G4VEG1_SCHMA Loading...

Endothelial differentiation-related factor 1

AlphaFold DB , UniProt , Accession G4VEG1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 134 aa.

						>G4VEG1_SCHMA|G4VEG1
MEGVRTVTLKSNSSFSAAQRRGDHIETHKRWAAGQNKQRTIEKSTAKLEEDTEDLHHDLVDMDIGKIIMQARGEKNLTQKDLATKINEKQQVIADYEQGRAVKNQAIISKLEKALGVKLRGKDKGKPLGSSKKN
					

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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	42.8	Very low	57.6	Low	246 Å²	246	143.7 Å²	143.7	100%	1.212	77%	0.77	S	S	*	*				0	101.3	0	-74.1	177.8	177.4	0	0	107	G3	M1-G3 PolarHBondContact O-N 2.78Å
2	E	40.4	Very low	59.2	Low	199 Å²	199	143.5 Å²	143.5	93%	0.93	77%	0.769	S	S	*	*			trans	-65.2	121.9	178.5	-78.6	-174.7	124.8	0	0	110	V4	E2-V4 PolarHBondContact O-N 2.63Å
3	G	50.1	Low	60.7	Low	72 Å²	72	139.1 Å²	139.1	74%	0.742	76%	0.756	S	S	*	*			trans	-72.9	114.1	-179.4	0	0	0	0	0	111.4	M1 R5	M1-G3 PolarHBondContact O-N 2.78Å; G3-R5 PolarHBondContact O-N 2.94Å
4	V	59.2	Low	61.9	Low	139 Å²	139	131.9 Å²	131.9	84%	0.842	72%	0.721	S	S	*	*			trans	-63.8	115.3	170.9	-179.4	0	0	0	0	108.6	E2 T6	E2-V4 PolarHBondContact O-N 2.63Å; V4-T6 PolarHBondContact O-N 3.09Å
5	R	58.4	Low	63	Low	230 Å²	230	128.3 Å²	128.3	87%	0.868	70%	0.696	S	S	*	*			trans	-74.3	112.9	175.4	-67.5	-178.4	176.6	-177.3	-0.4	109.6	G3 V7	G3-R5 PolarHBondContact O-N 2.94Å; R5-V7 PolarHBondContact O-N 3.41Å
6	T	58.5	Low	64.2	Low	130 Å²	130	123.1 Å²	123.1	80%	0.798	67%	0.672	S	S	*	*			trans	-72.7	119.5	170	52.7	0	0	0	0	109.9	V4	V4-T6 PolarHBondContact O-N 3.09Å
7	V	62.2	Low	65.4	Low	114 Å²	114	118.1 Å²	118.1	69%	0.691	65%	0.651	S	S	*	*			trans	-109.6	121.7	174.7	-179	0	0	0	0	109	R5 L9	R5-V7 PolarHBondContact O-N 3.41Å; V7-L9 PolarHBondContact O-N 3.45Å; V7-L9 VanDerWaalsContact O-N 3.14Å
8	T	63.9	Low	66.3	Low	120 Å²	120	112.1 Å²	112.1	74%	0.736	62%	0.619	S	S	*	*			trans	-68.2	110.5	171.4	-48.7	0	0	0	0	109.7	K10	T8-K10 PolarHBondContact O-N 3.41Å
9	L	62.9	Low	67.3	Low	73 Å²	73	112.6 Å²	112.6	38%	0.382	62%	0.617	S	S	.	*			trans	-70.2	100	179.6	-57.1	170.1	0	0	0	109.8	V7 S14 F15	V7-L9 PolarHBondContact O-N 3.45Å; V7-L9 VanDerWaalsContact O-N 3.14Å; L9-S14 VanDerWaalsContact CD2-OG 3.31Å; L9-S14 WeakPolarHBondContact CD2-OG 3.43Å; L9-F15 HydrophobicContact CD1-CB 4.01Å; L9-F15 HydrophobicContact CD1-CD2 3.84Å; L9-F15 HydrophobicContact CD1-CG 4.42Å
10	K	65.7	Low	68.3	Low	203 Å²	203	117.6 Å²	117.6	88%	0.883	63%	0.626	S	S	*	*			trans	-85.5	-17.7	177.5	-66.1	177.5	-176.2	177.9	0	113	T8	T8-K10 PolarHBondContact O-N 3.41Å
11	S	70.1	Confident	69.2	Low	55 Å²	55	120.4 Å²	120.4	39%	0.385	63%	0.628	S	S	.	*	S	Bend	trans	-127.6	143.5	-177	71	0	0	0	0	112.6	S13 S14 F15	S11-S13 PolarHBondContact O-N 2.95Å; S11-S13 VanDerWaalsContact O-N 3.14Å; S11-S13 PolarHBondContact OG-OG 2.98Å; S11-S14 PolarHBondContact O-N 2.93Å; S11-S14 PolarHBondContact O-OG 3.33Å; S11-S14 PolarHBondContact OG-OG 3.46Å; S11-F15 PolarHBondContact O-N 3.44Å
12	N	75.8	Confident	71	Confident	141 Å²	141	111.8 Å²	111.8	75%	0.754	60%	0.602	S	S	*	*	H	α-helix	trans	-57.2	-29.1	176.6	-68.4	-4.2	0	0	0	112.7	F15 S16	N12-F15 PolarHBondContact O-N 2.92Å; N12-S16 WeakPolarHBondContact O-CB 3.36Å; N12-S16 PolarHBondContact O-N 3Å; N12-S16 PolarHBondContact O-OG 3.18Å
13	S	79.1	Confident	73.1	Confident	86 Å²	86	105.6 Å²	105.6	60%	0.601	58%	0.575	S	S	*	*	H	α-helix	trans	-63.2	-42.5	178.9	54.5	0	0	0	0	112.7	S11 A17	S11-S13 PolarHBondContact O-N 2.95Å; S11-S13 VanDerWaalsContact O-N 3.14Å; S11-S13 PolarHBondContact OG-OG 2.98Å; S13-A17 WeakPolarHBondContact O-CB 3.3Å; S13-A17 PolarHBondContact O-N 3.28Å
14	S	77.5	Confident	74.5	Confident	39 Å²	39	110.3 Å²	110.3	27%	0.273	58%	0.578	S	S	.	*	H	α-helix	trans	-68.3	-40.6	178.9	61.7	0	0	0	0	112	L9 S11 A17 A18	L9-S14 VanDerWaalsContact CD2-OG 3.31Å; L9-S14 WeakPolarHBondContact CD2-OG 3.43Å; S11-S14 PolarHBondContact O-N 2.93Å; S11-S14 PolarHBondContact O-OG 3.33Å; S11-S14 PolarHBondContact OG-OG 3.46Å; S14-A17 PolarHBondContact O-N 2.96Å; S14-A18 PolarHBondContact O-N 3.35Å
15	F	78.6	Confident	75.5	Confident	77 Å²	77	106.1 Å²	106.1	34%	0.338	55%	0.55	S	S	.	*	H	α-helix	trans	-62.7	-49.5	174.4	177.9	-91.9	0	0	0	111.9	L9 S11 N12 A17 A18 Q19 I25	L9-F15 HydrophobicContact CD1-CB 4.01Å; L9-F15 HydrophobicContact CD1-CD2 3.84Å; L9-F15 HydrophobicContact CD1-CG 4.42Å; S11-F15 PolarHBondContact O-N 3.44Å; N12-F15 PolarHBondContact O-N 2.92Å; F15-A17 VanDerWaalsContact C-N 3.27Å; F15-A17 PolarHBondContact O-N 3.16Å; F15-A18 PolarHBondContact O-N 3.04Å; F15-Q19 WeakPolarHBondContact O-CB 3.17Å; F15-Q19 PolarHBondContact O-N 2.97Å; F15-I25 HydrophobicContact CD2-CG2 4.34Å; F15-I25 HydrophobicContact CE2-CD1 4.19Å; F15-I25 HydrophobicContact CE2-CG2 3.75Å
16	S	82.5	Confident	76.7	Confident	45 Å²	45	101.4 Å²	101.4	32%	0.315	54%	0.538	S	S	.	.	H	α-helix	trans	-61.7	-35.1	178.3	-64.1	0	0	0	0	112.5	N12 R20	N12-S16 WeakPolarHBondContact O-CB 3.36Å; N12-S16 PolarHBondContact O-N 3Å; N12-S16 PolarHBondContact O-OG 3.18Å; S16-R20 VanDerWaalsContact O-CG 3.3Å; S16-R20 WeakPolarHBondContact O-CG 3.33Å; S16-R20 PolarHBondContact O-N 3.17Å; S16-R20 VanDerWaalsContact O-N 3.1Å
17	A	84.1	Confident	77.8	Confident	38 Å²	38	100.7 Å²	100.7	31%	0.314	53%	0.533	S	S	.	.	H	α-helix	trans	-67.5	-46.1	175.8	0	0	0	0	0	111.9	S13 S14 F15 Q19 R20 R21	S13-A17 WeakPolarHBondContact O-CB 3.3Å; S13-A17 PolarHBondContact O-N 3.28Å; S14-A17 PolarHBondContact O-N 2.96Å; F15-A17 VanDerWaalsContact C-N 3.27Å; F15-A17 PolarHBondContact O-N 3.16Å; A17-Q19 VanDerWaalsContact C-N 3.32Å; A17-Q19 PolarHBondContact O-N 3.23Å; A17-R20 PolarHBondContact O-N 3.28Å; A17-R21 WeakPolarHBondContact O-CG 3.41Å; A17-R21 PolarHBondContact O-N 3.4Å
18	A	82.4	Confident	78.8	Confident	10 Å²	10	102 Å²	102	8%	0.083	53%	0.532	C	S	.	.	H	α-helix	trans	-58.9	-43.7	175.2	0	0	0	0	0	111.6	S14 F15 R20 R21 G22 D23 I25	S14-A18 PolarHBondContact O-N 3.35Å; F15-A18 PolarHBondContact O-N 3.04Å; A18-R20 PolarHBondContact O-N 3.2Å; A18-R21 PolarHBondContact O-N 2.92Å; A18-G22 PolarHBondContact O-N 3.22Å; A18-D23 HydrophobicContact CB-CB 4.12Å; A18-D23 PolarHBondContact O-N 3.05Å; A18-I25 HydrophobicContact CB-CD1 4.25Å; A18-I25 HydrophobicContact CB-CG1 4.27Å
19	Q	85.1	Confident	79.7	Confident	123 Å²	123	104.7 Å²	104.7	58%	0.575	53%	0.533	S	S	*	.	H	α-helix	trans	-63.2	-39	178.4	-171.7	179.3	-27	0	0	112.4	F15 A17 G22 I25	F15-Q19 WeakPolarHBondContact O-CB 3.17Å; F15-Q19 PolarHBondContact O-N 2.97Å; A17-Q19 VanDerWaalsContact C-N 3.32Å; A17-Q19 PolarHBondContact O-N 3.23Å; Q19-G22 PolarHBondContact O-N 2.94Å; Q19-I25 HydrophobicContact CB-CD1 3.91Å
20	R	86.7	Confident	80.7	Confident	211 Å²	211	111.5 Å²	111.5	80%	0.796	55%	0.554	S	S	*	*	H	α-helix	trans	-70.7	-34.1	177	-72.6	175.6	-163.8	156.5	2.1	113.3	S16 A17 A18 G22	S16-R20 VanDerWaalsContact O-CG 3.3Å; S16-R20 WeakPolarHBondContact O-CG 3.33Å; S16-R20 PolarHBondContact O-N 3.17Å; S16-R20 VanDerWaalsContact O-N 3.1Å; A17-R20 PolarHBondContact O-N 3.28Å; A18-R20 PolarHBondContact O-N 3.2Å; R20-G22 PolarHBondContact O-N 3.01Å
21	R	86.6	Confident	81.2	Confident	178 Å²	178	113.9 Å²	113.9	67%	0.672	56%	0.558	S	S	*	*	H	α-helix	trans	-76.9	-11.6	178	-68.6	-171.5	-56	-158.2	2.9	113.1	A17 A18 D23	A17-R21 WeakPolarHBondContact O-CG 3.41Å; A17-R21 PolarHBondContact O-N 3.4Å; A18-R21 PolarHBondContact O-N 2.92Å; R21-D23 VanDerWaalsContact C-N 3.26Å; R21-D23 IonicContact CZ-OD2 3.17Å; R21-D23 IonicContact NE-OD2 2.84Å; R21-D23 PolarHBondContact NE-OD2 3.3Å; R21-D23 IonicContact NH2-OD2 2.73Å; R21-D23 PolarHBondContact NH2-OD2 3.23Å
22	G	82.2	Confident	81.8	Confident	65 Å²	65	113.5 Å²	113.5	67%	0.67	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.3	22.5	-172.9	0	0	0	0	0	112.7	A18 Q19 R20	A18-G22 PolarHBondContact O-N 3.22Å; Q19-G22 PolarHBondContact O-N 2.94Å; R20-G22 PolarHBondContact O-N 3.01Å
23	D	83.2	Confident	82	Confident	68 Å²	68	108.7 Å²	108.7	36%	0.364	54%	0.538	S	S	.	.			trans	-64.4	150.8	176.1	-64.5	-28.9	0	0	0	109.9	A18 R21 I25	A18-D23 HydrophobicContact CB-CB 4.12Å; A18-D23 PolarHBondContact O-N 3.05Å; R21-D23 VanDerWaalsContact C-N 3.26Å; R21-D23 IonicContact CZ-OD2 3.17Å; R21-D23 IonicContact NE-OD2 2.84Å; R21-D23 PolarHBondContact NE-OD2 3.3Å; R21-D23 IonicContact NH2-OD2 2.73Å; R21-D23 PolarHBondContact NH2-OD2 3.23Å; D23-I25 PolarHBondContact O-N 3.21Å
