A0A077ZJ25_TRITR Loading...

Tigger transposable element derived protein

AlphaFold DB , UniProt , Accession A0A077ZJ25, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 142 aa.

						>A0A077ZJ25_TRITR|A0A077ZJ25
MTTKSSGPAESIQHPYQEIGGLAHQGVFGEINEEDIEERLEFHGEVQSNNDLLEIERQLTEDLEEPEPRNSEQVKILLTKDLSEASRLLENTVAILTEKDSQQERSAQVNRMITGAYSCYREIYESKTRHAQQTLDRFLQHR
					

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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	46.2	Very low	46.4	Very low	248 Å²	248	137.5 Å²	137.5	100%	1.222	83%	0.833	S	S	*	*				0	115.3	0	-73.7	-177.6	159.7	0	0	107
2	T	51	Low	46.9	Very low	143 Å²	143	135.5 Å²	135.5	88%	0.877	81%	0.812	S	S	*	*			trans	-94.9	144	-162.6	-23.2	0	0	0	0	110.8
3	T	45.1	Very low	47.8	Very low	136 Å²	136	137.3 Å²	137.3	83%	0.834	81%	0.807	S	S	*	*			trans	-61.7	140.8	-174.6	48.4	0	0	0	0	115
4	K	48.9	Very low	48.5	Very low	203 Å²	203	135.8 Å²	135.8	88%	0.883	79%	0.787	S	S	*	*			trans	-130.3	105.5	162	-122.6	179.7	176.3	-177.2	0	106
5	S	46	Very low	49.4	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	76%	0.76	S	S	*	*				64.9	105.6	96.3	173.1	0	0	0	0	114.3
6	S	39.4	Very low	50.3	Low	123 Å²	123	131.4 Å²	131.4	86%	0.86	75%	0.748	S	S	*	*			trans	-155.5	105.4	142.2	-167.9	0	0	0	0	107.4
7	G	43.7	Very low	51.1	Low	62 Å²	62	131.9 Å²	131.9	64%	0.639	74%	0.742	S	S	*	*			trans	-85.7	151	172.6	0	0	0	0	0	110.3
8	P	44.8	Very low	51.7	Low	113 Å²	113	130.9 Å²	130.9	73%	0.734	73%	0.731	S	S	*	*			trans	-81.2	127.8	-165.3	33.1	-33.4	0	0	0	111.5	E10	P8-E10 HydrophobicContact CB-CG 4.48Å; P8-E10 PolarHBondContact O-N 3.41Å
9	A	44.5	Very low	52.3	Low	101 Å²	101	128 Å²	128	84%	0.835	71%	0.712	S	S	*	*			trans	-81.3	92.9	148.3	0	0	0	0	0	106.1	S11	A9-S11 PolarHBondContact O-N 2.84Å
10	E	49.8	Very low	52.7	Low	174 Å²	174	122.7 Å²	122.7	81%	0.813	69%	0.688	S	S	*	*			trans	-66.1	106.1	168.1	-91.7	171.2	165.6	0	0	107.8	P8 I12	P8-E10 HydrophobicContact CB-CG 4.48Å; P8-E10 PolarHBondContact O-N 3.41Å; E10-I12 PolarHBondContact O-N 3.21Å
11	S	51.6	Low	53.1	Low	96 Å²	96	118.6 Å²	118.6	67%	0.671	67%	0.673	S	S	*	*			trans	-63.4	113.7	170.6	-170.4	0	0	0	0	107.5	A9 Q13	A9-S11 PolarHBondContact O-N 2.84Å; S11-Q13 VanDerWaalsContact C-N 3.32Å; S11-Q13 WeakPolarHBondContact O-CG 3.49Å; S11-Q13 PolarHBondContact O-N 3.47Å
12	I	51.6	Low	53.8	Low	113 Å²	113	112.1 Å²	112.1	58%	0.579	64%	0.643	S	S	*	*			trans	-65.2	93.8	173.2	-58.6	175	0	0	0	107	E10 H14 P15 E18	E10-I12 PolarHBondContact O-N 3.21Å; I12-H14 VanDerWaalsContact C-N 3.35Å; I12-P15 HydrophobicContact CG2-CB 3.92Å; I12-E18 WeakPolarHBondContact CG2-OE2 3.3Å
13	Q	58.5	Low	54.1	Low	159 Å²	159	106.1 Å²	106.1	74%	0.743	61%	0.608	S	S	*	*	S	Bend	trans	-76.6	-20.9	-172.8	-71.1	-165.5	-6.3	0	0	113.3	S11	S11-Q13 VanDerWaalsContact C-N 3.32Å; S11-Q13 WeakPolarHBondContact O-CG 3.49Å; S11-Q13 PolarHBondContact O-N 3.47Å
14	H	58.5	Low	54.7	Low	116 Å²	116	107.9 Å²	107.9	54%	0.537	61%	0.606	S	S	.	*			trans	-146.4	76	179.4	-77.1	-69.6	0	0	0	111.1	I12 Y16 Q17 E18	I12-H14 VanDerWaalsContact C-N 3.35Å; H14-Y16 PolarHBondContact O-N 2.97Å; H14-Y16 VanDerWaalsContact O-N 3.17Å; H14-Q17 HydrophobicContact CB-CB 4.03Å; H14-Q17 HydrophobicContact CB-CG 4.23Å; H14-Q17 VanDerWaalsContact CB-OE1 3.23Å; H14-Q17 PolarHBondContact O-N 2.85Å; H14-E18 PolarHBondContact O-N 3.29Å
15	P	61.3	Low	55.1	Low	57 Å²	57	106.3 Å²	106.3	37%	0.37	60%	0.602	S	S	.	*	H	α-helix	trans	-56.9	-34.8	-176.8	21	-31.3	0	0	0	112.5	I12 Q17 E18 I19	I12-P15 HydrophobicContact CG2-CB 3.92Å; P15-Q17 PolarHBondContact O-N 3.23Å; P15-E18 PolarHBondContact O-N 3.39Å; P15-I19 WeakPolarHBondContact O-CB 3.35Å; P15-I19 WeakPolarHBondContact O-CD1 3.47Å; P15-I19 WeakPolarHBondContact O-CG1 3.25Å; P15-I19 PolarHBondContact O-N 3.24Å
16	Y	63.7	Low	55.4	Low	145 Å²	145	102.3 Å²	102.3	57%	0.569	58%	0.579	S	S	*	*	H	α-helix	trans	-63	-40.5	177.2	-58	-80	0	0	0	113.3	H14 G20 L40	H14-Y16 PolarHBondContact O-N 2.97Å; H14-Y16 VanDerWaalsContact O-N 3.17Å; Y16-G20 PolarHBondContact O-N 2.69Å; Y16-L40 HydrophobicContact CD1-CD1 4.16Å; Y16-L40 HydrophobicContact CE1-CD1 3.81Å
17	Q	63.5	Low	56.2	Low	139 Å²	139	103.9 Å²	103.9	65%	0.65	58%	0.583	S	S	*	*	H	α-helix	trans	-72	-34.8	178.4	-74.8	175.7	-28.3	0	0	111.7	H14 P15 G21	H14-Q17 HydrophobicContact CB-CB 4.03Å; H14-Q17 HydrophobicContact CB-CG 4.23Å; H14-Q17 VanDerWaalsContact CB-OE1 3.23Å; H14-Q17 PolarHBondContact O-N 2.85Å; P15-Q17 PolarHBondContact O-N 3.23Å; Q17-G21 PolarHBondContact O-N 2.68Å
18	E	61.9	Low	56.7	Low	115 Å²	115	107.5 Å²	107.5	54%	0.537	58%	0.581	S	S	.	*	H	α-helix	trans	-68.5	-44	174.2	-111.4	179.5	-177.6	0	0	111.6	I12 H14 P15 G21 L22	I12-E18 WeakPolarHBondContact CG2-OE2 3.3Å; H14-E18 PolarHBondContact O-N 3.29Å; P15-E18 PolarHBondContact O-N 3.39Å; E18-G21 PolarHBondContact O-N 3.03Å; E18-L22 WeakPolarHBondContact O-CB 3.13Å; E18-L22 WeakPolarHBondContact O-CG 3.41Å; E18-L22 PolarHBondContact O-N 3.07Å
19	I	63.6	Low	57	Low	75 Å²	75	105.4 Å²	105.4	39%	0.385	58%	0.58	S	S	.	*	H	α-helix	trans	-66.6	-44.5	178.1	-66.7	165.2	0	0	0	110.7	P15 G21 L22 A23 I36	P15-I19 WeakPolarHBondContact O-CB 3.35Å; P15-I19 WeakPolarHBondContact O-CD1 3.47Å; P15-I19 WeakPolarHBondContact O-CG1 3.25Å; P15-I19 PolarHBondContact O-N 3.24Å; I19-G21 VanDerWaalsContact C-N 3.33Å; I19-G21 PolarHBondContact O-N 3.31Å; I19-L22 PolarHBondContact O-N 3.16Å; I19-A23 WeakPolarHBondContact O-CB 3.37Å; I19-A23 PolarHBondContact O-N 3.11Å; I19-I36 HydrophobicContact CG2-CG2 4.38Å
20	G	61.4	Low	57.6	Low	21 Å²	21	109.9 Å²	109.9	22%	0.216	58%	0.584	C	S	.	*	H	α-helix	trans	-62.4	-39.6	174.3	0	0	0	0	0	112.4	Y16 A23 H24	Y16-G20 PolarHBondContact O-N 2.69Å; G20-A23 PolarHBondContact O-N 3.26Å; G20-H24 PolarHBondContact O-CD2 2.89Å; G20-H24 PolarHBondContact O-N 2.83Å
21	G	60.9	Low	57.9	Low	38 Å²	38	103.7 Å²	103.7	39%	0.392	56%	0.556	S	S	.	*	H	α-helix	trans	-64.5	-37.6	174	0	0	0	0	0	113.4	Q17 E18 I19 Q25	Q17-G21 PolarHBondContact O-N 2.68Å; E18-G21 PolarHBondContact O-N 3.03Å; I19-G21 VanDerWaalsContact C-N 3.33Å; I19-G21 PolarHBondContact O-N 3.31Å; G21-Q25 PolarHBondContact O-N 3.27Å
22	L	60.8	Low	58.3	Low	112 Å²	112	103.4 Å²	103.4	59%	0.586	55%	0.547	S	S	*	.	H	α-helix	trans	-73.8	-38	177.1	-72.6	169	0	0	0	112.4	E18 I19 H24 Q25 G26	E18-L22 WeakPolarHBondContact O-CB 3.13Å; E18-L22 WeakPolarHBondContact O-CG 3.41Å; E18-L22 PolarHBondContact O-N 3.07Å; I19-L22 PolarHBondContact O-N 3.16Å; L22-H24 VanDerWaalsContact C-N 3.27Å; L22-H24 PolarHBondContact O-N 3.48Å; L22-Q25 PolarHBondContact O-N 3.1Å; L22-G26 PolarHBondContact O-N 3.34Å
23	A	56.8	Low	58.8	Low	17 Å²	17	104.9 Å²	104.9	14%	0.14	55%	0.551	C	S	.	*	H	α-helix	trans	-62.2	-35.9	175.7	0	0	0	0	0	111.6	I19 G20 Q25	I19-A23 WeakPolarHBondContact O-CB 3.37Å; I19-A23 PolarHBondContact O-N 3.11Å; G20-A23 PolarHBondContact O-N 3.26Å; A23-Q25 VanDerWaalsContact C-N 3.3Å; A23-Q25 PolarHBondContact O-N 2.86Å
24	H	57.8	Low	58.9	Low	172 Å²	172	103.7 Å²	103.7	80%	0.796	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-16.3	174	-75.6	-39.2	0	0	0	114.7	G20 L22	G20-H24 PolarHBondContact O-CD2 2.89Å; G20-H24 PolarHBondContact O-N 2.83Å; L22-H24 VanDerWaalsContact C-N 3.27Å; L22-H24 PolarHBondContact O-N 3.48Å
25	Q	57.9	Low	59.2	Low	171 Å²	171	101.5 Å²	101.5	80%	0.799	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-11.5	-177.3	-83.9	-170.7	-15.4	0	0	115.4	G21 L22 A23	G21-Q25 PolarHBondContact O-N 3.27Å; L22-Q25 PolarHBondContact O-N 3.1Å; A23-Q25 VanDerWaalsContact C-N 3.3Å; A23-Q25 PolarHBondContact O-N 2.86Å
26	G	51	Low	59.2	Low	30 Å²	30	100.1 Å²	100.1	31%	0.309	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.5	117.5	-177.5	0	0	0	0	0	113.5	L22 F28	L22-G26 PolarHBondContact O-N 3.34Å; G26-F28 WeakPolarHBondContact O-CB 3.32Å; G26-F28 WeakPolarHBondContact O-CD2 3.21Å; G26-F28 PolarHBondContact O-N 3.29Å
27	V	56.2	Low	59.1	Low	156 Å²	156	98.8 Å²	98.8	95%	0.945	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	0.2	152.2	-170.5	0	0	0	0	117.9	G29	V27-G29 PolarHBondContact O-N 3.45Å
28	F	53.9	Low	58.9	Low	137 Å²	137	98.6 Å²	98.6	60%	0.601	53%	0.526	S	S	*	.			trans	-100	89	178	-75	-68.1	0	0	0	106.8	G26 I31	G26-F28 WeakPolarHBondContact O-CB 3.32Å; G26-F28 WeakPolarHBondContact O-CD2 3.21Å; G26-F28 PolarHBondContact O-N 3.29Å; F28-I31 HydrophobicContact CB-CD1 3.54Å; F28-I31 HydrophobicContact CB-CG1 3.98Å; F28-I31 HydrophobicContact CD1-CD1 3.68Å; F28-I31 HydrophobicContact CG-CD1 3.77Å
29	G	52.3	Low	58.6	Low	69 Å²	69	100.3 Å²	100.3	71%	0.711	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	138.1	171.6	0	0	0	0	0	110.3	V27 I31	V27-G29 PolarHBondContact O-N 3.45Å; G29-I31 VanDerWaalsContact C-N 3.29Å; G29-I31 PolarHBondContact O-N 2.91Å
30	E	56	Low	58.3	Low	196 Å²	196	100.1 Å²	100.1	92%	0.916	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	17.4	66.8	173.8	-72.3	180	161.2	0	0	113.8	N32	E30-N32 PolarHBondContact O-N 3.47Å
