3.15Å
77	L	53	Low	61.5	Low	67 Å²	67	114.4 Å²	114.4	35%	0.351	62%	0.623	S	S	.	*	H	α-helix	trans	-50.1	-37.2	174.1	-79.7	156.1	0	0	0	112.9	L58 W75 L79 W80 G81	L58-L77 HydrophobicContact CD2-CD1 3.39Å; L58-L77 HydrophobicContact CD2-CD2 3.59Å; L58-L77 HydrophobicContact CD2-CG 4.14Å; W75-L77 HydrophobicContact CB-CD1 3.82Å; W75-L77 HydrophobicContact CB-CG 4.07Å; W75-L77 PolarHBondContact O-N 3.49Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-L79 PolarHBondContact O-N 2.76Å; L77-W80 HydrophobicContact CD2-CE3 4.41Å; L77-W80 PolarHBondContact O-N 2.7Å; L77-G81 WeakPolarHBondContact O-CA 3.41Å; L77-G81 PolarHBondContact O-N 3.45Å
78	P	60.7	Low	62.8	Low	103 Å²	103	110.6 Å²	110.6	67%	0.669	61%	0.607	S	S	*	*	H	α-helix	trans	-63.5	-40.1	174.4	-22.1	33.3	0	0	0	112.4	S76 R82	S76-P78 VanDerWaalsContact C-N 3.25Å; P78-R82 VanDerWaalsContact O-CB 3.27Å; P78-R82 WeakPolarHBondContact O-CB 3.26Å; P78-R82 PolarHBondContact O-N 2.97Å
79	L	59.3	Low	64	Low	128 Å²	128	109.7 Å²	109.7	67%	0.67	60%	0.602	S	S	*	*	H	α-helix	trans	-75.7	-37.9	179.7	-67.5	170.9	0	0	0	111.9	S76 L77 R83	S76-L79 PolarHBondContact O-N 2.99Å; L77-L79 VanDerWaalsContact C-N 3.34Å; L77-L79 PolarHBondContact O-N 2.76Å; L79-R83 VanDerWaalsContact O-CB 3.29Å; L79-R83 WeakPolarHBondContact O-CB 3.25Å; L79-R83 PolarHBondContact O-N 2.82Å
80	W	59.6	Low	65.4	Low	175 Å²	175	106.6 Å²	106.6	66%	0.663	59%	0.587	S	S	*	*	H	α-helix	trans	-72.4	-38.4	177	-167.6	46.3	0	0	0	111.8	S76 L77 S84	S76-W80 PolarHBondContact O-N 3.15Å; L77-W80 HydrophobicContact CD2-CE3 4.41Å; L77-W80 PolarHBondContact O-N 2.7Å; W80-S84 VanDerWaalsContact O-CB 3.25Å; W80-S84 WeakPolarHBondContact O-CB 3.27Å; W80-S84 PolarHBondContact O-N 2.91Å; W80-S84 PolarHBondContact O-OG 3.09Å
81	G	68.6	Low	66.6	Low	31 Å²	31	109.1 Å²	109.1	32%	0.32	59%	0.586	S	S	.	*	H	α-helix	trans	-60.9	-49.8	171.2	0	0	0	0	0	111.2	L77 R83 S84 L85	L77-G81 WeakPolarHBondContact O-CA 3.41Å; L77-G81 PolarHBondContact O-N 3.45Å; G81-R83 PolarHBondContact O-N 3.26Å; G81-S84 PolarHBondContact O-N 3.28Å; G81-L85 WeakPolarHBondContact O-CB 3.29Å; G81-L85 VanDerWaalsContact O-CG 3.26Å; G81-L85 WeakPolarHBondContact O-CG 3.29Å; G81-L85 PolarHBondContact O-N 3.49Å
