A0A077Z095_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z095, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 130 aa.

						>A0A077Z095_TRITR|A0A077Z095
MDDELATSTEPDPQAIFQSILAEAGLSPEDDVEAESENETEMVQKLKEEDVGRVLLQLKCFAAEKCPKMLSAVAIAETALGAYVCSKRSTRLELIPFSASSVAPKKLMHNFTMLFLCISPFNRPPIDALQ
					

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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	45.7	Very low	51.8	Low	230 Å²	230	145.1 Å²	145.1	100%	1.133	81%	0.81	S	S	*	*				0	89.5	0	-77.5	171.7	155.1	0	0	104.1	D3	M1-D3 PolarHBondContact O-N 3.21Å
2	D	45.5	Very low	52.7	Low	165 Å²	165	140.2 Å²	140.2	88%	0.882	78%	0.781	S	S	*	*			trans	-76.7	90.8	176.4	-75.1	-86.5	0	0	0	107.2	E4	D2-E4 VanDerWaalsContact C-N 3.32Å; D2-E4 PolarHBondContact O-N 2.98Å; D2-E4 VanDerWaalsContact O-N 3.11Å
3	D	53	Low	53.8	Low	150 Å²	150	136 Å²	136	80%	0.802	76%	0.764	S	S	*	*			trans	-76.4	93.7	166.3	-84.3	-62.4	0	0	0	107.3	M1 L5	M1-D3 PolarHBondContact O-N 3.21Å; D3-L5 PolarHBondContact O-N 3.16Å
4	E	54.8	Low	54.6	Low	187 Å²	187	135.5 Å²	135.5	87%	0.874	75%	0.752	S	S	*	*			trans	-45.8	106.2	162.8	-105.5	-176.4	128.1	0	0	108.4	D2 A6	D2-E4 VanDerWaalsContact C-N 3.32Å; D2-E4 PolarHBondContact O-N 2.98Å; D2-E4 VanDerWaalsContact O-N 3.11Å; E4-A6 PolarHBondContact O-N 3.11Å
5	L	51.1	Low	55.5	Low	163 Å²	163	130.1 Å²	130.1	85%	0.853	73%	0.732	S	S	*	*			trans	-62.4	85.4	162.9	-79.8	160.2	0	0	0	107.1	D3 T7	D3-L5 PolarHBondContact O-N 3.16Å; L5-T7 PolarHBondContact O-N 2.76Å
6	A	51.1	Low	56.6	Low	88 Å²	88	127.2 Å²	127.2	73%	0.727	71%	0.713	S	S	*	*			trans	-61	90.2	160.4	0	0	0	0	0	106.4	E4 S8	E4-A6 PolarHBondContact O-N 3.11Å; A6-S8 PolarHBondContact O-N 2.79Å
7	T	47	Very low	57.5	Low	115 Å²	115	127.8 Å²	127.8	71%	0.706	71%	0.706	S	S	*	*			trans	-65.2	87.2	170.1	52.4	0	0	0	0	106.8	L5 T9	L5-T7 PolarHBondContact O-N 2.76Å; T7-T9 PolarHBondContact O-N 2.81Å
8	S	48.8	Very low	58.2	Low	120 Å²	120	127.3 Å²	127.3	84%	0.839	70%	0.698	S	S	*	*			trans	-65.5	69.9	157.6	-76.6	0	0	0	0	107.6	A6 E10	A6-S8 PolarHBondContact O-N 2.79Å; S8-E10 PolarHBondContact O-N 2.81Å
9	T	55.5	Low	58.9	Low	112 Å²	112	124.5 Å²	124.5	69%	0.687	69%	0.689	S	S	*	*			trans	-71.8	92.7	166.8	-61.8	0	0	0	0	105.4	T7	T7-T9 PolarHBondContact O-N 2.81Å
10	E	59	Low	59.7	Low	177 Å²	177	123 Å²	123	83%	0.827	68%	0.679	S	S	*	*			trans	-45.5	121.2	160.6	-125.2	174.5	129	0	0	106.7	S8 D12	S8-E10 PolarHBondContact O-N 2.81Å; E10-D12 PolarHBondContact O-N 2.97Å
11	P	57.9	Low	60.1	Low	89 Å²	89	120.6 Å²	120.6	58%	0.578	66%	0.664	S	S	*	*			trans	-60.3	120.6	-178.6	23.4	-31.4	0	0	0	107.5	P13 I16	P11-P13 VanDerWaalsContact O-N 3.12Å; P11-I16 HydrophobicContact CB-CD1 4.47Å; P11-I16 HydrophobicContact CG-CD1 4.35Å
12	D	63.3	Low	61.4	Low	86 Å²	86	113.3 Å²	113.3	46%	0.46	64%	0.641	S	S	.	*			trans	-48.7	121	177.1	175.4	12	0	0	0	108.4	E10 Q14 A15 I16	E10-D12 PolarHBondContact O-N 2.97Å; D12-Q14 PolarHBondContact O-N 2.85Å; D12-Q14 WeakPolarHBondContact OD1-CB 3.32Å; D12-Q14 PolarHBondContact OD1-N 3.14Å; D12-Q14 VanDerWaalsContact OD1-N 3.14Å; D12-A15 HydrophobicContact CB-CB 4.33Å; D12-A15 WeakPolarHBondContact O-CA 3.48Å; D12-A15 WeakPolarHBondContact O-CB 3.43Å; D12-A15 PolarHBondContact O-N 3.37Å; D12-I16 PolarHBondContact O-N 3.41Å
13	P	66.2	Low	62.5	Low	86 Å²	86	113.6 Å²	113.6	56%	0.558	64%	0.637	S	S	*	*	H	α-helix	trans	-53.4	-29.5	-179.5	17.6	-30.3	0	0	0	111.7	P11 A15 I16 F17	P11-P13 VanDerWaalsContact O-N 3.12Å; P13-A15 VanDerWaalsContact C-N 3.34Å; P13-A15 PolarHBondContact O-N 3.2Å; P13-I16 WeakPolarHBondContact O-CB 3.42Å; P13-I16 PolarHBondContact O-N 3.05Å; P13-F17 WeakPolarHBondContact O-CD2 3.49Å; P13-F17 PolarHBondContact O-N 3.47Å; P13-F17 VanDerWaalsContact O-N 3.11Å
14	Q	65.9	Low	63.3	Low	129 Å²	129	109.4 Å²	109.4	60%	0.603	62%	0.623	S	S	*	*	H	α-helix	trans	-65.8	-34	176.3	-161.4	169.1	-15.9	0	0	113	D12 F17 Q18	D12-Q14 PolarHBondContact O-N 2.85Å; D12-Q14 WeakPolarHBondContact OD1-CB 3.32Å; D12-Q14 PolarHBondContact OD1-N 3.14Å; D12-Q14 VanDerWaalsContact OD1-N 3.14Å; Q14-F17 PolarHBondContact O-N 3.01Å; Q14-Q18 WeakPolarHBondContact O-CG 3.4Å; Q14-Q18 PolarHBondContact O-N 3Å
15	A	68.3	Low	63	Low	54 Å²	54	103.6 Å²	103.6	45%	0.446	61%	0.613	S	S	.	*	H	α-helix	trans	-68.2	-35.6	174.3	0	0	0	0	0	111.9	D12 P13 F17 Q18 S19	D12-A15 HydrophobicContact CB-CB 4.33Å; D12-A15 WeakPolarHBondContact O-CA 3.48Å; D12-A15 WeakPolarHBondContact O-CB 3.43Å; D12-A15 PolarHBondContact O-N 3.37Å; P13-A15 VanDerWaalsContact C-N 3.34Å; P13-A15 PolarHBondContact O-N 3.2Å; A15-F17 VanDerWaalsContact C-N 3.35Å; A15-Q18 PolarHBondContact O-N 2.88Å; A15-S19 WeakPolarHBondContact O-CB 3.48Å; A15-S19 PolarHBondContact O-N 3.44Å
16	I	72	Confident	63.2	Low	84 Å²	84	100.8 Å²	100.8	43%	0.431	60%	0.598	S	S	.	*	H	α-helix	trans	-64.1	-44.4	174.7	-57.4	175.1	0	0	0	109.7	P11 D12 P13 Q18 S19 I20	P11-I16 HydrophobicContact CB-CD1 4.47Å; P11-I16 HydrophobicContact CG-CD1 4.35Å; D12-I16 PolarHBondContact O-N 3.41Å; P13-I16 WeakPolarHBondContact O-CB 3.42Å; P13-I16 PolarHBondContact O-N 3.05Å; I16-Q18 PolarHBondContact O-N 3.25Å; I16-S19 PolarHBondContact O-N 3.37Å; I16-I20 HydrophobicContact CG2-CD1 3.91Å; I16-I20 VanDerWaalsContact O-CG1 3.29Å; I16-I20 WeakPolarHBondContact O-CG1 3.29Å; I16-I20 PolarHBondContact O-N 3.37Å
17	F	71.8	Confident	63	Low	137 Å²	137	101 Å²	101	60%	0.601	59%	0.594	S	S	*	*	H	α-helix	trans	-60	-45.9	175.2	-78.8	-69.6	0	0	0	112.1	P13 Q14 A15 S19 I20 L21	P13-F17 WeakPolarHBondContact O-CD2 3.49Å; P13-F17 PolarHBondContact O-N 3.47Å; P13-F17 VanDerWaalsContact O-N 3.11Å; Q14-F17 PolarHBondContact O-N 3.01Å; A15-F17 VanDerWaalsContact C-N 3.35Å; F17-S19 VanDerWaalsContact C-N 3.32Å; F17-S19 PolarHBondContact O-N 2.93Å; F17-I20 PolarHBondContact O-N 3.46Å; F17-L21 VanDerWaalsContact O-CG 3.31Å; F17-L21 WeakPolarHBondContact O-CG 3.31Å; F17-L21 PolarHBondContact O-N 2.92Å
18	Q	70.6	Confident	63.3	Low	119 Å²	119	100.5 Å²	100.5	56%	0.556	59%	0.593	S	S	*	*	H	α-helix	trans	-62.3	-39.4	176.3	-72	-124.5	6.4	0	0	112.5	Q14 A15 I16 I20 L21 A22	Q14-Q18 WeakPolarHBondContact O-CG 3.4Å; Q14-Q18 PolarHBondContact O-N 3Å; A15-Q18 PolarHBondContact O-N 2.88Å; I16-Q18 PolarHBondContact O-N 3.25Å; Q18-I20 PolarHBondContact O-N 2.84Å; Q18-L21 PolarHBondContact O-N 3.5Å; Q18-A22 VanDerWaalsContact O-CB 3.29Å; Q18-A22 WeakPolarHBondContact O-CB 3.21Å; Q18-A22 PolarHBondContact O-N 2.96Å
19	S	72.5	Confident	63.1	Low	75 Å²	75	102.4 Å²	102.4	52%	0.524	59%	0.589	S	S	.	*	H	α-helix	trans	-63.5	-41.7	176.7	-164.9	0	0	0	0	111.7	A15 I16 F17 A22 E23	A15-S19 WeakPolarHBondContact O-CB 3.48Å; A15-S19 PolarHBondContact O-N 3.44Å; I16-S19 PolarHBondContact O-N 3.37Å; F17-S19 VanDerWaalsContact C-N 3.32Å; F17-S19 PolarHBondContact O-N 2.93Å; S19-A22 PolarHBondContact O-N 2.87Å; S19-E23 WeakPolarHBondContact O-CB 3.09Å; S19-E23 PolarHBondContact O-N 3.03Å