24	H	80.6	Confident	82.1	Confident	172 Å²	172	108.9 Å²	108.9	80%	0.796	55%	0.553	S	S	*	*			trans	-63.7	123.7	174.1	-178.5	75	0	0	0	110.7
25	I	80.3	Confident	82.5	Confident	51 Å²	51	114 Å²	114	26%	0.262	57%	0.572	S	S	.	*			trans	-116.3	113.5	178	-62.5	171.4	0	0	0	108.3	F15 A18 Q19 D23 T27	F15-I25 HydrophobicContact CD2-CG2 4.34Å; F15-I25 HydrophobicContact CE2-CD1 4.19Å; F15-I25 HydrophobicContact CE2-CG2 3.75Å; A18-I25 HydrophobicContact CB-CD1 4.25Å; A18-I25 HydrophobicContact CB-CG1 4.27Å; Q19-I25 HydrophobicContact CB-CD1 3.91Å; D23-I25 PolarHBondContact O-N 3.21Å; I25-T27 HydrophobicContact CG2-CG2 4.04Å
26	E	82.4	Confident	82.7	Confident	130 Å²	130	117.3 Å²	117.3	61%	0.607	59%	0.593	S	S	*	*			trans	-86.3	133.1	169.4	-160.6	174.7	-173.8	0	0	109.5	H28	E26-H28 VanDerWaalsContact CD-CE1 3.42Å; E26-H28 WeakPolarHBondContact CG-NE2 2.98Å; E26-H28 IonicContact OE1-CE1 3.99Å; E26-H28 PolarHBondContact OE1-CE1 3.11Å; E26-H28 IonicContact OE1-NE2 2.68Å; E26-H28 PolarHBondContact OE1-NE2 3.37Å; E26-H28 IonicContact OE2-NE2 3.99Å
27	T	82.4	Confident	82.6	Confident	115 Å²	115	122 Å²	122	71%	0.706	61%	0.609	S	S	*	*			trans	-120	135.3	176.7	64.9	0	0	0	0	109.9	I25	I25-T27 HydrophobicContact CG2-CG2 4.04Å
28	H	82.8	Confident	82.2	Confident	141 Å²	141	129 Å²	129	65%	0.653	63%	0.634	S	S	*	*			trans	-128.4	140	174.8	-55.4	-79.4	0	0	0	109.9	E26 R30	E26-H28 VanDerWaalsContact CD-CE1 3.42Å; E26-H28 WeakPolarHBondContact CG-NE2 2.98Å; E26-H28 IonicContact OE1-CE1 3.99Å; E26-H28 PolarHBondContact OE1-CE1 3.11Å; E26-H28 IonicContact OE1-NE2 2.68Å; E26-H28 PolarHBondContact OE1-NE2 3.37Å; E26-H28 IonicContact OE2-NE2 3.99Å; H28-R30 PolarHBondContact O-N 3.46Å
29	K	83.4	Confident	81.8	Confident	178 Å²	178	137.1 Å²	137.1	77%	0.774	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-67.7	128.3	169.6	-173.9	176.7	-179.9	-178.8	0	108.7	A33	K29-A33 HydrophobicContact CD-CB 4.48Å; K29-A33 HydrophobicContact CG-CB 3.81Å
30	R	82.5	Confident	81.2	Confident	215 Å²	215	135.5 Å²	135.5	81%	0.811	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-63.6	142.5	175.4	-65.8	-176.2	176.2	179.3	-0.5	110.4	H28 A32 A33	H28-R30 PolarHBondContact O-N 3.46Å; R30-A32 PolarHBondContact O-N 3.13Å; R30-A33 HydrophobicContact CB-CB 4.21Å; R30-A33 WeakPolarHBondContact O-CB 3.5Å; R30-A33 PolarHBondContact O-N 2.92Å
31	W	77.1	Confident	80.6	Confident	254 Å²	254	130.5 Å²	130.5	96%	0.962	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	134.8	168.6	-170.3	82.2	0	0	0	109.4	A33	W31-A33 VanDerWaalsContact C-N 3.29Å; W31-A33 PolarHBondContact O-N 2.76Å
32	A	81.5	Confident	79.6	Confident	47 Å²	47	126.2 Å²	126.2	39%	0.388	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	64.2	15.5	-169	0	0	0	0	0	116.9	R30 G34 Q35	R30-A32 PolarHBondContact O-N 3.13Å; A32-G34 PolarHBondContact O-N 3.21Å; A32-Q35 PolarHBondContact O-N 3.41Å
33	A	80.1	Confident	78.8	Confident	40 Å²	40	127.5 Å²	127.5	33%	0.331	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.3	129.3	173	0	0	0	0	0	111.9	K29 R30 W31	K29-A33 HydrophobicContact CD-CB 4.48Å; K29-A33 HydrophobicContact CG-CB 3.81Å; R30-A33 HydrophobicContact CB-CB 4.21Å; R30-A33 WeakPolarHBondContact O-CB 3.5Å; R30-A33 PolarHBondContact O-N 2.92Å; W31-A33 VanDerWaalsContact C-N 3.29Å; W31-A33 PolarHBondContact O-N 2.76Å
34	G	82.1	Confident	78.2	Confident	89 Å²	89	127.6 Å²	127.6	92%	0.918	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	87.4	9.1	-178.2	0	0	0	0	0	114.5	A32	A32-G34 PolarHBondContact O-N 3.21Å
35	Q	85.6	Confident	77.6	Confident	147 Å²	147	122.6 Å²	122.6	69%	0.687	61%	0.612	S	S	*	*			trans	-111.7	151.2	176.2	-61.4	-176	-52.5	0	0	111.3	A32	A32-Q35 PolarHBondContact O-N 3.41Å
36	N	82.1	Confident	77.1	Confident	146 Å²	146	123 Å²	123	78%	0.781	62%	0.623	S	S	*	*			trans	-114.9	41.4	-178.9	65.9	-15.8	0	0	0	112.1	Q38	N36-Q38 PolarHBondContact O-N 2.76Å
37	K	81.2	Confident	76.2	Confident	145 Å²	145	123.9 Å²	123.9	63%	0.63	63%	0.625	S	S	*	*			trans	-61	109.8	-179	-173.6	169.9	-176.5	173.4	0	110.2	R39	K37-R39 WeakPolarHBondContact CE-O 3.31Å
38	Q	74.9	Confident	75.4	Confident	184 Å²	184	121.4 Å²	121.4	86%	0.86	61%	0.607	S	S	*	*	S	Bend	trans	-73.6	-28.1	-174.5	-67	-175.1	-35.7	0	0	113.6	N36	N36-Q38 PolarHBondContact O-N 2.76Å
39	R	74.6	Confident	74.5	Confident	181 Å²	181	122.3 Å²	122.3	68%	0.683	61%	0.611	S	S	*	*	S	Bend	trans	-111.9	102.7	179.3	-66.7	-174.3	176.5	-171.6	-1.3	110.2	K37	K37-R39 WeakPolarHBondContact CE-O 3.31Å
40	T	71.8	Confident	73.5	Confident	89 Å²	89	121.2 Å²	121.2	55%	0.546	61%	0.609	S	S	.	*			trans	-89	142.9	175.4	49.1	0	0	0	0	110.5
41	I	74.5	Confident	72.2	Confident	106 Å²	106	115.9 Å²	115.9	54%	0.544	60%	0.597	S	S	.	*			trans	-75.9	129	171.6	-49.4	175.8	0	0	0	106.9	K43 T45	I41-K43 WeakPolarHBondContact CG2-O 3.45Å; I41-T45 HydrophobicContact CD1-CG2 3.49Å; I41-T45 VanDerWaalsContact CD1-CG2 3.49Å; I41-T45 HydrophobicContact CG2-CG2 4.06Å
42	E	65.7	Low	71.2	Confident	88 Å²	88	110.1 Å²	110.1	41%	0.411	59%	0.59	S	S	.	*	S	Bend	trans	-86.3	-33.5	-172	-56.5	-164	109.2	0	0	113.6	N104 Q105	E42-N104 VanDerWaalsContact CD-CA 3.43Å; E42-N104 WeakPolarHBondContact OE1-CA 3.34Å; E42-N104 VanDerWaalsContact OE1-CB 3.3Å; E42-N104 WeakPolarHBondContact OE1-CB 3.48Å; E42-N104 PolarHBondContact OE1-ND2 2.95Å; E42-N104 VanDerWaalsContact OE1-ND2 3.12Å; E42-N104 PolarHBondContact OE1-OD1 3.13Å; E42-N104 WeakPolarHBondContact OE2-CA 3.44Å; E42-N104 WeakPolarHBondContact OE2-CB 3.17Å; E42-N104 VanDerWaalsContact OE2-CG 3.22Å; E42-N104 PolarHBondContact OE2-ND2 3.21Å; E42-Q105 PolarHBondContact OE1-N 2.72Å
43	K	66.7	Low	69.7	Low	91 Å²	91	116 Å²	116	40%	0.396	61%	0.609	S	S	.	*	S	Bend	trans	-94.2	143.7	171.6	-70.5	-177.8	173.4	-174	0	108.8	I41 T45 L48 L55	I41-K43 WeakPolarHBondContact CG2-O 3.45Å; K43-T45 PolarHBondContact O-N 2.98Å; K43-L48 HydrophobicContact CB-CD1 3.91Å; K43-L48 HydrophobicContact CB-CD2 4.18Å; K43-L48 HydrophobicContact CB-CG 3.92Å; K43-L48 HydrophobicContact CD-CD2 3.74Å; K43-L48 HydrophobicContact CD-CG 4.43Å; K43-L55 VanDerWaalsContact NZ-CD1 3.31Å
44	S	69.7	Low	68.3	Low	70 Å²	70	120.5 Å²	120.5	49%	0.49	63%	0.627	S	S	.	*			trans	-60.7	122.9	172.3	-174.7	0	0	0	0	108.4	A46 K47 L48	S44-A46 PolarHBondContact O-N 3.48Å; S44-K47 PolarHBondContact O-N 2.89Å; S44-L48 PolarHBondContact O-N 2.98Å
45	T	69	Low	67	Low	68 Å²	68	119.9 Å²	119.9	42%	0.417	60%	0.603	S	S	.	*	H	α-helix	trans	-57.9	-34	-178.9	53.1	0	0	0	0	111.5	I41 K43 K47 L48 E49	I41-T45 HydrophobicContact CD1-CG2 3.49Å; I41-T45 VanDerWaalsContact CD1-CG2 3.49Å; I41-T45 HydrophobicContact CG2-CG2 4.06Å; K43-T45 PolarHBondContact O-N 2.98Å; T45-K47 VanDerWaalsContact C-N 3.3Å; T45-K47 PolarHBondContact O-N 3.47Å; T45-L48 PolarHBondContact O-N 3.46Å; T45-L48 VanDerWaalsContact O-N 3.13Å; T45-E49 WeakPolarHBondContact O-CG 3.32Å; T45-E49 PolarHBondContact O-N 3.25Å
46	A	69.2	Low	65.7	Low	59 Å²	59	119.6 Å²	119.6	49%	0.488	60%	0.601	S	S	.	*	H	α-helix	trans	-60.6	-35.2	174.5	0	0	0	0	0	113.4	S44 E50	S44-A46 PolarHBondContact O-N 3.48Å; A46-E50 PolarHBondContact O-N 2.9Å
47	K	64.2	Low	64.7	Low	149 Å²	149	116.7 Å²	116.7	65%	0.648	58%	0.583	S	S	*	*	H	α-helix	trans	-75.9	-33.4	175.7	-68.7	-171.9	175.1	-166.8	0	112	S44 T45 E49 E50 D51	S44-K47 PolarHBondContact O-N 2.89Å; T45-K47 VanDerWaalsContact C-N 3.3Å; T45-K47 PolarHBondContact O-N 3.47Å; K47-E49 VanDerWaalsContact C-N 3.33Å; K47-E50 PolarHBondContact O-N 3.01Å; K47-D51 PolarHBondContact O-N 3.23Å; K47-D51 VanDerWaalsContact O-N 3.14Å
48	L	65.2	Low	64.1	Low	63 Å²	63	115.6 Å²	115.6	33%	0.33	58%	0.584	S	S	.	*	H	α-helix	trans	-69.5	-31.4	176.4	-73.1	173	0	0	0	112.5	K43 S44 T45 L55	K43-L48 HydrophobicContact CB-CD1 3.91Å; K43-L48 HydrophobicContact CB-CD2 4.18Å; K43-L48 HydrophobicContact CB-CG 3.92Å; K43-L48 HydrophobicContact CD-CD2 3.74Å; K43-L48 HydrophobicContact CD-CG 4.43Å; S44-L48 PolarHBondContact O-N 2.98Å; T45-L48 PolarHBondContact O-N 3.46Å; T45-L48 VanDerWaalsContact O-N 3.13Å; L48-L55 HydrophobicContact CD2-CD1 3.81Å; L48-L55 HydrophobicContact CD2-CD2 4.2Å
49	E	62.9	Low	64.3	Low	159 Å²	159	111 Å²	111	74%	0.743	57%	0.565	S	S	*	*	H	α-helix	trans	-75.5	-25.6	176.4	-73.1	170.2	175.2	0	0	112.6	T45 K47	T45-E49 WeakPolarHBondContact O-CG 3.32Å; T45-E49 PolarHBondContact O-N 3.25Å; K47-E49 VanDerWaalsContact C-N 3.33Å