82	R	68.1	Low	67.8	Low	180 Å²	180	107.4 Å²	107.4	68%	0.679	57%	0.571	S	S	*	*	H	α-helix	trans	-60.6	-48.3	177.7	-161	174.6	-166.3	173.6	4.5	112.1	P78 S84 L85 D86	P78-R82 VanDerWaalsContact O-CB 3.27Å; P78-R82 WeakPolarHBondContact O-CB 3.26Å; P78-R82 PolarHBondContact O-N 2.97Å; R82-S84 VanDerWaalsContact C-N 3.32Å; R82-S84 PolarHBondContact O-N 3.49Å; R82-L85 PolarHBondContact O-N 2.84Å; R82-D86 PolarHBondContact O-N 2.97Å
83	R	74.8	Confident	68.5	Low	185 Å²	185	103.8 Å²	103.8	70%	0.698	55%	0.548	S	S	*	.	H	α-helix	trans	-62.2	-38.3	177.7	-174.7	173.8	-176.3	162.4	1.9	112.8	L79 G81 D86 V87	L79-R83 VanDerWaalsContact O-CB 3.29Å; L79-R83 WeakPolarHBondContact O-CB 3.25Å; L79-R83 PolarHBondContact O-N 2.82Å; G81-R83 PolarHBondContact O-N 3.26Å; R83-D86 PolarHBondContact O-N 2.87Å; R83-V87 VanDerWaalsContact O-CG2 3.29Å; R83-V87 WeakPolarHBondContact O-CG2 3.39Å; R83-V87 PolarHBondContact O-N 3.37Å; R83-V87 VanDerWaalsContact O-N 3.09Å
84	S	75.8	Confident	69.4	Low	46 Å²	46	108.8 Å²	108.8	32%	0.322	56%	0.558	S	S	.	*	H	α-helix	trans	-69.8	-41.3	177.8	-57.9	0	0	0	0	111.2	W80 G81 R82 V87 L88	W80-S84 VanDerWaalsContact O-CB 3.25Å; W80-S84 WeakPolarHBondContact O-CB 3.27Å; W80-S84 PolarHBondContact O-N 2.91Å; W80-S84 PolarHBondContact O-OG 3.09Å; G81-S84 PolarHBondContact O-N 3.28Å; R82-S84 VanDerWaalsContact C-N 3.32Å; R82-S84 PolarHBondContact O-N 3.49Å; S84-V87 PolarHBondContact O-N 2.93Å; S84-L88 WeakPolarHBondContact O-CB 3.37Å; S84-L88 VanDerWaalsContact O-CG 3.27Å; S84-L88 WeakPolarHBondContact O-CG 3.44Å; S84-L88 PolarHBondContact O-N 3.37Å
85	L	78.3	Confident	70.4	Confident	108 Å²	108	112.8 Å²	112.8	57%	0.565	55%	0.552	S	S	*	*	H	α-helix	trans	-63.7	-39.4	173.6	-71.9	172.3	0	0	0	111.8	G81 R82 L88 T89	G81-L85 WeakPolarHBondContact O-CB 3.29Å; G81-L85 VanDerWaalsContact O-CG 3.26Å; G81-L85 WeakPolarHBondContact O-CG 3.29Å; G81-L85 PolarHBondContact O-N 3.49Å; R82-L85 PolarHBondContact O-N 2.84Å; L85-L88 PolarHBondContact O-N 2.94Å; L85-T89 VanDerWaalsContact O-CB 3.23Å; L85-T89 WeakPolarHBondContact O-CB 3.23Å; L85-T89 PolarHBondContact O-N 2.88Å; L85-T89 PolarHBondContact O-OG1 2.81Å
86	D	77.4	Confident	71	Confident	98 Å²	98	110.3 Å²	110.3	52%	0.524	55%	0.548	S	S	.	.	H	α-helix	trans	-63.3	-43	176.1	-68.5	-28.3	0	0	0	111.3	R82 R83 T89 A90	R82-D86 PolarHBondContact O-N 2.97Å; R83-D86 PolarHBondContact O-N 2.87Å; D86-T89 PolarHBondContact O-N 3.44Å; D86-A90 WeakPolarHBondContact O-CB 3.27Å; D86-A90 PolarHBondContact O-N 3.14Å