31	I	55.9	Low	57.9	Low	43 Å²	43	106.4 Å²	106.4	22%	0.221	55%	0.55	C	S	.	.			trans	-78.9	110.8	162.9	-55.7	-174.6	0	0	0	104.9	F28 G29 D35 I36	F28-I31 HydrophobicContact CB-CD1 3.54Å; F28-I31 HydrophobicContact CB-CG1 3.98Å; F28-I31 HydrophobicContact CD1-CD1 3.68Å; F28-I31 HydrophobicContact CG-CD1 3.77Å; G29-I31 VanDerWaalsContact C-N 3.29Å; G29-I31 PolarHBondContact O-N 2.91Å; I31-D35 HydrophobicContact CG2-CB 3.98Å; I31-I36 HydrophobicContact CB-CG1 4.48Å; I31-I36 HydrophobicContact CG2-CD1 3.97Å; I31-I36 HydrophobicContact CG2-CG1 3.38Å
32	N	60.7	Low	57.4	Low	90 Å²	90	112.5 Å²	112.5	48%	0.481	57%	0.566	S	S	.	*			trans	-66.9	146.1	176.7	-152.1	9	0	0	0	108.5	E30 E34 D35 I36	E30-N32 PolarHBondContact O-N 3.47Å; N32-E34 PolarHBondContact O-N 3.36Å; N32-D35 HydrophobicContact CB-CB 4.35Å; N32-D35 VanDerWaalsContact CB-OD2 3.31Å; N32-D35 WeakPolarHBondContact CB-OD2 3.27Å; N32-D35 PolarHBondContact N-OD2 3.48Å; N32-D35 VanDerWaalsContact N-OD2 3.14Å; N32-D35 WeakPolarHBondContact O-CA 3.31Å; N32-D35 WeakPolarHBondContact O-CB 3.43Å; N32-D35 PolarHBondContact O-N 2.9Å; N32-I36 PolarHBondContact O-N 3.03Å; N32-I36 VanDerWaalsContact O-N 3.15Å
33	E	61.5	Low	57	Low	144 Å²	144	114 Å²	114	67%	0.673	57%	0.57	S	S	*	*	H	α-helix	trans	-59.1	-34.3	178.8	-160.3	168.2	-156.9	0	0	110.5	D35 I36 E37	E33-D35 PolarHBondContact O-N 3.48Å; E33-I36 WeakPolarHBondContact O-CB 3.39Å; E33-I36 PolarHBondContact O-N 2.96Å; E33-I36 VanDerWaalsContact O-N 3.16Å; E33-E37 PolarHBondContact O-N 3.32Å
34	E	62.1	Low	56.6	Low	135 Å²	135	115.6 Å²	115.6	63%	0.631	59%	0.588	S	S	*	*	H	α-helix	trans	-60	-36.2	168.6	-79.8	172.7	157.8	0	0	113.4	N32 I36 E37 E38	N32-E34 PolarHBondContact O-N 3.36Å; E34-I36 VanDerWaalsContact C-N 3.31Å; E34-I36 PolarHBondContact O-N 2.91Å; E34-E37 PolarHBondContact O-N 3.28Å; E34-E38 VanDerWaalsContact O-CB 3.25Å; E34-E38 WeakPolarHBondContact O-CB 3.42Å; E34-E38 PolarHBondContact O-N 3.49Å
35	D	63.2	Low	56	Low	69 Å²	69	114.7 Å²	114.7	37%	0.369	58%	0.584	S	S	.	*	H	α-helix	trans	-70.8	-30.4	176.2	-65.5	-38.4	0	0	0	111.5	I31 N32 E33 R39	I31-D35 HydrophobicContact CG2-CB 3.98Å; N32-D35 HydrophobicContact CB-CB 4.35Å; N32-D35 VanDerWaalsContact CB-OD2 3.31Å; N32-D35 WeakPolarHBondContact CB-OD2 3.27Å; N32-D35 PolarHBondContact N-OD2 3.48Å; N32-D35 VanDerWaalsContact N-OD2 3.14Å; N32-D35 WeakPolarHBondContact O-CA 3.31Å; N32-D35 WeakPolarHBondContact O-CB 3.43Å; N32-D35 PolarHBondContact O-N 2.9Å; E33-D35 PolarHBondContact O-N 3.48Å; D35-R39 WeakPolarHBondContact O-CB 3.47Å; D35-R39 WeakPolarHBondContact O-CG 3.48Å; D35-R39 PolarHBondContact O-N 2.99Å; D35-R39 VanDerWaalsContact O-N 3.07Å
36	I	62.1	Low	55.5	Low	29 Å²	29	112.9 Å²	112.9	15%	0.149	59%	0.585	C	S	.	*	H	α-helix	trans	-72.6	-44	174.5	-59.1	179.5	0	0	0	109.4	I19 I31 N32 E33 E34 L40	I19-I36 HydrophobicContact CG2-CG2 4.38Å; I31-I36 HydrophobicContact CB-CG1 4.48Å; I31-I36 HydrophobicContact CG2-CD1 3.97Å; I31-I36 HydrophobicContact CG2-CG1 3.38Å; N32-I36 PolarHBondContact O-N 3.03Å; N32-I36 VanDerWaalsContact O-N 3.15Å; E33-I36 WeakPolarHBondContact O-CB 3.39Å; E33-I36 PolarHBondContact O-N 2.96Å; E33-I36 VanDerWaalsContact O-N 3.16Å; E34-I36 VanDerWaalsContact C-N 3.31Å; E34-I36 PolarHBondContact O-N 2.91Å; I36-L40 HydrophobicContact CG2-CD1 3.61Å; I36-L40 HydrophobicContact CG2-CG 4.27Å; I36-L40 WeakPolarHBondContact O-CB 3.48Å; I36-L40 WeakPolarHBondContact O-CG 3.35Å; I36-L40 PolarHBondContact O-N 3.43Å
37	E	61.2	Low	55.4	Low	117 Å²	117	118.2 Å²	118.2	55%	0.547	60%	0.601	S	S	.	*	H	α-helix	trans	-63.6	-47.6	176.1	-72.7	-174	170	0	0	111.4	E33 E34 R39 L40 E41	E33-E37 PolarHBondContact O-N 3.32Å; E34-E37 PolarHBondContact O-N 3.28Å; E37-R39 PolarHBondContact O-N 3.48Å; E37-L40 CarbonylContact O-C 3.55Å; E37-L40 PolarHBondContact O-N 3.33Å; E37-E41 WeakPolarHBondContact O-CB 3.35Å; E37-E41 PolarHBondContact O-N 2.94Å
38	E	59.1	Low	55.4	Low	135 Å²	135	114.3 Å²	114.3	63%	0.631	58%	0.581	S	S	*	*	H	α-helix	trans	-66.4	-38.3	-179.5	-159.5	-178.8	-145.7	0	0	111.7	E34 E41 F42	E34-E38 VanDerWaalsContact O-CB 3.25Å; E34-E38 WeakPolarHBondContact O-CB 3.42Å; E34-E38 PolarHBondContact O-N 3.49Å; E38-E41 PolarHBondContact O-N 3Å; E38-F42 WeakPolarHBondContact O-CB 3.37Å; E38-F42 PolarHBondContact O-N 2.87Å
39	R	55	Low	55.6	Low	151 Å²	151	110 Å²	110	57%	0.57	56%	0.564	S	S	*	*	H	α-helix	trans	-72.3	-32	173.9	-74.6	177.2	65.9	-157.8	-2	113.1	D35 E37 H43	D35-R39 WeakPolarHBondContact O-CB 3.47Å; D35-R39 WeakPolarHBondContact O-CG 3.48Å; D35-R39 PolarHBondContact O-N 2.99Å; D35-R39 VanDerWaalsContact O-N 3.07Å; E37-R39 PolarHBondContact O-N 3.48Å; R39-H43 PolarHBondContact O-CD2 3.17Å; R39-H43 PolarHBondContact O-N 2.78Å
40	L	57.4	Low	56.3	Low	70 Å²	70	111.5 Å²	111.5	37%	0.366	56%	0.556	S	S	.	*	H	α-helix	trans	-78.1	-26.3	174.4	-74.8	171.4	0	0	0	111.9	Y16 I36 E37 H43 G44	Y16-L40 HydrophobicContact CD1-CD1 4.16Å; Y16-L40 HydrophobicContact CE1-CD1 3.81Å; I36-L40 HydrophobicContact CG2-CD1 3.61Å; I36-L40 HydrophobicContact CG2-CG 4.27Å; I36-L40 WeakPolarHBondContact O-CB 3.48Å; I36-L40 WeakPolarHBondContact O-CG 3.35Å; I36-L40 PolarHBondContact O-N 3.43Å; E37-L40 CarbonylContact O-C 3.55Å; E37-L40 PolarHBondContact O-N 3.33Å; L40-H43 CarbonylContact O-C 3.5Å; L40-H43 PolarHBondContact O-N 3.4Å; L40-G44 WeakPolarHBondContact O-CA 3.36Å; L40-G44 PolarHBondContact O-N 2.96Å
41	E	54.1	Low	56.9	Low	153 Å²	153	103.4 Å²	103.4	72%	0.715	52%	0.519	S	S	*	.	H	α-helix	trans	-69.9	-41.1	168.4	-124.3	172.6	-174.6	0	0	110.3	E37 E38 H43 G44 E45	E37-E41 WeakPolarHBondContact O-CB 3.35Å; E37-E41 PolarHBondContact O-N 2.94Å; E38-E41 PolarHBondContact O-N 3Å; E41-H43 VanDerWaalsContact C-N 3.28Å; E41-H43 PolarHBondContact O-N 3.05Å; E41-G44 PolarHBondContact O-N 2.91Å; E41-G44 VanDerWaalsContact O-N 3.08Å; E41-E45 PolarHBondContact O-N 2.81Å
42	F	50.3	Low	57.5	Low	167 Å²	167	104.4 Å²	104.4	73%	0.732	53%	0.525	S	S	*	.	H	α-helix	trans	-64.8	-28.4	173.7	-169.4	-97.8	0	0	0	113.5	E38	E38-F42 WeakPolarHBondContact O-CB 3.37Å; E38-F42 PolarHBondContact O-N 2.87Å
43	H	52.4	Low	58.2	Low	143 Å²	143	104.5 Å²	104.5	66%	0.662	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-5	172	-80.6	-64.5	0	0	0	114	R39 L40 E41	R39-H43 PolarHBondContact O-CD2 3.17Å; R39-H43 PolarHBondContact O-N 2.78Å; L40-H43 CarbonylContact O-C 3.5Å; L40-H43 PolarHBondContact O-N 3.4Å; E41-H43 VanDerWaalsContact C-N 3.28Å; E41-H43 PolarHBondContact O-N 3.05Å
44	G	49.1	Very low	58.8	Low	51 Å²	51	99.5 Å²	99.5	53%	0.526	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-13.1	-174.8	0	0	0	0	0	113.3	L40 E41 V46	L40-G44 WeakPolarHBondContact O-CA 3.36Å; L40-G44 PolarHBondContact O-N 2.96Å; E41-G44 PolarHBondContact O-N 2.91Å; E41-G44 VanDerWaalsContact O-N 3.08Å; G44-V46 VanDerWaalsContact C-N 3.28Å; G44-V46 PolarHBondContact O-N 2.79Å
45	E	45.6	Very low	59.3	Low	152 Å²	152	95 Å²	95	71%	0.71	48%	0.481	S	S	*	.	S	Bend	trans	-60.1	103.6	149.1	-80.3	-163.1	160.8	0	0	106.6	E41 Q47	E41-E45 PolarHBondContact O-N 2.81Å; E45-Q47 PolarHBondContact O-N 2.98Å
46	V	46.7	Very low	59.6	Low	134 Å²	134	96.4 Å²	96.4	81%	0.812	49%	0.485	S	S	*	.			trans	-49.3	89.4	152.9	179.7	0	0	0	0	104.5	G44 S48	G44-V46 VanDerWaalsContact C-N 3.28Å; G44-V46 PolarHBondContact O-N 2.79Å; V46-S48 PolarHBondContact O-N 3.17Å
47	Q	49.1	Very low	60	Low	141 Å²	141	100 Å²	100	66%	0.659	50%	0.497	S	S	*	.			trans	-59.3	94.4	165.6	-80.7	-169.7	-36.7	0	0	102.4	E45 N49	E45-Q47 PolarHBondContact O-N 2.98Å; Q47-N49 WeakPolarHBondContact O-CA 3.47Å; Q47-N49 PolarHBondContact O-N 3.37Å
48	S	54.5	Low	60.4	Low	74 Å²	74	96.1 Å²	96.1	52%	0.517	48%	0.479	S	S	.	.			trans	-52.7	103.1	175.8	-178.7	0	0	0	0	103.4	V46 N50	V46-S48 PolarHBondContact O-N 3.17Å; S48-N50 PolarHBondContact O-N 3.42Å; S48-N50 PolarHBondContact OG-OD1 3.45Å
49	N	59.1	Low	60.9	Low	47 Å²	47	95.2 Å²	95.2	25%	0.251	48%	0.478	S	S	.	.			trans	-80	61.7	-166.2	-165.5	-9	0	0	0	107	Q47 D51 L52 L53 F138	Q47-N49 WeakPolarHBondContact O-CA 3.47Å; Q47-N49 PolarHBondContact O-N 3.37Å; N49-D51 PolarHBondContact O-N 3.32Å; N49-D51 VanDerWaalsContact O-N 3.11Å; N49-L52 HydrophobicContact CB-CB 3.95Å; N49-L52 WeakPolarHBondContact ND2-CB 3.47Å; N49-L52 VanDerWaalsContact ND2-CD2 3.28Å; N49-L52 WeakPolarHBondContact ND2-CD2 3.37Å; N49-L52 CarbonylContact O-C 3.56Å; N49-L52 PolarHBondContact O-N 3.28Å; N49-L52 WeakPolarHBondContact OD1-CB 3.11Å; N49-L52 PolarHBondContact OD1-N 2.93Å; N49-L53 WeakPolarHBondContact O-CG 3.39Å; N49-L53 PolarHBondContact O-N 3.03Å; N49-F138 WeakPolarHBondContact ND2-CE2 3.44Å; N49-F138 WeakPolarHBondContact ND2-CZ 3.44Å; N49-F138 WeakPolarHBondContact OD1-CD2 3.23Å; N49-F138 WeakPolarHBondContact OD1-CE2 3.14Å