20	I	74.4	Confident	62.6	Low	94 Å²	94	104.8 Å²	104.8	48%	0.482	60%	0.597	S	S	.	*	H	α-helix	trans	-66	-42.9	176.4	-66.4	164.8	0	0	0	110.5	I16 F17 Q18 E23 A24	I16-I20 HydrophobicContact CG2-CD1 3.91Å; I16-I20 VanDerWaalsContact O-CG1 3.29Å; I16-I20 WeakPolarHBondContact O-CG1 3.29Å; I16-I20 PolarHBondContact O-N 3.37Å; F17-I20 PolarHBondContact O-N 3.46Å; Q18-I20 PolarHBondContact O-N 2.84Å; I20-E23 PolarHBondContact O-N 3.31Å; I20-A24 WeakPolarHBondContact O-CB 3.29Å; I20-A24 PolarHBondContact O-N 3.33Å
21	L	68.9	Low	61.9	Low	73 Å²	73	104.1 Å²	104.1	38%	0.382	60%	0.599	S	S	.	*	H	α-helix	trans	-64.6	-40.2	177.4	-70.5	174.8	0	0	0	111.8	F17 Q18 A24 G25 L26	F17-L21 VanDerWaalsContact O-CG 3.31Å; F17-L21 WeakPolarHBondContact O-CG 3.31Å; F17-L21 PolarHBondContact O-N 2.92Å; Q18-L21 PolarHBondContact O-N 3.5Å; L21-A24 CarbonylContact O-C 3.5Å; L21-A24 PolarHBondContact O-N 3.29Å; L21-G25 PolarHBondContact O-N 3.24Å; L21-L26 HydrophobicContact CB-CB 4.42Å; L21-L26 HydrophobicContact CD2-CB 3.95Å; L21-L26 HydrophobicContact CD2-CD1 3.72Å; L21-L26 HydrophobicContact CD2-CG 4.49Å; L21-L26 PolarHBondContact O-N 3.37Å
22	A	71.5	Confident	61.5	Low	77 Å²	77	105.6 Å²	105.6	64%	0.636	61%	0.607	S	S	*	*	H	α-helix	trans	-65.4	-41.7	175.3	0	0	0	0	0	112.1	Q18 S19 A24 G25	Q18-A22 VanDerWaalsContact O-CB 3.29Å; Q18-A22 WeakPolarHBondContact O-CB 3.21Å; Q18-A22 PolarHBondContact O-N 2.96Å; S19-A22 PolarHBondContact O-N 2.87Å; A22-A24 VanDerWaalsContact C-N 3.32Å; A22-G25 PolarHBondContact O-N 3.4Å
23	E	70	Confident	60.3	Low	171 Å²	171	109.8 Å²	109.8	80%	0.799	62%	0.623	S	S	*	*	H	α-helix	trans	-65.7	-36.3	174.1	-170.7	179.9	169.5	0	0	111.7	S19 I20 G25	S19-E23 WeakPolarHBondContact O-CB 3.09Å; S19-E23 PolarHBondContact O-N 3.03Å; I20-E23 PolarHBondContact O-N 3.31Å; E23-G25 PolarHBondContact O-N 3.11Å
24	A	69.2	Low	59	Low	62 Å²	62	110 Å²	110	51%	0.512	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	-4.9	175.2	0	0	0	0	0	113.8	I20 L21 A22 L26	I20-A24 WeakPolarHBondContact O-CB 3.29Å; I20-A24 PolarHBondContact O-N 3.33Å; L21-A24 CarbonylContact O-C 3.5Å; L21-A24 PolarHBondContact O-N 3.29Å; A22-A24 VanDerWaalsContact C-N 3.32Å; A24-L26 VanDerWaalsContact C-N 3.26Å; A24-L26 HydrophobicContact CB-CD1 3.94Å; A24-L26 HydrophobicContact CB-CG 4.06Å; A24-L26 PolarHBondContact O-N 3.48Å
25	G	48.4	Very low	57.6	Low	64 Å²	64	113.1 Å²	113.1	66%	0.66	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.4	22.2	-178.4	0	0	0	0	0	114.3	L21 A22 E23 S27	L21-G25 PolarHBondContact O-N 3.24Å; A22-G25 PolarHBondContact O-N 3.4Å; E23-G25 PolarHBondContact O-N 3.11Å; G25-S27 PolarHBondContact O-N 2.8Å
26	L	55.9	Low	56.4	Low	105 Å²	105	115.3 Å²	115.3	55%	0.55	66%	0.659	S	S	.	*			trans	-92.8	90.8	179.4	-62.6	170.6	0	0	0	108.6	L21 A24	L21-L26 HydrophobicContact CB-CB 4.42Å; L21-L26 HydrophobicContact CD2-CB 3.95Å; L21-L26 HydrophobicContact CD2-CD1 3.72Å; L21-L26 HydrophobicContact CD2-CG 4.49Å; L21-L26 PolarHBondContact O-N 3.37Å; A24-L26 VanDerWaalsContact C-N 3.26Å; A24-L26 HydrophobicContact CB-CD1 3.94Å; A24-L26 HydrophobicContact CB-CG 4.06Å; A24-L26 PolarHBondContact O-N 3.48Å
27	S	45.8	Very low	55.3	Low	92 Å²	92	120.1 Å²	120.1	64%	0.643	68%	0.68	S	S	*	*			trans	-64.6	134.1	174.3	-159.6	0	0	0	0	110	G25 E29	G25-S27 PolarHBondContact O-N 2.8Å; S27-E29 PolarHBondContact O-N 3.38Å; S27-E29 VanDerWaalsContact O-N 3.16Å
28	P	54.1	Low	54	Low	104 Å²	104	118.1 Å²	118.1	68%	0.675	68%	0.675	S	S	*	*	S	Bend	trans	-79.3	13.7	-177.3	32.1	-35.1	0	0	0	114.3
29	E	44.6	Very low	52.8	Low	161 Å²	161	121.7 Å²	121.7	75%	0.752	69%	0.692	S	S	*	*			trans	-107.4	60	-173.3	-47.3	-164.7	143.8	0	0	111.7	S27	S27-E29 PolarHBondContact O-N 3.38Å; S27-E29 VanDerWaalsContact O-N 3.16Å
30	D	44.4	Very low	51.4	Low	162 Å²	162	122.7 Å²	122.7	87%	0.866	70%	0.695	S	S	*	*			trans	-154	73.5	159.5	-102.8	-48.6	0	0	0	109.5
31	D	45.3	Very low	49.7	Very low	162 Å²	162	125 Å²	125	87%	0.866	70%	0.704	S	S	*	*			trans	-84.1	94.5	159.1	-175.4	41.5	0	0	0	107.3
32	V	49.5	Very low	48.4	Very low	121 Å²	121	130 Å²	130	73%	0.733	73%	0.727	S	S	*	*			trans	-165.6	116.1	155.4	130.7	0	0	0	0	111.7
33	E	37.3	Very low	47.2	Very low	174 Å²	174	131.5 Å²	131.5	81%	0.813	73%	0.728	S	S	*	*			trans	60.4	103.9	150.6	-57.8	-136	114.3	0	0	120.5
34	A	37.8	Very low	46.1	Very low	90 Å²	90	130.5 Å²	130.5	74%	0.744	72%	0.724	S	S	*	*				49.4	125.7	124	0	0	0	0	0	119.6
35	E	38	Very low	45.4	Very low	195 Å²	195	137.1 Å²	137.1	91%	0.911	74%	0.741	S	S	*	*			trans	81.3	68.7	167.6	-54.5	-162	154.3	0	0	116.8
36	S	41.9	Very low	45.7	Very low	100 Å²	100	137 Å²	137	70%	0.699	73%	0.725	S	S	*	*			trans	-134.2	84.8	135	65.5	0	0	0	0	110.6	N38	S36-N38 PolarHBondContact O-N 2.85Å
37	E	48.8	Very low	46.2	Very low	185 Å²	185	138.6 Å²	138.6	86%	0.864	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	30.4	156	-143.3	167.6	-144.9	0	0	111.2	T40	E37-T40 PolarHBondContact O-OG1 3.49Å
38	N	45.1	Very low	47.2	Very low	94 Å²	94	138.1 Å²	138.1	50%	0.503	72%	0.715	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.4	3.8	178.7	-157.5	53.8	0	0	0	112.8	S36 T40 E41	S36-N38 PolarHBondContact O-N 2.85Å; N38-T40 PolarHBondContact O-N 2.91Å; N38-E41 PolarHBondContact ND2-OE2 2.96Å; N38-E41 PolarHBondContact O-N 3.41Å; N38-E41 PolarHBondContact OD1-OE2 3.23Å
39	E	44.9	Very low	48	Very low	194 Å²	194	139.9 Å²	139.9	91%	0.907	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	38.1	159.4	-152.7	-173.4	170.8	0	0	111.3
40	T	42.8	Very low	49.4	Very low	97 Å²	97	135.2 Å²	135.2	60%	0.595	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.9	9.7	171.5	58.9	0	0	0	0	112.7	E37 N38	E37-T40 PolarHBondContact O-OG1 3.49Å; N38-T40 PolarHBondContact O-N 2.91Å
41	E	40.5	Very low	50.6	Low	142 Å²	142	128.6 Å²	128.6	66%	0.664	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	1	-169.6	-145.4	-178.9	170.7	0	0	116.1	N38	N38-E41 PolarHBondContact ND2-OE2 2.96Å; N38-E41 PolarHBondContact O-N 3.41Å; N38-E41 PolarHBondContact OD1-OE2 3.23Å
42	M	41.6	Very low	52.1	Low	178 Å²	178	122.2 Å²	122.2	88%	0.877	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.9	16.5	169.3	-67.4	-146.4	-59.7	0	0	115	Q44	M42-Q44 PolarHBondContact O-N 3.45Å
43	V	45.7	Very low	53.4	Low	108 Å²	108	124 Å²	124	66%	0.655	63%	0.626	S	S	*	*	S	Bend	trans	-71.2	84.7	151.5	-173.6	0	0	0	0	104.4	K45	V43-K45 PolarHBondContact O-N 2.76Å
44	Q	46.1	Very low	55.4	Low	151 Å²	151	116.6 Å²	116.6	71%	0.706	59%	0.592	S	S	*	*			trans	-43.1	111.8	168.3	-74.9	-175.9	6.7	0	0	105.2	M42 L46	M42-Q44 PolarHBondContact O-N 3.45Å; Q44-L46 HydrophobicContact CB-CG 4.48Å; Q44-L46 PolarHBondContact O-N 3.34Å
45	K	54.9	Low	57.3	Low	201 Å²	201	113.3 Å²	113.3	87%	0.874	56%	0.562	S	S	*	*			trans	-67.5	77	172.2	-78.5	-177.7	178.3	171.5	0	105.1	V43 K47	V43-K45 PolarHBondContact O-N 2.76Å; K45-K47 PolarHBondContact O-N 2.81Å; K45-K47 VanDerWaalsContact O-N 3.11Å