50	E	62.2	Low	64.6	Low	156 Å²	156	102.5 Å²	102.5	73%	0.729	53%	0.533	S	S	*	.	H	α-helix	trans	-84.9	-30.9	177.8	-171.2	173.7	-163.5	0	0	112.9	A46 K47 T52	A46-E50 PolarHBondContact O-N 2.9Å; K47-E50 PolarHBondContact O-N 3.01Å; E50-T52 PolarHBondContact O-N 2.91Å
51	D	56.2	Low	65.1	Low	103 Å²	103	101.2 Å²	101.2	55%	0.551	52%	0.523	S	S	*	.			trans	-72.9	96.2	176.9	-103.9	-11.6	0	0	0	111.1	K47	K47-D51 PolarHBondContact O-N 3.23Å; K47-D51 VanDerWaalsContact O-N 3.14Å
52	T	56.7	Low	65.5	Low	133 Å²	133	102.2 Å²	102.2	82%	0.816	53%	0.526	S	S	*	.			trans	-88.5	-7.6	174	36.5	0	0	0	0	114.9	E50	E50-T52 PolarHBondContact O-N 2.91Å
53	E	48.3	Very low	66.5	Low	170 Å²	170	102.8 Å²	102.8	79%	0.794	53%	0.533	S	S	*	.	S	Bend	trans	-138.3	125.6	-177.8	-61.6	-164.7	158.4	0	0	112.5
54	D	51.8	Low	67.5	Low	134 Å²	134	98.8 Å²	98.8	72%	0.717	52%	0.515	S	S	*	.			trans	61.3	71.1	168	-104.1	-35.5	0	0	0	119.9	H56	D54-H56 VanDerWaalsContact C-N 3.29Å; D54-H56 PolarHBondContact O-N 3.43Å; D54-H56 PolarHBondContact O-ND1 2.82Å; D54-H56 IonicContact OD1-CE1 3.1Å; D54-H56 PolarHBondContact OD1-CE1 2.9Å; D54-H56 IonicContact OD1-ND1 3.82Å; D54-H56 IonicContact OD2-CE1 3.11Å
55	L	54.2	Low	68.6	Low	77 Å²	77	95.5 Å²	95.5	40%	0.403	49%	0.492	S	S	.	.			trans	-71.8	76.5	172.1	-164.9	68	0	0	0	112.3	K43 L48 H57	K43-L55 VanDerWaalsContact NZ-CD1 3.31Å; L48-L55 HydrophobicContact CD2-CD1 3.81Å; L48-L55 HydrophobicContact CD2-CD2 4.2Å; L55-H57 WeakPolarHBondContact CD2-CE1 3.44Å; L55-H57 VanDerWaalsContact CG-CE1 3.42Å; L55-H57 WeakPolarHBondContact CG-CE1 3.42Å; L55-H57 PolarHBondContact O-N 2.82Å; L55-H57 PolarHBondContact O-ND1 3.02Å; L55-H57 VanDerWaalsContact O-ND1 3.14Å
56	H	58.2	Low	69.7	Low	140 Å²	140	97.2 Å²	97.2	65%	0.648	49%	0.494	S	S	*	.			trans	-66.4	119.9	168.4	-72	75.2	0	0	0	109.3	D54	D54-H56 VanDerWaalsContact C-N 3.29Å; D54-H56 PolarHBondContact O-N 3.43Å; D54-H56 PolarHBondContact O-ND1 2.82Å; D54-H56 IonicContact OD1-CE1 3.1Å; D54-H56 PolarHBondContact OD1-CE1 2.9Å; D54-H56 IonicContact OD1-ND1 3.82Å; D54-H56 IonicContact OD2-CE1 3.11Å
57	H	62.7	Low	70.8	Confident	86 Å²	86	95.7 Å²	95.7	40%	0.398	48%	0.477	S	S	.	.			trans	-98.7	118.7	172.6	-67.3	89.3	0	0	0	108.7	L55 L59 V102	L55-H57 WeakPolarHBondContact CD2-CE1 3.44Å; L55-H57 VanDerWaalsContact CG-CE1 3.42Å; L55-H57 WeakPolarHBondContact CG-CE1 3.42Å; L55-H57 PolarHBondContact O-N 2.82Å; L55-H57 PolarHBondContact O-ND1 3.02Å; L55-H57 VanDerWaalsContact O-ND1 3.14Å; H57-L59 PolarHBondContact O-N 3.24Å; H57-V102 HydrophobicContact CB-CG1 4.06Å; H57-V102 HydrophobicContact CB-CG2 3.86Å
58	D	67.4	Low	72.1	Confident	122 Å²	122	88.6 Å²	88.6	65%	0.652	45%	0.446	S	S	*	.			trans	-62.4	106.1	170.9	-69.2	-31.2	0	0	0	108.9	K103	D58-K103 HydrophobicContact CB-CD 3.89Å; D58-K103 WeakPolarHBondContact O-CB 3.29Å; D58-K103 VanDerWaalsContact O-CG 3.31Å; D58-K103 WeakPolarHBondContact O-CG 3.48Å; D58-K103 PolarHBondContact O-N 2.93Å; D58-K103 VanDerWaalsContact O-N 3.12Å
59	L	79.1	Confident	73.4	Confident	87 Å²	87	90.2 Å²	90.2	46%	0.455	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-68.5	155.4	171.9	-60.2	-176.9	0	0	0	109.7	H57 D61 A101 V102 K103	H57-L59 PolarHBondContact O-N 3.24Å; L59-D61 PolarHBondContact O-N 3.44Å; L59-A101 WeakPolarHBondContact CA-O 3.14Å; L59-V102 HydrophobicContact CD2-CG2 4.29Å; L59-K103 WeakPolarHBondContact O-CE 3.47Å; L59-K103 PolarHBondContact O-NZ 3.06Å
60	V	80.6	Confident	74.9	Confident	3 Å²	3	88.5 Å²	88.5	2%	0.018	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-62.8	124.6	173.2	174.4	0	0	0	0	109.2	M62 I64 Y96 G99 A101 K103	V60-M62 PolarHBondContact O-N 3.37Å; V60-I64 HydrophobicContact CG1-CB 3.57Å; V60-I64 HydrophobicContact CG1-CD1 4.1Å; V60-I64 HydrophobicContact CG1-CG1 4.42Å; V60-I64 HydrophobicContact CG1-CG2 3.54Å; V60-Y96 HydrophobicContact CG1-CD1 4.35Å; V60-Y96 HydrophobicContact CG2-CD1 3.68Å; V60-Y96 HydrophobicContact CG2-CE1 3.58Å; V60-G99 CarbonylContact O-C 3.58Å; V60-G99 VanDerWaalsContact O-CA 3.23Å; V60-G99 WeakPolarHBondContact O-CA 3.16Å; V60-A101 HydrophobicContact CG2-CB 4.37Å; V60-A101 WeakPolarHBondContact CG2-O 3.3Å; V60-A101 PolarHBondContact N-O 3.43Å; V60-K103 HydrophobicContact CB-CG 4.49Å; V60-K103 HydrophobicContact CG2-CG 3.78Å
61	D	81.9	Confident	76.3	Confident	61 Å²	61	81.2 Å²	81.2	33%	0.326	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-58	140.9	178.2	-43	-27.7	0	0	0	109.9	L59 D63 I64 G65 K103 K124	L59-D61 PolarHBondContact O-N 3.44Å; D61-D63 PolarHBondContact O-N 3.16Å; D61-I64 HydrophobicContact CB-CD1 4.33Å; D61-I64 HydrophobicContact CB-CG1 4.45Å; D61-I64 WeakPolarHBondContact O-CB 2.95Å; D61-I64 PolarHBondContact O-N 3.45Å; D61-G65 PolarHBondContact O-N 3.23Å; D61-K103 IonicContact OD1-NZ 3.92Å; D61-K103 PolarHBondContact OD1-NZ 2.9Å; D61-K124 IonicContact OD2-NZ 3.82Å; D61-K124 PolarHBondContact OD2-NZ 3.44Å
62	M	83.7	Confident	78.1	Confident	127 Å²	127	78.4 Å²	78.4	63%	0.626	39%	0.394	S	S	*	.	H	α-helix	trans	-57.9	-27	-177.9	-170.3	158.1	64.4	0	0	113.1	V60 I64 G65 K66	V60-M62 PolarHBondContact O-N 3.37Å; M62-I64 VanDerWaalsContact C-N 3.34Å; M62-I64 PolarHBondContact O-N 3.01Å; M62-G65 PolarHBondContact O-N 3.35Å; M62-K66 PolarHBondContact O-N 3.22Å; M62-K66 VanDerWaalsContact O-N 3.11Å
63	D	87	Confident	79.8	Confident	101 Å²	101	74 Å²	74	54%	0.54	37%	0.374	S	S	.	.	H	α-helix	trans	-63.7	-37.4	173.8	-65.2	-29.2	0	0	0	112.8	D61 G65 K66 I67	D61-D63 PolarHBondContact O-N 3.16Å; D63-G65 VanDerWaalsContact C-N 3.32Å; D63-K66 PolarHBondContact O-N 3.43Å; D63-I67 WeakPolarHBondContact O-CD1 3.4Å; D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.26Å; D63-I67 PolarHBondContact O-N 3.29Å; D63-I67 VanDerWaalsContact O-N 3.08Å
64	I	88.4	Confident	81.9	Confident	7 Å²	7	73.3 Å²	73.3	4%	0.036	37%	0.371	C	S	.	.	H	α-helix	trans	-64.9	-41.7	175.7	-64.9	170.1	0	0	0	109.5	V60 D61 M62 K66 I67 I68 L119 K124	V60-I64 HydrophobicContact CG1-CB 3.57Å; V60-I64 HydrophobicContact CG1-CD1 4.1Å; V60-I64 HydrophobicContact CG1-CG1 4.42Å; V60-I64 HydrophobicContact CG1-CG2 3.54Å; D61-I64 HydrophobicContact CB-CD1 4.33Å; D61-I64 HydrophobicContact CB-CG1 4.45Å; D61-I64 WeakPolarHBondContact O-CB 2.95Å; D61-I64 PolarHBondContact O-N 3.45Å; M62-I64 VanDerWaalsContact C-N 3.34Å; M62-I64 PolarHBondContact O-N 3.01Å; I64-K66 VanDerWaalsContact C-N 3.35Å; I64-K66 PolarHBondContact O-N 2.92Å; I64-I67 PolarHBondContact O-N 3.04Å; I64-I68 HydrophobicContact CG2-CD1 3.82Å; I64-I68 HydrophobicContact CG2-CG1 4.38Å; I64-I68 VanDerWaalsContact O-CG1 3.3Å; I64-I68 WeakPolarHBondContact O-CG1 3.36Å; I64-I68 PolarHBondContact O-N 3.48Å; I64-L119 HydrophobicContact CG2-CB 4.34Å; I64-L119 HydrophobicContact CG2-CD2 4.35Å; I64-K124 HydrophobicContact CG1-CD 4.18Å
65	G	91.3	Very high	83.9	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-59.3	-43.7	177.1	0	0	0	0	0	112.8	D61 M62 D63 I68 M69 Y96 E97	D61-G65 PolarHBondContact O-N 3.23Å; M62-G65 PolarHBondContact O-N 3.35Å; D63-G65 VanDerWaalsContact C-N 3.32Å; G65-I68 PolarHBondContact O-N 3.37Å; G65-M69 PolarHBondContact O-N 3.09Å; G65-Y96 WeakPolarHBondContact CA-O 3.45Å; G65-E97 WeakPolarHBondContact CA-O 3.37Å
66	K	91.8	Very high	85.7	Confident	104 Å²	104	74.7 Å²	74.7	45%	0.452	38%	0.375	S	S	.	.	H	α-helix	trans	-61.9	-44.8	174.9	-69.3	176.1	-176.5	172.3	0	112.5	M62 D63 I64 I68 M69 Q70	M62-K66 PolarHBondContact O-N 3.22Å; M62-K66 VanDerWaalsContact O-N 3.11Å; D63-K66 PolarHBondContact O-N 3.43Å; I64-K66 VanDerWaalsContact C-N 3.35Å; I64-K66 PolarHBondContact O-N 2.92Å; K66-I68 VanDerWaalsContact C-N 3.34Å; K66-I68 PolarHBondContact O-N 2.97Å; K66-M69 PolarHBondContact O-N 3.36Å; K66-Q70 WeakPolarHBondContact O-CB 3.23Å; K66-Q70 WeakPolarHBondContact O-CG 3.36Å; K66-Q70 PolarHBondContact O-N 3.3Å
67	I	92.1	Very high	87.4	Confident	27 Å²	27	69.7 Å²	69.7	14%	0.138	35%	0.353	C	S	.	.	H	α-helix	trans	-62.2	-42.7	178.4	-68.4	162.7	0	0	0	110.9	D63 I64 Q70 A71 V117 L119 K124	D63-I67 WeakPolarHBondContact O-CD1 3.4Å; D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.26Å; D63-I67 PolarHBondContact O-N 3.29Å; D63-I67 VanDerWaalsContact O-N 3.08Å; I64-I67 PolarHBondContact O-N 3.04Å; I67-Q70 PolarHBondContact O-N 2.89Å; I67-A71 VanDerWaalsContact O-CB 3.32Å; I67-A71 WeakPolarHBondContact O-CB 3.3Å; I67-A71 PolarHBondContact O-N 3.32Å; I67-V117 HydrophobicContact CG2-CG2 4.16Å; I67-L119 HydrophobicContact CB-CD2 4.28Å; I67-L119 HydrophobicContact CG2-CD2 3.62Å; I67-K124 HydrophobicContact CD1-CB 3.84Å