50	N	67.9	Low	61.2	Low	101 Å²	101	90.8 Å²	90.8	54%	0.54	47%	0.468	S	S	.	.	H	α-helix	trans	-57.7	-28.5	-174.2	-73	-20.1	0	0	0	109.8	S48 E54	S48-N50 PolarHBondContact O-N 3.42Å; S48-N50 PolarHBondContact OG-OD1 3.45Å; N50-E54 VanDerWaalsContact O-CB 3.24Å; N50-E54 WeakPolarHBondContact O-CB 3.2Å; N50-E54 PolarHBondContact O-N 2.71Å
51	D	67.9	Low	61.2	Low	26 Å²	26	91.4 Å²	91.4	14%	0.139	47%	0.469	C	S	.	.	H	α-helix	trans	-74.4	-40.9	174.8	-68.5	-6.4	0	0	0	112.5	N49 E54 I55 R137 F138 H141	N49-D51 PolarHBondContact O-N 3.32Å; N49-D51 VanDerWaalsContact O-N 3.11Å; D51-E54 WeakPolarHBondContact O-CB 3.37Å; D51-E54 PolarHBondContact O-N 3.07Å; D51-I55 WeakPolarHBondContact O-CG1 3.1Å; D51-I55 PolarHBondContact O-N 3.44Å; D51-R137 IonicContact OD1-CZ 2.82Å; D51-R137 IonicContact OD1-NE 2.79Å; D51-R137 PolarHBondContact OD1-NE 2.84Å; D51-R137 IonicContact OD1-NH2 3.72Å; D51-R137 PolarHBondContact OD1-NH2 3.01Å; D51-R137 WeakPolarHBondContact OD2-CG 3.42Å; D51-R137 IonicContact OD2-CZ 2.65Å; D51-R137 IonicContact OD2-NE 3.75Å; D51-R137 PolarHBondContact OD2-NE 2.68Å; D51-R137 IonicContact OD2-NH2 3.09Å; D51-F138 HydrophobicContact CB-CB 3.87Å; D51-F138 HydrophobicContact CB-CD2 4.06Å; D51-F138 HydrophobicContact CB-CG 4.4Å; D51-H141 IonicContact OD2-CD2 3.45Å
52	L	69.2	Low	61.4	Low	64 Å²	64	85.3 Å²	85.3	34%	0.335	44%	0.441	S	S	.	.	H	α-helix	trans	-68.9	-38	171	-175.9	65.8	0	0	0	111.8	N49 E54 I55 E56 F138	N49-L52 HydrophobicContact CB-CB 3.95Å; N49-L52 WeakPolarHBondContact ND2-CB 3.47Å; N49-L52 VanDerWaalsContact ND2-CD2 3.28Å; N49-L52 WeakPolarHBondContact ND2-CD2 3.37Å; N49-L52 CarbonylContact O-C 3.56Å; N49-L52 PolarHBondContact O-N 3.28Å; N49-L52 WeakPolarHBondContact OD1-CB 3.11Å; N49-L52 PolarHBondContact OD1-N 2.93Å; L52-E54 PolarHBondContact O-N 2.89Å; L52-I55 PolarHBondContact O-N 3.18Å; L52-I55 VanDerWaalsContact O-N 3.16Å; L52-E56 WeakPolarHBondContact O-CB 3.45Å; L52-E56 WeakPolarHBondContact O-CG 3.45Å; L52-E56 PolarHBondContact O-N 2.88Å; L52-F138 HydrophobicContact CB-CE2 4.47Å
53	L	74.1	Confident	61.6	Low	92 Å²	92	82.5 Å²	82.5	48%	0.482	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-32.1	171.7	-69	175.5	0	0	0	110.9	N49 R57	N49-L53 WeakPolarHBondContact O-CG 3.39Å; N49-L53 PolarHBondContact O-N 3.03Å; L53-R57 WeakPolarHBondContact O-CA 3.42Å; L53-R57 WeakPolarHBondContact O-CB 3.43Å; L53-R57 PolarHBondContact O-N 3.27Å
54	E	74.1	Confident	61.5	Low	38 Å²	38	81.2 Å²	81.2	18%	0.178	43%	0.427	C	S	.	.	H	α-helix	trans	-68.8	-41.5	171.8	-177.7	68	-145.6	0	0	111.1	N50 D51 L52 R57 Q58 T134	N50-E54 VanDerWaalsContact O-CB 3.24Å; N50-E54 WeakPolarHBondContact O-CB 3.2Å; N50-E54 PolarHBondContact O-N 2.71Å; D51-E54 WeakPolarHBondContact O-CB 3.37Å; D51-E54 PolarHBondContact O-N 3.07Å; L52-E54 PolarHBondContact O-N 2.89Å; E54-R57 PolarHBondContact O-N 3.45Å; E54-R57 IonicContact OE1-CZ 3.97Å; E54-R57 IonicContact OE1-NH1 2.67Å; E54-R57 IonicContact OE1-NH2 3.16Å; E54-R57 PolarHBondContact OE1-NH2 3.34Å; E54-R57 IonicContact OE2-CZ 3.84Å; E54-R57 IonicContact OE2-NH1 3.27Å; E54-R57 PolarHBondContact OE2-NH1 3.3Å; E54-R57 IonicContact OE2-NH2 2.72Å; E54-R57 PolarHBondContact OE2-NH2 3.14Å; E54-Q58 WeakPolarHBondContact O-CB 3.49Å; E54-Q58 VanDerWaalsContact O-CG 3.24Å; E54-Q58 WeakPolarHBondContact O-CG 3.4Å; E54-Q58 PolarHBondContact O-N 3.05Å; E54-Q58 PolarHBondContact OE1-NE2 3.42Å; E54-T134 HydrophobicContact CB-CG2 3.96Å; E54-T134 HydrophobicContact CG-CG2 3.68Å
55	I	73.3	Confident	61.6	Low	42 Å²	42	87.5 Å²	87.5	22%	0.215	44%	0.443	C	S	.	.	H	α-helix	trans	-64.3	-47.2	174.4	-64.5	164.2	0	0	0	110.4	D51 L52 Q58 L59 T134 L135 F138	D51-I55 WeakPolarHBondContact O-CG1 3.1Å; D51-I55 PolarHBondContact O-N 3.44Å; L52-I55 PolarHBondContact O-N 3.18Å; L52-I55 VanDerWaalsContact O-N 3.16Å; I55-Q58 PolarHBondContact O-N 3.47Å; I55-L59 VanDerWaalsContact O-CB 3.29Å; I55-L59 WeakPolarHBondContact O-CB 3.33Å; I55-L59 PolarHBondContact O-N 2.61Å; I55-T134 HydrophobicContact CD1-CG2 4.31Å; I55-T134 HydrophobicContact CG1-CG2 3.56Å; I55-L135 HydrophobicContact CD1-CB 4.21Å; I55-L135 HydrophobicContact CD1-CD1 4.09Å; I55-F138 HydrophobicContact CD1-CB 4.36Å
56	E	69.6	Low	61.8	Low	97 Å²	97	85.5 Å²	85.5	45%	0.453	44%	0.443	S	S	.	.	H	α-helix	trans	-63	-42.6	176.1	-76.1	-175.8	171.8	0	0	110.5	L52 L59 T60	L52-E56 WeakPolarHBondContact O-CB 3.45Å; L52-E56 WeakPolarHBondContact O-CG 3.45Å; L52-E56 PolarHBondContact O-N 2.88Å; E56-L59 CarbonylContact O-C 3.48Å; E56-L59 PolarHBondContact O-N 2.93Å; E56-T60 WeakPolarHBondContact O-CA 3.45Å; E56-T60 WeakPolarHBondContact O-CB 3.46Å; E56-T60 PolarHBondContact O-N 3.32Å; E56-T60 PolarHBondContact O-OG1 3.43Å
57	R	70.9	Confident	62.2	Low	105 Å²	105	85.1 Å²	85.1	40%	0.396	43%	0.432	S	S	.	.	H	α-helix	trans	-67.2	-37.5	176.4	-166.7	-175.7	83	-116.4	-8	111.4	L53 E54 L59 T60 E61	L53-R57 WeakPolarHBondContact O-CA 3.42Å; L53-R57 WeakPolarHBondContact O-CB 3.43Å; L53-R57 PolarHBondContact O-N 3.27Å; E54-R57 PolarHBondContact O-N 3.45Å; E54-R57 IonicContact OE1-CZ 3.97Å; E54-R57 IonicContact OE1-NH1 2.67Å; E54-R57 IonicContact OE1-NH2 3.16Å; E54-R57 PolarHBondContact OE1-NH2 3.34Å; E54-R57 IonicContact OE2-CZ 3.84Å; E54-R57 IonicContact OE2-NH1 3.27Å; E54-R57 PolarHBondContact OE2-NH1 3.3Å; E54-R57 IonicContact OE2-NH2 2.72Å; E54-R57 PolarHBondContact OE2-NH2 3.14Å; R57-L59 VanDerWaalsContact C-N 3.31Å; R57-L59 PolarHBondContact O-N 3.47Å; R57-T60 CarbonylContact O-C 3.54Å; R57-T60 PolarHBondContact O-N 3.39Å; R57-E61 VanDerWaalsContact CD-OE1 3.31Å; R57-E61 WeakPolarHBondContact CD-OE1 3.49Å; R57-E61 HydrophobicContact CG-CG 3.86Å; R57-E61 WeakPolarHBondContact CG-OE1 3.37Å; R57-E61 IonicContact CZ-OE1 3.42Å; R57-E61 IonicContact NE-OE1 3.18Å; R57-E61 PolarHBondContact NE-OE1 2.88Å; R57-E61 IonicContact NH2-OE1 2.77Å; R57-E61 WeakPolarHBondContact O-CA 3.3Å; R57-E61 WeakPolarHBondContact O-CB 3.26Å; R57-E61 VanDerWaalsContact O-CG 3.23Å; R57-E61 WeakPolarHBondContact O-CG 3.3Å; R57-E61 PolarHBondContact O-N 2.91Å
58	Q	68.6	Low	62	Low	35 Å²	35	84.4 Å²	84.4	16%	0.164	44%	0.44	C	S	.	.	H	α-helix	trans	-68.8	-33.2	173.7	-72.4	178.1	26.6	0	0	112	E54 I55 H130	E54-Q58 WeakPolarHBondContact O-CB 3.49Å; E54-Q58 VanDerWaalsContact O-CG 3.24Å; E54-Q58 WeakPolarHBondContact O-CG 3.4Å; E54-Q58 PolarHBondContact O-N 3.05Å; E54-Q58 PolarHBondContact OE1-NE2 3.42Å; I55-Q58 PolarHBondContact O-N 3.47Å; Q58-H130 PolarHBondContact NE2-CD2 3.39Å; Q58-H130 VanDerWaalsContact NE2-CD2 3.33Å; Q58-H130 PolarHBondContact NE2-NE2 3.27Å; Q58-H130 PolarHBondContact OE1-CD2 2.68Å; Q58-H130 VanDerWaalsContact OE1-CD2 3.31Å
59	L	69.2	Low	61.8	Low	116 Å²	116	90.2 Å²	90.2	61%	0.607	45%	0.451	S	S	*	.	H	α-helix	trans	-74.1	-29.6	173.6	-169.3	66.5	0	0	0	112.2	I55 E56 R57 D62	I55-L59 VanDerWaalsContact O-CB 3.29Å; I55-L59 WeakPolarHBondContact O-CB 3.33Å; I55-L59 PolarHBondContact O-N 2.61Å; E56-L59 CarbonylContact O-C 3.48Å; E56-L59 PolarHBondContact O-N 2.93Å; R57-L59 VanDerWaalsContact C-N 3.31Å; R57-L59 PolarHBondContact O-N 3.47Å; L59-D62 WeakPolarHBondContact O-CB 3.47Å
60	T	61.3	Low	61.4	Low	59 Å²	59	95.5 Å²	95.5	36%	0.362	48%	0.479	S	S	.	.	H	α-helix	trans	-100.2	-24.3	-173.7	-49.7	0	0	0	0	112.8	E56 R57 D62 L63 E64	E56-T60 WeakPolarHBondContact O-CA 3.45Å; E56-T60 WeakPolarHBondContact O-CB 3.46Å; E56-T60 PolarHBondContact O-N 3.32Å; E56-T60 PolarHBondContact O-OG1 3.43Å; R57-T60 CarbonylContact O-C 3.54Å; R57-T60 PolarHBondContact O-N 3.39Å; T60-D62 PolarHBondContact O-N 2.97Å; T60-L63 VanDerWaalsContact C-N 3.35Å; T60-L63 HydrophobicContact CG2-CB 4.46Å; T60-L63 CarbonylContact O-C 3.12Å; T60-L63 WeakPolarHBondContact O-CA 3.48Å; T60-L63 PolarHBondContact O-N 2.74Å; T60-E64 HydrophobicContact CG2-CG 4.26Å; T60-E64 WeakPolarHBondContact O-CA 3.32Å; T60-E64 WeakPolarHBondContact O-CB 3.49Å; T60-E64 WeakPolarHBondContact O-CG 3.16Å; T60-E64 PolarHBondContact O-N 2.79Å
61	E	59.1	Low	60.4	Low	82 Å²	82	96.7 Å²	96.7	38%	0.383	50%	0.495	S	S	.	.	H	α-helix	trans	-62	-29.7	162.5	-82.1	170.5	-171.6	0	0	109.2	R57 L63	R57-E61 VanDerWaalsContact CD-OE1 3.31Å; R57-E61 WeakPolarHBondContact CD-OE1 3.49Å; R57-E61 HydrophobicContact CG-CG 3.86Å; R57-E61 WeakPolarHBondContact CG-OE1 3.37Å; R57-E61 IonicContact CZ-OE1 3.42Å; R57-E61 IonicContact NE-OE1 3.18Å; R57-E61 PolarHBondContact NE-OE1 2.88Å; R57-E61 IonicContact NH2-OE1 2.77Å; R57-E61 WeakPolarHBondContact O-CA 3.3Å; R57-E61 WeakPolarHBondContact O-CB 3.26Å; R57-E61 VanDerWaalsContact O-CG 3.23Å; R57-E61 WeakPolarHBondContact O-CG 3.3Å; R57-E61 PolarHBondContact O-N 2.91Å; E61-L63 PolarHBondContact O-N 2.91Å