46	L	55.1	Low	59.3	Low	61 Å²	61	109.2 Å²	109.2	32%	0.319	55%	0.546	S	S	.	.			trans	-53.4	121.3	171.3	-72.8	167.8	0	0	0	104.7	Q44 D50 V51 F115	Q44-L46 HydrophobicContact CB-CG 4.48Å; Q44-L46 PolarHBondContact O-N 3.34Å; L46-D50 HydrophobicContact CD2-CB 4.37Å; L46-V51 HydrophobicContact CB-CG2 3.84Å; L46-V51 HydrophobicContact CD1-CG2 4.41Å; L46-F115 HydrophobicContact CD1-CD2 4.18Å; L46-F115 HydrophobicContact CD1-CE1 4.37Å; L46-F115 HydrophobicContact CD1-CE2 3.44Å; L46-F115 VanDerWaalsContact CD1-CE2 3.44Å; L46-F115 HydrophobicContact CD1-CZ 3.55Å; L46-F115 HydrophobicContact CD2-CZ 4.33Å
47	K	66.4	Low	61	Low	138 Å²	138	109.1 Å²	109.1	60%	0.6	53%	0.534	S	S	*	.			trans	-62.5	147.7	176.4	-66.3	-177.2	175.8	179	0	106.7	K45 E49 D50 V51	K45-K47 PolarHBondContact O-N 2.81Å; K45-K47 VanDerWaalsContact O-N 3.11Å; K47-E49 HydrophobicContact CB-CB 4.42Å; K47-E49 PolarHBondContact O-N 2.7Å; K47-D50 WeakPolarHBondContact CB-OD2 3.37Å; K47-D50 PolarHBondContact N-OD2 2.82Å; K47-D50 VanDerWaalsContact N-OD2 3.09Å; K47-D50 WeakPolarHBondContact O-CA 3.38Å; K47-D50 WeakPolarHBondContact O-CB 3.24Å; K47-D50 PolarHBondContact O-N 2.9Å; K47-V51 PolarHBondContact O-N 3.02Å
48	E	66.6	Low	62.3	Low	82 Å²	82	101 Å²	101	38%	0.383	50%	0.497	S	S	.	.	H	α-helix	trans	-49.1	-36.4	174.7	-174.2	-172.2	140.6	0	0	111.1	V51 G52 V84 R88	E48-V51 PolarHBondContact O-N 3.27Å; E48-G52 PolarHBondContact O-N 3.14Å; E48-V84 HydrophobicContact CG-CG2 3.53Å; E48-V84 WeakPolarHBondContact OE1-CG1 3.19Å; E48-V84 WeakPolarHBondContact OE1-CG2 3.16Å; E48-R88 IonicContact OE1-NH2 2.82Å; E48-R88 IonicContact OE2-NH2 3.58Å
49	E	70.9	Confident	63.9	Low	141 Å²	141	100.6 Å²	100.6	66%	0.659	49%	0.49	S	S	*	.	H	α-helix	trans	-60.3	-40	173.9	-64.3	167.1	-173.3	0	0	113.6	K47 R53	K47-E49 HydrophobicContact CB-CB 4.42Å; K47-E49 PolarHBondContact O-N 2.7Å; E49-R53 WeakPolarHBondContact O-CB 2.98Å; E49-R53 PolarHBondContact O-N 3.44Å
50	D	73.3	Confident	65.7	Low	64 Å²	64	95.2 Å²	95.2	34%	0.342	47%	0.473	S	S	.	.	H	α-helix	trans	-70.1	-44	179.4	-60.6	-40	0	0	0	110.3	L46 K47 G52 R53 V54	L46-D50 HydrophobicContact CD2-CB 4.37Å; K47-D50 WeakPolarHBondContact CB-OD2 3.37Å; K47-D50 PolarHBondContact N-OD2 2.82Å; K47-D50 VanDerWaalsContact N-OD2 3.09Å; K47-D50 WeakPolarHBondContact O-CA 3.38Å; K47-D50 WeakPolarHBondContact O-CB 3.24Å; K47-D50 PolarHBondContact O-N 2.9Å; D50-G52 PolarHBondContact O-N 2.95Å; D50-R53 PolarHBondContact O-N 3.2Å; D50-V54 WeakPolarHBondContact O-CG2 3.31Å; D50-V54 PolarHBondContact O-N 3.29Å
51	V	71.4	Confident	67.3	Low	22 Å²	22	93.2 Å²	93.2	13%	0.133	46%	0.456	C	S	.	.	H	α-helix	trans	-63.4	-43.9	176.7	-173.5	0	0	0	0	110.4	L46 K47 E48 R53 V54 L55 L80 F111	L46-V51 HydrophobicContact CB-CG2 3.84Å; L46-V51 HydrophobicContact CD1-CG2 4.41Å; K47-V51 PolarHBondContact O-N 3.02Å; E48-V51 PolarHBondContact O-N 3.27Å; V51-R53 VanDerWaalsContact C-N 3.31Å; V51-R53 PolarHBondContact O-N 3.39Å; V51-V54 PolarHBondContact O-N 3.25Å; V51-L55 VanDerWaalsContact O-CB 3.27Å; V51-L55 WeakPolarHBondContact O-CB 3.43Å; V51-L55 PolarHBondContact O-N 2.98Å; V51-L80 HydrophobicContact CB-CD1 4.26Å; V51-L80 HydrophobicContact CB-CD2 4.33Å; V51-L80 HydrophobicContact CG1-CD1 3.91Å; V51-L80 HydrophobicContact CG1-CD2 3.99Å; V51-F111 HydrophobicContact CG1-CZ 3.91Å
52	G	74.7	Confident	69.1	Low	28 Å²	28	86.4 Å²	86.4	29%	0.289	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-39.7	175.1	0	0	0	0	0	112.9	E48 D50 L55 L56	E48-G52 PolarHBondContact O-N 3.14Å; D50-G52 PolarHBondContact O-N 2.95Å; G52-L55 PolarHBondContact O-N 2.65Å; G52-L56 WeakPolarHBondContact O-CB 3.49Å; G52-L56 PolarHBondContact O-N 3.4Å
53	R	77.6	Confident	70.9	Confident	160 Å²	160	81 Å²	81	60%	0.604	41%	0.408	S	S	*	.	H	α-helix	trans	-66.4	-46.8	176.6	-172.2	-172.4	-58.1	-105.6	-0.7	112.3	E49 D50 V51 L55 L56 Q57	E49-R53 WeakPolarHBondContact O-CB 2.98Å; E49-R53 PolarHBondContact O-N 3.44Å; D50-R53 PolarHBondContact O-N 3.2Å; V51-R53 VanDerWaalsContact C-N 3.31Å; V51-R53 PolarHBondContact O-N 3.39Å; R53-L55 VanDerWaalsContact C-N 3.28Å; R53-L55 PolarHBondContact O-N 2.73Å; R53-L56 PolarHBondContact O-N 2.77Å; R53-Q57 WeakPolarHBondContact O-CG 3.34Å; R53-Q57 PolarHBondContact O-N 2.89Å
54	V	79.9	Confident	72.4	Confident	18 Å²	18	82.4 Å²	82.4	11%	0.109	41%	0.407	C	S	.	.	H	α-helix	trans	-61.4	-41.2	177.2	172.8	0	0	0	0	110.4	D50 V51 L56 Q57 L58 I118 N122	D50-V54 WeakPolarHBondContact O-CG2 3.31Å; D50-V54 PolarHBondContact O-N 3.29Å; V51-V54 PolarHBondContact O-N 3.25Å; V54-L56 PolarHBondContact O-N 2.93Å; V54-Q57 PolarHBondContact O-N 3.41Å; V54-L58 WeakPolarHBondContact O-CB 3.33Å; V54-L58 PolarHBondContact O-N 2.79Å; V54-I118 HydrophobicContact CG1-CG2 3.86Å; V54-N122 WeakPolarHBondContact CG2-ND2 3.34Å
55	L	78.1	Confident	74.3	Confident	20 Å²	20	80.9 Å²	80.9	11%	0.105	40%	0.398	C	S	.	.	H	α-helix	trans	-64	-40.8	177.5	-171.6	74.2	0	0	0	112.2	V51 G52 R53 L58 K59 V73 A76 E77	V51-L55 VanDerWaalsContact O-CB 3.27Å; V51-L55 WeakPolarHBondContact O-CB 3.43Å; V51-L55 PolarHBondContact O-N 2.98Å; G52-L55 PolarHBondContact O-N 2.65Å; R53-L55 VanDerWaalsContact C-N 3.28Å; R53-L55 PolarHBondContact O-N 2.73Å; L55-L58 PolarHBondContact O-N 2.75Å; L55-K59 WeakPolarHBondContact O-CB 3.4Å; L55-K59 PolarHBondContact O-N 2.66Å; L55-V73 HydrophobicContact CD1-CG1 3.75Å; L55-V73 HydrophobicContact CG-CG1 4.12Å; L55-A76 HydrophobicContact CD1-CB 3.6Å; L55-E77 VanDerWaalsContact CD2-CA 3.4Å; L55-E77 HydrophobicContact CD2-CB 3.61Å; L55-E77 HydrophobicContact CD2-CG 3.75Å
56	L	79.6	Confident	75.3	Confident	109 Å²	109	73.9 Å²	73.9	57%	0.571	37%	0.374	S	S	*	.	H	α-helix	trans	-64.2	-44	175.2	-173.5	68	0	0	0	111.6	G52 R53 V54 L58 K59 C60	G52-L56 WeakPolarHBondContact O-CB 3.49Å; G52-L56 PolarHBondContact O-N 3.4Å; R53-L56 PolarHBondContact O-N 2.77Å; V54-L56 PolarHBondContact O-N 2.93Å; L56-L58 VanDerWaalsContact C-N 3.31Å; L56-L58 PolarHBondContact O-N 2.79Å; L56-K59 WeakPolarHBondContact O-CB 3.48Å; L56-K59 PolarHBondContact O-N 3.11Å; L56-K59 VanDerWaalsContact O-N 3.17Å; L56-C60 PolarHBondContact O-N 3.49Å; L56-C60 PolarHBondContact O-SG 3.31Å
57	Q	77.9	Confident	76.4	Confident	99 Å²	99	75 Å²	75	46%	0.463	39%	0.385	S	S	.	.	H	α-helix	trans	-59.9	-43.3	174.5	-74.5	179.9	-22.7	0	0	111.5	R53 V54 K59 C60 F61	R53-Q57 WeakPolarHBondContact O-CG 3.34Å; R53-Q57 PolarHBondContact O-N 2.89Å; V54-Q57 PolarHBondContact O-N 3.41Å; Q57-K59 VanDerWaalsContact C-N 3.29Å; Q57-K59 PolarHBondContact O-N 3.49Å; Q57-C60 PolarHBondContact O-N 3.46Å; Q57-F61 WeakPolarHBondContact O-CB 3.48Å; Q57-F61 PolarHBondContact O-N 3.22Å
