A0A3Q0KKP2_SCHMA Loading...

Putative ift20

AlphaFold DB , UniProt , Accession A0A3Q0KKP2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 131 aa.

						>A0A3Q0KKP2_SCHMA|A0A3Q0KKP2
MAELLAQAGLYIDDFYKLRIVDPRVAQETNELKEECEKYLSKMTDFKMIIGELLNLISSVAEKVESRKLKAIGSRNLLASMEKQRELQQKHLESQILAKKKDIDRLNVQLESLQKEEAEQTEFIERFLMGR
					

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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	73.9	Confident	85.5	Confident	165 Å²	165	89.5 Å²	89.5	81%	0.813	51%	0.506	S	S	*	.				0	-52.9	0	-70.9	-49.7	-69.4	0	0	112.7	E3 L4 L5	M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.38Å; M1-L4 PolarHBondContact O-N 2.92Å; M1-L4 VanDerWaalsContact O-N 3.15Å; M1-L4 HydrophobicContact SD-CD1 4.1Å; M1-L5 WeakPolarHBondContact O-CG 3.37Å; M1-L5 PolarHBondContact O-N 2.94Å
2	A	76.9	Confident	85.9	Confident	76 Å²	76	89.1 Å²	89.1	63%	0.628	50%	0.5	S	S	*	.	H	α-helix	trans	-55	-44.3	178.8	0	0	0	0	0	113.5	L5 A6	A2-L5 PolarHBondContact O-N 3.19Å; A2-A6 WeakPolarHBondContact O-CB 3.36Å; A2-A6 PolarHBondContact O-N 3.15Å
3	E	81.9	Confident	86.2	Confident	159 Å²	159	82.9 Å²	82.9	74%	0.743	47%	0.465	S	S	*	.	H	α-helix	trans	-64.7	-39.4	176.2	-70.2	177.6	166.8	0	0	113.4	M1 A6 Q7	M1-E3 VanDerWaalsContact C-N 3.34Å; M1-E3 PolarHBondContact O-N 3.38Å; E3-A6 PolarHBondContact O-N 3.5Å; E3-Q7 WeakPolarHBondContact O-CG 3.42Å; E3-Q7 PolarHBondContact O-N 3.35Å
4	L	87.4	Confident	86.4	Confident	105 Å²	105	87.7 Å²	87.7	55%	0.55	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-39.4	176	-72	167.3	0	0	0	111.5	M1 Q7 A8	M1-L4 PolarHBondContact O-N 2.92Å; M1-L4 VanDerWaalsContact O-N 3.15Å; M1-L4 HydrophobicContact SD-CD1 4.1Å; L4-Q7 PolarHBondContact O-N 2.99Å; L4-A8 PolarHBondContact O-N 3.34Å
5	L	86.8	Confident	86.7	Confident	36 Å²	36	92.1 Å²	92.1	19%	0.188	50%	0.502	C	S	.	.	H	α-helix	trans	-64.5	-45.6	173.7	-70.3	171.7	0	0	0	110.6	M1 A2 Q7 A8 G9 L10 I12 L18	M1-L5 WeakPolarHBondContact O-CG 3.37Å; M1-L5 PolarHBondContact O-N 2.94Å; A2-L5 PolarHBondContact O-N 3.19Å; L5-Q7 VanDerWaalsContact C-N 3.32Å; L5-Q7 PolarHBondContact O-N 3.35Å; L5-A8 CarbonylContact O-C 3.57Å; L5-A8 WeakPolarHBondContact O-CA 3.42Å; L5-A8 WeakPolarHBondContact O-CB 3.44Å; L5-A8 PolarHBondContact O-N 2.88Å; L5-G9 PolarHBondContact O-N 3.21Å; L5-G9 VanDerWaalsContact O-N 3.15Å; L5-L10 CarbonylContact C-O 3.39Å; L5-L10 HydrophobicContact CB-CB 4.11Å; L5-L10 WeakPolarHBondContact CB-O 3.48Å; L5-L10 HydrophobicContact CD2-CB 4.12Å; L5-L10 HydrophobicContact CD2-CD1 4.05Å; L5-L10 WeakPolarHBondContact O-CA 3.38Å; L5-L10 PolarHBondContact O-N 2.83Å; L5-L10 VanDerWaalsContact O-O 3.06Å; L5-I12 HydrophobicContact CD1-CD1 3.54Å; L5-I12 HydrophobicContact CD1-CG1 3.91Å; L5-L18 HydrophobicContact CD2-CD2 4.15Å
6	A	83.8	Confident	86.8	Confident	44 Å²	44	99.4 Å²	99.4	36%	0.364	52%	0.521	S	S	.	.	H	α-helix	trans	-61	-39.3	177.8	0	0	0	0	0	112.1	A2 E3 A8 G9 L10	A2-A6 WeakPolarHBondContact O-CB 3.36Å; A2-A6 PolarHBondContact O-N 3.15Å; E3-A6 PolarHBondContact O-N 3.5Å; A6-A8 PolarHBondContact O-N 3.15Å; A6-G9 PolarHBondContact O-N 2.95Å; A6-L10 PolarHBondContact N-O 3.33Å
7	Q	87.5	Confident	87.1	Confident	159 Å²	159	101.4 Å²	101.4	74%	0.743	53%	0.525	S	S	*	.	H	α-helix	trans	-62.2	-30.1	172.1	-75.5	177.4	3.3	0	0	112.9	E3 L4 L5 G9	E3-Q7 WeakPolarHBondContact O-CG 3.42Å; E3-Q7 PolarHBondContact O-N 3.35Å; L4-Q7 PolarHBondContact O-N 2.99Å; L5-Q7 VanDerWaalsContact C-N 3.32Å; L5-Q7 PolarHBondContact O-N 3.35Å; Q7-G9 VanDerWaalsContact C-N 3.3Å
8	A	90.6	Very high	87.3	Confident	70 Å²	70	102.2 Å²	102.2	58%	0.579	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	3.3	173.3	0	0	0	0	0	113.6	L4 L5 A6 L10	L4-A8 PolarHBondContact O-N 3.34Å; L5-A8 CarbonylContact O-C 3.57Å; L5-A8 WeakPolarHBondContact O-CA 3.42Å; L5-A8 WeakPolarHBondContact O-CB 3.44Å; L5-A8 PolarHBondContact O-N 2.88Å; A6-A8 PolarHBondContact O-N 3.15Å; A8-L10 VanDerWaalsContact C-N 3.3Å; A8-L10 HydrophobicContact CB-CD1 4.46Å; A8-L10 HydrophobicContact CB-CG 4.49Å
9	G	88.6	Confident	87.5	Confident	33 Å²	33	102.8 Å²	102.8	34%	0.34	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	19.6	-175.5	0	0	0	0	0	114.2	L5 A6 Q7	L5-G9 PolarHBondContact O-N 3.21Å; L5-G9 VanDerWaalsContact O-N 3.15Å; A6-G9 PolarHBondContact O-N 2.95Å; Q7-G9 VanDerWaalsContact C-N 3.3Å