62	D	56.7	Low	59.8	Low	25 Å²	25	103.9 Å²	103.9	13%	0.134	53%	0.528	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-4.2	167.5	-92.2	12.3	0	0	0	112.5	L59 T60 L78 T79 K127	L59-D62 WeakPolarHBondContact O-CB 3.47Å; T60-D62 PolarHBondContact O-N 2.97Å; D62-L78 HydrophobicContact CB-CD2 3.56Å; D62-L78 VanDerWaalsContact CG-CD2 3.47Å; D62-L78 VanDerWaalsContact O-CD1 3.23Å; D62-L78 WeakPolarHBondContact O-CD1 3.39Å; D62-L78 WeakPolarHBondContact O-CD2 3.33Å; D62-L78 WeakPolarHBondContact OD1-CD2 3.31Å; D62-T79 PolarHBondContact OD2-N 2.95Å; D62-T79 VanDerWaalsContact OD2-N 3.12Å; D62-T79 PolarHBondContact OD2-OG1 3.38Å; D62-K127 IonicContact OD1-NZ 3.89Å
63	L	54.6	Low	59.3	Low	108 Å²	108	109.4 Å²	109.4	57%	0.565	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.8	-2	179.9	-65.7	169.1	0	0	0	114.6	T60 E61 E65	T60-L63 VanDerWaalsContact C-N 3.35Å; T60-L63 HydrophobicContact CG2-CB 4.46Å; T60-L63 CarbonylContact O-C 3.12Å; T60-L63 WeakPolarHBondContact O-CA 3.48Å; T60-L63 PolarHBondContact O-N 2.74Å; E61-L63 PolarHBondContact O-N 2.91Å; L63-E65 PolarHBondContact O-N 2.81Å
64	E	50.3	Low	59.1	Low	117 Å²	117	110.3 Å²	110.3	55%	0.547	56%	0.561	S	S	.	*	P	Polyproline II helix	trans	-73	116.3	-168.9	-101.1	179.1	-178.9	0	0	108.6	T60	T60-E64 HydrophobicContact CG2-CG 4.26Å; T60-E64 WeakPolarHBondContact O-CA 3.32Å; T60-E64 WeakPolarHBondContact O-CB 3.49Å; T60-E64 WeakPolarHBondContact O-CG 3.16Å; T60-E64 PolarHBondContact O-N 2.79Å
65	E	52.5	Low	59.4	Low	182 Å²	182	118 Å²	118	85%	0.85	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-50.4	121.9	171.2	-69.8	-173.2	155.4	0	0	108.6	L63 E67	L63-E65 PolarHBondContact O-N 2.81Å; E65-E67 PolarHBondContact O-N 3.46Å
66	P	49.6	Very low	59.9	Low	110 Å²	110	120.5 Å²	120.5	71%	0.714	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-64.1	117.4	-179.3	24	-30.5	0	0	0	108.4
67	E	54.6	Low	60.6	Low	126 Å²	126	119.5 Å²	119.5	59%	0.589	60%	0.604	S	S	*	*			trans	-36.8	136.8	160.8	-85.2	-111.4	127.6	0	0	110.2	E65 R69	E65-E67 PolarHBondContact O-N 3.46Å; E67-R69 HydrophobicContact CB-CG 4.43Å; E67-R69 PolarHBondContact O-N 3.22Å; E67-R69 IonicContact OE2-CZ 2.68Å; E67-R69 IonicContact OE2-NE 3.57Å; E67-R69 PolarHBondContact OE2-NE 3.44Å; E67-R69 IonicContact OE2-NH2 3.89Å; E67-R69 PolarHBondContact OE2-NH2 2.96Å
68	P	44.8	Very low	61.4	Low	127 Å²	127	115.6 Å²	115.6	83%	0.825	59%	0.591	S	S	*	*	S	Bend	trans	-74.4	78.9	-173.7	32	-33.9	0	0	0	109.6
69	R	50.3	Low	62.4	Low	196 Å²	196	115.8 Å²	115.8	74%	0.74	60%	0.595	S	S	*	*			trans	-119.2	92	173.4	-58.7	-172.6	-155	179.1	9.5	108	E67	E67-R69 HydrophobicContact CB-CG 4.43Å; E67-R69 PolarHBondContact O-N 3.22Å; E67-R69 IonicContact OE2-CZ 2.68Å; E67-R69 IonicContact OE2-NE 3.57Å; E67-R69 PolarHBondContact OE2-NE 3.44Å; E67-R69 IonicContact OE2-NH2 3.89Å; E67-R69 PolarHBondContact OE2-NH2 2.96Å
70	N	50.3	Low	63.4	Low	158 Å²	158	115.8 Å²	115.8	85%	0.845	59%	0.59	S	S	*	*	S	Bend	trans	56.6	80.6	163.7	-109.3	-16.7	0	0	0	116.9	E72	N70-E72 VanDerWaalsContact C-N 3.27Å; N70-E72 PolarHBondContact O-N 3.36Å
71	S	46.5	Very low	64.8	Low	126 Å²	126	116.1 Å²	116.1	88%	0.881	59%	0.589	S	S	*	*	S	Bend	trans	23	26	147.4	-163.5	0	0	0	0	123.3
72	E	57.2	Low	66.4	Low	176 Å²	176	112.4 Å²	112.4	82%	0.822	57%	0.572	S	S	*	*			trans	-111	108.6	155.4	-76.2	-176.2	171.8	0	0	106.7	N70 V74	N70-E72 VanDerWaalsContact C-N 3.27Å; N70-E72 PolarHBondContact O-N 3.36Å; E72-V74 PolarHBondContact O-N 3.42Å
73	Q	58.5	Low	68	Low	181 Å²	181	113.8 Å²	113.8	85%	0.846	58%	0.584	S	S	*	*			trans	-56.9	105.9	176.7	-71.8	172.5	2.6	0	0	108.4	K75	Q73-K75 PolarHBondContact O-N 3.41Å
74	V	69.3	Low	70	Confident	110 Å²	110	112.9 Å²	112.9	67%	0.667	58%	0.577	S	S	*	*			trans	-59.7	111.2	174.1	179.1	0	0	0	0	107	E72 I76	E72-V74 PolarHBondContact O-N 3.42Å; V74-I76 HydrophobicContact CG1-CG1 3.92Å; V74-I76 PolarHBondContact O-N 3.46Å
75	K	80	Confident	72.1	Confident	200 Å²	200	109.5 Å²	109.5	87%	0.87	57%	0.568	S	S	*	*			trans	-80.6	100.4	176.6	-66.7	-177.8	-178	178.8	0	108.2	Q73	Q73-K75 PolarHBondContact O-N 3.41Å
76	I	83.2	Confident	74.1	Confident	94 Å²	94	101.6 Å²	101.6	48%	0.482	53%	0.534	S	S	.	.			trans	-89.8	129.7	173.5	-52.8	179	0	0	0	108.1	V74 L78	V74-I76 HydrophobicContact CG1-CG1 3.92Å; V74-I76 PolarHBondContact O-N 3.46Å; I76-L78 HydrophobicContact CB-CD2 4.16Å; I76-L78 HydrophobicContact CG2-CD2 3.65Å
77	L	84.3	Confident	76.3	Confident	77 Å²	77	102.1 Å²	102.1	40%	0.403	52%	0.521	S	S	.	.			trans	-92.2	102.1	175.9	-174	63.4	0	0	0	109.2	D81 L82 Y120	L77-D81 HydrophobicContact CD1-CB 4.13Å; L77-L82 HydrophobicContact CD1-CG 4.44Å; L77-L82 HydrophobicContact CD2-CD1 4.41Å; L77-L82 HydrophobicContact CD2-CD2 3.64Å; L77-L82 HydrophobicContact CD2-CG 4.05Å; L77-L82 HydrophobicContact CG-CD1 4.35Å; L77-L82 HydrophobicContact CG-CD2 4.06Å; L77-L82 HydrophobicContact CG-CG 3.92Å; L77-Y120 HydrophobicContact CD2-CD1 3.89Å; L77-Y120 HydrophobicContact CD2-CE1 3.86Å
78	L	89.2	Confident	78.3	Confident	22 Å²	22	100.1 Å²	100.1	12%	0.115	51%	0.514	C	S	.	.			trans	-79.7	155.9	-171	-51.3	176.9	0	0	0	111.4	D62 I76 K80 D81 L82	D62-L78 HydrophobicContact CB-CD2 3.56Å; D62-L78 VanDerWaalsContact CG-CD2 3.47Å; D62-L78 VanDerWaalsContact O-CD1 3.23Å; D62-L78 WeakPolarHBondContact O-CD1 3.39Å; D62-L78 WeakPolarHBondContact O-CD2 3.33Å; D62-L78 WeakPolarHBondContact OD1-CD2 3.31Å; I76-L78 HydrophobicContact CB-CD2 4.16Å; I76-L78 HydrophobicContact CG2-CD2 3.65Å; L78-K80 HydrophobicContact CB-CG 3.96Å; L78-K80 HydrophobicContact CD1-CD 4.41Å; L78-K80 PolarHBondContact O-N 3.07Å; L78-D81 HydrophobicContact CB-CB 4.4Å; L78-D81 WeakPolarHBondContact CB-OD2 3.28Å; L78-D81 VanDerWaalsContact CG-OD2 3.28Å; L78-D81 WeakPolarHBondContact CG-OD2 3.2Å; L78-D81 PolarHBondContact N-OD2 3.41Å; L78-D81 VanDerWaalsContact N-OD2 3.16Å; L78-D81 WeakPolarHBondContact O-CB 3.27Å; L78-D81 PolarHBondContact O-N 2.85Å; L78-L82 PolarHBondContact O-N 3.34Å
79	T	89.1	Confident	80.8	Confident	39 Å²	39	96.6 Å²	96.6	24%	0.239	49%	0.488	C	S	.	.	H	α-helix	trans	-58.7	-37.4	177.3	-52.1	0	0	0	0	111.5	D62 L82 S83 Y124 T128	D62-T79 PolarHBondContact OD2-N 2.95Å; D62-T79 VanDerWaalsContact OD2-N 3.12Å; D62-T79 PolarHBondContact OD2-OG1 3.38Å; T79-L82 PolarHBondContact O-N 2.91Å; T79-S83 WeakPolarHBondContact O-CB 3.43Å; T79-S83 PolarHBondContact O-N 2.93Å; T79-Y124 HydrophobicContact CG2-CD2 4Å; T79-Y124 HydrophobicContact CG2-CE2 3.76Å; T79-T128 HydrophobicContact CG2-CG2 4.3Å
80	K	89.9	Confident	83	Confident	117 Å²	117	92.7 Å²	92.7	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-36.4	174.8	70.6	-173.2	-177	-159.2	0	112.8	L78 S83 E84	L78-K80 HydrophobicContact CB-CG 3.96Å; L78-K80 HydrophobicContact CD1-CD 4.41Å; L78-K80 PolarHBondContact O-N 3.07Å; K80-S83 PolarHBondContact O-N 3.33Å; K80-E84 WeakPolarHBondContact O-CB 3.48Å; K80-E84 PolarHBondContact O-N 2.99Å
81	D	91.2	Very high	85.3	Confident	66 Å²	66	89 Å²	89	35%	0.353	46%	0.458	S	S	.	.	H	α-helix	trans	-70.1	-41	179.7	-57.5	-29.4	0	0	0	110.3	L77 L78 E84 A85	L77-D81 HydrophobicContact CD1-CB 4.13Å; L78-D81 HydrophobicContact CB-CB 4.4Å; L78-D81 WeakPolarHBondContact CB-OD2 3.28Å; L78-D81 VanDerWaalsContact CG-OD2 3.28Å; L78-D81 WeakPolarHBondContact CG-OD2 3.2Å; L78-D81 PolarHBondContact N-OD2 3.41Å; L78-D81 VanDerWaalsContact N-OD2 3.16Å; L78-D81 WeakPolarHBondContact O-CB 3.27Å; L78-D81 PolarHBondContact O-N 2.85Å; D81-E84 PolarHBondContact O-N 3.39Å; D81-A85 VanDerWaalsContact O-CB 3.26Å; D81-A85 WeakPolarHBondContact O-CB 3.24Å; D81-A85 PolarHBondContact O-N 3.12Å
82	L	91.8	Very high	87.7	Confident	4 Å²	4	85.9 Å²	85.9	2%	0.021	43%	0.434	C	S	.	.	H	α-helix	trans	-63	-42.4	173.1	-75.7	167.2	0	0	0	112.2	L77 L78 T79 S86 Y120 I123 Y124 K127	L77-L82 HydrophobicContact CD1-CG 4.44Å; L77-L82 HydrophobicContact CD2-CD1 4.41Å; L77-L82 HydrophobicContact CD2-CD2 3.64Å; L77-L82 HydrophobicContact CD2-CG 4.05Å; L77-L82 HydrophobicContact CG-CD1 4.35Å; L77-L82 HydrophobicContact CG-CD2 4.06Å; L77-L82 HydrophobicContact CG-CG 3.92Å; L78-L82 PolarHBondContact O-N 3.34Å; T79-L82 PolarHBondContact O-N 2.91Å; L82-S86 VanDerWaalsContact O-CB 3.3Å; L82-S86 WeakPolarHBondContact O-CB 3.39Å; L82-S86 PolarHBondContact O-N 3.45Å; L82-S86 PolarHBondContact O-OG 2.85Å; L82-Y120 HydrophobicContact CD2-CD1 3.98Å; L82-Y120 HydrophobicContact CD2-CG 4.39Å; L82-I123 HydrophobicContact CD1-CB 4.41Å; L82-I123 HydrophobicContact CD1-CG2 3.73Å; L82-Y124 HydrophobicContact CB-CD2 3.9Å; L82-Y124 HydrophobicContact CB-CG 4.47Å; L82-K127 HydrophobicContact CD1-CD 4.14Å
83	S	91.7	Very high	89.6	Confident	54 Å²	54	79 Å²	79	38%	0.378	40%	0.404	S	S	.	.	H	α-helix	trans	-62.6	-46.8	176.9	-174	0	0	0	0	111.3	T79 K80 S86 R87	T79-S83 WeakPolarHBondContact O-CB 3.43Å; T79-S83 PolarHBondContact O-N 2.93Å; K80-S83 PolarHBondContact O-N 3.33Å; S83-S86 PolarHBondContact O-N 3.16Å; S83-R87 WeakPolarHBondContact O-CB 3.19Å; S83-R87 PolarHBondContact O-N 3.37Å