58	L	75.3	Confident	77.1	Confident	15 Å²	15	77.6 Å²	77.6	8%	0.079	40%	0.397	C	S	.	.	H	α-helix	trans	-63.7	-35.9	176.6	-171.9	65.9	0	0	0	111.8	V54 L55 L56 F61 A62 V73 I118	V54-L58 WeakPolarHBondContact O-CB 3.33Å; V54-L58 PolarHBondContact O-N 2.79Å; L55-L58 PolarHBondContact O-N 2.75Å; L56-L58 VanDerWaalsContact C-N 3.31Å; L56-L58 PolarHBondContact O-N 2.79Å; L58-F61 PolarHBondContact O-N 3.4Å; L58-A62 WeakPolarHBondContact O-CB 3.23Å; L58-A62 PolarHBondContact O-N 3.47Å; L58-V73 HydrophobicContact CB-CG2 4.39Å; L58-V73 HydrophobicContact CD2-CG2 3.71Å; L58-V73 HydrophobicContact CG-CG2 3.63Å; L58-I118 HydrophobicContact CD1-CG1 4.2Å; L58-I118 HydrophobicContact CD1-CG2 4.29Å; L58-I118 HydrophobicContact CD2-CD1 3.52Å; L58-I118 HydrophobicContact CD2-CG1 3.94Å
59	K	79.3	Confident	77.8	Confident	84 Å²	84	77.6 Å²	77.6	37%	0.365	40%	0.397	S	S	.	.	H	α-helix	trans	-63	-45.6	174.4	-161.1	170	-174.6	161.5	0	111.4	L55 L56 Q57 A63 L70 V73 E77	L55-K59 WeakPolarHBondContact O-CB 3.4Å; L55-K59 PolarHBondContact O-N 2.66Å; L56-K59 WeakPolarHBondContact O-CB 3.48Å; L56-K59 PolarHBondContact O-N 3.11Å; L56-K59 VanDerWaalsContact O-N 3.17Å; Q57-K59 VanDerWaalsContact C-N 3.29Å; Q57-K59 PolarHBondContact O-N 3.49Å; K59-A63 WeakPolarHBondContact O-CB 3.34Å; K59-A63 PolarHBondContact O-N 2.93Å; K59-L70 HydrophobicContact CG-CD2 4.16Å; K59-V73 HydrophobicContact CB-CG1 3.92Å; K59-V73 HydrophobicContact CG-CG1 4.27Å; K59-E77 IonicContact NZ-OE1 3.53Å; K59-E77 IonicContact NZ-OE2 3.55Å; K59-E77 PolarHBondContact NZ-OE2 3.48Å
60	C	81.6	Confident	78	Confident	81 Å²	81	73.8 Å²	73.8	55%	0.547	38%	0.381	S	S	.	.	H	α-helix	trans	-63.3	-46.1	175.5	-65.5	0	0	0	0	111.5	L56 Q57 A63 E64	L56-C60 PolarHBondContact O-N 3.49Å; L56-C60 PolarHBondContact O-SG 3.31Å; Q57-C60 PolarHBondContact O-N 3.46Å; C60-A63 PolarHBondContact O-N 2.91Å; C60-E64 PolarHBondContact O-N 3.13Å
61	F	76.5	Confident	78.3	Confident	55 Å²	55	74.3 Å²	74.3	24%	0.241	39%	0.39	C	S	.	.	H	α-helix	trans	-62.7	-44.4	178.3	-179	-95.6	0	0	0	112.2	Q57 L58 E64 K65 F121	Q57-F61 WeakPolarHBondContact O-CB 3.48Å; Q57-F61 PolarHBondContact O-N 3.22Å; L58-F61 PolarHBondContact O-N 3.4Å; F61-E64 PolarHBondContact O-N 3.48Å; F61-K65 HydrophobicContact CD2-CG 3.87Å; F61-K65 HydrophobicContact CE1-CB 4.03Å; F61-K65 HydrophobicContact CE1-CG 4.18Å; F61-K65 HydrophobicContact CE2-CB 4.1Å; F61-K65 HydrophobicContact CE2-CD 4.5Å; F61-K65 HydrophobicContact CE2-CG 3.32Å; F61-K65 HydrophobicContact CG-CG 4.49Å; F61-K65 HydrophobicContact CZ-CB 3.77Å; F61-K65 HydrophobicContact CZ-CG 3.49Å; F61-K65 VanDerWaalsContact CZ-CG 3.49Å; F61-K65 PolarHBondContact O-N 3.38Å; F61-F121 HydrophobicContact CD1-CE1 4.19Å; F61-F121 HydrophobicContact CD1-CE2 4.43Å; F61-F121 AromaticContact CD1-CZ 3.95Å; F61-F121 HydrophobicContact CD1-CZ 3.95Å; F61-F121 HydrophobicContact CD2-CD1 4.19Å; F61-F121 AromaticContact CD2-CE1 3.36Å; F61-F121 HydrophobicContact CD2-CE1 3.36Å; F61-F121 AromaticContact CD2-CZ 3.81Å; F61-F121 HydrophobicContact CD2-CZ 3.81Å; F61-F121 HydrophobicContact CE1-CE1 4.09Å; F61-F121 HydrophobicContact CE1-CE2 4.05Å; F61-F121 AromaticContact CE1-CZ 3.5Å; F61-F121 HydrophobicContact CE1-CZ 3.5Å; F61-F121 VanDerWaalsContact CE1-CZ 3.5Å; F61-F121 HydrophobicContact CE2-CD1 4.41Å; F61-F121 AromaticContact CE2-CE1 3.23Å; F61-F121 HydrophobicContact CE2-CE1 3.23Å; F61-F121 AromaticContact CE2-CZ 3.32Å; F61-F121 HydrophobicContact CE2-CZ 3.32Å; F61-F121 HydrophobicContact CG-CD1 4.44Å; F61-F121 AromaticContact CG-CE1 3.85Å; F61-F121 HydrophobicContact CG-CE1 3.85Å; F61-F121 HydrophobicContact CG-CZ 4.1Å; F61-F121 AromaticContact CZ-CE1 3.64Å; F61-F121 HydrophobicContact CZ-CE1 3.64Å; F61-F121 HydrophobicContact CZ-CE2 4.12Å; F61-F121 AromaticContact CZ-CZ 3.16Å; F61-F121 HydrophobicContact CZ-CZ 3.16Å
62	A	78.4	Confident	78.7	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-65	-39.8	176.6	0	0	0	0	0	111.3	L58 E64 C66 P67 M69 L70 V73	L58-A62 WeakPolarHBondContact O-CB 3.23Å; L58-A62 PolarHBondContact O-N 3.47Å; A62-E64 VanDerWaalsContact C-N 3.27Å; A62-E64 PolarHBondContact O-N 3.23Å; A62-C66 CarbonylContact O-C 2.82Å; A62-C66 PolarHBondContact O-N 2.81Å; A62-C66 VanDerWaalsContact O-O 3.04Å; A62-P67 VanDerWaalsContact O-CA 3.25Å; A62-P67 WeakPolarHBondContact O-CA 3.39Å; A62-M69 HydrophobicContact CB-CB 4.01Å; A62-L70 HydrophobicContact CB-CD2 3.7Å; A62-L70 HydrophobicContact CB-CG 4.01Å; A62-V73 HydrophobicContact CB-CG2 4.19Å
63	A	79.5	Confident	78.8	Confident	63 Å²	63	74.2 Å²	74.2	52%	0.521	39%	0.389	S	S	.	.	H	α-helix	trans	-61.9	-35.8	175.7	0	0	0	0	0	112.5	K59 C60 L70	K59-A63 WeakPolarHBondContact O-CB 3.34Å; K59-A63 PolarHBondContact O-N 2.93Å; C60-A63 PolarHBondContact O-N 2.91Å; A63-L70 HydrophobicContact CB-CD2 4.38Å
64	E	77.6	Confident	78.9	Confident	138 Å²	138	68.9 Å²	68.9	65%	0.645	38%	0.379	S	S	*	.	H	α-helix	trans	-85	-48.5	-178.3	-164.4	-166.7	139.6	0	0	113.4	C60 F61 A62	C60-E64 PolarHBondContact O-N 3.13Å; F61-E64 PolarHBondContact O-N 3.48Å; A62-E64 VanDerWaalsContact C-N 3.27Å; A62-E64 PolarHBondContact O-N 3.23Å
65	K	85.1	Confident	79	Confident	119 Å²	119	73 Å²	73	52%	0.517	40%	0.399	S	S	.	.	H	α-helix	trans	-95.9	-42.8	-172	-59.2	-48	-168.9	-159.6	0	113.4	F61	F61-K65 HydrophobicContact CD2-CG 3.87Å; F61-K65 HydrophobicContact CE1-CB 4.03Å; F61-K65 HydrophobicContact CE1-CG 4.18Å; F61-K65 HydrophobicContact CE2-CB 4.1Å; F61-K65 HydrophobicContact CE2-CD 4.5Å; F61-K65 HydrophobicContact CE2-CG 3.32Å; F61-K65 HydrophobicContact CG-CG 4.49Å; F61-K65 HydrophobicContact CZ-CB 3.77Å; F61-K65 HydrophobicContact CZ-CG 3.49Å; F61-K65 VanDerWaalsContact CZ-CG 3.49Å; F61-K65 PolarHBondContact O-N 3.38Å
66	C	77.7	Confident	79.1	Confident	55 Å²	55	72.5 Å²	72.5	37%	0.372	40%	0.398	S	S	.	.			trans	-145.3	76.8	-166.7	-72	0	0	0	0	111.5	A62 K68 M69	A62-C66 CarbonylContact O-C 2.82Å; A62-C66 PolarHBondContact O-N 2.81Å; A62-C66 VanDerWaalsContact O-O 3.04Å; C66-K68 PolarHBondContact O-N 2.7Å; C66-M69 HydrophobicContact CB-CB 4.4Å; C66-M69 HydrophobicContact CB-CG 3.95Å; C66-M69 HydrophobicContact CB-SD 3.73Å; C66-M69 WeakPolarHBondContact O-CB 3.49Å; C66-M69 PolarHBondContact O-N 2.81Å
67	P	77.2	Confident	78.9	Confident	84 Å²	84	71.5 Å²	71.5	55%	0.545	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-60.7	-22.8	-175.5	19.6	-31.5	0	0	0	112.9	A62 M69 L70	A62-P67 VanDerWaalsContact O-CA 3.25Å; A62-P67 WeakPolarHBondContact O-CA 3.39Å; P67-M69 PolarHBondContact O-N 2.76Å; P67-L70 HydrophobicContact CB-CD1 4.23Å; P67-L70 VanDerWaalsContact O-CB 3.28Å; P67-L70 WeakPolarHBondContact O-CB 3.39Å; P67-L70 WeakPolarHBondContact O-CG 3.42Å; P67-L70 PolarHBondContact O-N 3.06Å; P67-L70 VanDerWaalsContact O-N 3.07Å