68	I	92.7	Very high	88.9	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-59.9	-48.5	176.7	-70.2	166.2	0	0	0	110.1	I64 G65 K66 Q70 A71 R72 L82 Y96 E97 L111 L115 L119	I64-I68 HydrophobicContact CG2-CD1 3.82Å; I64-I68 HydrophobicContact CG2-CG1 4.38Å; I64-I68 VanDerWaalsContact O-CG1 3.3Å; I64-I68 WeakPolarHBondContact O-CG1 3.36Å; I64-I68 PolarHBondContact O-N 3.48Å; G65-I68 PolarHBondContact O-N 3.37Å; K66-I68 VanDerWaalsContact C-N 3.34Å; K66-I68 PolarHBondContact O-N 2.97Å; I68-Q70 PolarHBondContact O-N 3.08Å; I68-A71 PolarHBondContact O-N 3.27Å; I68-R72 WeakPolarHBondContact O-CB 3.36Å; I68-R72 PolarHBondContact O-N 3.07Å; I68-L82 HydrophobicContact CG2-CD2 4.4Å; I68-Y96 HydrophobicContact CD1-CD1 4.35Å; I68-E97 HydrophobicContact CB-CG 4.31Å; I68-E97 HydrophobicContact CG2-CG 3.7Å; I68-L111 HydrophobicContact CD1-CD1 4.03Å; I68-L115 HydrophobicContact CB-CD1 4.29Å; I68-L115 HydrophobicContact CG1-CD1 4.27Å; I68-L115 HydrophobicContact CG2-CD1 3.96Å; I68-L119 HydrophobicContact CD1-CD1 4.04Å; I68-L119 HydrophobicContact CG1-CD1 3.79Å; I68-L119 HydrophobicContact CG1-CD2 3.88Å
69	M	92.8	Very high	90.2	Very high	97 Å²	97	65.3 Å²	65.3	48%	0.478	33%	0.333	S	S	.	.	H	α-helix	trans	-62.3	-43.1	-179.5	-173.8	179.6	62.1	0	0	112	G65 K66 R72 G73 E97	G65-M69 PolarHBondContact O-N 3.09Å; K66-M69 PolarHBondContact O-N 3.36Å; M69-R72 PolarHBondContact O-N 3.32Å; M69-G73 PolarHBondContact O-N 2.89Å; M69-E97 HydrophobicContact CB-CG 4.42Å
70	Q	92.9	Very high	91	Very high	123 Å²	123	67.4 Å²	67.4	58%	0.575	34%	0.339	S	S	*	.	H	α-helix	trans	-63.1	-53.4	176.3	-74.9	176.2	-24.5	0	0	111.7	K66 I67 I68 R72 G73 E74	K66-Q70 WeakPolarHBondContact O-CB 3.23Å; K66-Q70 WeakPolarHBondContact O-CG 3.36Å; K66-Q70 PolarHBondContact O-N 3.3Å; I67-Q70 PolarHBondContact O-N 2.89Å; I68-Q70 PolarHBondContact O-N 3.08Å; Q70-R72 PolarHBondContact O-N 3.23Å; Q70-G73 WeakPolarHBondContact O-CA 3.39Å; Q70-G73 PolarHBondContact O-N 3.24Å; Q70-E74 WeakPolarHBondContact O-CG 3.2Å; Q70-E74 PolarHBondContact O-N 3.32Å
71	A	93.2	Very high	91.6	Very high	3 Å²	3	70.7 Å²	70.7	3%	0.025	36%	0.356	C	S	.	.	H	α-helix	trans	-62.7	-29.7	179.8	0	0	0	0	0	112.5	I67 I68 K75 L115 V117	I67-A71 VanDerWaalsContact O-CB 3.32Å; I67-A71 WeakPolarHBondContact O-CB 3.3Å; I67-A71 PolarHBondContact O-N 3.32Å; I68-A71 PolarHBondContact O-N 3.27Å; A71-K75 WeakPolarHBondContact O-CG 3.49Å; A71-K75 PolarHBondContact O-N 2.91Å; A71-L115 HydrophobicContact CB-CB 4.05Å; A71-L115 HydrophobicContact CB-CD1 4.37Å; A71-L115 HydrophobicContact CB-CD2 4.36Å; A71-L115 HydrophobicContact CB-CG 4.49Å; A71-V117 HydrophobicContact CB-CG1 3.94Å; A71-V117 HydrophobicContact CB-CG2 3.85Å
72	R	94.3	Very high	92.2	Very high	44 Å²	44	67.8 Å²	67.8	17%	0.166	34%	0.341	C	S	.	.	H	α-helix	trans	-68.3	-44.6	172.4	-179.6	174.6	64.1	75.4	-2.9	111.2	I68 M69 Q70 K75 N76 L77 E97 L115	I68-R72 WeakPolarHBondContact O-CB 3.36Å; I68-R72 PolarHBondContact O-N 3.07Å; M69-R72 PolarHBondContact O-N 3.32Å; Q70-R72 PolarHBondContact O-N 3.23Å; R72-K75 PolarHBondContact O-N 3.29Å; R72-N76 PolarHBondContact O-N 3.33Å; R72-L77 WeakPolarHBondContact CD-O 3.44Å; R72-L77 HydrophobicContact CG-CB 3.85Å; R72-L77 WeakPolarHBondContact CG-O 3.48Å; R72-L77 PolarHBondContact NH1-O 2.84Å; R72-L77 PolarHBondContact O-N 2.78Å; R72-E97 IonicContact CZ-OE1 3.25Å; R72-E97 IonicContact CZ-OE2 2.82Å; R72-E97 IonicContact NE-OE1 3.7Å; R72-E97 PolarHBondContact NE-OE1 2.89Å; R72-E97 IonicContact NE-OE2 2.79Å; R72-E97 IonicContact NH2-OE1 3.86Å; R72-E97 PolarHBondContact NH2-OE1 2.86Å; R72-E97 IonicContact NH2-OE2 3.85Å; R72-E97 PolarHBondContact NH2-OE2 3.35Å; R72-L115 HydrophobicContact CB-CD2 4.21Å
73	G	92.3	Very high	92.8	Very high	40 Å²	40	61.9 Å²	61.9	41%	0.412	31%	0.312	S	S	.	.	H	α-helix	trans	-60.8	-45.8	175.4	0	0	0	0	0	112.7	M69 Q70 K75 N76	M69-G73 PolarHBondContact O-N 2.89Å; Q70-G73 WeakPolarHBondContact O-CA 3.39Å; Q70-G73 PolarHBondContact O-N 3.24Å; G73-K75 PolarHBondContact O-N 3.38Å; G73-K75 VanDerWaalsContact O-N 3.17Å; G73-N76 PolarHBondContact O-N 3.34Å
74	E	92.3	Very high	93.2	Very high	157 Å²	157	61.6 Å²	61.6	73%	0.734	31%	0.314	S	S	*	.	H	α-helix	trans	-58.5	-29.2	176.4	-71.4	175.1	-175.6	0	0	113.2	Q70	Q70-E74 WeakPolarHBondContact O-CG 3.2Å; Q70-E74 PolarHBondContact O-N 3.32Å
75	K	92.4	Very high	93.4	Very high	91 Å²	91	67.1 Å²	67.1	40%	0.396	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	3.7	177.4	-67.1	-168.6	179.5	-169.7	0	114.2	A71 R72 G73 L77 A114 L115	A71-K75 WeakPolarHBondContact O-CG 3.49Å; A71-K75 PolarHBondContact O-N 2.91Å; R72-K75 PolarHBondContact O-N 3.29Å; G73-K75 PolarHBondContact O-N 3.38Å; G73-K75 VanDerWaalsContact O-N 3.17Å; K75-L77 HydrophobicContact CB-CD1 3.87Å; K75-L77 HydrophobicContact CB-CG 3.9Å; K75-L77 HydrophobicContact CD-CD1 4.28Å; K75-L77 PolarHBondContact O-N 2.78Å; K75-A114 PolarHBondContact NZ-O 3.41Å; K75-L115 WeakPolarHBondContact CE-O 3.34Å; K75-L115 PolarHBondContact NZ-O 3.03Å
76	N	93.4	Very high	93.4	Very high	149 Å²	149	67.4 Å²	67.4	80%	0.797	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.8	36.5	-174.9	-61.2	-55.6	0	0	0	113.3	R72 G73	R72-N76 PolarHBondContact O-N 3.33Å; G73-N76 PolarHBondContact O-N 3.34Å
77	L	93.3	Very high	93.5	Very high	34 Å²	34	68.9 Å²	68.9	18%	0.178	35%	0.352	C	S	.	.			trans	-95.1	137.3	179.5	-68.6	172.8	0	0	0	110.2	R72 K75 D81	R72-L77 WeakPolarHBondContact CD-O 3.44Å; R72-L77 HydrophobicContact CG-CB 3.85Å; R72-L77 WeakPolarHBondContact CG-O 3.48Å; R72-L77 PolarHBondContact NH1-O 2.84Å; R72-L77 PolarHBondContact O-N 2.78Å; K75-L77 HydrophobicContact CB-CD1 3.87Å; K75-L77 HydrophobicContact CB-CG 3.9Å; K75-L77 HydrophobicContact CD-CD1 4.28Å; K75-L77 PolarHBondContact O-N 2.78Å; L77-D81 HydrophobicContact CB-CB 4.48Å; L77-D81 HydrophobicContact CD2-CB 3.95Å
78	T	94.8	Very high	93.6	Very high	68 Å²	68	69.4 Å²	69.4	42%	0.417	35%	0.354	S	S	.	.			trans	-78.7	163.9	165.5	71	0	0	0	0	110.3	K80 D81 L82	T78-K80 PolarHBondContact O-N 2.9Å; T78-K80 PolarHBondContact OG1-N 3.35Å; T78-D81 VanDerWaalsContact CB-OD2 3.3Å; T78-D81 WeakPolarHBondContact CB-OD2 3.33Å; T78-D81 WeakPolarHBondContact CG2-OD2 3.32Å; T78-D81 PolarHBondContact N-OD2 2.95Å; T78-D81 PolarHBondContact O-N 3.4Å; T78-D81 PolarHBondContact OG1-N 2.87Å; T78-D81 VanDerWaalsContact OG1-N 3.09Å; T78-D81 PolarHBondContact OG1-OD2 3.44Å; T78-L82 PolarHBondContact O-N 2.89Å
79	Q	93.9	Very high	93.5	Very high	48 Å²	48	76.4 Å²	76.4	22%	0.224	38%	0.384	C	S	.	.	H	α-helix	trans	-57.2	-35.4	172.1	-70.2	179.2	-20.8	0	0	111.3	A83 Q90 I93 E97	Q79-A83 WeakPolarHBondContact O-CB 3.33Å; Q79-A83 PolarHBondContact O-N 3.05Å; Q79-Q90 HydrophobicContact CB-CG 4Å; Q79-I93 HydrophobicContact CB-CG2 4.17Å; Q79-I93 HydrophobicContact CG-CG2 4.06Å; Q79-E97 PolarHBondContact NE2-OE2 3.5Å
80	K	95.4	Very high	93.6	Very high	132 Å²	132	76.4 Å²	76.4	57%	0.574	38%	0.383	S	S	*	.	H	α-helix	trans	-65.8	-42.9	176.4	-176.6	-178.8	176.9	-176.6	0	111.8	T78 A83 T84	T78-K80 PolarHBondContact O-N 2.9Å; T78-K80 PolarHBondContact OG1-N 3.35Å; K80-A83 PolarHBondContact O-N 3.11Å; K80-T84 WeakPolarHBondContact O-CB 3.39Å; K80-T84 PolarHBondContact O-N 2.91Å; K80-T84 PolarHBondContact O-OG1 2.7Å
81	D	94.3	Very high	93.6	Very high	72 Å²	72	75.7 Å²	75.7	39%	0.385	38%	0.38	S	S	.	.	H	α-helix	trans	-66.3	-44.1	178.9	-56.5	-39.8	0	0	0	111	L77 T78 T84 K85	L77-D81 HydrophobicContact CB-CB 4.48Å; L77-D81 HydrophobicContact CD2-CB 3.95Å; T78-D81 VanDerWaalsContact CB-OD2 3.3Å; T78-D81 WeakPolarHBondContact CB-OD2 3.33Å; T78-D81 WeakPolarHBondContact CG2-OD2 3.32Å; T78-D81 PolarHBondContact N-OD2 2.95Å; T78-D81 PolarHBondContact O-N 3.4Å; T78-D81 PolarHBondContact OG1-N 2.87Å; T78-D81 VanDerWaalsContact OG1-N 3.09Å; T78-D81 PolarHBondContact OG1-OD2 3.44Å; D81-T84 PolarHBondContact O-N 3.06Å; D81-K85 VanDerWaalsContact O-CB 3.31Å; D81-K85 WeakPolarHBondContact O-CB 3.24Å; D81-K85 PolarHBondContact O-N 2.94Å