87	V	81.5	Confident	71.1	Confident	95 Å²	95	115.1 Å²	115.1	58%	0.576	57%	0.568	S	S	*	*	H	α-helix	trans	-65.6	-43.5	176.8	170.5	0	0	0	0	111.5	R83 S84 A90 W91	R83-V87 VanDerWaalsContact O-CG2 3.29Å; R83-V87 WeakPolarHBondContact O-CG2 3.39Å; R83-V87 PolarHBondContact O-N 3.37Å; R83-V87 VanDerWaalsContact O-N 3.09Å; S84-V87 PolarHBondContact O-N 2.93Å; V87-A90 PolarHBondContact O-N 3.3Å; V87-W91 WeakPolarHBondContact O-CB 3.27Å; V87-W91 PolarHBondContact O-N 3.39Å
88	L	81.1	Confident	71.7	Confident	105 Å²	105	113.7 Å²	113.7	55%	0.55	56%	0.563	S	S	.	*	H	α-helix	trans	-64.7	-42.6	177	-73.3	169.7	0	0	0	111.3	S84 L85 W91 L92	S84-L88 WeakPolarHBondContact O-CB 3.37Å; S84-L88 VanDerWaalsContact O-CG 3.27Å; S84-L88 WeakPolarHBondContact O-CG 3.44Å; S84-L88 PolarHBondContact O-N 3.37Å; L85-L88 PolarHBondContact O-N 2.94Å; L88-W91 PolarHBondContact O-N 3.4Å; L88-L92 VanDerWaalsContact O-CB 3.27Å; L88-L92 WeakPolarHBondContact O-CB 3.25Å; L88-L92 PolarHBondContact O-N 3.21Å
89	T	76.6	Confident	71.7	Confident	79 Å²	79	112.9 Å²	112.9	49%	0.485	56%	0.559	S	S	.	*	H	α-helix	trans	-61.1	-48.8	175.8	-57.3	0	0	0	0	110.6	L85 D86 W91 L92 C93	L85-T89 VanDerWaalsContact O-CB 3.23Å; L85-T89 WeakPolarHBondContact O-CB 3.23Å; L85-T89 PolarHBondContact O-N 2.88Å; L85-T89 PolarHBondContact O-OG1 2.81Å; D86-T89 PolarHBondContact O-N 3.44Å; T89-W91 VanDerWaalsContact C-N 3.33Å; T89-W91 PolarHBondContact O-N 3.37Å; T89-L92 PolarHBondContact O-N 2.88Å; T89-C93 VanDerWaalsContact O-CB 3.25Å; T89-C93 WeakPolarHBondContact O-CB 3.32Å; T89-C93 PolarHBondContact O-N 2.66Å; T89-C93 PolarHBondContact O-SG 3.45Å
90	A	81.4	Confident	71.4	Confident	65 Å²	65	113.5 Å²	113.5	54%	0.537	57%	0.574	S	S	.	*	H	α-helix	trans	-61.9	-39.5	178.1	0	0	0	0	0	112.7	D86 V87 R94	D86-A90 WeakPolarHBondContact O-CB 3.27Å; D86-A90 PolarHBondContact O-N 3.14Å; V87-A90 PolarHBondContact O-N 3.3Å; A90-R94 PolarHBondContact O-N 2.84Å; A90-R94 VanDerWaalsContact O-N 3.14Å
91	W	81.2	Confident	71.2	Confident	158 Å²	158	107.9 Å²	107.9	60%	0.598	57%	0.57	S	S	*	*	H	α-helix	trans	-68.5	-43.6	176.4	-178.9	84.9	0	0	0	112	V87 L88 T89 C93 R94 F95	V87-W91 WeakPolarHBondContact O-CB 3.27Å; V87-W91 PolarHBondContact O-N 3.39Å; L88-W91 PolarHBondContact O-N 3.4Å; T89-W91 VanDerWaalsContact C-N 3.33Å; T89-W91 PolarHBondContact O-N 3.37Å; W91-C93 VanDerWaalsContact C-N 3.28Å; W91-C93 PolarHBondContact O-N 3.36Å; W91-R94 WeakPolarHBondContact O-CB 2.96Å; W91-R94 PolarHBondContact O-N 3.12Å; W91-R94 VanDerWaalsContact O-N 3.12Å; W91-F95 PolarHBondContact O-N 3.04Å