10	L	92.4	Very high	87.8	Confident	59 Å²	59	104.9 Å²	104.9	31%	0.309	54%	0.535	S	S	.	.			trans	-108.2	136.4	178.7	-62.7	174.4	0	0	0	110.7	L5 A6 A8 L18 I20	L5-L10 CarbonylContact C-O 3.39Å; L5-L10 HydrophobicContact CB-CB 4.11Å; L5-L10 WeakPolarHBondContact CB-O 3.48Å; L5-L10 HydrophobicContact CD2-CB 4.12Å; L5-L10 HydrophobicContact CD2-CD1 4.05Å; L5-L10 WeakPolarHBondContact O-CA 3.38Å; L5-L10 PolarHBondContact O-N 2.83Å; L5-L10 VanDerWaalsContact O-O 3.06Å; A6-L10 PolarHBondContact N-O 3.33Å; A8-L10 VanDerWaalsContact C-N 3.3Å; A8-L10 HydrophobicContact CB-CD1 4.46Å; A8-L10 HydrophobicContact CB-CG 4.49Å; L10-L18 HydrophobicContact CB-CD2 4.06Å; L10-L18 HydrophobicContact CD1-CD2 4.25Å; L10-I20 HydrophobicContact CD2-CG2 4.36Å
11	Y	91.1	Very high	87.9	Confident	78 Å²	78	103.4 Å²	103.4	31%	0.306	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	155.8	179.7	-58.1	-92.8	0	0	0	109.7	L18 R19 D22	Y11-L18 CarbonylContact O-C 2.99Å; Y11-L18 WeakPolarHBondContact O-CA 3.42Å; Y11-R19 PolarHBondContact N-O 2.84Å; Y11-R19 PolarHBondContact O-N 2.76Å; Y11-D22 HydrophobicContact CD1-CB 3.82Å; Y11-D22 HydrophobicContact CD2-CB 4.38Å; Y11-D22 HydrophobicContact CE1-CB 3.74Å; Y11-D22 HydrophobicContact CE2-CB 4.32Å; Y11-D22 HydrophobicContact CG-CB 4.16Å
12	I	90.4	Very high	88.7	Confident	85 Å²	85	96.7 Å²	96.7	44%	0.436	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	131	174.5	-62.3	176.7	0	0	0	107.7	L5 K17	L5-I12 HydrophobicContact CD1-CD1 3.54Å; L5-I12 HydrophobicContact CD1-CG1 3.91Å; I12-K17 WeakPolarHBondContact CA-O 3.47Å
13	D	89.5	Confident	89.3	Confident	9 Å²	9	94.5 Å²	94.5	5%	0.048	48%	0.477	C	S	.	.			trans	-88.2	176.1	175.2	72.9	9.3	0	0	0	113.2	F15 Y16 K17 R19 P23	D13-F15 PolarHBondContact O-N 2.76Å; D13-F15 WeakPolarHBondContact OD1-CA 3.35Å; D13-F15 WeakPolarHBondContact OD1-CB 3.23Å; D13-F15 PolarHBondContact OD1-N 3.22Å; D13-Y16 PolarHBondContact O-N 3.39Å; D13-Y16 PolarHBondContact OD1-N 3.44Å; D13-K17 PolarHBondContact N-O 3.41Å; D13-K17 WeakPolarHBondContact OD1-CB 3.37Å; D13-K17 PolarHBondContact OD1-N 2.94Å; D13-R19 HydrophobicContact CB-CG 4.28Å; D13-R19 IonicContact OD2-CZ 3.41Å; D13-R19 VanDerWaalsContact OD2-CZ 3.22Å; D13-R19 IonicContact OD2-NE 3.22Å; D13-R19 PolarHBondContact OD2-NE 2.68Å; D13-R19 IonicContact OD2-NH2 3.22Å; D13-R19 PolarHBondContact OD2-NH2 3.11Å; D13-P23 HydrophobicContact CB-CB 4.27Å; D13-P23 HydrophobicContact CB-CG 3.83Å
14	D	89.5	Confident	89.7	Confident	150 Å²	150	94.9 Å²	94.9	80%	0.802	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-13.6	-179.7	-60.3	-31	0	0	0	113.9
15	F	90.6	Very high	89.9	Confident	154 Å²	154	93.2 Å²	93.2	68%	0.675	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	15.4	175.5	-58.1	-76	0	0	0	112.5	D13 K17	D13-F15 PolarHBondContact O-N 2.76Å; D13-F15 WeakPolarHBondContact OD1-CA 3.35Å; D13-F15 WeakPolarHBondContact OD1-CB 3.23Å; D13-F15 PolarHBondContact OD1-N 3.22Å; F15-K17 HydrophobicContact CB-CD 4.44Å; F15-K17 HydrophobicContact CB-CG 4.28Å; F15-K17 PolarHBondContact O-N 2.9Å
16	Y	88.1	Confident	90.2	Very high	209 Å²	209	92.8 Å²	92.8	82%	0.82	47%	0.467	S	S	*	.	S	Bend	trans	57.4	27	-176.8	-59	-83.7	0	0	0	113.8	D13	D13-Y16 PolarHBondContact O-N 3.39Å; D13-Y16 PolarHBondContact OD1-N 3.44Å
17	K	91.4	Very high	90.7	Very high	132 Å²	132	96 Å²	96	57%	0.574	48%	0.475	S	S	*	.			trans	-93.5	140.4	175.7	-59.9	-179.7	-178.9	176.4	0	110.4	I12 D13 F15	I12-K17 WeakPolarHBondContact CA-O 3.47Å; D13-K17 PolarHBondContact N-O 3.41Å; D13-K17 WeakPolarHBondContact OD1-CB 3.37Å; D13-K17 PolarHBondContact OD1-N 2.94Å; F15-K17 HydrophobicContact CB-CD 4.44Å; F15-K17 HydrophobicContact CB-CG 4.28Å; F15-K17 PolarHBondContact O-N 2.9Å
18	L	91.4	Very high	91.1	Very high	116 Å²	116	94.3 Å²	94.3	61%	0.607	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	128.9	170.7	-84.9	155	0	0	0	110.3	L5 L10 Y11	L5-L18 HydrophobicContact CD2-CD2 4.15Å; L10-L18 HydrophobicContact CB-CD2 4.06Å; L10-L18 HydrophobicContact CD1-CD2 4.25Å; Y11-L18 CarbonylContact O-C 2.99Å; Y11-L18 WeakPolarHBondContact O-CA 3.42Å
19	R	91.4	Very high	91.3	Very high	114 Å²	114	94.9 Å²	94.9	43%	0.43	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	152.5	174.1	-62.4	-151.1	-178.7	-155.4	5	110.9	Y11 D13	Y11-R19 PolarHBondContact N-O 2.84Å; Y11-R19 PolarHBondContact O-N 2.76Å; D13-R19 HydrophobicContact CB-CG 4.28Å; D13-R19 IonicContact OD2-CZ 3.41Å; D13-R19 VanDerWaalsContact OD2-CZ 3.22Å; D13-R19 IonicContact OD2-NE 3.22Å; D13-R19 PolarHBondContact OD2-NE 2.68Å; D13-R19 IonicContact OD2-NH2 3.22Å; D13-R19 PolarHBondContact OD2-NH2 3.11Å
20	I	92.5	Very high	91.7	Very high	144 Å²	144	97.8 Å²	97.8	74%	0.738	47%	0.471	S	S	*	.	S	Bend	trans	-92.8	-9.2	176.3	57.6	168.6	0	0	0	113.3	L10	L10-I20 HydrophobicContact CD2-CG2 4.36Å
21	V	90.2	Very high	91.9	Very high	75 Å²	75	99.4 Å²	99.4	46%	0.455	48%	0.477	S	S	.	.	S	Bend	trans	-124.5	141	175.5	-178.7	0	0	0	0	107.5	P23 A26	V21-P23 WeakPolarHBondContact O-CD 3.35Å; V21-P23 VanDerWaalsContact O-N 3.17Å; V21-A26 HydrophobicContact CG1-CB 4.24Å