82	L	94.6	Very high	93.6	Very high	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-62.1	-46.6	176.2	-179.4	59	0	0	0	111.2	I68 T78 T84 K85 I86 I93 L111 A114 L115	I68-L82 HydrophobicContact CG2-CD2 4.4Å; T78-L82 PolarHBondContact O-N 2.89Å; L82-T84 VanDerWaalsContact C-N 3.35Å; L82-T84 PolarHBondContact O-N 3.12Å; L82-K85 WeakPolarHBondContact O-CB 3.34Å; L82-K85 PolarHBondContact O-N 3.46Å; L82-I86 HydrophobicContact CD1-CG2 4.31Å; L82-I86 WeakPolarHBondContact O-CG1 3.36Å; L82-I86 PolarHBondContact O-N 3.41Å; L82-I93 HydrophobicContact CD2-CD1 4.13Å; L82-I93 HydrophobicContact CD2-CG2 3.95Å; L82-I93 HydrophobicContact CG-CD1 4.03Å; L82-L111 HydrophobicContact CD1-CD2 4.3Å; L82-L111 HydrophobicContact CD2-CD2 3.91Å; L82-L111 HydrophobicContact CG-CD2 4.19Å; L82-A114 HydrophobicContact CD1-CB 3.86Å; L82-L115 HydrophobicContact CD1-CD2 3.88Å; L82-L115 HydrophobicContact CD1-CG 4.12Å; L82-L115 HydrophobicContact CD2-CD1 4.26Å; L82-L115 HydrophobicContact CD2-CD2 4.07Å; L82-L115 HydrophobicContact CD2-CG 4.42Å
83	A	95.2	Very high	93.6	Very high	3 Å²	3	75.1 Å²	75.1	3%	0.025	38%	0.381	C	S	.	.	H	α-helix	trans	-57.8	-46.9	177.7	0	0	0	0	0	111.8	Q79 K80 K85 I86 N87 E88 Q90 I93	Q79-A83 WeakPolarHBondContact O-CB 3.33Å; Q79-A83 PolarHBondContact O-N 3.05Å; K80-A83 PolarHBondContact O-N 3.11Å; A83-K85 VanDerWaalsContact C-N 3.35Å; A83-K85 PolarHBondContact O-N 3.49Å; A83-I86 PolarHBondContact O-N 3.26Å; A83-N87 PolarHBondContact O-N 2.94Å; A83-E88 CarbonylContact C-O 3.44Å; A83-E88 WeakPolarHBondContact CB-O 3.32Å; A83-E88 PolarHBondContact O-N 2.93Å; A83-Q90 HydrophobicContact CB-CB 4.37Å; A83-I93 HydrophobicContact CB-CG1 3.75Å
84	T	95.1	Very high	93.6	Very high	95 Å²	95	73.7 Å²	73.7	58%	0.583	37%	0.365	S	S	*	.	H	α-helix	trans	-61.2	-44.1	176.4	-54	0	0	0	0	111	K80 D81 L82 I86 N87	K80-T84 WeakPolarHBondContact O-CB 3.39Å; K80-T84 PolarHBondContact O-N 2.91Å; K80-T84 PolarHBondContact O-OG1 2.7Å; D81-T84 PolarHBondContact O-N 3.06Å; L82-T84 VanDerWaalsContact C-N 3.35Å; L82-T84 PolarHBondContact O-N 3.12Å; T84-I86 VanDerWaalsContact C-N 3.31Å; T84-I86 PolarHBondContact O-N 3.13Å; T84-N87 PolarHBondContact O-N 3.45Å; T84-N87 VanDerWaalsContact O-N 3.16Å
85	K	92.7	Very high	93.6	Very high	122 Å²	122	68.2 Å²	68.2	53%	0.53	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-34.3	-180	-172.4	167	-177.7	167.6	0	113.4	D81 L82 A83 A114	D81-K85 VanDerWaalsContact O-CB 3.31Å; D81-K85 WeakPolarHBondContact O-CB 3.24Å; D81-K85 PolarHBondContact O-N 2.94Å; L82-K85 WeakPolarHBondContact O-CB 3.34Å; L82-K85 PolarHBondContact O-N 3.46Å; A83-K85 VanDerWaalsContact C-N 3.35Å; A83-K85 PolarHBondContact O-N 3.49Å; K85-A114 HydrophobicContact CD-CB 4.29Å; K85-A114 HydrophobicContact CG-CB 4.39Å
86	I	93	Very high	93.7	Very high	7 Å²	7	64 Å²	64	4%	0.036	32%	0.323	C	S	.	.	H	α-helix	trans	-95.7	1.3	177.4	70.7	163.2	0	0	0	113.8	L82 A83 T84 E88 I93 I107 K110 L111 A114	L82-I86 HydrophobicContact CD1-CG2 4.31Å; L82-I86 WeakPolarHBondContact O-CG1 3.36Å; L82-I86 PolarHBondContact O-N 3.41Å; A83-I86 PolarHBondContact O-N 3.26Å; T84-I86 VanDerWaalsContact C-N 3.31Å; T84-I86 PolarHBondContact O-N 3.13Å; I86-E88 HydrophobicContact CD1-CB 3.9Å; I86-E88 HydrophobicContact CD1-CG 3.65Å; I86-E88 HydrophobicContact CG1-CB 3.9Å; I86-E88 HydrophobicContact CG1-CG 3.83Å; I86-I93 HydrophobicContact CD1-CD1 3.58Å; I86-I93 HydrophobicContact CG1-CD1 4.3Å; I86-I107 HydrophobicContact CD1-CG2 4.4Å; I86-K110 HydrophobicContact CB-CB 3.92Å; I86-K110 HydrophobicContact CB-CD 4.21Å; I86-K110 HydrophobicContact CG2-CB 3.97Å; I86-K110 WeakPolarHBondContact O-CD 3.21Å; I86-K110 PolarHBondContact O-NZ 2.93Å; I86-L111 HydrophobicContact CD1-CD2 3.83Å; I86-L111 HydrophobicContact CD1-CG 4.11Å; I86-A114 HydrophobicContact CG2-CB 3.68Å
87	N	93.4	Very high	93.6	Very high	134 Å²	134	58.1 Å²	58.1	72%	0.717	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	46.2	-175.2	-56.3	-84.8	0	0	0	112.8	A83 T84	A83-N87 PolarHBondContact O-N 2.94Å; T84-N87 PolarHBondContact O-N 3.45Å; T84-N87 VanDerWaalsContact O-N 3.16Å
88	E	93	Very high	93.5	Very high	39 Å²	39	61.5 Å²	61.5	18%	0.182	31%	0.305	C	S	.	.			trans	-124.2	170.5	172.2	-63.1	-59.9	162.1	0	0	110.6	A83 I86 V92 I107 K110	A83-E88 CarbonylContact C-O 3.44Å; A83-E88 WeakPolarHBondContact CB-O 3.32Å; A83-E88 PolarHBondContact O-N 2.93Å; I86-E88 HydrophobicContact CD1-CB 3.9Å; I86-E88 HydrophobicContact CD1-CG 3.65Å; I86-E88 HydrophobicContact CG1-CB 3.9Å; I86-E88 HydrophobicContact CG1-CG 3.83Å; E88-V92 HydrophobicContact CB-CB 4.45Å; E88-I107 HydrophobicContact CG-CG1 4.35Å; E88-K110 IonicContact OE1-NZ 2.73Å; E88-K110 PolarHBondContact OE1-NZ 3.39Å
89	K	92.4	Very high	93.1	Very high	146 Å²	146	58.8 Å²	58.8	64%	0.635	29%	0.291	S	S	*	.			trans	-76.3	149	175.9	-64.6	-174.9	175.4	-175.2	0	110.8	Q91 V92	K89-Q91 PolarHBondContact O-N 3.06Å; K89-V92 HydrophobicContact CB-CG2 4.19Å; K89-V92 WeakPolarHBondContact O-CB 3.3Å; K89-V92 PolarHBondContact O-N 2.86Å
90	Q	93.6	Very high	92.7	Very high	97 Å²	97	63.3 Å²	63.3	45%	0.453	31%	0.306	S	S	.	.	H	α-helix	trans	-55.2	-38.5	174.7	-176.2	178	-0.6	0	0	112.5	Q79 A83 V92 I93 A94	Q79-Q90 HydrophobicContact CB-CG 4Å; A83-Q90 HydrophobicContact CB-CB 4.37Å; Q90-V92 VanDerWaalsContact C-N 3.25Å; Q90-V92 PolarHBondContact O-N 2.82Å; Q90-I93 WeakPolarHBondContact O-CB 3.4Å; Q90-I93 PolarHBondContact O-N 3.37Å; Q90-I93 VanDerWaalsContact O-N 3.13Å; Q90-A94 PolarHBondContact O-N 2.99Å; Q90-A94 VanDerWaalsContact O-N 3.11Å
91	Q	93.7	Very high	92.3	Very high	108 Å²	108	57.6 Å²	57.6	51%	0.505	28%	0.283	S	S	.	.	H	α-helix	trans	-58.3	-37.2	177.1	-171.7	58.2	48.5	0	0	112.6	K89 I93 A94 D95	K89-Q91 PolarHBondContact O-N 3.06Å; Q91-I93 VanDerWaalsContact C-N 3.35Å; Q91-I93 PolarHBondContact O-N 3.46Å; Q91-A94 PolarHBondContact O-N 3.43Å; Q91-D95 PolarHBondContact NE2-OD1 2.73Å; Q91-D95 VanDerWaalsContact O-CG 3.28Å; Q91-D95 PolarHBondContact O-N 3.25Å
92	V	92.7	Very high	91.8	Very high	35 Å²	35	57.3 Å²	57.3	21%	0.212	28%	0.284	C	S	.	.	H	α-helix	trans	-60.9	-47.3	177.4	176.8	0	0	0	0	109.5	E88 K89 Q90 A94 D95 Y96 I107	E88-V92 HydrophobicContact CB-CB 4.45Å; K89-V92 HydrophobicContact CB-CG2 4.19Å; K89-V92 WeakPolarHBondContact O-CB 3.3Å; K89-V92 PolarHBondContact O-N 2.86Å; Q90-V92 VanDerWaalsContact C-N 3.25Å; Q90-V92 PolarHBondContact O-N 2.82Å; V92-A94 VanDerWaalsContact C-N 3.31Å; V92-A94 PolarHBondContact O-N 2.68Å; V92-D95 PolarHBondContact O-N 3.11Å; V92-Y96 HydrophobicContact CG1-CD2 3.8Å; V92-Y96 HydrophobicContact CG1-CE2 3.73Å; V92-Y96 VanDerWaalsContact O-CD2 3.23Å; V92-Y96 WeakPolarHBondContact O-CD2 3.23Å; V92-Y96 PolarHBondContact O-N 3.12Å; V92-I107 HydrophobicContact CG1-CD1 4.03Å; V92-I107 HydrophobicContact CG1-CG2 4.41Å
93	I	93.2	Very high	91.1	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-58.6	-44.8	177	-55.8	-58	0	0	0	111.3	Q79 L82 A83 I86 Q90 Q91 D95 Y96 E97 L111	Q79-I93 HydrophobicContact CB-CG2 4.17Å; Q79-I93 HydrophobicContact CG-CG2 4.06Å; L82-I93 HydrophobicContact CD2-CD1 4.13Å; L82-I93 HydrophobicContact CD2-CG2 3.95Å; L82-I93 HydrophobicContact CG-CD1 4.03Å; A83-I93 HydrophobicContact CB-CG1 3.75Å; I86-I93 HydrophobicContact CD1-CD1 3.58Å; I86-I93 HydrophobicContact CG1-CD1 4.3Å; Q90-I93 WeakPolarHBondContact O-CB 3.4Å; Q90-I93 PolarHBondContact O-N 3.37Å; Q90-I93 VanDerWaalsContact O-N 3.13Å; Q91-I93 VanDerWaalsContact C-N 3.35Å; Q91-I93 PolarHBondContact O-N 3.46Å; I93-D95 VanDerWaalsContact C-N 3.35Å; I93-D95 PolarHBondContact O-N 3.1Å; I93-Y96 PolarHBondContact O-N 2.97Å; I93-E97 HydrophobicContact CG2-CG 4.4Å; I93-E97 PolarHBondContact O-N 3.4Å; I93-L111 HydrophobicContact CD1-CD2 3.79Å
94	A	94	Very high	90.7	Very high	10 Å²	10	62.1 Å²	62.1	8%	0.083	31%	0.306	C	S	.	.	H	α-helix	trans	-60.8	-43	178.8	0	0	0	0	0	112.1	Q90 Q91 V92 Y96 E97 Q98	Q90-A94 PolarHBondContact O-N 2.99Å; Q90-A94 VanDerWaalsContact O-N 3.11Å; Q91-A94 PolarHBondContact O-N 3.43Å; V92-A94 VanDerWaalsContact C-N 3.31Å; V92-A94 PolarHBondContact O-N 2.68Å; A94-Y96 VanDerWaalsContact C-N 3.31Å; A94-Y96 PolarHBondContact O-N 3.14Å; A94-E97 PolarHBondContact O-N 3.12Å; A94-Q98 WeakPolarHBondContact O-CB 3.32Å; A94-Q98 VanDerWaalsContact O-CG 3.26Å; A94-Q98 WeakPolarHBondContact O-CG 3.41Å; A94-Q98 PolarHBondContact O-N 2.79Å