84	E	95.6	Very high	91.4	Very high	89 Å²	89	72.9 Å²	72.9	42%	0.416	38%	0.384	S	S	.	.	H	α-helix	trans	-65.6	-44.2	178.5	-179.9	63.2	-177.4	0	0	112	K80 D81 S86 R87 L88	K80-E84 WeakPolarHBondContact O-CB 3.48Å; K80-E84 PolarHBondContact O-N 2.99Å; D81-E84 PolarHBondContact O-N 3.39Å; E84-S86 VanDerWaalsContact C-N 3.32Å; E84-S86 PolarHBondContact O-N 2.95Å; E84-R87 VanDerWaalsContact CD-NH2 3.32Å; E84-R87 WeakPolarHBondContact O-CB 2.85Å; E84-R87 PolarHBondContact O-N 2.96Å; E84-R87 IonicContact OE1-CZ 3.49Å; E84-R87 IonicContact OE1-NE 3.57Å; E84-R87 IonicContact OE1-NH2 3.62Å; E84-R87 PolarHBondContact OE1-NH2 3.17Å; E84-R87 IonicContact OE2-CZ 2.83Å; E84-R87 IonicContact OE2-NE 3.64Å; E84-R87 PolarHBondContact OE2-NE 3.16Å; E84-R87 IonicContact OE2-NH2 3Å; E84-R87 PolarHBondContact OE2-NH2 3.35Å; E84-L88 HydrophobicContact CG-CD1 4.47Å; E84-L88 WeakPolarHBondContact O-CG 3.04Å; E84-L88 PolarHBondContact O-N 3.09Å
85	A	95	Very high	92.8	Very high	45 Å²	45	71.3 Å²	71.3	37%	0.372	37%	0.372	S	S	.	.	H	α-helix	trans	-60	-42.9	174.8	0	0	0	0	0	111.7	D81 L88 L89	D81-A85 VanDerWaalsContact O-CB 3.26Å; D81-A85 WeakPolarHBondContact O-CB 3.24Å; D81-A85 PolarHBondContact O-N 3.12Å; A85-L88 PolarHBondContact O-N 2.95Å; A85-L89 VanDerWaalsContact O-CG 3.3Å; A85-L89 WeakPolarHBondContact O-CG 3.31Å; A85-L89 PolarHBondContact O-N 3.47Å
86	S	93.3	Very high	93.7	Very high	17 Å²	17	64.5 Å²	64.5	12%	0.119	34%	0.344	C	S	.	.	H	α-helix	trans	-61.9	-45.4	176.6	-60	0	0	0	0	111.3	L82 S83 E84 L88 L89 E90	L82-S86 VanDerWaalsContact O-CB 3.3Å; L82-S86 WeakPolarHBondContact O-CB 3.39Å; L82-S86 PolarHBondContact O-N 3.45Å; L82-S86 PolarHBondContact O-OG 2.85Å; S83-S86 PolarHBondContact O-N 3.16Å; E84-S86 VanDerWaalsContact C-N 3.32Å; E84-S86 PolarHBondContact O-N 2.95Å; S86-L88 VanDerWaalsContact C-N 3.33Å; S86-L88 PolarHBondContact O-N 3.19Å; S86-L89 PolarHBondContact O-N 3.14Å; S86-E90 WeakPolarHBondContact O-CG 3.33Å; S86-E90 PolarHBondContact O-N 3.15Å
87	R	96.4	Very high	94.3	Very high	121 Å²	121	64 Å²	64	46%	0.457	35%	0.346	S	S	.	.	H	α-helix	trans	-58	-42.6	176.2	-171.2	-170.3	68.6	74.4	-1.1	112.3	S83 E84 N91	S83-R87 WeakPolarHBondContact O-CB 3.19Å; S83-R87 PolarHBondContact O-N 3.37Å; E84-R87 VanDerWaalsContact CD-NH2 3.32Å; E84-R87 WeakPolarHBondContact O-CB 2.85Å; E84-R87 PolarHBondContact O-N 2.96Å; E84-R87 IonicContact OE1-CZ 3.49Å; E84-R87 IonicContact OE1-NE 3.57Å; E84-R87 IonicContact OE1-NH2 3.62Å; E84-R87 PolarHBondContact OE1-NH2 3.17Å; E84-R87 IonicContact OE2-CZ 2.83Å; E84-R87 IonicContact OE2-NE 3.64Å; E84-R87 PolarHBondContact OE2-NE 3.16Å; E84-R87 IonicContact OE2-NH2 3Å; E84-R87 PolarHBondContact OE2-NH2 3.35Å; R87-N91 WeakPolarHBondContact O-CB 3.44Å; R87-N91 PolarHBondContact O-N 2.88Å
88	L	97.6	Very high	95	Very high	83 Å²	83	67 Å²	67	44%	0.435	36%	0.358	S	S	.	.	H	α-helix	trans	-66	-40.1	177.5	-69.7	171.5	0	0	0	112.3	E84 A85 S86 T92	E84-L88 HydrophobicContact CG-CD1 4.47Å; E84-L88 WeakPolarHBondContact O-CG 3.04Å; E84-L88 PolarHBondContact O-N 3.09Å; A85-L88 PolarHBondContact O-N 2.95Å; S86-L88 VanDerWaalsContact C-N 3.33Å; S86-L88 PolarHBondContact O-N 3.19Å; L88-T92 PolarHBondContact O-N 3.4Å; L88-T92 PolarHBondContact O-OG1 3.04Å
89	L	96.5	Very high	95.4	Very high	54 Å²	54	72.7 Å²	72.7	28%	0.283	38%	0.382	S	S	.	.	H	α-helix	trans	-66.4	-44.8	176.7	-71.1	165	0	0	0	111.6	A85 S86 N91 T92 V93 I113 Y117	A85-L89 VanDerWaalsContact O-CG 3.3Å; A85-L89 WeakPolarHBondContact O-CG 3.31Å; A85-L89 PolarHBondContact O-N 3.47Å; S86-L89 PolarHBondContact O-N 3.14Å; L89-N91 PolarHBondContact O-N 2.88Å; L89-T92 WeakPolarHBondContact O-CB 3.44Å; L89-T92 PolarHBondContact O-N 3.48Å; L89-V93 WeakPolarHBondContact O-CG2 3.44Å; L89-V93 PolarHBondContact O-N 3.02Å; L89-I113 HydrophobicContact CD2-CG2 3.91Å; L89-Y117 HydrophobicContact CB-CD1 4.47Å; L89-Y117 HydrophobicContact CB-CE1 4.29Å; L89-Y117 HydrophobicContact CD1-CD1 3.81Å; L89-Y117 HydrophobicContact CD1-CD2 4.1Å; L89-Y117 HydrophobicContact CD1-CE1 4.34Å; L89-Y117 HydrophobicContact CD1-CG 3.69Å
90	E	96.1	Very high	95.8	Very high	113 Å²	113	72.3 Å²	72.3	53%	0.528	38%	0.378	S	S	.	.	H	α-helix	trans	-61.3	-43.6	176	-73.1	174.7	-176.8	0	0	111.9	S86 T92 V93 A94	S86-E90 WeakPolarHBondContact O-CG 3.33Å; S86-E90 PolarHBondContact O-N 3.15Å; E90-T92 VanDerWaalsContact C-N 3.3Å; E90-T92 PolarHBondContact O-N 3.47Å; E90-V93 PolarHBondContact O-N 3.26Å; E90-A94 WeakPolarHBondContact O-CB 3.49Å; E90-A94 PolarHBondContact O-N 3.34Å
91	N	97.8	Very high	96.1	Very high	80 Å²	80	72 Å²	72	43%	0.428	39%	0.391	S	S	.	.	H	α-helix	trans	-61.8	-39.4	174.4	-175.1	50.3	0	0	0	111.9	R87 L89 A94 I95	R87-N91 WeakPolarHBondContact O-CB 3.44Å; R87-N91 PolarHBondContact O-N 2.88Å; L89-N91 PolarHBondContact O-N 2.88Å; N91-A94 PolarHBondContact O-N 3.25Å; N91-I95 VanDerWaalsContact O-CG1 3.27Å; N91-I95 WeakPolarHBondContact O-CG1 3.19Å; N91-I95 PolarHBondContact O-N 3.35Å
92	T	97.3	Very high	96.5	Very high	61 Å²	61	74.3 Å²	74.3	37%	0.374	40%	0.399	S	S	.	.	H	α-helix	trans	-61.4	-48	175.3	-58.6	0	0	0	0	111	L88 L89 E90 A94 I95 L96 I113	L88-T92 PolarHBondContact O-N 3.4Å; L88-T92 PolarHBondContact O-OG1 3.04Å; L89-T92 WeakPolarHBondContact O-CB 3.44Å; L89-T92 PolarHBondContact O-N 3.48Å; E90-T92 VanDerWaalsContact C-N 3.3Å; E90-T92 PolarHBondContact O-N 3.47Å; T92-A94 VanDerWaalsContact C-N 3.33Å; T92-A94 PolarHBondContact O-N 3.14Å; T92-I95 PolarHBondContact O-N 3.42Å; T92-L96 HydrophobicContact CG2-CD1 4.17Å; T92-L96 HydrophobicContact CG2-CG 4.48Å; T92-L96 WeakPolarHBondContact O-CG 3.44Å; T92-L96 PolarHBondContact O-N 3.38Å; T92-I113 HydrophobicContact CG2-CD1 4.25Å
93	V	97.2	Very high	96.7	Very high	31 Å²	31	81.6 Å²	81.6	19%	0.188	43%	0.434	C	S	.	.	H	α-helix	trans	-59.2	-43.9	176.9	166.9	0	0	0	0	111.2	L89 E90 T97 N110 I113	L89-V93 WeakPolarHBondContact O-CG2 3.44Å; L89-V93 PolarHBondContact O-N 3.02Å; E90-V93 PolarHBondContact O-N 3.26Å; V93-T97 WeakPolarHBondContact O-CB 3.46Å; V93-T97 PolarHBondContact O-N 3.35Å; V93-T97 PolarHBondContact O-OG1 3.24Å; V93-N110 HydrophobicContact CG1-CB 4.17Å; V93-N110 HydrophobicContact CG2-CB 4.44Å; V93-I113 HydrophobicContact CG2-CB 4.47Å; V93-I113 HydrophobicContact CG2-CD1 4.44Å; V93-I113 HydrophobicContact CG2-CG2 4.08Å
94	A	97.9	Very high	97	Very high	53 Å²	53	86.9 Å²	86.9	44%	0.438	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-48.2	177.2	0	0	0	0	0	112.1	E90 N91 T92 L96 T97 E98	E90-A94 WeakPolarHBondContact O-CB 3.49Å; E90-A94 PolarHBondContact O-N 3.34Å; N91-A94 PolarHBondContact O-N 3.25Å; T92-A94 VanDerWaalsContact C-N 3.33Å; T92-A94 PolarHBondContact O-N 3.14Å; A94-L96 PolarHBondContact O-N 3.33Å; A94-T97 PolarHBondContact O-N 3.28Å; A94-E98 WeakPolarHBondContact O-CB 3.29Å; A94-E98 PolarHBondContact O-N 3.12Å
95	I	98	Very high	97.1	Very high	78 Å²	78	89 Å²	89	40%	0.4	46%	0.456	S	S	.	.	H	α-helix	trans	-60.6	-47.1	178.9	-69.6	165.7	0	0	0	111.1	N91 T92 T97 E98 K99	N91-I95 VanDerWaalsContact O-CG1 3.27Å; N91-I95 WeakPolarHBondContact O-CG1 3.19Å; N91-I95 PolarHBondContact O-N 3.35Å; T92-I95 PolarHBondContact O-N 3.42Å; I95-T97 VanDerWaalsContact C-N 3.27Å; I95-T97 PolarHBondContact O-N 2.97Å; I95-E98 PolarHBondContact O-N 3.44Å; I95-K99 HydrophobicContact CG2-CG 4.07Å; I95-K99 VanDerWaalsContact O-CB 3.3Å; I95-K99 WeakPolarHBondContact O-CB 3.1Å; I95-K99 WeakPolarHBondContact O-CG 3.23Å; I95-K99 PolarHBondContact O-N 2.96Å
96	L	97.6	Very high	97.2	Very high	56 Å²	56	87.1 Å²	87.1	29%	0.293	44%	0.44	S	S	.	.	H	α-helix	trans	-63.5	-36.1	179.4	-67.8	178.7	0	0	0	111.9	T92 A94 D100 S106 V109 I113	T92-L96 HydrophobicContact CG2-CD1 4.17Å; T92-L96 HydrophobicContact CG2-CG 4.48Å; T92-L96 WeakPolarHBondContact O-CG 3.44Å; T92-L96 PolarHBondContact O-N 3.38Å; A94-L96 PolarHBondContact O-N 3.33Å; L96-D100 WeakPolarHBondContact O-CB 3.41Å; L96-D100 PolarHBondContact O-N 3.07Å; L96-S106 VanDerWaalsContact O-CB 3.25Å; L96-S106 WeakPolarHBondContact O-CB 3.46Å; L96-V109 HydrophobicContact CD1-CG1 3.72Å; L96-I113 HydrophobicContact CD1-CD1 4.12Å
97	T	97.4	Very high	97.5	Very high	85 Å²	85	88 Å²	88	52%	0.521	45%	0.448	S	S	.	.	H	α-helix	trans	-67.8	-40.5	177.7	-55.9	0	0	0	0	111.5	V93 A94 I95 N110	V93-T97 WeakPolarHBondContact O-CB 3.46Å; V93-T97 PolarHBondContact O-N 3.35Å; V93-T97 PolarHBondContact O-OG1 3.24Å; A94-T97 PolarHBondContact O-N 3.28Å; I95-T97 VanDerWaalsContact C-N 3.27Å; I95-T97 PolarHBondContact O-N 2.97Å; T97-N110 PolarHBondContact OG1-ND2 2.97Å
98	E	98.1	Very high	97.5	Very high	139 Å²	139	87.8 Å²	87.8	65%	0.65	45%	0.453	S	S	*	.	H	α-helix	trans	-81.2	-39.5	-176.5	-164.9	-160.9	152	0	0	113	A94 I95	A94-E98 WeakPolarHBondContact O-CB 3.29Å; A94-E98 PolarHBondContact O-N 3.12Å; I95-E98 PolarHBondContact O-N 3.44Å