22	D	90.4	Very high	92.2	Very high	23 Å²	23	100.6 Å²	100.6	12%	0.123	49%	0.488	C	S	.	.			trans	-53.6	120	173.3	-173.8	-32.5	0	0	0	109.1	Y11 R24 V25 A26	Y11-D22 HydrophobicContact CD1-CB 3.82Å; Y11-D22 HydrophobicContact CD2-CB 4.38Å; Y11-D22 HydrophobicContact CE1-CB 3.74Å; Y11-D22 HydrophobicContact CE2-CB 4.32Å; Y11-D22 HydrophobicContact CG-CB 4.16Å; D22-R24 PolarHBondContact O-N 2.89Å; D22-R24 VanDerWaalsContact O-N 3.15Å; D22-R24 WeakPolarHBondContact OD1-CB 3.45Å; D22-R24 PolarHBondContact OD1-N 3.15Å; D22-R24 IonicContact OD1-NE 3.51Å; D22-R24 PolarHBondContact OD1-NE 2.92Å; D22-R24 IonicContact OD1-NH2 3.96Å; D22-R24 IonicContact OD2-CZ 3.74Å; D22-R24 IonicContact OD2-NE 2.8Å; D22-R24 PolarHBondContact OD2-NE 2.87Å; D22-R24 IonicContact OD2-NH2 2.76Å; D22-R24 PolarHBondContact OD2-NH2 3.29Å; D22-V25 HydrophobicContact CB-CB 4.09Å; D22-V25 HydrophobicContact CB-CG2 3.81Å; D22-V25 PolarHBondContact O-N 3.04Å; D22-V25 VanDerWaalsContact O-N 3.11Å; D22-A26 PolarHBondContact O-N 2.78Å
23	P	90.7	Very high	92.5	Very high	30 Å²	30	102.3 Å²	102.3	20%	0.195	49%	0.493	C	S	.	.	H	α-helix	trans	-52.9	-34.7	-180	-26.3	32.8	0	0	0	113.5	D13 V21 A26 Q27	D13-P23 HydrophobicContact CB-CB 4.27Å; D13-P23 HydrophobicContact CB-CG 3.83Å; V21-P23 WeakPolarHBondContact O-CD 3.35Å; V21-P23 VanDerWaalsContact O-N 3.17Å; P23-A26 PolarHBondContact O-N 3.23Å; P23-Q27 WeakPolarHBondContact O-CB 3.49Å; P23-Q27 PolarHBondContact O-N 3.19Å
24	R	90	Very high	92.9	Very high	168 Å²	168	106.9 Å²	106.9	63%	0.634	51%	0.514	S	S	*	.	H	α-helix	trans	-68.3	-47	178.8	-60.5	172.3	-65	171.5	4.2	111	D22 A26 Q27 E28	D22-R24 PolarHBondContact O-N 2.89Å; D22-R24 VanDerWaalsContact O-N 3.15Å; D22-R24 WeakPolarHBondContact OD1-CB 3.45Å; D22-R24 PolarHBondContact OD1-N 3.15Å; D22-R24 IonicContact OD1-NE 3.51Å; D22-R24 PolarHBondContact OD1-NE 2.92Å; D22-R24 IonicContact OD1-NH2 3.96Å; D22-R24 IonicContact OD2-CZ 3.74Å; D22-R24 IonicContact OD2-NE 2.8Å; D22-R24 PolarHBondContact OD2-NE 2.87Å; D22-R24 IonicContact OD2-NH2 2.76Å; D22-R24 PolarHBondContact OD2-NH2 3.29Å; R24-A26 VanDerWaalsContact C-N 3.29Å; R24-A26 PolarHBondContact O-N 2.87Å; R24-Q27 PolarHBondContact O-N 2.93Å; R24-E28 WeakPolarHBondContact O-CB 3.39Å; R24-E28 WeakPolarHBondContact O-CG 3.41Å; R24-E28 PolarHBondContact O-N 3.06Å
25	V	92.1	Very high	93.3	Very high	70 Å²	70	105.9 Å²	105.9	42%	0.424	50%	0.504	S	S	.	.	H	α-helix	trans	-61.6	-40.4	176	177.3	0	0	0	0	110.6	D22 T29	D22-V25 HydrophobicContact CB-CB 4.09Å; D22-V25 HydrophobicContact CB-CG2 3.81Å; D22-V25 PolarHBondContact O-N 3.04Å; D22-V25 VanDerWaalsContact O-N 3.11Å; V25-T29 VanDerWaalsContact O-CB 3.23Å; V25-T29 WeakPolarHBondContact O-CB 3.5Å; V25-T29 PolarHBondContact O-N 2.98Å; V25-T29 PolarHBondContact O-OG1 2.79Å
26	A	92.5	Very high	93.6	Very high	26 Å²	26	101.5 Å²	101.5	22%	0.215	49%	0.492	C	S	.	.	H	α-helix	trans	-64.6	-40.2	176.6	0	0	0	0	0	112.4	V21 D22 P23 R24 N30	V21-A26 HydrophobicContact CG1-CB 4.24Å; D22-A26 PolarHBondContact O-N 2.78Å; P23-A26 PolarHBondContact O-N 3.23Å; R24-A26 VanDerWaalsContact C-N 3.29Å; R24-A26 PolarHBondContact O-N 2.87Å; A26-N30 PolarHBondContact O-N 3.36Å; A26-N30 VanDerWaalsContact O-N 3.11Å; A26-N30 PolarHBondContact O-ND2 3.14Å; A26-N30 VanDerWaalsContact O-ND2 3.14Å
27	Q	93.4	Very high	94.1	Very high	112 Å²	112	96.6 Å²	96.6	52%	0.523	48%	0.477	S	S	.	.	H	α-helix	trans	-65.2	-53.1	174.9	-179.9	179.6	-11.4	0	0	111.3	P23 R24 T29 N30 E31	P23-Q27 WeakPolarHBondContact O-CB 3.49Å; P23-Q27 PolarHBondContact O-N 3.19Å; R24-Q27 PolarHBondContact O-N 2.93Å; Q27-T29 PolarHBondContact O-N 2.99Å; Q27-N30 WeakPolarHBondContact O-CB 3.48Å; Q27-N30 PolarHBondContact O-N 3.21Å; Q27-E31 HydrophobicContact CG-CG 4.44Å; Q27-E31 WeakPolarHBondContact CG-OE1 3.28Å; Q27-E31 PolarHBondContact NE2-OE1 3.27Å; Q27-E31 PolarHBondContact O-N 3Å
28	E	95.4	Very high	94.4	Very high	124 Å²	124	96.2 Å²	96.2	58%	0.579	48%	0.475	S	S	*	.	H	α-helix	trans	-56.9	-39.4	178	-71.8	173.9	-176.7	0	0	111.6	R24 E31 L32	R24-E28 WeakPolarHBondContact O-CB 3.39Å; R24-E28 WeakPolarHBondContact O-CG 3.41Å; R24-E28 PolarHBondContact O-N 3.06Å; E28-E31 PolarHBondContact O-N 2.89Å; E28-L32 VanDerWaalsContact O-CB 3.28Å; E28-L32 WeakPolarHBondContact O-CB 3.38Å; E28-L32 PolarHBondContact O-N 3.45Å
29	T	95.9	Very high	94.7	Very high	82 Å²	82	98 Å²	98	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-64.6	-39.4	175.9	-59.5	0	0	0	0	111.8	V25 Q27 K33	V25-T29 VanDerWaalsContact O-CB 3.23Å; V25-T29 WeakPolarHBondContact O-CB 3.5Å; V25-T29 PolarHBondContact O-N 2.98Å; V25-T29 PolarHBondContact O-OG1 2.79Å; Q27-T29 PolarHBondContact O-N 2.99Å; T29-K33 WeakPolarHBondContact O-CB 3.37Å; T29-K33 PolarHBondContact O-N 2.83Å