95	D	92.7	Very high	90.3	Very high	41 Å²	41	61.8 Å²	61.8	22%	0.219	30%	0.298	C	S	.	.	H	α-helix	trans	-67.3	-32.6	178.4	-64.6	-28.5	0	0	0	112.3	Q91 V92 I93 G99 R100 A101	Q91-D95 PolarHBondContact NE2-OD1 2.73Å; Q91-D95 VanDerWaalsContact O-CG 3.28Å; Q91-D95 PolarHBondContact O-N 3.25Å; V92-D95 PolarHBondContact O-N 3.11Å; I93-D95 VanDerWaalsContact C-N 3.35Å; I93-D95 PolarHBondContact O-N 3.1Å; D95-G99 PolarHBondContact O-N 2.79Å; D95-G99 VanDerWaalsContact O-N 3.16Å; D95-R100 PolarHBondContact O-N 2.82Å; D95-R100 IonicContact OD1-CZ 3.99Å; D95-R100 IonicContact OD1-NE 3.02Å; D95-R100 IonicContact OD1-NH2 3.21Å; D95-R100 PolarHBondContact OD1-NH2 3.45Å; D95-A101 HydrophobicContact CB-CB 3.94Å; D95-A101 PolarHBondContact O-N 3.4Å
96	Y	93.1	Very high	90.1	Very high	4 Å²	4	57.9 Å²	57.9	2%	0.016	29%	0.288	C	S	.	.	H	α-helix	trans	-70.3	-44	172.9	-90.7	-97.7	0	0	0	112.4	V60 G65 I68 V92 I93 A94 Q98 G99 A101 V102 N104 I107 I108 L111	V60-Y96 HydrophobicContact CG1-CD1 4.35Å; V60-Y96 HydrophobicContact CG2-CD1 3.68Å; V60-Y96 HydrophobicContact CG2-CE1 3.58Å; G65-Y96 WeakPolarHBondContact CA-O 3.45Å; I68-Y96 HydrophobicContact CD1-CD1 4.35Å; V92-Y96 HydrophobicContact CG1-CD2 3.8Å; V92-Y96 HydrophobicContact CG1-CE2 3.73Å; V92-Y96 VanDerWaalsContact O-CD2 3.23Å; V92-Y96 WeakPolarHBondContact O-CD2 3.23Å; V92-Y96 PolarHBondContact O-N 3.12Å; I93-Y96 PolarHBondContact O-N 2.97Å; A94-Y96 VanDerWaalsContact C-N 3.31Å; A94-Y96 PolarHBondContact O-N 3.14Å; Y96-Q98 PolarHBondContact O-N 3.23Å; Y96-G99 PolarHBondContact O-N 2.9Å; Y96-A101 HydrophobicContact CD1-CB 4.36Å; Y96-A101 HydrophobicContact CD2-CB 3.31Å; Y96-A101 HydrophobicContact CE2-CB 3.52Å; Y96-A101 HydrophobicContact CG-CB 3.79Å; Y96-V102 PolarHBondContact OH-O 2.73Å; Y96-N104 VanDerWaalsContact OH-CB 3.3Å; Y96-N104 WeakPolarHBondContact OH-CB 3Å; Y96-N104 PolarHBondContact OH-N 2.97Å; Y96-N104 VanDerWaalsContact OH-N 3.13Å; Y96-I107 HydrophobicContact CD2-CG2 4.45Å; Y96-I107 HydrophobicContact CE1-CG2 4.25Å; Y96-I107 HydrophobicContact CE2-CB 4.45Å; Y96-I107 HydrophobicContact CE2-CD1 4.3Å; Y96-I107 HydrophobicContact CE2-CG2 3.75Å; Y96-I108 HydrophobicContact CE1-CG1 3.95Å; Y96-L111 HydrophobicContact CD1-CD1 3.99Å; Y96-L111 HydrophobicContact CE1-CD1 4.3Å; Y96-L111 HydrophobicContact CG-CD1 4.35Å
97	E	91.5	Very high	89.9	Confident	24 Å²	24	58.4 Å²	58.4	11%	0.112	29%	0.291	C	S	.	.	H	α-helix	trans	-63.1	-31.8	176.4	-74.4	-175.6	176.6	0	0	111.9	G65 I68 M69 R72 Q79 I93 A94	G65-E97 WeakPolarHBondContact CA-O 3.37Å; I68-E97 HydrophobicContact CB-CG 4.31Å; I68-E97 HydrophobicContact CG2-CG 3.7Å; M69-E97 HydrophobicContact CB-CG 4.42Å; R72-E97 IonicContact CZ-OE1 3.25Å; R72-E97 IonicContact CZ-OE2 2.82Å; R72-E97 IonicContact NE-OE1 3.7Å; R72-E97 PolarHBondContact NE-OE1 2.89Å; R72-E97 IonicContact NE-OE2 2.79Å; R72-E97 IonicContact NH2-OE1 3.86Å; R72-E97 PolarHBondContact NH2-OE1 2.86Å; R72-E97 IonicContact NH2-OE2 3.85Å; R72-E97 PolarHBondContact NH2-OE2 3.35Å; Q79-E97 PolarHBondContact NE2-OE2 3.5Å; I93-E97 HydrophobicContact CG2-CG 4.4Å; I93-E97 PolarHBondContact O-N 3.4Å; A94-E97 PolarHBondContact O-N 3.12Å
98	Q	90.9	Very high	89.8	Confident	105 Å²	105	52.6 Å²	52.6	49%	0.491	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-3.2	178.2	-66.4	174.3	5.1	0	0	114.1	A94 Y96 R100	A94-Q98 WeakPolarHBondContact O-CB 3.32Å; A94-Q98 VanDerWaalsContact O-CG 3.26Å; A94-Q98 WeakPolarHBondContact O-CG 3.41Å; A94-Q98 PolarHBondContact O-N 2.79Å; Y96-Q98 PolarHBondContact O-N 3.23Å; Q98-R100 VanDerWaalsContact C-N 3.26Å; Q98-R100 HydrophobicContact CB-CG 4.18Å; Q98-R100 PolarHBondContact O-N 3.17Å
99	G	87.2	Confident	89.7	Confident	12 Å²	12	52.3 Å²	52.3	12%	0.124	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	18	-178.5	0	0	0	0	0	115	V60 D95 Y96	V60-G99 CarbonylContact O-C 3.58Å; V60-G99 VanDerWaalsContact O-CA 3.23Å; V60-G99 WeakPolarHBondContact O-CA 3.16Å; D95-G99 PolarHBondContact O-N 2.79Å; D95-G99 VanDerWaalsContact O-N 3.16Å; Y96-G99 PolarHBondContact O-N 2.9Å
100	R	85.5	Confident	89.6	Confident	143 Å²	143	48.5 Å²	48.5	54%	0.54	25%	0.245	S	C	.	.			trans	-96	-12.3	179.3	-57	-174.2	-53.9	176	7.8	113.1	D95 Q98	D95-R100 PolarHBondContact O-N 2.82Å; D95-R100 IonicContact OD1-CZ 3.99Å; D95-R100 IonicContact OD1-NE 3.02Å; D95-R100 IonicContact OD1-NH2 3.21Å; D95-R100 PolarHBondContact OD1-NH2 3.45Å; Q98-R100 VanDerWaalsContact C-N 3.26Å; Q98-R100 HydrophobicContact CB-CG 4.18Å; Q98-R100 PolarHBondContact O-N 3.17Å
101	A	85.9	Confident	89.6	Confident	11 Å²	11	43.9 Å²	43.9	9%	0.091	22%	0.224	C	C	.	.	S	Bend	trans	-74.8	143.2	179	0	0	0	0	0	111.8	L59 V60 D95 Y96	L59-A101 WeakPolarHBondContact CA-O 3.14Å; V60-A101 HydrophobicContact CG2-CB 4.37Å; V60-A101 WeakPolarHBondContact CG2-O 3.3Å; V60-A101 PolarHBondContact N-O 3.43Å; D95-A101 HydrophobicContact CB-CB 3.94Å; D95-A101 PolarHBondContact O-N 3.4Å; Y96-A101 HydrophobicContact CD1-CB 4.36Å; Y96-A101 HydrophobicContact CD2-CB 3.31Å; Y96-A101 HydrophobicContact CE2-CB 3.52Å; Y96-A101 HydrophobicContact CG-CB 3.79Å
102	V	83.8	Confident	89.5	Confident	67 Å²	67	39.1 Å²	39.1	41%	0.406	20%	0.202	S	C	.	.	B	Isolated β-bridge	trans	-67.7	134.3	167.5	177	0	0	0	0	109.1	H57 L59 Y96 N104	H57-V102 HydrophobicContact CB-CG1 4.06Å; H57-V102 HydrophobicContact CB-CG2 3.86Å; L59-V102 HydrophobicContact CD2-CG2 4.29Å; Y96-V102 PolarHBondContact OH-O 2.73Å; V102-N104 PolarHBondContact O-N 3.03Å
103	K	81.4	Confident	89.4	Confident	71 Å²	71	45.3 Å²	45.3	31%	0.309	23%	0.225	S	C	.	.			trans	-61.2	99.8	179.4	-78	169.8	175	143.7	0	111.6	D58 L59 V60 D61 I108	D58-K103 HydrophobicContact CB-CD 3.89Å; D58-K103 WeakPolarHBondContact O-CB 3.29Å; D58-K103 VanDerWaalsContact O-CG 3.31Å; D58-K103 WeakPolarHBondContact O-CG 3.48Å; D58-K103 PolarHBondContact O-N 2.93Å; D58-K103 VanDerWaalsContact O-N 3.12Å; L59-K103 WeakPolarHBondContact O-CE 3.47Å; L59-K103 PolarHBondContact O-NZ 3.06Å; V60-K103 HydrophobicContact CB-CG 4.49Å; V60-K103 HydrophobicContact CG2-CG 3.78Å; D61-K103 IonicContact OD1-NZ 3.92Å; D61-K103 PolarHBondContact OD1-NZ 2.9Å; K103-I108 HydrophobicContact CB-CD1 4.49Å
104	N	86	Confident	89.3	Confident	33 Å²	33	45.6 Å²	45.6	18%	0.176	23%	0.228	C	C	.	.			trans	-100	119.9	170.1	-179.3	-57.9	0	0	0	112.9	E42 Y96 V102 A106 I107 I108	E42-N104 VanDerWaalsContact CD-CA 3.43Å; E42-N104 WeakPolarHBondContact OE1-CA 3.34Å; E42-N104 VanDerWaalsContact OE1-CB 3.3Å; E42-N104 WeakPolarHBondContact OE1-CB 3.48Å; E42-N104 PolarHBondContact OE1-ND2 2.95Å; E42-N104 VanDerWaalsContact OE1-ND2 3.12Å; E42-N104 PolarHBondContact OE1-OD1 3.13Å; E42-N104 WeakPolarHBondContact OE2-CA 3.44Å; E42-N104 WeakPolarHBondContact OE2-CB 3.17Å; E42-N104 VanDerWaalsContact OE2-CG 3.22Å; E42-N104 PolarHBondContact OE2-ND2 3.21Å; Y96-N104 VanDerWaalsContact OH-CB 3.3Å; Y96-N104 WeakPolarHBondContact OH-CB 3Å; Y96-N104 PolarHBondContact OH-N 2.97Å; Y96-N104 VanDerWaalsContact OH-N 3.13Å; V102-N104 PolarHBondContact O-N 3.03Å; N104-A106 PolarHBondContact O-N 3.31Å; N104-A106 WeakPolarHBondContact OD1-CA 3.3Å; N104-A106 VanDerWaalsContact OD1-CB 3.32Å; N104-A106 WeakPolarHBondContact OD1-CB 3.46Å; N104-A106 PolarHBondContact OD1-N 3.18Å; N104-I107 HydrophobicContact CB-CB 4.2Å; N104-I107 HydrophobicContact CB-CD1 3.93Å; N104-I107 HydrophobicContact CB-CG1 4.18Å; N104-I107 PolarHBondContact O-N 2.82Å; N104-I107 PolarHBondContact OD1-N 3.25Å; N104-I108 WeakPolarHBondContact O-CB 3.47Å; N104-I108 WeakPolarHBondContact O-CD1 3.19Å; N104-I108 WeakPolarHBondContact O-CG1 3.45Å; N104-I108 PolarHBondContact O-N 3.34Å
105	Q	86.6	Confident	89.2	Confident	88 Å²	88	45.3 Å²	45.3	41%	0.411	23%	0.225	S	C	.	.	H	α-helix	trans	-69.4	-31.9	-174.7	-174.8	53.8	100.5	0	0	112.4	E42 S109 R120	E42-Q105 PolarHBondContact OE1-N 2.72Å; Q105-S109 PolarHBondContact NE2-OG 3.14Å; Q105-S109 WeakPolarHBondContact O-CB 3.29Å; Q105-S109 PolarHBondContact O-N 3.46Å; Q105-S109 PolarHBondContact O-OG 3.02Å; Q105-R120 VanDerWaalsContact NE2-CD 3.33Å; Q105-R120 VanDerWaalsContact NE2-CZ 3.26Å; Q105-R120 VanDerWaalsContact OE1-CD 3.32Å