68	K	81.5	Confident	79	Confident	193 Å²	193	70.2 Å²	70.2	84%	0.839	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-59.9	-25.6	172.1	-64.5	-179.5	-178.1	175.2	0	113.4	C66 L70 S71	C66-K68 PolarHBondContact O-N 2.7Å; K68-L70 VanDerWaalsContact C-N 3.34Å; K68-S71 PolarHBondContact O-OG 3.06Å
69	M	81.7	Confident	79.2	Confident	81 Å²	81	71.1 Å²	71.1	40%	0.399	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-80	-13.9	177.3	-67.7	177.5	65.1	0	0	112.9	A62 C66 P67 S71 A72 V73	A62-M69 HydrophobicContact CB-CB 4.01Å; C66-M69 HydrophobicContact CB-CB 4.4Å; C66-M69 HydrophobicContact CB-CG 3.95Å; C66-M69 HydrophobicContact CB-SD 3.73Å; C66-M69 WeakPolarHBondContact O-CB 3.49Å; C66-M69 PolarHBondContact O-N 2.81Å; P67-M69 PolarHBondContact O-N 2.76Å; M69-S71 PolarHBondContact O-N 3.21Å; M69-S71 VanDerWaalsContact O-N 3.14Å; M69-A72 WeakPolarHBondContact O-CB 3.45Å; M69-A72 PolarHBondContact O-N 3.11Å; M69-V73 WeakPolarHBondContact O-CG2 3.37Å; M69-V73 PolarHBondContact O-N 2.83Å; M69-V73 VanDerWaalsContact O-N 3.09Å
70	L	75.2	Confident	78.7	Confident	62 Å²	62	68.4 Å²	68.4	33%	0.325	39%	0.388	S	S	.	.	H	α-helix	trans	-58.2	-29.9	180	-71.2	171.4	0	0	0	112.6	K59 A62 A63 P67 K68 V73 A74	K59-L70 HydrophobicContact CG-CD2 4.16Å; A62-L70 HydrophobicContact CB-CD2 3.7Å; A62-L70 HydrophobicContact CB-CG 4.01Å; A63-L70 HydrophobicContact CB-CD2 4.38Å; P67-L70 HydrophobicContact CB-CD1 4.23Å; P67-L70 VanDerWaalsContact O-CB 3.28Å; P67-L70 WeakPolarHBondContact O-CB 3.39Å; P67-L70 WeakPolarHBondContact O-CG 3.42Å; P67-L70 PolarHBondContact O-N 3.06Å; P67-L70 VanDerWaalsContact O-N 3.07Å; K68-L70 VanDerWaalsContact C-N 3.34Å; L70-V73 PolarHBondContact O-N 2.82Å; L70-A74 WeakPolarHBondContact O-CB 3.27Å; L70-A74 PolarHBondContact O-N 3.39Å
71	S	79.2	Confident	78.4	Confident	75 Å²	75	66 Å²	66	52%	0.524	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-43.2	173.9	58	0	0	0	0	112.1	K68 M69 V73 A74 I75	K68-S71 PolarHBondContact O-OG 3.06Å; M69-S71 PolarHBondContact O-N 3.21Å; M69-S71 VanDerWaalsContact O-N 3.14Å; S71-V73 VanDerWaalsContact C-N 3.35Å; S71-A74 PolarHBondContact O-N 3.23Å; S71-I75 WeakPolarHBondContact O-CD1 3.41Å; S71-I75 VanDerWaalsContact O-CG1 3.26Å; S71-I75 WeakPolarHBondContact O-CG1 3.41Å; S71-I75 PolarHBondContact O-N 3.48Å
72	A	79.8	Confident	78.3	Confident	46 Å²	46	66.2 Å²	66.2	38%	0.38	39%	0.389	S	S	.	.	H	α-helix	trans	-64.9	-40.2	175.6	0	0	0	0	0	111.4	M69 I75 A76	M69-A72 WeakPolarHBondContact O-CB 3.45Å; M69-A72 PolarHBondContact O-N 3.11Å; A72-I75 PolarHBondContact O-N 3.43Å; A72-A76 PolarHBondContact O-N 3.17Å
73	V	77.3	Confident	77.7	Confident	2 Å²	2	72.7 Å²	72.7	1%	0.012	42%	0.415	C	S	.	.	H	α-helix	trans	-62.5	-44.3	174.6	-174.2	0	0	0	0	111.1	L55 L58 K59 A62 M69 L70 S71 I75 A76 E77	L55-V73 HydrophobicContact CD1-CG1 3.75Å; L55-V73 HydrophobicContact CG-CG1 4.12Å; L58-V73 HydrophobicContact CB-CG2 4.39Å; L58-V73 HydrophobicContact CD2-CG2 3.71Å; L58-V73 HydrophobicContact CG-CG2 3.63Å; K59-V73 HydrophobicContact CB-CG1 3.92Å; K59-V73 HydrophobicContact CG-CG1 4.27Å; A62-V73 HydrophobicContact CB-CG2 4.19Å; M69-V73 WeakPolarHBondContact O-CG2 3.37Å; M69-V73 PolarHBondContact O-N 2.83Å; M69-V73 VanDerWaalsContact O-N 3.09Å; L70-V73 PolarHBondContact O-N 2.82Å; S71-V73 VanDerWaalsContact C-N 3.35Å; V73-I75 VanDerWaalsContact C-N 3.31Å; V73-I75 PolarHBondContact O-N 3.43Å; V73-A76 PolarHBondContact O-N 3.43Å; V73-E77 PolarHBondContact O-N 3.35Å
74	A	79.7	Confident	77	Confident	48 Å²	48	70.6 Å²	70.6	40%	0.397	40%	0.395	S	S	.	.	H	α-helix	trans	-63.6	-36	178	0	0	0	0	0	112.6	L70 S71 E77 T78	L70-A74 WeakPolarHBondContact O-CB 3.27Å; L70-A74 PolarHBondContact O-N 3.39Å; S71-A74 PolarHBondContact O-N 3.23Å; A74-E77 PolarHBondContact O-N 2.91Å; A74-T78 WeakPolarHBondContact O-CB 3.16Å; A74-T78 PolarHBondContact O-N 3.3Å; A74-T78 PolarHBondContact O-OG1 2.93Å
75	I	81.6	Confident	76.3	Confident	104 Å²	104	67.7 Å²	67.7	53%	0.533	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-45	173.7	-67.5	162.4	0	0	0	110.2	S71 A72 V73 E77 T78 A79	S71-I75 WeakPolarHBondContact O-CD1 3.41Å; S71-I75 VanDerWaalsContact O-CG1 3.26Å; S71-I75 WeakPolarHBondContact O-CG1 3.41Å; S71-I75 PolarHBondContact O-N 3.48Å; A72-I75 PolarHBondContact O-N 3.43Å; V73-I75 VanDerWaalsContact C-N 3.31Å; V73-I75 PolarHBondContact O-N 3.43Å; I75-E77 VanDerWaalsContact C-N 3.34Å; I75-E77 PolarHBondContact O-N 2.64Å; I75-T78 PolarHBondContact O-N 2.69Å; I75-A79 WeakPolarHBondContact O-CB 3.26Å; I75-A79 PolarHBondContact O-N 2.98Å
76	A	78.9	Confident	75.3	Confident	10 Å²	10	66.8 Å²	66.8	8%	0.083	40%	0.398	C	S	.	.	H	α-helix	trans	-63.8	-37.9	176.1	0	0	0	0	0	112.2	L55 A72 V73 A79 L80 L114	L55-A76 HydrophobicContact CD1-CB 3.6Å; A72-A76 PolarHBondContact O-N 3.17Å; V73-A76 PolarHBondContact O-N 3.43Å; A76-A79 PolarHBondContact O-N 3.19Å; A76-L80 WeakPolarHBondContact O-CB 3.48Å; A76-L80 PolarHBondContact O-N 3.09Å; A76-L114 HydrophobicContact CB-CD2 3.97Å
77	E	76.7	Confident	74.4	Confident	87 Å²	87	71.5 Å²	71.5	41%	0.407	41%	0.412	S	S	.	.	H	α-helix	trans	-59.8	-45.3	173.1	-160.4	168.5	174.1	0	0	111.5	L55 K59 V73 A74 I75 L80 G81	L55-E77 VanDerWaalsContact CD2-CA 3.4Å; L55-E77 HydrophobicContact CD2-CB 3.61Å; L55-E77 HydrophobicContact CD2-CG 3.75Å; K59-E77 IonicContact NZ-OE1 3.53Å; K59-E77 IonicContact NZ-OE2 3.55Å; K59-E77 PolarHBondContact NZ-OE2 3.48Å; V73-E77 PolarHBondContact O-N 3.35Å; A74-E77 PolarHBondContact O-N 2.91Å; I75-E77 VanDerWaalsContact C-N 3.34Å; I75-E77 PolarHBondContact O-N 2.64Å; E77-L80 PolarHBondContact O-N 3.19Å; E77-G81 PolarHBondContact O-N 3.01Å
78	T	79.5	Confident	73.1	Confident	72 Å²	72	76.4 Å²	76.4	44%	0.442	42%	0.42	S	S	.	.	H	α-helix	trans	-66.8	-41.5	178.4	-55.8	0	0	0	0	111.4	A74 I75 G81 A82	A74-T78 WeakPolarHBondContact O-CB 3.16Å; A74-T78 PolarHBondContact O-N 3.3Å; A74-T78 PolarHBondContact O-OG1 2.93Å; I75-T78 PolarHBondContact O-N 2.69Å; T78-G81 PolarHBondContact O-N 3.27Å; T78-A82 WeakPolarHBondContact O-CB 3.45Å; T78-A82 PolarHBondContact O-N 2.88Å
79	A	78.5	Confident	71.2	Confident	34 Å²	34	70 Å²	70	28%	0.281	40%	0.4	S	S	.	.	H	α-helix	trans	-65	-41	177.2	0	0	0	0	0	111.9	I75 A76 A82 Y83	I75-A79 WeakPolarHBondContact O-CB 3.26Å; I75-A79 PolarHBondContact O-N 2.98Å; A76-A79 PolarHBondContact O-N 3.19Å; A79-A82 PolarHBondContact O-N 2.92Å; A79-Y83 WeakPolarHBondContact O-CB 3.3Å; A79-Y83 PolarHBondContact O-N 2.85Å
80	L	69.8	Low	69.4	Low	27 Å²	27	73.3 Å²	73.3	14%	0.141	42%	0.424	C	S	.	.	H	α-helix	trans	-64.5	-46.2	174.4	-175.2	65.7	0	0	0	110.7	V51 A76 E77 A82 Y83 V84	V51-L80 HydrophobicContact CB-CD1 4.26Å; V51-L80 HydrophobicContact CB-CD2 4.33Å; V51-L80 HydrophobicContact CG1-CD1 3.91Å; V51-L80 HydrophobicContact CG1-CD2 3.99Å; A76-L80 WeakPolarHBondContact O-CB 3.48Å; A76-L80 PolarHBondContact O-N 3.09Å; E77-L80 PolarHBondContact O-N 3.19Å; L80-A82 VanDerWaalsContact C-N 3.31Å; L80-A82 PolarHBondContact O-N 3.06Å; L80-Y83 WeakPolarHBondContact O-CB 3.2Å; L80-Y83 PolarHBondContact O-N 3.37Å; L80-Y83 VanDerWaalsContact O-N 3.13Å; L80-V84 HydrophobicContact CD1-CG2 4.44Å; L80-V84 HydrophobicContact CG-CG2 4.46Å; L80-V84 VanDerWaalsContact O-CG2 3.3Å; L80-V84 WeakPolarHBondContact O-CG2 3.45Å; L80-V84 PolarHBondContact O-N 3.16Å