30	N	96	Very high	95.1	Very high	93 Å²	93	97.8 Å²	97.8	50%	0.497	48%	0.481	S	S	.	.	H	α-helix	trans	-70.4	-42.4	176.7	-76.3	-34.8	0	0	0	111.8	A26 Q27 K33 E34	A26-N30 PolarHBondContact O-N 3.36Å; A26-N30 VanDerWaalsContact O-N 3.11Å; A26-N30 PolarHBondContact O-ND2 3.14Å; A26-N30 VanDerWaalsContact O-ND2 3.14Å; Q27-N30 WeakPolarHBondContact O-CB 3.48Å; Q27-N30 PolarHBondContact O-N 3.21Å; N30-K33 WeakPolarHBondContact O-CB 3.05Å; N30-K33 PolarHBondContact O-N 3.13Å; N30-E34 WeakPolarHBondContact O-CG 3.46Å; N30-E34 PolarHBondContact O-N 2.87Å
31	E	96.8	Very high	95.3	Very high	94 Å²	94	94.1 Å²	94.1	44%	0.439	47%	0.469	S	S	.	.	H	α-helix	trans	-59.8	-47.5	175	-71.5	175	-172.7	0	0	110.7	Q27 E28 K33 E34 E35	Q27-E31 HydrophobicContact CG-CG 4.44Å; Q27-E31 WeakPolarHBondContact CG-OE1 3.28Å; Q27-E31 PolarHBondContact NE2-OE1 3.27Å; Q27-E31 PolarHBondContact O-N 3Å; E28-E31 PolarHBondContact O-N 2.89Å; E31-K33 VanDerWaalsContact C-N 3.3Å; E31-K33 PolarHBondContact O-N 3.25Å; E31-E34 PolarHBondContact O-N 3.11Å; E31-E35 WeakPolarHBondContact O-CG 3.49Å; E31-E35 PolarHBondContact O-N 2.9Å
32	L	97.5	Very high	95.7	Very high	103 Å²	103	97.9 Å²	97.9	54%	0.539	48%	0.479	S	S	.	.	H	α-helix	trans	-58.9	-41.3	175	178.3	61.9	0	0	0	112	E28 E35 C36	E28-L32 VanDerWaalsContact O-CB 3.28Å; E28-L32 WeakPolarHBondContact O-CB 3.38Å; E28-L32 PolarHBondContact O-N 3.45Å; L32-E35 PolarHBondContact O-N 3.4Å; L32-C36 WeakPolarHBondContact O-CB 3.39Å; L32-C36 PolarHBondContact O-N 2.95Å; L32-C36 PolarHBondContact O-SG 2.87Å
33	K	97.5	Very high	96.1	Very high	120 Å²	120	100 Å²	100	52%	0.522	49%	0.489	S	S	.	.	H	α-helix	trans	-60.5	-48.4	175.9	179.4	-171.9	168.2	-168.3	0	111.1	T29 N30 E31 E35 C36 E37	T29-K33 WeakPolarHBondContact O-CB 3.37Å; T29-K33 PolarHBondContact O-N 2.83Å; N30-K33 WeakPolarHBondContact O-CB 3.05Å; N30-K33 PolarHBondContact O-N 3.13Å; E31-K33 VanDerWaalsContact C-N 3.3Å; E31-K33 PolarHBondContact O-N 3.25Å; K33-E35 VanDerWaalsContact C-N 3.33Å; K33-E35 PolarHBondContact O-N 2.92Å; K33-C36 WeakPolarHBondContact O-CB 3.3Å; K33-C36 PolarHBondContact O-N 3.43Å; K33-E37 WeakPolarHBondContact CE-OE1 3.41Å; K33-E37 IonicContact NZ-OE1 2.79Å; K33-E37 WeakPolarHBondContact O-CG 3.45Å; K33-E37 PolarHBondContact O-N 2.85Å
34	E	97.8	Very high	96.4	Very high	105 Å²	105	102.9 Å²	102.9	49%	0.491	51%	0.506	S	S	.	.	H	α-helix	trans	-62.3	-40	178.2	-71.4	-176.6	-169.4	0	0	112.2	N30 E31 E37 K38	N30-E34 WeakPolarHBondContact O-CG 3.46Å; N30-E34 PolarHBondContact O-N 2.87Å; E31-E34 PolarHBondContact O-N 3.11Å; E34-E37 PolarHBondContact O-N 3.35Å; E34-K38 VanDerWaalsContact O-CG 3.3Å; E34-K38 WeakPolarHBondContact O-CG 3.42Å; E34-K38 PolarHBondContact O-N 3.07Å
35	E	97.5	Very high	96.8	Very high	129 Å²	129	98.5 Å²	98.5	60%	0.603	50%	0.495	S	S	*	.	H	α-helix	trans	-64.5	-41.8	174.9	-73.3	-168.4	165.4	0	0	112.1	E31 L32 K33 K38 Y39	E31-E35 WeakPolarHBondContact O-CG 3.49Å; E31-E35 PolarHBondContact O-N 2.9Å; L32-E35 PolarHBondContact O-N 3.4Å; K33-E35 VanDerWaalsContact C-N 3.33Å; K33-E35 PolarHBondContact O-N 2.92Å; E35-K38 PolarHBondContact O-N 3.46Å; E35-Y39 WeakPolarHBondContact O-CB 3.39Å; E35-Y39 PolarHBondContact O-N 3.2Å
36	C	97.9	Very high	97.1	Very high	62 Å²	62	100.6 Å²	100.6	42%	0.419	50%	0.499	S	S	.	.	H	α-helix	trans	-62.4	-43.1	175.2	-71.7	0	0	0	0	111.6	L32 K33 Y39 L40	L32-C36 WeakPolarHBondContact O-CB 3.39Å; L32-C36 PolarHBondContact O-N 2.95Å; L32-C36 PolarHBondContact O-SG 2.87Å; K33-C36 WeakPolarHBondContact O-CB 3.3Å; K33-C36 PolarHBondContact O-N 3.43Å; C36-Y39 PolarHBondContact O-N 2.94Å; C36-L40 WeakPolarHBondContact O-CB 3.3Å; C36-L40 VanDerWaalsContact O-CG 3.3Å; C36-L40 WeakPolarHBondContact O-CG 3.38Å; C36-L40 PolarHBondContact O-N 3.28Å
37	E	97.9	Very high	97.4	Very high	107 Å²	107	105.9 Å²	105.9	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-61.9	-44.8	176	-73.9	176.1	178.9	0	0	111.4	K33 E34 Y39 L40 S41	K33-E37 WeakPolarHBondContact CE-OE1 3.41Å; K33-E37 IonicContact NZ-OE1 2.79Å; K33-E37 WeakPolarHBondContact O-CG 3.45Å; K33-E37 PolarHBondContact O-N 2.85Å; E34-E37 PolarHBondContact O-N 3.35Å; E37-Y39 VanDerWaalsContact C-N 3.35Å; E37-Y39 PolarHBondContact O-N 3.29Å; E37-L40 PolarHBondContact O-N 3.26Å; E37-S41 PolarHBondContact O-N 3.43Å
38	K	98	Very high	97.6	Very high	124 Å²	124	105.8 Å²	105.8	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-60.9	-42.6	174.1	-72.3	166.6	-172.7	159.3	0	111.8	E34 E35 S41 K42	E34-K38 VanDerWaalsContact O-CG 3.3Å; E34-K38 WeakPolarHBondContact O-CG 3.42Å; E34-K38 PolarHBondContact O-N 3.07Å; E35-K38 PolarHBondContact O-N 3.46Å; K38-S41 PolarHBondContact O-N 3.45Å; K38-K42 WeakPolarHBondContact O-CG 3.5Å; K38-K42 PolarHBondContact O-N 2.85Å