106	A	87.7	Confident	89	Confident	40 Å²	40	44.4 Å²	44.4	33%	0.331	23%	0.225	S	C	.	.	H	α-helix	trans	-67.5	-47.2	175.7	0	0	0	0	0	110.7	N104 S109 K110	N104-A106 PolarHBondContact O-N 3.31Å; N104-A106 WeakPolarHBondContact OD1-CA 3.3Å; N104-A106 VanDerWaalsContact OD1-CB 3.32Å; N104-A106 WeakPolarHBondContact OD1-CB 3.46Å; N104-A106 PolarHBondContact OD1-N 3.18Å; A106-S109 PolarHBondContact O-N 3.04Å; A106-K110 WeakPolarHBondContact O-CG 3.23Å; A106-K110 PolarHBondContact O-N 2.74Å; A106-K110 VanDerWaalsContact O-N 3.09Å
107	I	90.4	Very high	89	Confident	17 Å²	17	44.8 Å²	44.8	9%	0.087	23%	0.228	C	C	.	.	H	α-helix	trans	-63.6	-46.3	178.3	-64.2	172.3	0	0	0	110.8	I86 E88 V92 Y96 N104 S109 K110 L111	I86-I107 HydrophobicContact CD1-CG2 4.4Å; E88-I107 HydrophobicContact CG-CG1 4.35Å; V92-I107 HydrophobicContact CG1-CD1 4.03Å; V92-I107 HydrophobicContact CG1-CG2 4.41Å; Y96-I107 HydrophobicContact CD2-CG2 4.45Å; Y96-I107 HydrophobicContact CE1-CG2 4.25Å; Y96-I107 HydrophobicContact CE2-CB 4.45Å; Y96-I107 HydrophobicContact CE2-CD1 4.3Å; Y96-I107 HydrophobicContact CE2-CG2 3.75Å; N104-I107 HydrophobicContact CB-CB 4.2Å; N104-I107 HydrophobicContact CB-CD1 3.93Å; N104-I107 HydrophobicContact CB-CG1 4.18Å; N104-I107 PolarHBondContact O-N 2.82Å; N104-I107 PolarHBondContact OD1-N 3.25Å; I107-S109 VanDerWaalsContact C-N 3.28Å; I107-S109 PolarHBondContact O-N 3.27Å; I107-K110 WeakPolarHBondContact O-CB 3.41Å; I107-K110 PolarHBondContact O-N 2.92Å; I107-K110 VanDerWaalsContact O-N 3.07Å; I107-L111 HydrophobicContact CG2-CD1 3.94Å; I107-L111 HydrophobicContact CG2-CG 4.3Å; I107-L111 WeakPolarHBondContact O-CG 3.4Å; I107-L111 PolarHBondContact O-N 3.46Å
108	I	90.4	Very high	88.9	Confident	13 Å²	13	47 Å²	47	7%	0.067	24%	0.238	C	C	.	.	H	α-helix	trans	-57.1	-44.4	176.8	-69	164.9	0	0	0	110.6	Y96 K103 N104 K110 L111 E112 L119 R120	Y96-I108 HydrophobicContact CE1-CG1 3.95Å; K103-I108 HydrophobicContact CB-CD1 4.49Å; N104-I108 WeakPolarHBondContact O-CB 3.47Å; N104-I108 WeakPolarHBondContact O-CD1 3.19Å; N104-I108 WeakPolarHBondContact O-CG1 3.45Å; N104-I108 PolarHBondContact O-N 3.34Å; I108-K110 VanDerWaalsContact C-N 3.3Å; I108-K110 PolarHBondContact O-N 3.17Å; I108-L111 PolarHBondContact O-N 3.17Å; I108-E112 HydrophobicContact CG2-CG 4.28Å; I108-E112 WeakPolarHBondContact O-CG 3.43Å; I108-E112 PolarHBondContact O-N 3.24Å; I108-L119 HydrophobicContact CG2-CB 4.07Å; I108-R120 HydrophobicContact CG2-CG 3.64Å
109	S	90.3	Very high	88.7	Confident	32 Å²	32	42.1 Å²	42.1	22%	0.224	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-35	178.6	-56.8	0	0	0	0	112.7	Q105 A106 I107 K113	Q105-S109 PolarHBondContact NE2-OG 3.14Å; Q105-S109 WeakPolarHBondContact O-CB 3.29Å; Q105-S109 PolarHBondContact O-N 3.46Å; Q105-S109 PolarHBondContact O-OG 3.02Å; A106-S109 PolarHBondContact O-N 3.04Å; I107-S109 VanDerWaalsContact C-N 3.28Å; I107-S109 PolarHBondContact O-N 3.27Å; S109-K113 WeakPolarHBondContact O-CG 3.11Å; S109-K113 PolarHBondContact O-N 3.44Å
110	K	91.5	Very high	88.6	Confident	66 Å²	66	46.5 Å²	46.5	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-70.2	-42.6	174.8	-65	175.6	-175.4	179.9	0	111.4	I86 E88 A106 I107 I108 K113 A114	I86-K110 HydrophobicContact CB-CB 3.92Å; I86-K110 HydrophobicContact CB-CD 4.21Å; I86-K110 HydrophobicContact CG2-CB 3.97Å; I86-K110 WeakPolarHBondContact O-CD 3.21Å; I86-K110 PolarHBondContact O-NZ 2.93Å; E88-K110 IonicContact OE1-NZ 2.73Å; E88-K110 PolarHBondContact OE1-NZ 3.39Å; A106-K110 WeakPolarHBondContact O-CG 3.23Å; A106-K110 PolarHBondContact O-N 2.74Å; A106-K110 VanDerWaalsContact O-N 3.09Å; I107-K110 WeakPolarHBondContact O-CB 3.41Å; I107-K110 PolarHBondContact O-N 2.92Å; I107-K110 VanDerWaalsContact O-N 3.07Å; I108-K110 VanDerWaalsContact C-N 3.3Å; I108-K110 PolarHBondContact O-N 3.17Å; K110-K113 PolarHBondContact O-N 3.14Å; K110-A114 WeakPolarHBondContact O-CB 3.42Å; K110-A114 PolarHBondContact O-N 3.45Å
111	L	92.1	Very high	88.4	Confident	1 Å²	1	42.5 Å²	42.5	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-47.3	177	-73.6	170.2	0	0	0	111.5	I68 L82 I86 I93 Y96 I107 I108 K113 A114 L115 L119	I68-L111 HydrophobicContact CD1-CD1 4.03Å; L82-L111 HydrophobicContact CD1-CD2 4.3Å; L82-L111 HydrophobicContact CD2-CD2 3.91Å; L82-L111 HydrophobicContact CG-CD2 4.19Å; I86-L111 HydrophobicContact CD1-CD2 3.83Å; I86-L111 HydrophobicContact CD1-CG 4.11Å; I93-L111 HydrophobicContact CD1-CD2 3.79Å; Y96-L111 HydrophobicContact CD1-CD1 3.99Å; Y96-L111 HydrophobicContact CE1-CD1 4.3Å; Y96-L111 HydrophobicContact CG-CD1 4.35Å; I107-L111 HydrophobicContact CG2-CD1 3.94Å; I107-L111 HydrophobicContact CG2-CG 4.3Å; I107-L111 WeakPolarHBondContact O-CG 3.4Å; I107-L111 PolarHBondContact O-N 3.46Å; I108-L111 PolarHBondContact O-N 3.17Å; L111-K113 VanDerWaalsContact C-N 3.28Å; L111-K113 PolarHBondContact O-N 3.28Å; L111-A114 PolarHBondContact O-N 3.42Å; L111-L115 HydrophobicContact CD2-CD1 4.47Å; L111-L115 VanDerWaalsContact O-CB 3.29Å; L111-L115 WeakPolarHBondContact O-CB 3.46Å; L111-L115 WeakPolarHBondContact O-CG 3.36Å; L111-L115 PolarHBondContact O-N 3.04Å; L111-L119 HydrophobicContact CB-CD1 3.66Å; L111-L119 HydrophobicContact CD1-CD1 4.36Å
112	E	91.7	Very high	88.1	Confident	8 Å²	8	52.4 Å²	52.4	4%	0.037	27%	0.272	C	S	.	.	H	α-helix	trans	-55.5	-44.6	176.6	-73.2	-178.2	154.8	0	0	111.3	I108 G116 V117 L119 R120 L128	I108-E112 HydrophobicContact CG2-CG 4.28Å; I108-E112 WeakPolarHBondContact O-CG 3.43Å; I108-E112 PolarHBondContact O-N 3.24Å; E112-G116 VanDerWaalsContact O-CA 3.24Å; E112-G116 WeakPolarHBondContact O-CA 2.99Å; E112-G116 PolarHBondContact O-N 3.07Å; E112-V117 WeakPolarHBondContact CA-O 3.42Å; E112-V117 WeakPolarHBondContact CB-O 3.21Å; E112-V117 WeakPolarHBondContact CG-O 3.42Å; E112-V117 PolarHBondContact O-N 3.32Å; E112-L119 HydrophobicContact CG-CB 3.82Å; E112-L119 HydrophobicContact CG-CD1 4.12Å; E112-L119 HydrophobicContact CG-CG 3.8Å; E112-L119 PolarHBondContact OE1-N 3.1Å; E112-R120 WeakPolarHBondContact OE1-CG 3.31Å; E112-R120 IonicContact OE1-CZ 2.76Å; E112-R120 PolarHBondContact OE1-N 3.4Å; E112-R120 VanDerWaalsContact OE1-N 3.17Å; E112-R120 IonicContact OE1-NE 2.82Å; E112-R120 PolarHBondContact OE1-NE 3.4Å; E112-R120 VanDerWaalsContact OE1-NE 3.1Å; E112-R120 IonicContact OE1-NH2 3.52Å; E112-R120 IonicContact OE2-CZ 3.41Å; E112-R120 VanDerWaalsContact OE2-CZ 3.29Å; E112-R120 IonicContact OE2-NE 3.72Å; E112-R120 PolarHBondContact OE2-NE 3.44Å; E112-R120 VanDerWaalsContact OE2-NE 3.11Å; E112-R120 IonicContact OE2-NH2 2.72Å; E112-R120 PolarHBondContact OE2-NH2 3.06Å; E112-L128 HydrophobicContact CB-CD1 4.45Å; E112-L128 HydrophobicContact CB-CD2 4.13Å; E112-L128 WeakPolarHBondContact O-CD2 3.31Å
113	K	90.5	Very high	87.9	Confident	164 Å²	164	52.1 Å²	52.1	71%	0.713	27%	0.268	S	S	*	.	H	α-helix	trans	-68.2	-43.1	178.2	-71.5	175.4	-178.3	-177.9	0	112.9	S109 K110 L111 L128	S109-K113 WeakPolarHBondContact O-CG 3.11Å; S109-K113 PolarHBondContact O-N 3.44Å; K110-K113 PolarHBondContact O-N 3.14Å; L111-K113 VanDerWaalsContact C-N 3.28Å; L111-K113 PolarHBondContact O-N 3.28Å; K113-L128 HydrophobicContact CG-CD2 4.21Å
114	A	91.4	Very high	88	Confident	8 Å²	8	52.3 Å²	52.3	7%	0.066	27%	0.269	C	S	.	.	H	α-helix	trans	-69.6	-40.9	-178.2	0	0	0	0	0	112.1	K75 L82 K85 I86 K110 L111	K75-A114 PolarHBondContact NZ-O 3.41Å; L82-A114 HydrophobicContact CD1-CB 3.86Å; K85-A114 HydrophobicContact CD-CB 4.29Å; K85-A114 HydrophobicContact CG-CB 4.39Å; I86-A114 HydrophobicContact CG2-CB 3.68Å; K110-A114 WeakPolarHBondContact O-CB 3.42Å; K110-A114 PolarHBondContact O-N 3.45Å; L111-A114 PolarHBondContact O-N 3.42Å
115	L	92.1	Very high	87.8	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-88.3	-16.6	-178.9	-62.1	175	0	0	0	112.7	I68 A71 R72 K75 L82 L111 V117	I68-L115 HydrophobicContact CB-CD1 4.29Å; I68-L115 HydrophobicContact CG1-CD1 4.27Å; I68-L115 HydrophobicContact CG2-CD1 3.96Å; A71-L115 HydrophobicContact CB-CB 4.05Å; A71-L115 HydrophobicContact CB-CD1 4.37Å; A71-L115 HydrophobicContact CB-CD2 4.36Å; A71-L115 HydrophobicContact CB-CG 4.49Å; R72-L115 HydrophobicContact CB-CD2 4.21Å; K75-L115 WeakPolarHBondContact CE-O 3.34Å; K75-L115 PolarHBondContact NZ-O 3.03Å; L82-L115 HydrophobicContact CD1-CD2 3.88Å; L82-L115 HydrophobicContact CD1-CG 4.12Å; L82-L115 HydrophobicContact CD2-CD1 4.26Å; L82-L115 HydrophobicContact CD2-CD2 4.07Å; L82-L115 HydrophobicContact CD2-CG 4.42Å; L111-L115 HydrophobicContact CD2-CD1 4.47Å; L111-L115 VanDerWaalsContact O-CB 3.29Å; L111-L115 WeakPolarHBondContact O-CB 3.46Å; L111-L115 WeakPolarHBondContact O-CG 3.36Å; L111-L115 PolarHBondContact O-N 3.04Å; L115-V117 HydrophobicContact CB-CG2 3.83Å; L115-V117 PolarHBondContact O-N 3.49Å