99	K	97.6	Very high	97.5	Very high	141 Å²	141	86.1 Å²	86.1	61%	0.613	45%	0.446	S	S	*	.	H	α-helix	trans	-97.9	-18.6	-168.4	-55	-53.4	-175.9	-166.4	0	114.2	I95 S101	I95-K99 HydrophobicContact CG2-CG 4.07Å; I95-K99 VanDerWaalsContact O-CB 3.3Å; I95-K99 WeakPolarHBondContact O-CB 3.1Å; I95-K99 WeakPolarHBondContact O-CG 3.23Å; I95-K99 PolarHBondContact O-N 2.96Å; K99-S101 PolarHBondContact O-N 3.39Å
100	D	97.4	Very high	97.6	Very high	32 Å²	32	84.4 Å²	84.4	17%	0.171	44%	0.437	C	S	.	.			trans	-82.7	112.9	179.3	-165.1	-9.9	0	0	0	111.7	L96 Q102 R105	L96-D100 WeakPolarHBondContact O-CB 3.41Å; L96-D100 PolarHBondContact O-N 3.07Å; D100-Q102 PolarHBondContact O-N 3.05Å; D100-Q102 WeakPolarHBondContact OD1-CB 3.28Å; D100-Q102 PolarHBondContact OD1-N 3.18Å; D100-R105 IonicContact OD1-CZ 3.9Å; D100-R105 IonicContact OD1-NE 2.97Å; D100-R105 IonicContact OD1-NH2 2.69Å; D100-R105 PolarHBondContact OD1-NH2 3.24Å; D100-R105 IonicContact OD2-CZ 3.56Å; D100-R105 IonicContact OD2-NE 2.73Å; D100-R105 PolarHBondContact OD2-NE 3.4Å; D100-R105 IonicContact OD2-NH2 3.31Å; D100-R105 PolarHBondContact OD2-NH2 3.41Å
101	S	97.7	Very high	97.6	Very high	111 Å²	111	88.3 Å²	88.3	78%	0.776	45%	0.447	S	S	*	.	S	Bend	trans	-58.9	-23.3	171.5	60.9	0	0	0	0	114.4	K99	K99-S101 PolarHBondContact O-N 3.39Å
102	Q	97.7	Very high	97.6	Very high	113 Å²	113	89.8 Å²	89.8	53%	0.528	45%	0.453	S	S	.	.			trans	-97.8	88	177.9	-68.5	-71.4	-18.2	0	0	109.7	D100 E104 R105 S106	D100-Q102 PolarHBondContact O-N 3.05Å; D100-Q102 WeakPolarHBondContact OD1-CB 3.28Å; D100-Q102 PolarHBondContact OD1-N 3.18Å; Q102-E104 VanDerWaalsContact C-N 3.3Å; Q102-E104 PolarHBondContact O-N 2.98Å; Q102-R105 HydrophobicContact CB-CB 3.97Å; Q102-R105 WeakPolarHBondContact O-CB 3.22Å; Q102-R105 PolarHBondContact O-N 3.47Å; Q102-R105 VanDerWaalsContact O-N 3.11Å; Q102-S106 PolarHBondContact O-N 2.98Å; Q102-S106 VanDerWaalsContact O-N 3.16Å
103	Q	96.8	Very high	97.6	Very high	158 Å²	158	88.5 Å²	88.5	74%	0.738	44%	0.443	S	S	*	.	H	α-helix	trans	-60.1	-35.4	-174.3	-171	179.6	10	0	0	113.8	R105 S106 A107	Q103-R105 VanDerWaalsContact C-N 3.32Å; Q103-R105 PolarHBondContact O-N 3.38Å; Q103-S106 PolarHBondContact O-N 2.99Å; Q103-S106 PolarHBondContact O-OG 2.86Å; Q103-S106 VanDerWaalsContact O-OG 3.07Å; Q103-A107 WeakPolarHBondContact O-CB 3.33Å; Q103-A107 PolarHBondContact O-N 2.88Å
104	E	97.9	Very high	97.5	Very high	165 Å²	165	89.4 Å²	89.4	77%	0.771	45%	0.449	S	S	*	.	H	α-helix	trans	-64.8	-39.6	178.1	-176.2	171.7	-157.7	0	0	111.5	Q102 A107 Q108	Q102-E104 VanDerWaalsContact C-N 3.3Å; Q102-E104 PolarHBondContact O-N 2.98Å; E104-A107 PolarHBondContact O-N 3.34Å; E104-Q108 WeakPolarHBondContact O-CB 3.43Å; E104-Q108 PolarHBondContact O-N 3.27Å
105	R	98	Very high	97.4	Very high	133 Å²	133	89.2 Å²	89.2	50%	0.502	45%	0.452	S	S	.	.	H	α-helix	trans	-64.5	-49.5	176.6	-179.5	174.9	63	-167.5	-3.9	111.1	D100 Q102 Q103 A107 Q108 V109	D100-R105 IonicContact OD1-CZ 3.9Å; D100-R105 IonicContact OD1-NE 2.97Å; D100-R105 IonicContact OD1-NH2 2.69Å; D100-R105 PolarHBondContact OD1-NH2 3.24Å; D100-R105 IonicContact OD2-CZ 3.56Å; D100-R105 IonicContact OD2-NE 2.73Å; D100-R105 PolarHBondContact OD2-NE 3.4Å; D100-R105 IonicContact OD2-NH2 3.31Å; D100-R105 PolarHBondContact OD2-NH2 3.41Å; Q102-R105 HydrophobicContact CB-CB 3.97Å; Q102-R105 WeakPolarHBondContact O-CB 3.22Å; Q102-R105 PolarHBondContact O-N 3.47Å; Q102-R105 VanDerWaalsContact O-N 3.11Å; Q103-R105 VanDerWaalsContact C-N 3.32Å; Q103-R105 PolarHBondContact O-N 3.38Å; R105-A107 VanDerWaalsContact C-N 3.34Å; R105-A107 PolarHBondContact O-N 3.2Å; R105-Q108 PolarHBondContact O-N 2.68Å; R105-V109 WeakPolarHBondContact O-CG2 3.49Å; R105-V109 PolarHBondContact O-N 2.97Å
106	S	97.9	Very high	97.3	Very high	5 Å²	5	89.1 Å²	89.1	4%	0.035	46%	0.463	C	S	.	.	H	α-helix	trans	-63.7	-40.6	178.3	60.3	0	0	0	0	111.7	L96 Q102 Q103 Q108 V109 N110	L96-S106 VanDerWaalsContact O-CB 3.25Å; L96-S106 WeakPolarHBondContact O-CB 3.46Å; Q102-S106 PolarHBondContact O-N 2.98Å; Q102-S106 VanDerWaalsContact O-N 3.16Å; Q103-S106 PolarHBondContact O-N 2.99Å; Q103-S106 PolarHBondContact O-OG 2.86Å; Q103-S106 VanDerWaalsContact O-OG 3.07Å; S106-Q108 PolarHBondContact O-N 3.42Å; S106-V109 PolarHBondContact O-N 2.89Å; S106-N110 VanDerWaalsContact O-CB 3.31Å; S106-N110 WeakPolarHBondContact O-CB 3.43Å; S106-N110 PolarHBondContact O-N 3.35Å; S106-N110 PolarHBondContact O-ND2 3.16Å; S106-N110 PolarHBondContact O-OD1 2.84Å
107	A	98	Very high	97.1	Very high	35 Å²	35	87.3 Å²	87.3	29%	0.289	45%	0.452	S	S	.	.	H	α-helix	trans	-61.1	-42.8	175	0	0	0	0	0	112.5	Q103 E104 R105 R111	Q103-A107 WeakPolarHBondContact O-CB 3.33Å; Q103-A107 PolarHBondContact O-N 2.88Å; E104-A107 PolarHBondContact O-N 3.34Å; R105-A107 VanDerWaalsContact C-N 3.34Å; R105-A107 PolarHBondContact O-N 3.2Å; A107-R111 VanDerWaalsContact O-CG 3.32Å; A107-R111 WeakPolarHBondContact O-CG 3.19Å; A107-R111 PolarHBondContact O-N 3.48Å; A107-R111 VanDerWaalsContact O-N 3.1Å
108	Q	98.3	Very high	96.9	Very high	118 Å²	118	85.6 Å²	85.6	55%	0.551	44%	0.444	S	S	*	.	H	α-helix	trans	-61.7	-47.7	176.5	-174.2	-177	9.2	0	0	111.3	E104 R105 S106 R111 M112	E104-Q108 WeakPolarHBondContact O-CB 3.43Å; E104-Q108 PolarHBondContact O-N 3.27Å; R105-Q108 PolarHBondContact O-N 2.68Å; S106-Q108 PolarHBondContact O-N 3.42Å; Q108-R111 PolarHBondContact O-N 3.15Å; Q108-M112 HydrophobicContact CG-CE 4.32Å; Q108-M112 WeakPolarHBondContact O-CG 3.18Å; Q108-M112 PolarHBondContact O-N 3.16Å; Q108-M112 VanDerWaalsContact O-N 3.17Å
109	V	97.5	Very high	96.8	Very high	48 Å²	48	81.8 Å²	81.8	29%	0.291	43%	0.432	S	S	.	.	H	α-helix	trans	-63.6	-44.9	178.9	173.5	0	0	0	0	111.4	L96 R105 S106 R111 M112 I113	L96-V109 HydrophobicContact CD1-CG1 3.72Å; R105-V109 WeakPolarHBondContact O-CG2 3.49Å; R105-V109 PolarHBondContact O-N 2.97Å; S106-V109 PolarHBondContact O-N 2.89Å; V109-R111 VanDerWaalsContact C-N 3.29Å; V109-R111 PolarHBondContact O-N 3.41Å; V109-M112 HydrophobicContact CB-CE 4.41Å; V109-M112 HydrophobicContact CG2-CE 4.03Å; V109-M112 WeakPolarHBondContact O-CB 3.17Å; V109-M112 PolarHBondContact O-N 3.22Å; V109-I113 HydrophobicContact CG1-CD1 3.74Å; V109-I113 HydrophobicContact CG1-CG1 4.21Å; V109-I113 WeakPolarHBondContact O-CG1 2.99Å; V109-I113 PolarHBondContact O-N 3.45Å
110	N	97.3	Very high	96.6	Very high	17 Å²	17	80.9 Å²	80.9	9%	0.091	43%	0.426	C	S	.	.	H	α-helix	trans	-62.2	-36.6	-179.8	-69.4	-16	0	0	0	112.4	V93 T97 S106 T114	V93-N110 HydrophobicContact CG1-CB 4.17Å; V93-N110 HydrophobicContact CG2-CB 4.44Å; T97-N110 PolarHBondContact OG1-ND2 2.97Å; S106-N110 VanDerWaalsContact O-CB 3.31Å; S106-N110 WeakPolarHBondContact O-CB 3.43Å; S106-N110 PolarHBondContact O-N 3.35Å; S106-N110 PolarHBondContact O-ND2 3.16Å; S106-N110 PolarHBondContact O-OD1 2.84Å; N110-T114 WeakPolarHBondContact O-CB 3.28Å; N110-T114 PolarHBondContact O-N 2.92Å; N110-T114 PolarHBondContact O-OG1 2.76Å
111	R	97.4	Very high	96.4	Very high	195 Å²	195	83.4 Å²	83.4	74%	0.736	43%	0.433	S	S	*	.	H	α-helix	trans	-63.2	-43.7	172.2	-72.8	173.7	-172.2	169.8	4.4	111.7	A107 Q108 V109 G115	A107-R111 VanDerWaalsContact O-CG 3.32Å; A107-R111 WeakPolarHBondContact O-CG 3.19Å; A107-R111 PolarHBondContact O-N 3.48Å; A107-R111 VanDerWaalsContact O-N 3.1Å; Q108-R111 PolarHBondContact O-N 3.15Å; V109-R111 VanDerWaalsContact C-N 3.29Å; V109-R111 PolarHBondContact O-N 3.41Å; R111-G115 PolarHBondContact O-N 2.86Å
112	M	97.4	Very high	96.3	Very high	111 Å²	111	84 Å²	84	55%	0.547	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-45.1	177.7	-68.7	-173.8	-65.1	0	0	111.9	Q108 V109 G115 A116	Q108-M112 HydrophobicContact CG-CE 4.32Å; Q108-M112 WeakPolarHBondContact O-CG 3.18Å; Q108-M112 PolarHBondContact O-N 3.16Å; Q108-M112 VanDerWaalsContact O-N 3.17Å; V109-M112 HydrophobicContact CB-CE 4.41Å; V109-M112 HydrophobicContact CG2-CE 4.03Å; V109-M112 WeakPolarHBondContact O-CB 3.17Å; V109-M112 PolarHBondContact O-N 3.22Å; M112-G115 PolarHBondContact O-N 3.16Å; M112-A116 WeakPolarHBondContact O-CB 3.1Å; M112-A116 PolarHBondContact O-N 3.24Å
113	I	96.3	Very high	96.1	Very high	35 Å²	35	82.1 Å²	82.1	18%	0.179	42%	0.416	C	S	.	.	H	α-helix	trans	-56.8	-55.9	175.6	-68.5	170.5	0	0	0	109.2	L89 T92 V93 L96 V109 G115 A116 Y117	L89-I113 HydrophobicContact CD2-CG2 3.91Å; T92-I113 HydrophobicContact CG2-CD1 4.25Å; V93-I113 HydrophobicContact CG2-CB 4.47Å; V93-I113 HydrophobicContact CG2-CD1 4.44Å; V93-I113 HydrophobicContact CG2-CG2 4.08Å; L96-I113 HydrophobicContact CD1-CD1 4.12Å; V109-I113 HydrophobicContact CG1-CD1 3.74Å; V109-I113 HydrophobicContact CG1-CG1 4.21Å; V109-I113 WeakPolarHBondContact O-CG1 2.99Å; V109-I113 PolarHBondContact O-N 3.45Å; I113-G115 VanDerWaalsContact C-N 3.32Å; I113-G115 PolarHBondContact O-N 3.49Å; I113-A116 PolarHBondContact O-N 3.2Å; I113-A116 VanDerWaalsContact O-N 3.07Å; I113-Y117 HydrophobicContact CG2-CD1 4.07Å; I113-Y117 HydrophobicContact CG2-CE1 4.21Å; I113-Y117 WeakPolarHBondContact O-CD1 3.2Å; I113-Y117 PolarHBondContact O-N 3.05Å; I113-Y117 VanDerWaalsContact O-N 3.14Å