39	Y	98.2	Very high	97.8	Very high	154 Å²	154	104.6 Å²	104.6	60%	0.604	51%	0.514	S	S	*	.	H	α-helix	trans	-63.7	-45.7	177.6	177.7	-94.6	0	0	0	111.7	E35 C36 E37 S41 K42 M43	E35-Y39 WeakPolarHBondContact O-CB 3.39Å; E35-Y39 PolarHBondContact O-N 3.2Å; C36-Y39 PolarHBondContact O-N 2.94Å; E37-Y39 VanDerWaalsContact C-N 3.35Å; E37-Y39 PolarHBondContact O-N 3.29Å; Y39-S41 VanDerWaalsContact C-N 3.32Å; Y39-S41 PolarHBondContact O-N 3.41Å; Y39-K42 PolarHBondContact O-N 3.36Å; Y39-M43 WeakPolarHBondContact O-CB 3.42Å; Y39-M43 PolarHBondContact O-N 3.03Å
40	L	98.2	Very high	97.9	Very high	108 Å²	108	103.8 Å²	103.8	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-61.6	-40	177.4	-73.9	170.9	0	0	0	112.1	C36 E37 M43 T44	C36-L40 WeakPolarHBondContact O-CB 3.3Å; C36-L40 VanDerWaalsContact O-CG 3.3Å; C36-L40 WeakPolarHBondContact O-CG 3.38Å; C36-L40 PolarHBondContact O-N 3.28Å; E37-L40 PolarHBondContact O-N 3.26Å; L40-M43 PolarHBondContact O-N 2.99Å; L40-T44 PolarHBondContact O-N 3.02Å; L40-T44 PolarHBondContact O-OG1 3.46Å
41	S	98.2	Very high	98	Very high	68 Å²	68	100.7 Å²	100.7	48%	0.476	50%	0.497	S	S	.	.	H	α-helix	trans	-60.5	-52.4	173.3	-172	0	0	0	0	111	E37 K38 Y39 M43 T44 D45	E37-S41 PolarHBondContact O-N 3.43Å; K38-S41 PolarHBondContact O-N 3.45Å; Y39-S41 VanDerWaalsContact C-N 3.32Å; Y39-S41 PolarHBondContact O-N 3.41Å; S41-M43 VanDerWaalsContact C-N 3.27Å; S41-M43 PolarHBondContact O-N 2.83Å; S41-T44 WeakPolarHBondContact O-CA 3.36Å; S41-T44 WeakPolarHBondContact O-CB 3.48Å; S41-T44 PolarHBondContact O-N 3.39Å; S41-D45 PolarHBondContact O-N 2.99Å
42	K	98.2	Very high	98.1	Very high	153 Å²	153	101.9 Å²	101.9	67%	0.665	50%	0.502	S	S	*	.	H	α-helix	trans	-58.9	-38.6	177.9	-73.4	179.3	178.9	-179.9	0	112.6	K38 Y39 T44 D45 F46	K38-K42 WeakPolarHBondContact O-CG 3.5Å; K38-K42 PolarHBondContact O-N 2.85Å; Y39-K42 PolarHBondContact O-N 3.36Å; K42-T44 VanDerWaalsContact C-N 3.3Å; K42-T44 PolarHBondContact O-N 2.99Å; K42-D45 PolarHBondContact O-N 3.46Å; K42-F46 WeakPolarHBondContact O-CB 3.34Å; K42-F46 PolarHBondContact O-N 2.92Å
43	M	97.9	Very high	98.1	Very high	68 Å²	68	101.3 Å²	101.3	34%	0.335	50%	0.499	S	S	.	.	H	α-helix	trans	-68	-32.8	177.7	-169.3	61.5	-171.3	0	0	111.8	Y39 L40 S41 F46 K47	Y39-M43 WeakPolarHBondContact O-CB 3.42Å; Y39-M43 PolarHBondContact O-N 3.03Å; L40-M43 PolarHBondContact O-N 2.99Å; S41-M43 VanDerWaalsContact C-N 3.27Å; S41-M43 PolarHBondContact O-N 2.83Å; M43-F46 HydrophobicContact CE-CD1 4.39Å; M43-F46 HydrophobicContact SD-CD1 4.24Å; M43-K47 VanDerWaalsContact O-CG 3.3Å; M43-K47 WeakPolarHBondContact O-CG 3.3Å; M43-K47 PolarHBondContact O-N 2.97Å; M43-K47 VanDerWaalsContact O-N 3.07Å
44	T	98.3	Very high	98.2	Very high	90 Å²	90	100.4 Å²	100.4	55%	0.552	50%	0.499	S	S	*	.	H	α-helix	trans	-68.1	-46.6	174.2	-57.5	0	0	0	0	110.8	L40 S41 K42 F46 K47 M48	L40-T44 PolarHBondContact O-N 3.02Å; L40-T44 PolarHBondContact O-OG1 3.46Å; S41-T44 WeakPolarHBondContact O-CA 3.36Å; S41-T44 WeakPolarHBondContact O-CB 3.48Å; S41-T44 PolarHBondContact O-N 3.39Å; K42-T44 VanDerWaalsContact C-N 3.3Å; K42-T44 PolarHBondContact O-N 2.99Å; T44-F46 VanDerWaalsContact C-N 3.33Å; T44-F46 PolarHBondContact O-N 3.42Å; T44-K47 PolarHBondContact O-N 3.15Å; T44-M48 PolarHBondContact O-N 2.94Å
45	D	98.2	Very high	98.2	Very high	77 Å²	77	100.9 Å²	100.9	41%	0.412	51%	0.505	S	S	.	.	H	α-helix	trans	-60.1	-43.9	175.7	-61.6	-25.5	0	0	0	111.3	S41 K42 K47 M48 I49	S41-D45 PolarHBondContact O-N 2.99Å; K42-D45 PolarHBondContact O-N 3.46Å; D45-K47 PolarHBondContact O-N 3.02Å; D45-M48 WeakPolarHBondContact O-CB 3.41Å; D45-M48 PolarHBondContact O-N 2.98Å; D45-M48 VanDerWaalsContact O-N 3.15Å; D45-I49 WeakPolarHBondContact O-CG1 3.47Å; D45-I49 PolarHBondContact O-N 3.42Å
46	F	98.3	Very high	98.2	Very high	114 Å²	114	99.9 Å²	99.9	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-43.3	177.2	-178.5	-109.3	0	0	0	112.4	K42 M43 T44 M48 I49 I50	K42-F46 WeakPolarHBondContact O-CB 3.34Å; K42-F46 PolarHBondContact O-N 2.92Å; M43-F46 HydrophobicContact CE-CD1 4.39Å; M43-F46 HydrophobicContact SD-CD1 4.24Å; T44-F46 VanDerWaalsContact C-N 3.33Å; T44-F46 PolarHBondContact O-N 3.42Å; F46-M48 VanDerWaalsContact C-N 3.31Å; F46-M48 PolarHBondContact O-N 3.5Å; F46-I49 PolarHBondContact O-N 2.96Å; F46-I50 HydrophobicContact CD1-CD1 3.84Å; F46-I50 HydrophobicContact CE1-CD1 3.25Å; F46-I50 HydrophobicContact CE1-CG1 4.34Å; F46-I50 HydrophobicContact CE2-CD1 4.04Å; F46-I50 HydrophobicContact CE2-CG1 4.42Å; F46-I50 HydrophobicContact CG-CD1 4.46Å; F46-I50 HydrophobicContact CZ-CD1 3.38Å; F46-I50 HydrophobicContact CZ-CG1 4.23Å; F46-I50 WeakPolarHBondContact O-CG1 3.29Å; F46-I50 PolarHBondContact O-N 3.47Å