81	G	75.3	Confident	67.4	Low	32 Å²	32	79.6 Å²	79.6	33%	0.33	44%	0.444	S	S	.	.	H	α-helix	trans	-55.7	-45.3	174.4	0	0	0	0	0	112	E77 T78 Y83 V84 C85	E77-G81 PolarHBondContact O-N 3.01Å; T78-G81 PolarHBondContact O-N 3.27Å; G81-Y83 PolarHBondContact O-N 2.88Å; G81-V84 PolarHBondContact O-N 2.81Å; G81-C85 WeakPolarHBondContact O-CB 3.28Å; G81-C85 PolarHBondContact O-N 3.01Å; G81-C85 PolarHBondContact O-SG 2.76Å
82	A	73.6	Confident	65.3	Low	58 Å²	58	82.8 Å²	82.8	48%	0.479	45%	0.454	S	S	.	.	H	α-helix	trans	-63.7	-39.5	175.9	0	0	0	0	0	112.7	T78 A79 L80 S86	T78-A82 WeakPolarHBondContact O-CB 3.45Å; T78-A82 PolarHBondContact O-N 2.88Å; A79-A82 PolarHBondContact O-N 2.92Å; L80-A82 VanDerWaalsContact C-N 3.31Å; L80-A82 PolarHBondContact O-N 3.06Å; A82-S86 VanDerWaalsContact O-CB 3.23Å; A82-S86 WeakPolarHBondContact O-CB 3.41Å; A82-S86 PolarHBondContact O-N 3.16Å
83	Y	65.8	Low	63.3	Low	137 Å²	137	88.8 Å²	88.8	54%	0.537	47%	0.474	S	S	.	.	H	α-helix	trans	-64.1	-45.7	176	173.9	-106	0	0	0	112	A79 L80 G81 S86 K87	A79-Y83 WeakPolarHBondContact O-CB 3.3Å; A79-Y83 PolarHBondContact O-N 2.85Å; L80-Y83 WeakPolarHBondContact O-CB 3.2Å; L80-Y83 PolarHBondContact O-N 3.37Å; L80-Y83 VanDerWaalsContact O-N 3.13Å; G81-Y83 PolarHBondContact O-N 2.88Å; Y83-S86 PolarHBondContact O-N 3.42Å; Y83-K87 PolarHBondContact O-N 3.38Å
84	V	66.4	Low	61.4	Low	19 Å²	19	96.2 Å²	96.2	12%	0.115	51%	0.513	C	S	.	.	H	α-helix	trans	-67.3	-43.7	177.7	177.4	0	0	0	0	111	E48 L80 G81 K87 R88	E48-V84 HydrophobicContact CG-CG2 3.53Å; E48-V84 WeakPolarHBondContact OE1-CG1 3.19Å; E48-V84 WeakPolarHBondContact OE1-CG2 3.16Å; L80-V84 HydrophobicContact CD1-CG2 4.44Å; L80-V84 HydrophobicContact CG-CG2 4.46Å; L80-V84 VanDerWaalsContact O-CG2 3.3Å; L80-V84 WeakPolarHBondContact O-CG2 3.45Å; L80-V84 PolarHBondContact O-N 3.16Å; G81-V84 PolarHBondContact O-N 2.81Å; V84-K87 WeakPolarHBondContact O-CB 3.2Å; V84-K87 PolarHBondContact O-N 3.09Å; V84-K87 VanDerWaalsContact O-N 3.11Å; V84-R88 PolarHBondContact O-N 3.37Å
85	C	62.3	Low	59.2	Low	77 Å²	77	100.6 Å²	100.6	52%	0.52	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-41.2	176.3	-73.7	0	0	0	0	111.8	G81 K87 R88 S89	G81-C85 WeakPolarHBondContact O-CB 3.28Å; G81-C85 PolarHBondContact O-N 3.01Å; G81-C85 PolarHBondContact O-SG 2.76Å; C85-K87 PolarHBondContact O-N 3.03Å; C85-R88 CarbonylContact O-C 3.59Å; C85-R88 PolarHBondContact O-N 3.49Å; C85-S89 PolarHBondContact O-N 3.1Å
86	S	62.8	Low	56.9	Low	99 Å²	99	100.5 Å²	100.5	69%	0.692	53%	0.534	S	S	*	.	H	α-helix	trans	-60.2	-29.3	174.1	-177.9	0	0	0	0	112	A82 Y83	A82-S86 VanDerWaalsContact O-CB 3.23Å; A82-S86 WeakPolarHBondContact O-CB 3.41Å; A82-S86 PolarHBondContact O-N 3.16Å; Y83-S86 PolarHBondContact O-N 3.42Å
87	K	59.9	Low	54.8	Low	155 Å²	155	106.3 Å²	106.3	67%	0.674	56%	0.558	S	S	*	*	H	α-helix	trans	-80.7	-26.1	177	-135.3	173.3	-173.2	170.3	0	112.9	Y83 V84 C85	Y83-K87 PolarHBondContact O-N 3.38Å; V84-K87 WeakPolarHBondContact O-CB 3.2Å; V84-K87 PolarHBondContact O-N 3.09Å; V84-K87 VanDerWaalsContact O-N 3.11Å; C85-K87 PolarHBondContact O-N 3.03Å
88	R	48.8	Very low	52.8	Low	186 Å²	186	107.1 Å²	107.1	70%	0.702	57%	0.573	S	S	*	*	H	α-helix	trans	-109.3	-13.8	-173.9	-64.6	-169.8	-166	-179.3	10.7	115.2	E48 V84 C85	E48-R88 IonicContact OE1-NH2 2.82Å; E48-R88 IonicContact OE2-NH2 3.58Å; V84-R88 PolarHBondContact O-N 3.37Å; C85-R88 CarbonylContact O-C 3.59Å; C85-R88 PolarHBondContact O-N 3.49Å
89	S	42.5	Very low	50.7	Low	60 Å²	60	108.2 Å²	108.2	42%	0.42	59%	0.59	S	S	.	*			trans	-152.8	95.2	-172.4	-153.6	0	0	0	0	112.2	C85 R91	C85-S89 PolarHBondContact O-N 3.1Å; S89-R91 PolarHBondContact O-N 2.97Å; S89-R91 PolarHBondContact OG-N 3.14Å; S89-R91 PolarHBondContact OG-O 2.93Å
90	T	43.2	Very low	48.8	Very low	149 Å²	149	110 Å²	110	91%	0.914	60%	0.6	S	S	*	*	S	Bend	trans	-61.4	68.6	140.1	37.4	0	0	0	0	108.7
91	R	33.3	Very low	47.2	Very low	194 Å²	194	114.3 Å²	114.3	73%	0.732	63%	0.632	S	S	*	*			trans	178.7	109.6	166.2	-114.4	179.9	155.5	-165.8	-6	110.1	S89	S89-R91 PolarHBondContact O-N 2.97Å; S89-R91 PolarHBondContact OG-N 3.14Å; S89-R91 PolarHBondContact OG-O 2.93Å
92	L	35.1	Very low	45.5	Very low	142 Å²	142	115.8 Å²	115.8	74%	0.743	64%	0.635	S	S	*	*	S	Bend	trans	67.1	124.2	139.7	-55.4	166.3	0	0	0	116.2
93	E	39.3	Very low	43.8	Very low	172 Å²	172	115.7 Å²	115.7	80%	0.804	63%	0.634	S	S	*	*			cis	-143.4	131	11.4	-65.9	-165.8	146.3	0	0	107.8	I95	E93-I95 PolarHBondContact O-N 3.44Å
94	L	37.4	Very low	42.7	Very low	158 Å²	158	114.2 Å²	114.2	83%	0.827	64%	0.642	S	S	*	*			trans	-60.6	107.5	170.1	-90.9	82.9	0	0	0	108.1	P96	L94-P96 WeakPolarHBondContact O-CD 3.48Å
95	I	33	Very low	41.7	Very low	140 Å²	140	122.1 Å²	122.1	72%	0.718	67%	0.674	S	S	*	*			trans	-58.2	118.6	141.6	-50.9	174.5	0	0	0	103.5	E93 F97	E93-I95 PolarHBondContact O-N 3.44Å; I95-F97 VanDerWaalsContact C-N 3.28Å; I95-F97 PolarHBondContact O-N 3.49Å
96	P	32.4	Very low	40.8	Very low	102 Å²	102	125.2 Å²	125.2	66%	0.662	68%	0.679	S	S	*	*			trans	-64.4	95.2	-172.5	23.8	-31.3	0	0	0	108.2	L94 S98	L94-P96 WeakPolarHBondContact O-CD 3.48Å; P96-S98 PolarHBondContact O-N 2.88Å
97	F	35	Very low	39.9	Very low	133 Å²	133	125.6 Å²	125.6	58%	0.583	67%	0.673	S	S	*	*			trans	-60.3	92.8	154.2	-141.8	-91.7	0	0	0	103.3	I95 A99	I95-F97 VanDerWaalsContact C-N 3.28Å; I95-F97 PolarHBondContact O-N 3.49Å; F97-A99 PolarHBondContact O-N 3.33Å
98	S	35.4	Very low	39.4	Very low	103 Å²	103	124.6 Å²	124.6	72%	0.72	67%	0.672	S	S	*	*			trans	-59.8	93.5	-175.9	28.7	0	0	0	0	107.4	P96 S100	P96-S98 PolarHBondContact O-N 2.88Å; S98-S100 PolarHBondContact O-N 3.49Å
99	A	35.8	Very low	39.5	Very low	95 Å²	95	122 Å²	122	79%	0.785	67%	0.668	S	S	*	*			trans	35.9	29.6	147.2	0	0	0	0	0	118.4	F97 S101	F97-A99 PolarHBondContact O-N 3.33Å; A99-S101 PolarHBondContact O-N 3.38Å
100	S	37.7	Very low	39.9	Very low	72 Å²	72	124.7 Å²	124.7	50%	0.503	68%	0.677	S	S	.	*			trans	-78	82.8	156.3	146.1	0	0	0	0	104.7	S98 V102	S98-S100 PolarHBondContact O-N 3.49Å; S100-V102 PolarHBondContact O-N 3.42Å; S100-V102 WeakPolarHBondContact OG-CG2 3.35Å
101	S	36	Very low	40.4	Very low	117 Å²	117	121.4 Å²	121.4	82%	0.818	65%	0.65	S	S	*	*			trans	-62.8	60.2	163.8	64.4	0	0	0	0	109	A99 A103	A99-S101 PolarHBondContact O-N 3.38Å; S101-A103 VanDerWaalsContact C-N 3.33Å; S101-A103 PolarHBondContact O-N 2.94Å; S101-A103 VanDerWaalsContact O-N 3.14Å