92	L	75.6	Confident	70.5	Confident	62 Å²	62	111.1 Å²	111.1	33%	0.325	60%	0.604	S	S	.	*	H	α-helix	trans	-61.6	-40.3	176.5	-167.5	69.6	0	0	0	110.9	L88 T89 R94 F95 Q96	L88-L92 VanDerWaalsContact O-CB 3.27Å; L88-L92 WeakPolarHBondContact O-CB 3.25Å; L88-L92 PolarHBondContact O-N 3.21Å; T89-L92 PolarHBondContact O-N 2.88Å; L92-R94 PolarHBondContact O-N 3.26Å; L92-F95 CarbonylContact O-C 3.58Å; L92-F95 PolarHBondContact O-N 2.03Å; L92-Q96 VanDerWaalsContact CD1-NE2 3.32Å; L92-Q96 PolarHBondContact O-N 3.41Å
93	C	71.8	Confident	69.6	Low	48 Å²	48	105.1 Å²	105.1	32%	0.324	60%	0.598	S	S	.	*	H	α-helix	trans	-72.6	-13.1	176.9	-72.5	0	0	0	0	115.3	T89 W91 Q96 C98	T89-C93 VanDerWaalsContact O-CB 3.25Å; T89-C93 WeakPolarHBondContact O-CB 3.32Å; T89-C93 PolarHBondContact O-N 2.66Å; T89-C93 PolarHBondContact O-SG 3.45Å; W91-C93 VanDerWaalsContact C-N 3.28Å; W91-C93 PolarHBondContact O-N 3.36Å; C93-Q96 CarbonylContact C-O 3.38Å; C93-C98 WeakPolarHBondContact CA-SG 2.9Å; C93-C98 HydrophobicContact CB-CB 3.24Å; C93-C98 WeakPolarHBondContact CB-SG 3.39Å; C93-C98 WeakPolarHBondContact SG-CB 3.16Å; C93-C98 CovalentContact SG-SG 2.03Å; C93-C98 PolarHBondContact SG-SG 2.78Å
94	R	71.9	Confident	68.8	Low	223 Å²	223	104.4 Å²	104.4	84%	0.842	61%	0.608	S	S	*	*	H	α-helix	trans	-83.1	-26.8	167.1	-174.8	177.6	-179.7	-177.9	0.9	111.7	A90 W91 L92	A90-R94 PolarHBondContact O-N 2.84Å; A90-R94 VanDerWaalsContact O-N 3.14Å; W91-R94 WeakPolarHBondContact O-CB 2.96Å; W91-R94 PolarHBondContact O-N 3.12Å; W91-R94 VanDerWaalsContact O-N 3.12Å; L92-R94 PolarHBondContact O-N 3.26Å
95	F	71.4	Confident	68.1	Low	167 Å²	167	105.2 Å²	105.2	73%	0.732	61%	0.613	S	S	*	*	H	α-helix	trans	-97.5	-27.7	-175	-156.4	-92.2	0	0	0	113	W91 L92	W91-F95 PolarHBondContact O-N 3.04Å; L92-F95 CarbonylContact O-C 3.58Å; L92-F95 PolarHBondContact O-N 2.03Å
96	Q	64.5	Low	67	Low	118 Å²	118	111.3 Å²	111.3	55%	0.551	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	153	172.3	-60.8	-169.8	46.5	0	0	109.3	L92 C93 C98	L92-Q96 VanDerWaalsContact CD1-NE2 3.32Å; L92-Q96 PolarHBondContact O-N 3.41Å; C93-Q96 CarbonylContact C-O 3.38Å; Q96-C98 PolarHBondContact O-N 2.77Å