47	K	98.2	Very high	98.3	Very high	136 Å²	136	101.4 Å²	101.4	59%	0.591	51%	0.507	S	S	*	.	H	α-helix	trans	-61.8	-40	174.7	-76.4	174.6	-179.1	179.4	0	111.8	M43 T44 D45 I50 G51	M43-K47 VanDerWaalsContact O-CG 3.3Å; M43-K47 WeakPolarHBondContact O-CG 3.3Å; M43-K47 PolarHBondContact O-N 2.97Å; M43-K47 VanDerWaalsContact O-N 3.07Å; T44-K47 PolarHBondContact O-N 3.15Å; D45-K47 PolarHBondContact O-N 3.02Å; K47-I50 PolarHBondContact O-N 3.43Å; K47-G51 PolarHBondContact O-N 3.23Å
48	M	98.4	Very high	98.3	Very high	110 Å²	110	99.3 Å²	99.3	54%	0.542	50%	0.504	S	S	.	.	H	α-helix	trans	-63.1	-48.4	177	-172.8	174.7	69.4	0	0	111.2	T44 D45 F46 I50 G51 E52	T44-M48 PolarHBondContact O-N 2.94Å; D45-M48 WeakPolarHBondContact O-CB 3.41Å; D45-M48 PolarHBondContact O-N 2.98Å; D45-M48 VanDerWaalsContact O-N 3.15Å; F46-M48 VanDerWaalsContact C-N 3.31Å; F46-M48 PolarHBondContact O-N 3.5Å; M48-I50 VanDerWaalsContact C-N 3.33Å; M48-I50 PolarHBondContact O-N 3.26Å; M48-G51 PolarHBondContact O-N 3.09Å; M48-G51 VanDerWaalsContact O-N 3.09Å; M48-E52 WeakPolarHBondContact O-CG 3.35Å; M48-E52 PolarHBondContact O-N 3.43Å
49	I	98.3	Very high	98.3	Very high	99 Å²	99	95.3 Å²	95.3	51%	0.508	49%	0.491	S	S	.	.	H	α-helix	trans	-59.4	-43.4	177.8	-66.7	165.2	0	0	0	111.2	D45 F46 G51 E52 L53	D45-I49 WeakPolarHBondContact O-CG1 3.47Å; D45-I49 PolarHBondContact O-N 3.42Å; F46-I49 PolarHBondContact O-N 2.96Å; I49-G51 VanDerWaalsContact C-N 3.35Å; I49-E52 PolarHBondContact O-N 2.86Å; I49-L53 WeakPolarHBondContact O-CB 3.44Å; I49-L53 PolarHBondContact O-N 3.47Å
50	I	98.3	Very high	98.3	Very high	66 Å²	66	91.5 Å²	91.5	34%	0.338	48%	0.484	S	S	.	.	H	α-helix	trans	-62.5	-43.4	175.5	-73.9	177.9	0	0	0	111	F46 K47 M48 E52 L53 L54	F46-I50 HydrophobicContact CD1-CD1 3.84Å; F46-I50 HydrophobicContact CE1-CD1 3.25Å; F46-I50 HydrophobicContact CE1-CG1 4.34Å; F46-I50 HydrophobicContact CE2-CD1 4.04Å; F46-I50 HydrophobicContact CE2-CG1 4.42Å; F46-I50 HydrophobicContact CG-CD1 4.46Å; F46-I50 HydrophobicContact CZ-CD1 3.38Å; F46-I50 HydrophobicContact CZ-CG1 4.23Å; F46-I50 WeakPolarHBondContact O-CG1 3.29Å; F46-I50 PolarHBondContact O-N 3.47Å; K47-I50 PolarHBondContact O-N 3.43Å; M48-I50 VanDerWaalsContact C-N 3.33Å; M48-I50 PolarHBondContact O-N 3.26Å; I50-E52 VanDerWaalsContact C-N 3.35Å; I50-E52 PolarHBondContact O-N 2.9Å; I50-L53 PolarHBondContact O-N 3.39Å; I50-L54 HydrophobicContact CG2-CD1 3.82Å; I50-L54 HydrophobicContact CG2-CG 4.16Å; I50-L54 WeakPolarHBondContact O-CB 3.34Å; I50-L54 VanDerWaalsContact O-CG 3.29Å; I50-L54 WeakPolarHBondContact O-CG 3.41Å; I50-L54 PolarHBondContact O-N 2.79Å
51	G	98.3	Very high	98.3	Very high	28 Å²	28	89.1 Å²	89.1	29%	0.289	48%	0.48	S	S	.	.	H	α-helix	trans	-58.3	-46.6	177.2	0	0	0	0	0	112.1	K47 M48 I49 L54 N55	K47-G51 PolarHBondContact O-N 3.23Å; M48-G51 PolarHBondContact O-N 3.09Å; M48-G51 VanDerWaalsContact O-N 3.09Å; I49-G51 VanDerWaalsContact C-N 3.35Å; G51-L54 PolarHBondContact O-N 3.32Å; G51-N55 VanDerWaalsContact O-CG 3.23Å; G51-N55 PolarHBondContact O-N 2.97Å; G51-N55 PolarHBondContact O-ND2 2.88Å
52	E	98.5	Very high	98.3	Very high	119 Å²	119	92.5 Å²	92.5	56%	0.556	49%	0.488	S	S	*	.	H	α-helix	trans	-62.2	-43.5	175.4	-69.6	179.6	173.9	0	0	112.3	M48 I49 I50 N55 L56	M48-E52 WeakPolarHBondContact O-CG 3.35Å; M48-E52 PolarHBondContact O-N 3.43Å; I49-E52 PolarHBondContact O-N 2.86Å; I50-E52 VanDerWaalsContact C-N 3.35Å; I50-E52 PolarHBondContact O-N 2.9Å; E52-N55 PolarHBondContact O-N 3.25Å; E52-L56 WeakPolarHBondContact O-CB 3.42Å; E52-L56 PolarHBondContact O-N 3.29Å
53	L	98.4	Very high	98.4	Very high	91 Å²	91	91.2 Å²	91.2	48%	0.476	48%	0.483	S	S	.	.	H	α-helix	trans	-63.3	-43.9	177.9	179.1	60.9	0	0	0	111.8	I49 I50 N55 L56 I57	I49-L53 WeakPolarHBondContact O-CB 3.44Å; I49-L53 PolarHBondContact O-N 3.47Å; I50-L53 PolarHBondContact O-N 3.39Å; L53-N55 VanDerWaalsContact C-N 3.32Å; L53-N55 PolarHBondContact O-N 3.4Å; L53-L56 PolarHBondContact O-N 2.94Å; L53-I57 HydrophobicContact CD1-CD1 4.04Å; L53-I57 HydrophobicContact CD1-CG1 4.23Å; L53-I57 HydrophobicContact CG-CD1 3.91Å; L53-I57 HydrophobicContact CG-CG1 4.5Å; L53-I57 WeakPolarHBondContact O-CB 3.29Å; L53-I57 VanDerWaalsContact O-CG1 3.29Å; L53-I57 WeakPolarHBondContact O-CG1 3.47Å; L53-I57 PolarHBondContact O-N 3.48Å