102	V	39.3	Very low	41.4	Very low	64 Å²	64	115.7 Å²	115.7	39%	0.388	64%	0.637	S	S	.	*			trans	-83	96.5	173.1	164.8	0	0	0	0	102.5	S100 K106	S100-V102 PolarHBondContact O-N 3.42Å; S100-V102 WeakPolarHBondContact OG-CG2 3.35Å; V102-K106 HydrophobicContact CB-CB 4.44Å; V102-K106 HydrophobicContact CG1-CB 3.11Å; V102-K106 HydrophobicContact CG1-CD 3.87Å; V102-K106 HydrophobicContact CG1-CG 4.12Å
103	A	37.7	Very low	42.5	Very low	55 Å²	55	113.8 Å²	113.8	46%	0.455	63%	0.626	S	S	.	*			trans	-33.5	141.7	179.4	0	0	0	0	0	111	S101 K105 K106	S101-A103 VanDerWaalsContact C-N 3.33Å; S101-A103 PolarHBondContact O-N 2.94Å; S101-A103 VanDerWaalsContact O-N 3.14Å; A103-K105 CarbonylContact O-C 3.59Å; A103-K105 PolarHBondContact O-N 3.24Å; A103-K106 PolarHBondContact O-N 3.5Å
104	P	43.8	Very low	43.4	Very low	107 Å²	107	108.1 Å²	108.1	70%	0.695	60%	0.601	S	S	*	*	H	α-helix	trans	-48.2	-29.5	-171.4	14.7	-29.8	0	0	0	114.2	K106 L107 M108	P104-K106 PolarHBondContact O-N 2.83Å; P104-L107 PolarHBondContact O-N 3.41Å; P104-M108 PolarHBondContact O-N 2.88Å
105	K	45.3	Very low	44.4	Very low	185 Å²	185	103.1 Å²	103.1	80%	0.804	57%	0.572	S	S	*	*	H	α-helix	trans	-59.3	-39.4	173.5	-61	-172	177	-173.9	0	114.1	A103 H109	A103-K105 CarbonylContact O-C 3.59Å; A103-K105 PolarHBondContact O-N 3.24Å; K105-H109 PolarHBondContact O-N 2.96Å
106	K	43	Very low	45.5	Very low	141 Å²	141	101.5 Å²	101.5	61%	0.613	57%	0.565	S	S	*	*	H	α-helix	trans	-80.1	-28.5	-179.9	-77.3	-178.8	-179.5	-178.5	0	112.9	V102 A103 P104 H109 N110	V102-K106 HydrophobicContact CB-CB 4.44Å; V102-K106 HydrophobicContact CG1-CB 3.11Å; V102-K106 HydrophobicContact CG1-CD 3.87Å; V102-K106 HydrophobicContact CG1-CG 4.12Å; A103-K106 PolarHBondContact O-N 3.5Å; P104-K106 PolarHBondContact O-N 2.83Å; K106-H109 PolarHBondContact O-N 3.34Å; K106-N110 PolarHBondContact O-N 3.01Å
107	L	44.2	Very low	46.5	Very low	108 Å²	108	101 Å²	101	57%	0.565	56%	0.562	S	S	*	*	H	α-helix	trans	-65.9	-42.7	174.6	-173.9	69.5	0	0	0	110.7	P104 H109 N110 F111	P104-L107 PolarHBondContact O-N 3.41Å; L107-H109 VanDerWaalsContact C-N 3.3Å; L107-H109 PolarHBondContact O-N 2.84Å; L107-N110 PolarHBondContact O-N 2.96Å; L107-F111 PolarHBondContact O-N 3.33Å
108	M	50.1	Low	47.3	Very low	134 Å²	134	95.7 Å²	95.7	66%	0.66	54%	0.54	S	S	*	.	H	α-helix	trans	-59.2	-42.5	172.2	-71.8	-123.6	170.6	0	0	111.1	P104 N110 F111 T112	P104-M108 PolarHBondContact O-N 2.88Å; M108-N110 VanDerWaalsContact C-N 3.34Å; M108-N110 PolarHBondContact O-N 2.86Å; M108-F111 PolarHBondContact O-N 3.42Å; M108-T112 WeakPolarHBondContact O-CB 3.49Å; M108-T112 PolarHBondContact O-N 2.85Å; M108-T112 PolarHBondContact O-OG1 2.81Å
109	H	50.5	Low	47.8	Very low	132 Å²	132	92.9 Å²	92.9	61%	0.611	52%	0.52	S	S	*	.	H	α-helix	trans	-62.7	-39.6	177.7	-147.3	-102	0	0	0	112.8	K105 K106 L107 M113	K105-H109 PolarHBondContact O-N 2.96Å; K106-H109 PolarHBondContact O-N 3.34Å; L107-H109 VanDerWaalsContact C-N 3.3Å; L107-H109 PolarHBondContact O-N 2.84Å; H109-M113 WeakPolarHBondContact O-CB 3.42Å; H109-M113 VanDerWaalsContact O-CG 3.24Å; H109-M113 WeakPolarHBondContact O-CG 3.47Å; H109-M113 PolarHBondContact O-N 2.83Å
110	N	50.4	Low	48.2	Very low	116 Å²	116	92.8 Å²	92.8	62%	0.62	51%	0.512	S	S	*	.	H	α-helix	trans	-67.2	-40.4	176	-154.7	-51.1	0	0	0	111.1	K106 L107 M108 M113 L114	K106-N110 PolarHBondContact O-N 3.01Å; L107-N110 PolarHBondContact O-N 2.96Å; M108-N110 VanDerWaalsContact C-N 3.34Å; M108-N110 PolarHBondContact O-N 2.86Å; N110-M113 PolarHBondContact O-N 2.87Å; N110-L114 WeakPolarHBondContact O-CB 3.39Å; N110-L114 PolarHBondContact O-N 3.41Å
111	F	53.4	Low	48.6	Very low	79 Å²	79	94 Å²	94	35%	0.346	51%	0.508	S	S	.	.	H	α-helix	trans	-67.9	-41.2	176.5	-155	-91.9	0	0	0	112.3	V51 L107 M108 L114 F115	V51-F111 HydrophobicContact CG1-CZ 3.91Å; L107-F111 PolarHBondContact O-N 3.33Å; M108-F111 PolarHBondContact O-N 3.42Å; F111-L114 WeakPolarHBondContact O-CB 3.27Å; F111-L114 PolarHBondContact O-N 3.07Å; F111-F115 WeakPolarHBondContact O-CB 3.36Å; F111-F115 PolarHBondContact O-N 2.9Å
112	T	55.9	Low	48.6	Very low	75 Å²	75	92.3 Å²	92.3	46%	0.46	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-44.4	174.5	-59.5	0	0	0	0	110.9	M108 L114 F115 L116	M108-T112 WeakPolarHBondContact O-CB 3.49Å; M108-T112 PolarHBondContact O-N 2.85Å; M108-T112 PolarHBondContact O-OG1 2.81Å; T112-L114 VanDerWaalsContact C-N 3.35Å; T112-L114 PolarHBondContact O-N 3.24Å; T112-F115 CarbonylContact O-C 3.6Å; T112-F115 PolarHBondContact O-N 3.01Å; T112-L116 HydrophobicContact CG2-CD1 4.12Å; T112-L116 HydrophobicContact CG2-CG 4.36Å; T112-L116 WeakPolarHBondContact O-CB 3.47Å; T112-L116 VanDerWaalsContact O-CG 3.31Å; T112-L116 WeakPolarHBondContact O-CG 3.49Å; T112-L116 PolarHBondContact O-N 3.17Å
113	M	56.8	Low	48.5	Very low	101 Å²	101	98.3 Å²	98.3	50%	0.498	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-41.6	175.1	-74.2	-66.8	-75.5	0	0	111.6	H109 N110 F115 L116 C117	H109-M113 WeakPolarHBondContact O-CB 3.42Å; H109-M113 VanDerWaalsContact O-CG 3.24Å; H109-M113 WeakPolarHBondContact O-CG 3.47Å; H109-M113 PolarHBondContact O-N 2.83Å; N110-M113 PolarHBondContact O-N 2.87Å; M113-F115 VanDerWaalsContact C-N 3.33Å; M113-F115 PolarHBondContact O-N 3.25Å; M113-L116 PolarHBondContact O-N 2.9Å; M113-C117 WeakPolarHBondContact O-CB 3.41Å; M113-C117 PolarHBondContact O-N 2.98Å; M113-C117 PolarHBondContact O-SG 2.99Å
114	L	59.6	Low	48.4	Very low	54 Å²	54	100.1 Å²	100.1	28%	0.283	51%	0.513	S	S	.	.	H	α-helix	trans	-61.1	-44.6	174	-167	75.4	0	0	0	110.5	A76 N110 F111 T112 C117 I118	A76-L114 HydrophobicContact CB-CD2 3.97Å; N110-L114 WeakPolarHBondContact O-CB 3.39Å; N110-L114 PolarHBondContact O-N 3.41Å; F111-L114 WeakPolarHBondContact O-CB 3.27Å; F111-L114 PolarHBondContact O-N 3.07Å; T112-L114 VanDerWaalsContact C-N 3.35Å; T112-L114 PolarHBondContact O-N 3.24Å; L114-C117 PolarHBondContact O-N 3.43Å; L114-I118 HydrophobicContact CD1-CD1 4.42Å; L114-I118 HydrophobicContact CD2-CD1 4.28Å; L114-I118 HydrophobicContact CG-CD1 3.75Å; L114-I118 VanDerWaalsContact O-CD1 3.27Å; L114-I118 WeakPolarHBondContact O-CD1 3.28Å; L114-I118 WeakPolarHBondContact O-CG1 3.4Å; L114-I118 PolarHBondContact O-N 3.25Å
115	F	56.9	Low	48.1	Very low	53 Å²	53	100.4 Å²	100.4	23%	0.232	51%	0.514	C	S	.	.	H	α-helix	trans	-65.4	-42	178.4	-158.4	-90.4	0	0	0	111.7	L46 F111 T112 M113 C117 I118 S119	L46-F115 HydrophobicContact CD1-CD2 4.18Å; L46-F115 HydrophobicContact CD1-CE1 4.37Å; L46-F115 HydrophobicContact CD1-CE2 3.44Å; L46-F115 VanDerWaalsContact CD1-CE2 3.44Å; L46-F115 HydrophobicContact CD1-CZ 3.55Å; L46-F115 HydrophobicContact CD2-CZ 4.33Å; F111-F115 WeakPolarHBondContact O-CB 3.36Å; F111-F115 PolarHBondContact O-N 2.9Å; T112-F115 CarbonylContact O-C 3.6Å; T112-F115 PolarHBondContact O-N 3.01Å; M113-F115 VanDerWaalsContact C-N 3.33Å; M113-F115 PolarHBondContact O-N 3.25Å; F115-C117 VanDerWaalsContact C-N 3.33Å; F115-C117 PolarHBondContact O-N 3.02Å; F115-I118 CarbonylContact O-C 3.49Å; F115-I118 PolarHBondContact O-N 2.82Å; F115-S119 WeakPolarHBondContact O-CA 3.17Å; F115-S119 WeakPolarHBondContact O-CB 3.34Å; F115-S119 PolarHBondContact O-N 3.06Å; F115-S119 PolarHBondContact O-OG 2.82Å