114	T	94.6	Very high	95.8	Very high	50 Å²	50	78.1 Å²	78.1	31%	0.307	40%	0.395	S	S	.	.	H	α-helix	trans	-60.8	-40	-176.3	-52.2	0	0	0	0	112.6	N110 Y117 S118	N110-T114 WeakPolarHBondContact O-CB 3.28Å; N110-T114 PolarHBondContact O-N 2.92Å; N110-T114 PolarHBondContact O-OG1 2.76Å; T114-Y117 HydrophobicContact CG2-CE1 4.4Å; T114-S118 PolarHBondContact O-N 2.76Å
115	G	96.6	Very high	95.5	Very high	49 Å²	49	74.3 Å²	74.3	51%	0.505	38%	0.377	S	S	.	.	H	α-helix	trans	-67.8	-37.9	174.8	0	0	0	0	0	112.9	R111 M112 I113 S118	R111-G115 PolarHBondContact O-N 2.86Å; M112-G115 PolarHBondContact O-N 3.16Å; I113-G115 VanDerWaalsContact C-N 3.32Å; I113-G115 PolarHBondContact O-N 3.49Å; G115-S118 PolarHBondContact O-OG 3.41Å
116	A	95.5	Very high	95.2	Very high	76 Å²	76	71.1 Å²	71.1	63%	0.628	38%	0.375	S	S	*	.	H	α-helix	trans	-70.4	-31.1	-177.4	0	0	0	0	0	113.4	M112 I113	M112-A116 WeakPolarHBondContact O-CB 3.1Å; M112-A116 PolarHBondContact O-N 3.24Å; I113-A116 PolarHBondContact O-N 3.2Å; I113-A116 VanDerWaalsContact O-N 3.07Å
117	Y	93.7	Very high	94.7	Very high	17 Å²	17	74.1 Å²	74.1	7%	0.067	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	2	-179.8	84.6	-101	0	0	0	114.5	L89 I113 T114 C119 Y120 R121	L89-Y117 HydrophobicContact CB-CD1 4.47Å; L89-Y117 HydrophobicContact CB-CE1 4.29Å; L89-Y117 HydrophobicContact CD1-CD1 3.81Å; L89-Y117 HydrophobicContact CD1-CD2 4.1Å; L89-Y117 HydrophobicContact CD1-CE1 4.34Å; L89-Y117 HydrophobicContact CD1-CG 3.69Å; I113-Y117 HydrophobicContact CG2-CD1 4.07Å; I113-Y117 HydrophobicContact CG2-CE1 4.21Å; I113-Y117 WeakPolarHBondContact O-CD1 3.2Å; I113-Y117 PolarHBondContact O-N 3.05Å; I113-Y117 VanDerWaalsContact O-N 3.14Å; T114-Y117 HydrophobicContact CG2-CE1 4.4Å; Y117-C119 PolarHBondContact O-N 3.47Å; Y117-C119 VanDerWaalsContact O-N 3.16Å; Y117-Y120 PolarHBondContact O-N 3.35Å; Y117-R121 HydrophobicContact CD2-CB 4.34Å; Y117-R121 HydrophobicContact CE2-CB 4.28Å; Y117-R121 PolarHBondContact O-N 2.82Å; Y117-R121 VanDerWaalsContact O-N 3.15Å; Y117-R121 PolarHBondContact OH-NH2 2.91Å
118	S	94.5	Very high	94.2	Very high	49 Å²	49	74.8 Å²	74.8	34%	0.343	39%	0.388	S	S	.	.	H	α-helix	trans	-56	-37.2	-175.3	69.3	0	0	0	0	113	T114 G115 Y120 R121 E122	T114-S118 PolarHBondContact O-N 2.76Å; G115-S118 PolarHBondContact O-OG 3.41Å; S118-Y120 VanDerWaalsContact C-N 3.31Å; S118-Y120 PolarHBondContact O-N 2.8Å; S118-R121 WeakPolarHBondContact O-CB 3.25Å; S118-R121 PolarHBondContact O-N 3.07Å; S118-R121 VanDerWaalsContact O-N 3.14Å; S118-E122 WeakPolarHBondContact O-CG 3.41Å; S118-E122 PolarHBondContact O-N 3.45Å
119	C	94.6	Very high	93.9	Very high	60 Å²	60	75.6 Å²	75.6	41%	0.405	39%	0.386	S	S	.	.	H	α-helix	trans	-60.7	-37.6	176.4	59.7	0	0	0	0	113	Y117 E122 I123	Y117-C119 PolarHBondContact O-N 3.47Å; Y117-C119 VanDerWaalsContact O-N 3.16Å; C119-E122 PolarHBondContact O-N 3.47Å; C119-I123 WeakPolarHBondContact O-CG1 3.39Å; C119-I123 PolarHBondContact O-N 3.35Å; C119-I123 VanDerWaalsContact O-N 3.12Å
120	Y	94.5	Very high	93.3	Very high	122 Å²	122	77.4 Å²	77.4	48%	0.478	39%	0.391	S	S	.	.	H	α-helix	trans	-73	-33.3	176.1	-68.8	-66.9	0	0	0	112	L77 L82 Y117 S118 I123 Y124	L77-Y120 HydrophobicContact CD2-CD1 3.89Å; L77-Y120 HydrophobicContact CD2-CE1 3.86Å; L82-Y120 HydrophobicContact CD2-CD1 3.98Å; L82-Y120 HydrophobicContact CD2-CG 4.39Å; Y117-Y120 PolarHBondContact O-N 3.35Å; S118-Y120 VanDerWaalsContact C-N 3.31Å; S118-Y120 PolarHBondContact O-N 2.8Å; Y120-I123 HydrophobicContact CD1-CD1 4.1Å; Y120-I123 PolarHBondContact O-N 3.06Å; Y120-Y124 PolarHBondContact O-N 2.96Å
121	R	92.9	Very high	92.7	Very high	84 Å²	84	78.7 Å²	78.7	32%	0.317	40%	0.404	S	S	.	.	H	α-helix	trans	-63	-44.9	171.8	-170.8	-171.6	-67.9	164.3	-5.1	110.9	Y117 S118 I123 Y124 E125	Y117-R121 HydrophobicContact CD2-CB 4.34Å; Y117-R121 HydrophobicContact CE2-CB 4.28Å; Y117-R121 PolarHBondContact O-N 2.82Å; Y117-R121 VanDerWaalsContact O-N 3.15Å; Y117-R121 PolarHBondContact OH-NH2 2.91Å; S118-R121 WeakPolarHBondContact O-CB 3.25Å; S118-R121 PolarHBondContact O-N 3.07Å; S118-R121 VanDerWaalsContact O-N 3.14Å; R121-I123 VanDerWaalsContact C-N 3.3Å; R121-I123 PolarHBondContact O-N 2.95Å; R121-Y124 WeakPolarHBondContact O-CB 3.44Å; R121-Y124 PolarHBondContact O-N 3.11Å; R121-Y124 VanDerWaalsContact O-N 3.16Å; R121-E125 WeakPolarHBondContact CD-OE1 3.06Å; R121-E125 HydrophobicContact CG-CG 4.38Å; R121-E125 WeakPolarHBondContact CG-OE1 3.47Å; R121-E125 WeakPolarHBondContact O-CB 3.24Å; R121-E125 WeakPolarHBondContact O-CG 3.24Å; R121-E125 PolarHBondContact O-N 2.82Å
122	E	94.9	Very high	92.2	Very high	125 Å²	125	74 Å²	74	58%	0.584	39%	0.391	S	S	*	.	H	α-helix	trans	-59.2	-40.6	175.7	-71.5	170.4	-162.3	0	0	112	S118 C119 S126	S118-E122 WeakPolarHBondContact O-CG 3.41Å; S118-E122 PolarHBondContact O-N 3.45Å; C119-E122 PolarHBondContact O-N 3.47Å; E122-S126 VanDerWaalsContact O-CB 3.28Å; E122-S126 WeakPolarHBondContact O-CB 3.38Å; E122-S126 PolarHBondContact O-N 3.31Å
123	I	92.8	Very high	91.7	Very high	72 Å²	72	74 Å²	74	37%	0.369	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-46.3	174.5	-66.8	159.9	0	0	0	110.9	L82 C119 Y120 R121 S126 K127	L82-I123 HydrophobicContact CD1-CB 4.41Å; L82-I123 HydrophobicContact CD1-CG2 3.73Å; C119-I123 WeakPolarHBondContact O-CG1 3.39Å; C119-I123 PolarHBondContact O-N 3.35Å; C119-I123 VanDerWaalsContact O-N 3.12Å; Y120-I123 HydrophobicContact CD1-CD1 4.1Å; Y120-I123 PolarHBondContact O-N 3.06Å; R121-I123 VanDerWaalsContact C-N 3.3Å; R121-I123 PolarHBondContact O-N 2.95Å; I123-S126 PolarHBondContact O-N 2.82Å; I123-K127 HydrophobicContact CG2-CD 4.29Å; I123-K127 PolarHBondContact O-N 3.33Å
124	Y	91.1	Very high	91.1	Very high	74 Å²	74	72.4 Å²	72.4	29%	0.29	38%	0.381	S	S	.	.	H	α-helix	trans	-62.2	-46.9	178.3	176.2	-99.4	0	0	0	112.1	T79 L82 Y120 R121 S126 K127 T128	T79-Y124 HydrophobicContact CG2-CD2 4Å; T79-Y124 HydrophobicContact CG2-CE2 3.76Å; L82-Y124 HydrophobicContact CB-CD2 3.9Å; L82-Y124 HydrophobicContact CB-CG 4.47Å; Y120-Y124 PolarHBondContact O-N 2.96Å; R121-Y124 WeakPolarHBondContact O-CB 3.44Å; R121-Y124 PolarHBondContact O-N 3.11Å; R121-Y124 VanDerWaalsContact O-N 3.16Å; Y124-S126 VanDerWaalsContact C-N 3.29Å; Y124-S126 PolarHBondContact O-N 3Å; Y124-K127 PolarHBondContact O-N 2.96Å; Y124-T128 HydrophobicContact CD1-CG2 4.36Å; Y124-T128 HydrophobicContact CD2-CG2 4.31Å; Y124-T128 HydrophobicContact CE1-CG2 3.93Å; Y124-T128 HydrophobicContact CE2-CG2 3.89Å; Y124-T128 WeakPolarHBondContact O-CB 3.39Å; Y124-T128 WeakPolarHBondContact O-CG2 3.22Å; Y124-T128 PolarHBondContact O-N 3.27Å; Y124-T128 PolarHBondContact O-OG1 2.89Å
125	E	92.1	Very high	90.6	Very high	85 Å²	85	73.1 Å²	73.1	40%	0.397	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-37.2	176.6	-73.1	176.8	-167.5	0	0	112	R121 T128 R129	R121-E125 WeakPolarHBondContact CD-OE1 3.06Å; R121-E125 HydrophobicContact CG-CG 4.38Å; R121-E125 WeakPolarHBondContact CG-OE1 3.47Å; R121-E125 WeakPolarHBondContact O-CB 3.24Å; R121-E125 WeakPolarHBondContact O-CG 3.24Å; R121-E125 PolarHBondContact O-N 2.82Å; E125-T128 WeakPolarHBondContact CA-OG1 3.41Å; E125-T128 PolarHBondContact O-OG1 3.05Å; E125-T128 VanDerWaalsContact O-OG1 3.07Å; E125-R129 WeakPolarHBondContact O-CB 3.38Å; E125-R129 PolarHBondContact O-N 3.26Å
126	S	91	Very high	90.1	Very high	66 Å²	66	74.1 Å²	74.1	46%	0.462	38%	0.377	S	S	.	.	H	α-helix	trans	-64.8	-49.6	175.1	-171.6	0	0	0	0	111.7	E122 I123 Y124 T128 R129 H130	E122-S126 VanDerWaalsContact O-CB 3.28Å; E122-S126 WeakPolarHBondContact O-CB 3.38Å; E122-S126 PolarHBondContact O-N 3.31Å; I123-S126 PolarHBondContact O-N 2.82Å; Y124-S126 VanDerWaalsContact C-N 3.29Å; Y124-S126 PolarHBondContact O-N 3Å; S126-T128 PolarHBondContact O-N 2.97Å; S126-R129 PolarHBondContact O-N 3.06Å; S126-H130 PolarHBondContact O-N 3.17Å
127	K	88.3	Confident	89.7	Confident	68 Å²	68	75.5 Å²	75.5	30%	0.296	37%	0.365	S	S	.	.	H	α-helix	trans	-58.9	-46.7	177.9	-80.6	177.5	162.8	-80	0	111.8	D62 L82 I123 Y124 H130 A131	D62-K127 IonicContact OD1-NZ 3.89Å; L82-K127 HydrophobicContact CD1-CD 4.14Å; I123-K127 HydrophobicContact CG2-CD 4.29Å; I123-K127 PolarHBondContact O-N 3.33Å; Y124-K127 PolarHBondContact O-N 2.96Å; K127-H130 PolarHBondContact O-N 2.73Å; K127-A131 PolarHBondContact O-N 3.2Å