97	D	61.3	Low	65.8	Low	177 Å²	177	113 Å²	113	95%	0.947	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	78.2	174.5	-73.1	-46.5	0	0	0	110.7
98	C	64.8	Low	64.3	Low	36 Å²	36	113.6 Å²	113.6	24%	0.243	64%	0.644	C	S	.	*			trans	-73.6	141.7	166	-78.9	0	0	0	0	110	C93 Q96 S100	C93-C98 WeakPolarHBondContact CA-SG 2.9Å; C93-C98 HydrophobicContact CB-CB 3.24Å; C93-C98 WeakPolarHBondContact CB-SG 3.39Å; C93-C98 WeakPolarHBondContact SG-CB 3.16Å; C93-C98 CovalentContact SG-SG 2.03Å; C93-C98 PolarHBondContact SG-SG 2.78Å; Q96-C98 PolarHBondContact O-N 2.77Å; C98-S100 PolarHBondContact O-N 2.85Å
99	C	60.8	Low	62.8	Low	87 Å²	87	114.2 Å²	114.2	59%	0.588	65%	0.648	S	S	*	*			trans	-52.7	123.4	-170.6	-58.1	0	0	0	0	113.1	G101 C105	C99-G101 PolarHBondContact O-N 3.18Å; C99-C105 HydrophobicContact CB-CB 4.25Å
100	S	54	Low	61.8	Low	141 Å²	141	116.5 Å²	116.5	99%	0.986	66%	0.657	S	S	*	*	S	Bend	trans	-71.1	15.6	-179.3	-53.4	0	0	0	0	115.4	C98	C98-S100 PolarHBondContact O-N 2.85Å
101	G	55.6	Low	60.4	Low	57 Å²	57	120.1 Å²	120.1	59%	0.588	67%	0.667	S	S	*	*	S	Bend	trans	-150	76.8	-167.7	0	0	0	0	0	113.7	C99 G103	C99-G101 PolarHBondContact O-N 3.18Å; G101-G103 PolarHBondContact O-N 2.85Å
102	G	52.8	Low	58.6	Low	99 Å²	99	118 Å²	118	100%	1.021	67%	0.672	S	S	*	*	S	Bend	trans	42.1	25.1	144.2	0	0	0	0	0	121.1
103	G	48.9	Very low	57.4	Low	53 Å²	53	117.5 Å²	117.5	55%	0.546	68%	0.682	S	S	.	*	S	Bend	trans	-149.7	145.5	-179.7	0	0	0	0	0	110.6	G101 C105	G101-G103 PolarHBondContact O-N 2.85Å; G103-C105 PolarHBondContact O-N 3Å
104	D	58.8	Low	55.9	Low	170 Å²	170	127.9 Å²	127.9	91%	0.909	71%	0.714	S	S	*	*			trans	-37.2	94.3	-168.7	-71.3	-41.5	0	0	0	114.3	R106	D104-R106 PolarHBondContact O-N 3.24Å
105	C	59.9	Low	54.4	Low	64 Å²	64	126.5 Å²	126.5	43%	0.432	74%	0.738	S	S	.	*			trans	-73.7	75.9	172.8	-179.2	0	0	0	0	108.4	C99 G103 I107	C99-C105 HydrophobicContact CB-CB 4.25Å; G103-C105 PolarHBondContact O-N 3Å; C105-I107 PolarHBondContact O-N 2.96Å
106	R	55.3	Low	53.6	Low	235 Å²	235	124.5 Å²	124.5	89%	0.887	74%	0.739	S	S	*	*			trans	-71	110.8	168.7	-145.8	-177.4	-174.8	177	2	106.6	D104 S108	D104-R106 PolarHBondContact O-N 3.24Å; R106-S108 PolarHBondContact O-N 2.73Å
107	I	53.4	Low	53	Low	133 Å²	133	124.8 Å²	124.8	68%	0.682	75%	0.749	S	S	*	*			trans	-54	101.6	172.2	-60.2	174.3	0	0	0	107	C105 N109	C105-I107 PolarHBondContact O-N 2.96Å; I107-N109 VanDerWaalsContact C-N 3.34Å; I107-N109 PolarHBondContact O-N 2.83Å