54	L	98.4	Very high	98.4	Very high	100 Å²	100	92.1 Å²	92.1	52%	0.524	49%	0.492	S	S	.	.	H	α-helix	trans	-62	-40.7	176.8	-73.2	174.2	0	0	0	111.6	I50 G51 I57 S58	I50-L54 HydrophobicContact CG2-CD1 3.82Å; I50-L54 HydrophobicContact CG2-CG 4.16Å; I50-L54 WeakPolarHBondContact O-CB 3.34Å; I50-L54 VanDerWaalsContact O-CG 3.29Å; I50-L54 WeakPolarHBondContact O-CG 3.41Å; I50-L54 PolarHBondContact O-N 2.79Å; G51-L54 PolarHBondContact O-N 3.32Å; L54-I57 PolarHBondContact O-N 3.25Å; L54-S58 WeakPolarHBondContact O-CB 3.49Å; L54-S58 PolarHBondContact O-N 3.06Å; L54-S58 PolarHBondContact O-OG 3.37Å
55	N	98.5	Very high	98.4	Very high	116 Å²	116	91.9 Å²	91.9	62%	0.62	48%	0.484	S	S	*	.	H	α-helix	trans	-64.7	-42.5	175.2	-70.7	-23.3	0	0	0	111.6	G51 E52 L53 S58 S59	G51-N55 VanDerWaalsContact O-CG 3.23Å; G51-N55 PolarHBondContact O-N 2.97Å; G51-N55 PolarHBondContact O-ND2 2.88Å; E52-N55 PolarHBondContact O-N 3.25Å; L53-N55 VanDerWaalsContact C-N 3.32Å; L53-N55 PolarHBondContact O-N 3.4Å; N55-S58 PolarHBondContact O-N 2.94Å; N55-S59 WeakPolarHBondContact O-CB 3.5Å; N55-S59 PolarHBondContact O-N 2.93Å
56	L	98.5	Very high	98.4	Very high	108 Å²	108	90.9 Å²	90.9	57%	0.565	48%	0.484	S	S	*	.	H	α-helix	trans	-62.5	-47.1	176.7	-179.1	63.7	0	0	0	111.5	E52 L53 S58 S59 V60	E52-L56 WeakPolarHBondContact O-CB 3.42Å; E52-L56 PolarHBondContact O-N 3.29Å; L53-L56 PolarHBondContact O-N 2.94Å; L56-S58 VanDerWaalsContact C-N 3.31Å; L56-S58 PolarHBondContact O-N 3.01Å; L56-S59 PolarHBondContact O-N 2.9Å; L56-V60 HydrophobicContact CD1-CG2 4.41Å; L56-V60 WeakPolarHBondContact O-CG2 3.31Å; L56-V60 PolarHBondContact O-N 2.88Å
57	I	98.5	Very high	98.4	Very high	94 Å²	94	94.8 Å²	94.8	48%	0.482	50%	0.495	S	S	.	.	H	α-helix	trans	-59.1	-45	177.4	-70.8	168.6	0	0	0	110.2	L53 L54 V60 A61	L53-I57 HydrophobicContact CD1-CD1 4.04Å; L53-I57 HydrophobicContact CD1-CG1 4.23Å; L53-I57 HydrophobicContact CG-CD1 3.91Å; L53-I57 HydrophobicContact CG-CG1 4.5Å; L53-I57 WeakPolarHBondContact O-CB 3.29Å; L53-I57 VanDerWaalsContact O-CG1 3.29Å; L53-I57 WeakPolarHBondContact O-CG1 3.47Å; L53-I57 PolarHBondContact O-N 3.48Å; L54-I57 PolarHBondContact O-N 3.25Å; I57-V60 PolarHBondContact O-N 3.46Å; I57-A61 WeakPolarHBondContact O-CB 3.5Å; I57-A61 PolarHBondContact O-N 3.3Å
58	S	98.4	Very high	98.4	Very high	63 Å²	63	93.6 Å²	93.6	44%	0.441	49%	0.49	S	S	.	.	H	α-helix	trans	-62.1	-46	178.6	-57	0	0	0	0	111.5	L54 N55 L56 V60 A61 E62	L54-S58 WeakPolarHBondContact O-CB 3.49Å; L54-S58 PolarHBondContact O-N 3.06Å; L54-S58 PolarHBondContact O-OG 3.37Å; N55-S58 PolarHBondContact O-N 2.94Å; L56-S58 VanDerWaalsContact C-N 3.31Å; L56-S58 PolarHBondContact O-N 3.01Å; S58-V60 VanDerWaalsContact C-N 3.33Å; S58-V60 PolarHBondContact O-N 3.23Å; S58-A61 PolarHBondContact O-N 3.39Å; S58-E62 WeakPolarHBondContact O-CG 3.46Å; S58-E62 PolarHBondContact O-N 3.43Å
59	S	98.5	Very high	98.4	Very high	40 Å²	40	93.4 Å²	93.4	28%	0.28	49%	0.49	S	S	.	.	H	α-helix	trans	-61.4	-39.6	176.3	-175.5	0	0	0	0	112.7	N55 L56 K63	N55-S59 WeakPolarHBondContact O-CB 3.5Å; N55-S59 PolarHBondContact O-N 2.93Å; L56-S59 PolarHBondContact O-N 2.9Å; S59-K63 VanDerWaalsContact O-CG 3.29Å; S59-K63 WeakPolarHBondContact O-CG 3.5Å; S59-K63 PolarHBondContact O-N 3.24Å; S59-K63 VanDerWaalsContact O-N 3.11Å; S59-K63 PolarHBondContact OG-NZ 2.95Å
60	V	98.4	Very high	98.4	Very high	73 Å²	73	95.6 Å²	95.6	44%	0.442	50%	0.496	S	S	.	.	H	α-helix	trans	-67.4	-43.3	176.6	171.5	0	0	0	0	110.6	L56 I57 S58 E62 K63 V64	L56-V60 HydrophobicContact CD1-CG2 4.41Å; L56-V60 WeakPolarHBondContact O-CG2 3.31Å; L56-V60 PolarHBondContact O-N 2.88Å; I57-V60 PolarHBondContact O-N 3.46Å; S58-V60 VanDerWaalsContact C-N 3.33Å; S58-V60 PolarHBondContact O-N 3.23Å; V60-E62 PolarHBondContact O-N 2.98Å; V60-K63 PolarHBondContact O-N 3.38Å; V60-V64 HydrophobicContact CG1-CG2 4.28Å; V60-V64 VanDerWaalsContact O-CG2 3.31Å; V60-V64 WeakPolarHBondContact O-CG2 3.47Å; V60-V64 PolarHBondContact O-N 3.48Å
61	A	98.5	Very high	98.4	Very high	58 Å²	58	95.4 Å²	95.4	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-58.7	-45.9	177.4	0	0	0	0	0	111.8	I57 S58 K63 V64 E65	I57-A61 WeakPolarHBondContact O-CB 3.5Å; I57-A61 PolarHBondContact O-N 3.3Å; S58-A61 PolarHBondContact O-N 3.39Å; A61-K63 PolarHBondContact O-N 3.36Å; A61-V64 PolarHBondContact O-N 3.41Å; A61-E65 PolarHBondContact O-N 3.48Å
62	E	98.4	Very high	98.4	Very high	139 Å²	139	97.8 Å²	97.8	65%	0.65	51%	0.509	S	S	*	.	H	α-helix	trans	-60.5	-43.7	175.5	-72	176.5	179.7	0	0	112.5	S58 V60 V64 E65 S66	S58-E62 WeakPolarHBondContact O-CG 3.46Å; S58-E62 PolarHBondContact O-N 3.43Å; V60-E62 PolarHBondContact O-N 2.98Å; E62-V64 VanDerWaalsContact C-N 3.34Å; E62-V64 PolarHBondContact O-N 2.98Å; E62-E65 PolarHBondContact O-N 3.27Å; E62-S66 WeakPolarHBondContact O-CB 3.32Å; E62-S66 PolarHBondContact O-N 3.11Å