116	G	89.7	Confident	87.7	Confident	22 Å²	22	53.8 Å²	53.8	23%	0.227	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	28.5	179.1	0	0	0	0	0	112.7	E112 P127 L128	E112-G116 VanDerWaalsContact O-CA 3.24Å; E112-G116 WeakPolarHBondContact O-CA 2.99Å; E112-G116 PolarHBondContact O-N 3.07Å; G116-P127 CarbonylContact O-C 3.5Å; G116-P127 VanDerWaalsContact O-CA 3.3Å; G116-P127 WeakPolarHBondContact O-CA 3.48Å; G116-L128 PolarHBondContact O-N 3.45Å
117	V	91.5	Very high	87.5	Confident	13 Å²	13	55.8 Å²	55.8	8%	0.079	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-129.4	149.9	177.7	-63.1	0	0	0	0	109.5	I67 A71 E112 L115 L119 K126	I67-V117 HydrophobicContact CG2-CG2 4.16Å; A71-V117 HydrophobicContact CB-CG1 3.94Å; A71-V117 HydrophobicContact CB-CG2 3.85Å; E112-V117 WeakPolarHBondContact CA-O 3.42Å; E112-V117 WeakPolarHBondContact CB-O 3.21Å; E112-V117 WeakPolarHBondContact CG-O 3.42Å; E112-V117 PolarHBondContact O-N 3.32Å; L115-V117 HydrophobicContact CB-CG2 3.83Å; L115-V117 PolarHBondContact O-N 3.49Å; V117-L119 HydrophobicContact CG2-CD2 3.98Å; V117-L119 HydrophobicContact CG2-CG 4.49Å; V117-K126 CarbonylContact C-O 3.59Å; V117-K126 WeakPolarHBondContact CA-O 3.39Å
118	K	89.9	Confident	86.8	Confident	70 Å²	70	58.4 Å²	58.4	30%	0.304	31%	0.306	S	S	.	.			trans	-79.5	131.6	172.2	-68.5	-175.9	-175.2	178.9	0	109.4	D123 K124 G125 K126 L128	K118-D123 HydrophobicContact CD-CB 4.02Å; K118-D123 IonicContact NZ-OD2 3.4Å; K118-K124 CarbonylContact O-C 3.52Å; K118-K124 WeakPolarHBondContact O-CA 3.38Å; K118-G125 PolarHBondContact O-N 3.27Å; K118-K126 PolarHBondContact N-O 3.06Å; K118-L128 HydrophobicContact CG-CD1 3.85Å
119	L	87.1	Confident	85.6	Confident	2 Å²	2	60.5 Å²	60.5	1%	0.01	33%	0.331	C	S	.	.			trans	-110.2	-1.9	175.9	-60	178.6	0	0	0	111.5	I64 I67 I68 I108 L111 E112 V117	I64-L119 HydrophobicContact CG2-CB 4.34Å; I64-L119 HydrophobicContact CG2-CD2 4.35Å; I67-L119 HydrophobicContact CB-CD2 4.28Å; I67-L119 HydrophobicContact CG2-CD2 3.62Å; I68-L119 HydrophobicContact CD1-CD1 4.04Å; I68-L119 HydrophobicContact CG1-CD1 3.79Å; I68-L119 HydrophobicContact CG1-CD2 3.88Å; I108-L119 HydrophobicContact CG2-CB 4.07Å; L111-L119 HydrophobicContact CB-CD1 3.66Å; L111-L119 HydrophobicContact CD1-CD1 4.36Å; E112-L119 HydrophobicContact CG-CB 3.82Å; E112-L119 HydrophobicContact CG-CD1 4.12Å; E112-L119 HydrophobicContact CG-CG 3.8Å; E112-L119 PolarHBondContact OE1-N 3.1Å; V117-L119 HydrophobicContact CG2-CD2 3.98Å; V117-L119 HydrophobicContact CG2-CG 4.49Å
120	R	84.8	Confident	83.8	Confident	104 Å²	104	63.8 Å²	63.8	39%	0.392	35%	0.354	S	S	.	.	S	Bend	trans	-122.6	157.6	-177.2	-63	177.5	-70.8	162.2	-0.3	112.4	Q105 I108 E112	Q105-R120 VanDerWaalsContact NE2-CD 3.33Å; Q105-R120 VanDerWaalsContact NE2-CZ 3.26Å; Q105-R120 VanDerWaalsContact OE1-CD 3.32Å; I108-R120 HydrophobicContact CG2-CG 3.64Å; E112-R120 WeakPolarHBondContact OE1-CG 3.31Å; E112-R120 IonicContact OE1-CZ 2.76Å; E112-R120 PolarHBondContact OE1-N 3.4Å; E112-R120 VanDerWaalsContact OE1-N 3.17Å; E112-R120 IonicContact OE1-NE 2.82Å; E112-R120 PolarHBondContact OE1-NE 3.4Å; E112-R120 VanDerWaalsContact OE1-NE 3.1Å; E112-R120 IonicContact OE1-NH2 3.52Å; E112-R120 IonicContact OE2-CZ 3.41Å; E112-R120 VanDerWaalsContact OE2-CZ 3.29Å; E112-R120 IonicContact OE2-NE 3.72Å; E112-R120 PolarHBondContact OE2-NE 3.44Å; E112-R120 VanDerWaalsContact OE2-NE 3.11Å; E112-R120 IonicContact OE2-NH2 2.72Å; E112-R120 PolarHBondContact OE2-NH2 3.06Å
121	G	82.1	Confident	81.2	Confident	60 Å²	60	66.1 Å²	66.1	62%	0.619	38%	0.379	S	S	*	.	S	Bend	trans	78.6	-159.6	174.6	0	0	0	0	0	113.4	K124	G121-K124 WeakPolarHBondContact O-CG 3.42Å
122	K	78.7	Confident	78.5	Confident	218 Å²	218	75.5 Å²	75.5	95%	0.948	42%	0.42	S	S	*	.	S	Bend	trans	-79.7	-20.3	179.7	-62.9	-178.2	178.6	-177.3	0	113	K124	K122-K124 PolarHBondContact O-N 3.14Å
123	D	80.7	Confident	75.5	Confident	61 Å²	61	84.7 Å²	84.7	33%	0.326	46%	0.459	S	S	.	.			trans	-96	31.2	-175.8	-68.9	-46.4	0	0	0	113.1	K118 G125 K126	K118-D123 HydrophobicContact CD-CB 4.02Å; K118-D123 IonicContact NZ-OD2 3.4Å; D123-G125 PolarHBondContact O-N 2.84Å; D123-K126 HydrophobicContact CB-CB 4.35Å; D123-K126 HydrophobicContact CB-CD 3.89Å; D123-K126 HydrophobicContact CB-CG 4.24Å; D123-K126 WeakPolarHBondContact O-CB 3.3Å; D123-K126 PolarHBondContact O-N 2.73Å; D123-K126 VanDerWaalsContact O-N 3.12Å; D123-K126 WeakPolarHBondContact OD1-CE 3.42Å; D123-K126 IonicContact OD1-NZ 3.29Å; D123-K126 PolarHBondContact OD1-NZ 3.21Å
124	K	82.2	Confident	72.7	Confident	76 Å²	76	87.3 Å²	87.3	33%	0.33	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	134	179.2	-64.2	178.8	-177.4	177	0	109.8	D61 I64 I67 K118 G121 K122 K126	D61-K124 IonicContact OD2-NZ 3.82Å; D61-K124 PolarHBondContact OD2-NZ 3.44Å; I64-K124 HydrophobicContact CG1-CD 4.18Å; I67-K124 HydrophobicContact CD1-CB 3.84Å; K118-K124 CarbonylContact O-C 3.52Å; K118-K124 WeakPolarHBondContact O-CA 3.38Å; G121-K124 WeakPolarHBondContact O-CG 3.42Å; K122-K124 PolarHBondContact O-N 3.14Å; K124-K126 VanDerWaalsContact C-N 3.32Å; K124-K126 PolarHBondContact O-N 3.25Å
125	G	81.9	Confident	71.8	Confident	35 Å²	35	91.3 Å²	91.3	36%	0.361	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-13.1	-178.6	0	0	0	0	0	115.2	K118 D123	K118-G125 PolarHBondContact O-N 3.27Å; D123-G125 PolarHBondContact O-N 2.84Å
126	K	85.9	Confident	70.7	Confident	116 Å²	116	95.9 Å²	95.9	50%	0.504	53%	0.527	S	S	.	.	S	Bend	trans	-72.8	151.9	174.5	-65	-167.5	-174.2	166.2	0	111.2	V117 K118 D123 K124 L128	V117-K126 CarbonylContact C-O 3.59Å; V117-K126 WeakPolarHBondContact CA-O 3.39Å; K118-K126 PolarHBondContact N-O 3.06Å; D123-K126 HydrophobicContact CB-CB 4.35Å; D123-K126 HydrophobicContact CB-CD 3.89Å; D123-K126 HydrophobicContact CB-CG 4.24Å; D123-K126 WeakPolarHBondContact O-CB 3.3Å; D123-K126 PolarHBondContact O-N 2.73Å; D123-K126 VanDerWaalsContact O-N 3.12Å; D123-K126 WeakPolarHBondContact OD1-CE 3.42Å; D123-K126 IonicContact OD1-NZ 3.29Å; D123-K126 PolarHBondContact OD1-NZ 3.21Å; K124-K126 VanDerWaalsContact C-N 3.32Å; K124-K126 PolarHBondContact O-N 3.25Å; K126-L128 PolarHBondContact O-N 3.33Å
127	P	83.2	Confident	69.7	Low	83 Å²	83	100 Å²	100	54%	0.539	54%	0.544	S	S	.	.	B	Isolated β-bridge	trans	-58.3	135.6	177.1	23.2	-33.7	0	0	0	111.6	G116 G129	G116-P127 CarbonylContact O-C 3.5Å; G116-P127 VanDerWaalsContact O-CA 3.3Å; G116-P127 WeakPolarHBondContact O-CA 3.48Å; P127-G129 PolarHBondContact O-N 3.33Å
128	L	76.2	Confident	68.4	Low	71 Å²	71	105.1 Å²	105.1	37%	0.372	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.1	90.2	173.5	-173.1	76.9	0	0	0	108.3	E112 K113 G116 K118 K126	E112-L128 HydrophobicContact CB-CD1 4.45Å; E112-L128 HydrophobicContact CB-CD2 4.13Å; E112-L128 WeakPolarHBondContact O-CD2 3.31Å; K113-L128 HydrophobicContact CG-CD2 4.21Å; G116-L128 PolarHBondContact O-N 3.45Å; K118-L128 HydrophobicContact CG-CD1 3.85Å; K126-L128 PolarHBondContact O-N 3.33Å
129	G	65.2	Low	67.1	Low	57 Å²	57	107.3 Å²	107.3	59%	0.588	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	110.6	44.1	168.6	0	0	0	0	0	116.2	P127 S131	P127-G129 PolarHBondContact O-N 3.33Å; G129-S131 VanDerWaalsContact C-N 3.32Å; G129-S131 PolarHBondContact O-N 3.33Å
130	S	52	Low	65.7	Low	101 Å²	101	114.3 Å²	114.3	71%	0.706	63%	0.627	S	S	*	*	S	Bend	trans	-52.4	103.4	151.7	54.3	0	0	0	0	108.6
131	S	36.3	Very low	64.4	Low	116 Å²	116	115.1 Å²	115.1	81%	0.811	64%	0.643	S	S	*	*	S	Bend	trans	77.7	84.8	174	-57.8	0	0	0	0	118.4	G129	G129-S131 VanDerWaalsContact C-N 3.32Å; G129-S131 PolarHBondContact O-N 3.33Å
132	K	34.6	Very low	63	Low	198 Å²	198	119.3 Å²	119.3	86%	0.861	65%	0.645	S	S	*	*				-165.2	96	116.1	-111	178.7	-179	175.8	0	111
133	K	30	Very low	61.7	Low	200 Å²	200	111.1 Å²	111.1	87%	0.87	62%	0.62	S	S	*	*			trans	-83.9	130.6	155.5	-141.8	176.8	-171.3	177.9	0	105
134	N	32	Very low	60	Low	219 Å²	219	115.6 Å²	115.6	100%	1.171	65%	0.647	S	S	*	*			trans	87.8	0	-178.7	-52.7	-6.8	0	0	0	116.2

Retrieved 134 of 134 residues in 283.2 ms (Link to these results)

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