108	S	49.6	Very low	52.5	Low	108 Å²	108	121.9 Å²	121.9	76%	0.755	74%	0.738	S	S	*	*			trans	-75.6	93.4	175.3	63	0	0	0	0	106.9	R106 N110	R106-S108 PolarHBondContact O-N 2.73Å; S108-N110 VanDerWaalsContact C-N 3.27Å; S108-N110 PolarHBondContact O-N 2.86Å
109	N	49.9	Very low	51.8	Low	118 Å²	118	126.9 Å²	126.9	63%	0.631	77%	0.767	S	S	*	*			trans	-72.5	92.7	167.1	-153.1	-26.6	0	0	0	107	I107 L111	I107-N109 VanDerWaalsContact C-N 3.34Å; I107-N109 PolarHBondContact O-N 2.83Å; N109-L111 HydrophobicContact CB-CD1 4.4Å; N109-L111 VanDerWaalsContact CG-CD1 3.46Å; N109-L111 PolarHBondContact O-N 2.96Å; N109-L111 VanDerWaalsContact OD1-CD1 3.29Å; N109-L111 WeakPolarHBondContact OD1-CD1 3.16Å; N109-L111 WeakPolarHBondContact OD1-CG 3.29Å
110	N	54.4	Low	51.2	Low	127 Å²	127	129.4 Å²	129.4	68%	0.679	78%	0.778	S	S	*	*			trans	-74.1	72.3	171.3	-172.9	7.6	0	0	0	108.7	S108 T112	S108-N110 VanDerWaalsContact C-N 3.27Å; S108-N110 PolarHBondContact O-N 2.86Å; N110-T112 PolarHBondContact OD1-N 2.96Å; N110-T112 PolarHBondContact OD1-O 3.46Å; N110-T112 PolarHBondContact OD1-OG1 3.48Å
111	L	51.6	Low	51	Low	141 Å²	141	128.7 Å²	128.7	74%	0.738	76%	0.764	S	S	*	*			trans	-87.7	17.8	170.1	-85.5	161.6	0	0	0	112.1	N109 G113	N109-L111 HydrophobicContact CB-CD1 4.4Å; N109-L111 VanDerWaalsContact CG-CD1 3.46Å; N109-L111 PolarHBondContact O-N 2.96Å; N109-L111 VanDerWaalsContact OD1-CD1 3.29Å; N109-L111 WeakPolarHBondContact OD1-CD1 3.16Å; N109-L111 WeakPolarHBondContact OD1-CG 3.29Å; L111-G113 PolarHBondContact O-N 3.48Å
112	T	43.6	Very low	50.7	Low	115 Å²	115	133.8 Å²	133.8	71%	0.706	78%	0.777	S	S	*	*			trans	-98.5	78.6	166.9	45.9	0	0	0	0	108.7	N110	N110-T112 PolarHBondContact OD1-N 2.96Å; N110-T112 PolarHBondContact OD1-O 3.46Å; N110-T112 PolarHBondContact OD1-OG1 3.48Å
113	G	51.6	Low	50.6	Low	51 Å²	51	136.5 Å²	136.5	53%	0.526	76%	0.758	S	S	.	*			trans	-61.2	173.2	136.9	0	0	0	0	0	108.7	L111	L111-G113 PolarHBondContact O-N 3.48Å
114	W	39.3	Very low	50.7	Low	265 Å²	265	143.4 Å²	143.4	100%	1.004	78%	0.775	S	S	*	*			trans	86.5	71.1	-169.9	-50.9	66.7	0	0	0	113.6
115	S	41	Very low	50	Low	194 Å²	194	141 Å²	141	100%	1.357	76%	0.763	S	S	*	*				-171.8	0	113.8	177.7	0	0	0	0	110.6

Retrieved 115 of 115 residues in 25.4 ms (Link to these results)

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