128	T	87.9	Confident	89.1	Confident	50 Å²	50	76.3 Å²	76.3	31%	0.307	37%	0.369	S	S	.	.	H	α-helix	trans	-67.7	-40.4	179.5	50.2	0	0	0	0	112.7	T79 Y124 E125 S126 H130 A131 Q132	T79-T128 HydrophobicContact CG2-CG2 4.3Å; Y124-T128 HydrophobicContact CD1-CG2 4.36Å; Y124-T128 HydrophobicContact CD2-CG2 4.31Å; Y124-T128 HydrophobicContact CE1-CG2 3.93Å; Y124-T128 HydrophobicContact CE2-CG2 3.89Å; Y124-T128 WeakPolarHBondContact O-CB 3.39Å; Y124-T128 WeakPolarHBondContact O-CG2 3.22Å; Y124-T128 PolarHBondContact O-N 3.27Å; Y124-T128 PolarHBondContact O-OG1 2.89Å; E125-T128 WeakPolarHBondContact CA-OG1 3.41Å; E125-T128 PolarHBondContact O-OG1 3.05Å; E125-T128 VanDerWaalsContact O-OG1 3.07Å; S126-T128 PolarHBondContact O-N 2.97Å; T128-H130 VanDerWaalsContact C-N 3.32Å; T128-H130 PolarHBondContact O-N 3Å; T128-A131 PolarHBondContact O-N 2.67Å; T128-Q132 WeakPolarHBondContact O-CB 3.38Å; T128-Q132 PolarHBondContact O-N 3.35Å
129	R	90.9	Very high	88.7	Confident	134 Å²	134	78.3 Å²	78.3	51%	0.506	38%	0.376	S	S	.	.	H	α-helix	trans	-61.7	-41.4	174.6	-170.1	-173.8	-52.9	118.3	5.2	111.6	E125 S126 Q132 Q133	E125-R129 WeakPolarHBondContact O-CB 3.38Å; E125-R129 PolarHBondContact O-N 3.26Å; S126-R129 PolarHBondContact O-N 3.06Å; R129-Q132 PolarHBondContact O-N 3.35Å; R129-Q133 VanDerWaalsContact O-CG 3.27Å; R129-Q133 WeakPolarHBondContact O-CG 3.17Å; R129-Q133 PolarHBondContact O-N 3.08Å
130	H	85.2	Confident	88.2	Confident	87 Å²	87	82.7 Å²	82.7	40%	0.403	39%	0.39	S	S	.	.	H	α-helix	trans	-65	-46.9	178.2	-170.2	46.6	0	0	0	111.8	Q58 S126 K127 T128 Q132 Q133 T134	Q58-H130 PolarHBondContact NE2-CD2 3.39Å; Q58-H130 VanDerWaalsContact NE2-CD2 3.33Å; Q58-H130 PolarHBondContact NE2-NE2 3.27Å; Q58-H130 PolarHBondContact OE1-CD2 2.68Å; Q58-H130 VanDerWaalsContact OE1-CD2 3.31Å; S126-H130 PolarHBondContact O-N 3.17Å; K127-H130 PolarHBondContact O-N 2.73Å; T128-H130 VanDerWaalsContact C-N 3.32Å; T128-H130 PolarHBondContact O-N 3Å; H130-Q132 VanDerWaalsContact C-N 3.29Å; H130-Q132 PolarHBondContact O-N 3.5Å; H130-Q133 PolarHBondContact O-N 2.61Å; H130-T134 PolarHBondContact O-N 2.62Å; H130-T134 PolarHBondContact O-OG1 3.43Å; H130-T134 VanDerWaalsContact O-OG1 3.07Å
131	A	84.2	Confident	87.1	Confident	44 Å²	44	82.9 Å²	82.9	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-58.1	-41.9	175.3	0	0	0	0	0	112.1	K127 T128 T134 L135	K127-A131 PolarHBondContact O-N 3.2Å; T128-A131 PolarHBondContact O-N 2.67Å; A131-T134 PolarHBondContact O-N 2.75Å; A131-L135 WeakPolarHBondContact O-CB 3.42Å; A131-L135 PolarHBondContact O-N 2.63Å
132	Q	86.5	Confident	85.4	Confident	96 Å²	96	90.2 Å²	90.2	45%	0.449	42%	0.423	S	S	.	.	H	α-helix	trans	-64.9	-43	176.5	-172.4	62.8	50	0	0	112	T128 R129 H130 T134 L135 D136	T128-Q132 WeakPolarHBondContact O-CB 3.38Å; T128-Q132 PolarHBondContact O-N 3.35Å; R129-Q132 PolarHBondContact O-N 3.35Å; H130-Q132 VanDerWaalsContact C-N 3.29Å; H130-Q132 PolarHBondContact O-N 3.5Å; Q132-T134 VanDerWaalsContact C-N 3.32Å; Q132-T134 PolarHBondContact O-N 2.75Å; Q132-L135 PolarHBondContact O-N 2.92Å; Q132-D136 PolarHBondContact NE2-OD1 2.67Å; Q132-D136 WeakPolarHBondContact O-CB 3.39Å; Q132-D136 PolarHBondContact O-N 3.19Å
133	Q	87.2	Confident	84.9	Confident	110 Å²	110	88.5 Å²	88.5	51%	0.514	42%	0.415	S	S	.	.	H	α-helix	trans	-61.8	-40.1	176.7	-74.6	171.7	-24.3	0	0	112.2	R129 H130 D136 R137	R129-Q133 VanDerWaalsContact O-CG 3.27Å; R129-Q133 WeakPolarHBondContact O-CG 3.17Å; R129-Q133 PolarHBondContact O-N 3.08Å; H130-Q133 PolarHBondContact O-N 2.61Å; Q133-D136 PolarHBondContact O-N 2.64Å; Q133-R137 WeakPolarHBondContact O-CB 3.02Å; Q133-R137 PolarHBondContact O-N 2.74Å
134	T	83.9	Confident	84.5	Confident	3 Å²	3	89.3 Å²	89.3	2%	0.018	42%	0.417	C	S	.	.	H	α-helix	trans	-64.9	-42.4	175.2	-52.3	0	0	0	0	110.8	E54 I55 H130 A131 Q132 R137 F138	E54-T134 HydrophobicContact CB-CG2 3.96Å; E54-T134 HydrophobicContact CG-CG2 3.68Å; I55-T134 HydrophobicContact CD1-CG2 4.31Å; I55-T134 HydrophobicContact CG1-CG2 3.56Å; H130-T134 PolarHBondContact O-N 2.62Å; H130-T134 PolarHBondContact O-OG1 3.43Å; H130-T134 VanDerWaalsContact O-OG1 3.07Å; A131-T134 PolarHBondContact O-N 2.75Å; Q132-T134 VanDerWaalsContact C-N 3.32Å; Q132-T134 PolarHBondContact O-N 2.75Å; T134-R137 PolarHBondContact O-N 2.72Å; T134-F138 PolarHBondContact O-N 2.65Å
135	L	83.5	Confident	84.2	Confident	65 Å²	65	90.2 Å²	90.2	34%	0.34	42%	0.424	S	S	.	.	H	α-helix	trans	-63	-44.6	174.7	179.9	61.2	0	0	0	112.4	I55 A131 Q132 R137 F138 L139	I55-L135 HydrophobicContact CD1-CB 4.21Å; I55-L135 HydrophobicContact CD1-CD1 4.09Å; A131-L135 WeakPolarHBondContact O-CB 3.42Å; A131-L135 PolarHBondContact O-N 2.63Å; Q132-L135 PolarHBondContact O-N 2.92Å; L135-R137 VanDerWaalsContact C-N 3.31Å; L135-R137 PolarHBondContact O-N 2.76Å; L135-F138 HydrophobicContact CD1-CD1 4.45Å; L135-F138 WeakPolarHBondContact O-CB 3.4Å; L135-F138 PolarHBondContact O-N 2.82Å; L135-L139 HydrophobicContact CD1-CD1 4.29Å; L135-L139 HydrophobicContact CD1-CG 4.3Å; L135-L139 HydrophobicContact CG-CD1 4.2Å; L135-L139 WeakPolarHBondContact O-CG 3.43Å; L135-L139 PolarHBondContact O-N 3.22Å
136	D	87.5	Confident	83.7	Confident	70 Å²	70	90.5 Å²	90.5	37%	0.374	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-40.5	178.1	-67.7	-17.7	0	0	0	110.9	Q132 Q133 L139 Q140	Q132-D136 PolarHBondContact NE2-OD1 2.67Å; Q132-D136 WeakPolarHBondContact O-CB 3.39Å; Q132-D136 PolarHBondContact O-N 3.19Å; Q133-D136 PolarHBondContact O-N 2.64Å; D136-L139 PolarHBondContact O-N 2.89Å; D136-Q140 VanDerWaalsContact O-CG 3.31Å; D136-Q140 WeakPolarHBondContact O-CG 3.31Å; D136-Q140 PolarHBondContact O-N 2.7Å; D136-Q140 VanDerWaalsContact O-N 3.09Å
137	R	86.7	Confident	83.2	Confident	104 Å²	104	92 Å²	92	39%	0.392	42%	0.424	S	S	.	.	H	α-helix	trans	-61.9	-45.8	174.3	-171.7	-179.3	71.8	-152.9	-2	111.4	D51 Q133 T134 L135 L139 Q140 H141	D51-R137 IonicContact OD1-CZ 2.82Å; D51-R137 IonicContact OD1-NE 2.79Å; D51-R137 PolarHBondContact OD1-NE 2.84Å; D51-R137 IonicContact OD1-NH2 3.72Å; D51-R137 PolarHBondContact OD1-NH2 3.01Å; D51-R137 WeakPolarHBondContact OD2-CG 3.42Å; D51-R137 IonicContact OD2-CZ 2.65Å; D51-R137 IonicContact OD2-NE 3.75Å; D51-R137 PolarHBondContact OD2-NE 2.68Å; D51-R137 IonicContact OD2-NH2 3.09Å; Q133-R137 WeakPolarHBondContact O-CB 3.02Å; Q133-R137 PolarHBondContact O-N 2.74Å; T134-R137 PolarHBondContact O-N 2.72Å; L135-R137 VanDerWaalsContact C-N 3.31Å; L135-R137 PolarHBondContact O-N 2.76Å; R137-L139 VanDerWaalsContact C-N 3.3Å; R137-L139 PolarHBondContact O-N 3.01Å; R137-Q140 PolarHBondContact O-N 2.69Å; R137-H141 PolarHBondContact O-CD2 3.18Å; R137-H141 VanDerWaalsContact O-CD2 3.24Å; R137-H141 PolarHBondContact O-N 2.77Å
138	F	81.4	Confident	82.9	Confident	34 Å²	34	93.6 Å²	93.6	15%	0.149	43%	0.432	C	S	.	.	H	α-helix	trans	-57.7	-44.2	176.5	174.1	-116.1	0	0	0	111.8	N49 D51 L52 I55 T134 L135 Q140 H141	N49-F138 WeakPolarHBondContact ND2-CE2 3.44Å; N49-F138 WeakPolarHBondContact ND2-CZ 3.44Å; N49-F138 WeakPolarHBondContact OD1-CD2 3.23Å; N49-F138 WeakPolarHBondContact OD1-CE2 3.14Å; D51-F138 HydrophobicContact CB-CB 3.87Å; D51-F138 HydrophobicContact CB-CD2 4.06Å; D51-F138 HydrophobicContact CB-CG 4.4Å; L52-F138 HydrophobicContact CB-CE2 4.47Å; I55-F138 HydrophobicContact CD1-CB 4.36Å; T134-F138 PolarHBondContact O-N 2.65Å; L135-F138 HydrophobicContact CD1-CD1 4.45Å; L135-F138 WeakPolarHBondContact O-CB 3.4Å; L135-F138 PolarHBondContact O-N 2.82Å; F138-Q140 VanDerWaalsContact C-N 3.31Å; F138-Q140 PolarHBondContact O-N 2.72Å; F138-H141 PolarHBondContact O-N 3.02Å
139	L	85.5	Confident	82.5	Confident	92 Å²	92	96.7 Å²	96.7	48%	0.482	44%	0.441	S	S	.	.	H	α-helix	trans	-71.6	-21.7	-179.7	-66.6	175.7	0	0	0	113.7	L135 D136 R137	L135-L139 HydrophobicContact CD1-CD1 4.29Å; L135-L139 HydrophobicContact CD1-CG 4.3Å; L135-L139 HydrophobicContact CG-CD1 4.2Å; L135-L139 WeakPolarHBondContact O-CG 3.43Å; L135-L139 PolarHBondContact O-N 3.22Å; D136-L139 PolarHBondContact O-N 2.89Å; R137-L139 VanDerWaalsContact C-N 3.3Å; R137-L139 PolarHBondContact O-N 3.01Å
140	Q	83.9	Confident	81.9	Confident	151 Å²	151	93.8 Å²	93.8	71%	0.706	44%	0.436	S	S	*	.	H	α-helix	trans	-77.9	-21.6	175.2	-75.1	172.8	11.6	0	0	113.5	D136 R137 F138	D136-Q140 VanDerWaalsContact O-CG 3.31Å; D136-Q140 WeakPolarHBondContact O-CG 3.31Å; D136-Q140 PolarHBondContact O-N 2.7Å; D136-Q140 VanDerWaalsContact O-N 3.09Å; R137-Q140 PolarHBondContact O-N 2.69Å; F138-Q140 VanDerWaalsContact C-N 3.31Å; F138-Q140 PolarHBondContact O-N 2.72Å
141	H	71.8	Confident	81.6	Confident	126 Å²	126	94.4 Å²	94.4	58%	0.583	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	9.2	180	-69.1	-59.1	0	0	0	113.6	D51 R137 F138	D51-H141 IonicContact OD2-CD2 3.45Å; R137-H141 PolarHBondContact O-CD2 3.18Å; R137-H141 VanDerWaalsContact O-CD2 3.24Å; R137-H141 PolarHBondContact O-N 2.77Å; F138-H141 PolarHBondContact O-N 3.02Å
142	R	57.4	Low	81.4	Confident	238 Å²	238	99 Å²	99	90%	0.898	45%	0.446	S	S	*	.			trans	-112.8	0	179.4	-167.2	-178.1	-175.3	178.3	3.7	111.4

Retrieved 142 of 142 residues in 177.4 ms (Link to these results)

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