116	L	56.9	Low	47.9	Very low	106 Å²	106	97.2 Å²	97.2	56%	0.555	51%	0.505	S	S	*	.	H	α-helix	trans	-63	-39.9	174.8	-73.3	173.6	0	0	0	111.5	T112 M113 I118 S119 P120	T112-L116 HydrophobicContact CG2-CD1 4.12Å; T112-L116 HydrophobicContact CG2-CG 4.36Å; T112-L116 WeakPolarHBondContact O-CB 3.47Å; T112-L116 VanDerWaalsContact O-CG 3.31Å; T112-L116 WeakPolarHBondContact O-CG 3.49Å; T112-L116 PolarHBondContact O-N 3.17Å; M113-L116 PolarHBondContact O-N 2.9Å; L116-I118 VanDerWaalsContact C-N 3.3Å; L116-I118 PolarHBondContact O-N 3.45Å; L116-S119 WeakPolarHBondContact O-CB 3.38Å; L116-S119 PolarHBondContact O-N 3.33Å; L116-P120 WeakPolarHBondContact O-CD 3.44Å
117	C	52.5	Low	47.7	Very low	91 Å²	91	97.8 Å²	97.8	62%	0.615	52%	0.515	S	S	*	.	H	α-helix	trans	-66.2	-30.6	174.6	-72.3	0	0	0	0	113	M113 L114 F115	M113-C117 WeakPolarHBondContact O-CB 3.41Å; M113-C117 PolarHBondContact O-N 2.98Å; M113-C117 PolarHBondContact O-SG 2.99Å; L114-C117 PolarHBondContact O-N 3.43Å; F115-C117 VanDerWaalsContact C-N 3.33Å; F115-C117 PolarHBondContact O-N 3.02Å
118	I	52.6	Low	47.5	Very low	21 Å²	21	97.1 Å²	97.1	11%	0.108	53%	0.525	C	S	.	.	H	α-helix	trans	-92.3	-19.5	178.5	-55.9	156	0	0	0	111.9	V54 L58 L114 F115 L116 P120 F121	V54-I118 HydrophobicContact CG1-CG2 3.86Å; L58-I118 HydrophobicContact CD1-CG1 4.2Å; L58-I118 HydrophobicContact CD1-CG2 4.29Å; L58-I118 HydrophobicContact CD2-CD1 3.52Å; L58-I118 HydrophobicContact CD2-CG1 3.94Å; L114-I118 HydrophobicContact CD1-CD1 4.42Å; L114-I118 HydrophobicContact CD2-CD1 4.28Å; L114-I118 HydrophobicContact CG-CD1 3.75Å; L114-I118 VanDerWaalsContact O-CD1 3.27Å; L114-I118 WeakPolarHBondContact O-CD1 3.28Å; L114-I118 WeakPolarHBondContact O-CG1 3.4Å; L114-I118 PolarHBondContact O-N 3.25Å; F115-I118 CarbonylContact O-C 3.49Å; F115-I118 PolarHBondContact O-N 2.82Å; L116-I118 VanDerWaalsContact C-N 3.3Å; L116-I118 PolarHBondContact O-N 3.45Å; I118-P120 VanDerWaalsContact C-N 3.28Å; I118-P120 VanDerWaalsContact O-N 3.12Å; I118-F121 HydrophobicContact CG2-CB 4.3Å; I118-F121 WeakPolarHBondContact O-CA 3.49Å; I118-F121 VanDerWaalsContact O-CB 3.28Å; I118-F121 WeakPolarHBondContact O-CB 3.49Å; I118-F121 PolarHBondContact O-N 3.37Å
119	S	44.9	Very low	47	Very low	45 Å²	45	98.9 Å²	98.9	32%	0.315	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-49.1	-36.8	179.6	-68.2	0	0	0	0	114.6	F115 L116 F121 N122	F115-S119 WeakPolarHBondContact O-CA 3.17Å; F115-S119 WeakPolarHBondContact O-CB 3.34Å; F115-S119 PolarHBondContact O-N 3.06Å; F115-S119 PolarHBondContact O-OG 2.82Å; L116-S119 WeakPolarHBondContact O-CB 3.38Å; L116-S119 PolarHBondContact O-N 3.33Å; S119-F121 PolarHBondContact O-N 3.28Å; S119-F121 VanDerWaalsContact O-N 3.1Å; S119-N122 PolarHBondContact O-N 3.44Å
120	P	44.2	Very low	46.8	Very low	92 Å²	92	105.5 Å²	105.5	60%	0.597	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-60	-19.3	172.7	21.3	-33.3	0	0	0	114.3	L116 I118	L116-P120 WeakPolarHBondContact O-CD 3.44Å; I118-P120 VanDerWaalsContact C-N 3.28Å; I118-P120 VanDerWaalsContact O-N 3.12Å
121	F	45.7	Very low	46.6	Very low	99 Å²	99	105 Å²	105	43%	0.434	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-87.1	-14.7	174.7	-77.3	-81.8	0	0	0	114.7	F61 I118 S119 R123	F61-F121 HydrophobicContact CD1-CE1 4.19Å; F61-F121 HydrophobicContact CD1-CE2 4.43Å; F61-F121 AromaticContact CD1-CZ 3.95Å; F61-F121 HydrophobicContact CD1-CZ 3.95Å; F61-F121 HydrophobicContact CD2-CD1 4.19Å; F61-F121 AromaticContact CD2-CE1 3.36Å; F61-F121 HydrophobicContact CD2-CE1 3.36Å; F61-F121 AromaticContact CD2-CZ 3.81Å; F61-F121 HydrophobicContact CD2-CZ 3.81Å; F61-F121 HydrophobicContact CE1-CE1 4.09Å; F61-F121 HydrophobicContact CE1-CE2 4.05Å; F61-F121 AromaticContact CE1-CZ 3.5Å; F61-F121 HydrophobicContact CE1-CZ 3.5Å; F61-F121 VanDerWaalsContact CE1-CZ 3.5Å; F61-F121 HydrophobicContact CE2-CD1 4.41Å; F61-F121 AromaticContact CE2-CE1 3.23Å; F61-F121 HydrophobicContact CE2-CE1 3.23Å; F61-F121 AromaticContact CE2-CZ 3.32Å; F61-F121 HydrophobicContact CE2-CZ 3.32Å; F61-F121 HydrophobicContact CG-CD1 4.44Å; F61-F121 AromaticContact CG-CE1 3.85Å; F61-F121 HydrophobicContact CG-CE1 3.85Å; F61-F121 HydrophobicContact CG-CZ 4.1Å; F61-F121 AromaticContact CZ-CE1 3.64Å; F61-F121 HydrophobicContact CZ-CE1 3.64Å; F61-F121 HydrophobicContact CZ-CE2 4.12Å; F61-F121 AromaticContact CZ-CZ 3.16Å; F61-F121 HydrophobicContact CZ-CZ 3.16Å; I118-F121 HydrophobicContact CG2-CB 4.3Å; I118-F121 WeakPolarHBondContact O-CA 3.49Å; I118-F121 VanDerWaalsContact O-CB 3.28Å; I118-F121 WeakPolarHBondContact O-CB 3.49Å; I118-F121 PolarHBondContact O-N 3.37Å; S119-F121 PolarHBondContact O-N 3.28Å; S119-F121 VanDerWaalsContact O-N 3.1Å; F121-R123 PolarHBondContact O-N 3.07Å
122	N	37	Very low	46.3	Very low	81 Å²	81	106.3 Å²	106.3	43%	0.433	58%	0.576	S	S	.	*	G	3₁₀ helix	trans	-90.4	13.8	173.9	-145.2	-20.3	0	0	0	112	V54 S119 P124	V54-N122 WeakPolarHBondContact CG2-ND2 3.34Å; S119-N122 PolarHBondContact O-N 3.44Å; N122-P124 WeakPolarHBondContact O-CD 3.25Å
123	R	37	Very low	45.7	Very low	189 Å²	189	108.1 Å²	108.1	71%	0.713	58%	0.583	S	S	*	*	S	Bend	trans	-73.7	110.7	162.7	-155.4	176.4	-155	-173.8	4.8	106.1	F121	F121-R123 PolarHBondContact O-N 3.07Å
124	P	35.3	Very low	45.1	Very low	94 Å²	94	108.5 Å²	108.5	61%	0.61	59%	0.588	S	S	*	*			trans	-55.3	146.2	173.6	25.1	-32.7	0	0	0	108	N122 I126	N122-P124 WeakPolarHBondContact O-CD 3.25Å; P124-I126 PolarHBondContact O-N 3.29Å
125	P	37.3	Very low	44.2	Very low	112 Å²	112	111.9 Å²	111.9	73%	0.727	61%	0.607	S	S	*	*			trans	-56.5	110.1	177	24	-31.7	0	0	0	107.5	D127	P125-D127 PolarHBondContact O-N 2.92Å
126	I	42	Very low	43.3	Very low	119 Å²	119	115.8 Å²	115.8	61%	0.61	63%	0.632	S	S	*	*			trans	-79	60.6	169.3	-47.7	177.6	0	0	0	106	P124	P124-I126 PolarHBondContact O-N 3.29Å
127	D	38.6	Very low	42.4	Very low	152 Å²	152	116.5 Å²	116.5	81%	0.813	64%	0.637	S	S	*	*			trans	-142	60.9	175.8	-71.6	-50.6	0	0	0	107.8	P125	P125-D127 PolarHBondContact O-N 2.92Å
128	A	40	Very low	41.6	Very low	95 Å²	95	118.5 Å²	118.5	79%	0.785	64%	0.639	S	S	*	*			trans	-147.3	31.2	161	0	0	0	0	0	111.2
129	L	40.5	Very low	40.6	Very low	171 Å²	171	126.6 Å²	126.6	90%	0.895	68%	0.683	S	S	*	*			trans	-126.2	68.9	170.5	-112	160.4	0	0	0	108.7
130	Q	45.4	Very low	40.3	Very low	270 Å²	270	134 Å²	134	100%	1.262	72%	0.716	S	S	*	*			trans	-149.8	0	151.7	-111.2	-170.7	-58.8	0	0	107.9

Retrieved 130 of 130 residues in 92.2 ms (Link to these results)

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