63	K	98.4	Very high	98.4	Very high	127 Å²	127	94 Å²	94	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-63.9	-39.7	177.2	-75.2	169.4	-177.1	164.4	0	112	S59 V60 A61 R67	S59-K63 VanDerWaalsContact O-CG 3.29Å; S59-K63 WeakPolarHBondContact O-CG 3.5Å; S59-K63 PolarHBondContact O-N 3.24Å; S59-K63 VanDerWaalsContact O-N 3.11Å; S59-K63 PolarHBondContact OG-NZ 2.95Å; V60-K63 PolarHBondContact O-N 3.38Å; A61-K63 PolarHBondContact O-N 3.36Å; K63-R67 WeakPolarHBondContact O-CB 3.32Å; K63-R67 WeakPolarHBondContact O-CG 3.47Å; K63-R67 PolarHBondContact O-N 3.46Å
64	V	98.6	Very high	98.4	Very high	87 Å²	87	93.1 Å²	93.1	53%	0.527	50%	0.504	S	S	.	.	H	α-helix	trans	-64.9	-47.2	177.4	168.8	0	0	0	0	110.3	V60 A61 E62 S66 R67 K68	V60-V64 HydrophobicContact CG1-CG2 4.28Å; V60-V64 VanDerWaalsContact O-CG2 3.31Å; V60-V64 WeakPolarHBondContact O-CG2 3.47Å; V60-V64 PolarHBondContact O-N 3.48Å; A61-V64 PolarHBondContact O-N 3.41Å; E62-V64 VanDerWaalsContact C-N 3.34Å; E62-V64 PolarHBondContact O-N 2.98Å; V64-S66 PolarHBondContact O-N 3.45Å; V64-R67 PolarHBondContact O-N 3.24Å; V64-K68 WeakPolarHBondContact O-CB 3.32Å; V64-K68 PolarHBondContact O-N 2.88Å
65	E	98.3	Very high	98.4	Very high	84 Å²	84	97.3 Å²	97.3	39%	0.393	51%	0.513	S	S	.	.	H	α-helix	trans	-64.6	-42.2	179.7	-169.2	57.3	-149	0	0	111.5	A61 E62 R67 K68 L69	A61-E65 PolarHBondContact O-N 3.48Å; E62-E65 PolarHBondContact O-N 3.27Å; E65-R67 VanDerWaalsContact C-N 3.33Å; E65-R67 PolarHBondContact O-N 2.9Å; E65-K68 WeakPolarHBondContact O-CB 3.4Å; E65-K68 PolarHBondContact O-N 3.46Å; E65-K68 IonicContact OE1-NZ 3.94Å; E65-K68 IonicContact OE2-NZ 2.78Å; E65-K68 PolarHBondContact OE2-NZ 3.03Å; E65-L69 WeakPolarHBondContact O-CG 3.29Å; E65-L69 PolarHBondContact O-N 3.23Å
66	S	98.2	Very high	98.3	Very high	57 Å²	57	96.3 Å²	96.3	40%	0.399	51%	0.507	S	S	.	.	H	α-helix	trans	-58.2	-43.8	173.7	-175.8	0	0	0	0	112.4	E62 V64 K70	E62-S66 WeakPolarHBondContact O-CB 3.32Å; E62-S66 PolarHBondContact O-N 3.11Å; V64-S66 PolarHBondContact O-N 3.45Å; S66-K70 WeakPolarHBondContact O-CG 3.45Å; S66-K70 PolarHBondContact O-N 3.13Å; S66-K70 VanDerWaalsContact O-N 3.13Å
67	R	98.3	Very high	98.3	Very high	196 Å²	196	95.6 Å²	95.6	74%	0.74	50%	0.504	S	S	*	.	H	α-helix	trans	-66.7	-40.5	177.3	-77.4	-178.2	176.4	-151.7	0.1	112.2	K63 V64 E65 K70 A71	K63-R67 WeakPolarHBondContact O-CB 3.32Å; K63-R67 WeakPolarHBondContact O-CG 3.47Å; K63-R67 PolarHBondContact O-N 3.46Å; V64-R67 PolarHBondContact O-N 3.24Å; E65-R67 VanDerWaalsContact C-N 3.33Å; E65-R67 PolarHBondContact O-N 2.9Å; R67-K70 PolarHBondContact O-N 3.46Å; R67-A71 WeakPolarHBondContact O-CB 3.41Å; R67-A71 PolarHBondContact O-N 2.95Å
68	K	98.5	Very high	98.3	Very high	110 Å²	110	96.7 Å²	96.7	48%	0.478	51%	0.51	S	S	.	.	H	α-helix	trans	-60.6	-46.1	176.8	179.2	-174.7	163.7	-155.5	0	111.2	V64 E65 K70 A71 I72	V64-K68 WeakPolarHBondContact O-CB 3.32Å; V64-K68 PolarHBondContact O-N 2.88Å; E65-K68 WeakPolarHBondContact O-CB 3.4Å; E65-K68 PolarHBondContact O-N 3.46Å; E65-K68 IonicContact OE1-NZ 3.94Å; E65-K68 IonicContact OE2-NZ 2.78Å; E65-K68 PolarHBondContact OE2-NZ 3.03Å; K68-K70 PolarHBondContact O-N 2.91Å; K68-A71 PolarHBondContact O-N 3.3Å; K68-I72 HydrophobicContact CG-CD1 4.08Å; K68-I72 WeakPolarHBondContact O-CG1 3.42Å; K68-I72 PolarHBondContact O-N 3.22Å
69	L	98.4	Very high	98.2	Very high	107 Å²	107	96.3 Å²	96.3	56%	0.56	51%	0.511	S	S	*	.	H	α-helix	trans	-60.2	-43.9	175.8	-72	173	0	0	0	112.1	E65 A71 I72 G73	E65-L69 WeakPolarHBondContact O-CG 3.29Å; E65-L69 PolarHBondContact O-N 3.23Å; L69-A71 PolarHBondContact O-N 3.34Å; L69-I72 PolarHBondContact O-N 3.22Å; L69-G73 PolarHBondContact O-N 2.94Å
70	K	98.4	Very high	98.2	Very high	145 Å²	145	97.3 Å²	97.3	63%	0.63	52%	0.518	S	S	*	.	H	α-helix	trans	-60.7	-44.8	174.9	-72	178.7	-177.6	-177.3	0	112	S66 R67 K68 I72 G73 S74	S66-K70 WeakPolarHBondContact O-CG 3.45Å; S66-K70 PolarHBondContact O-N 3.13Å; S66-K70 VanDerWaalsContact O-N 3.13Å; R67-K70 PolarHBondContact O-N 3.46Å; K68-K70 PolarHBondContact O-N 2.91Å; K70-I72 PolarHBondContact O-N 2.93Å; K70-G73 PolarHBondContact O-N 3.47Å; K70-S74 PolarHBondContact O-N 3.38Å; K70-S74 PolarHBondContact O-OG 3.48Å
71	A	98.4	Very high	98.1	Very high	61 Å²	61	98.5 Å²	98.5	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-62.8	-41.6	178.8	0	0	0	0	0	112.3	R67 K68 L69 S74 R75	R67-A71 WeakPolarHBondContact O-CB 3.41Å; R67-A71 PolarHBondContact O-N 2.95Å; K68-A71 PolarHBondContact O-N 3.3Å; L69-A71 PolarHBondContact O-N 3.34Å; A71-S74 PolarHBondContact O-N 2.94Å; A71-R75 WeakPolarHBondContact O-CB 3.43Å; A71-R75 PolarHBondContact O-N 3.43Å
72	I	98.1	Very high	98.1	Very high	78 Å²	78	101.3 Å²	101.3	40%	0.4	52%	0.523	S	S	.	.	H	α-helix	trans	-61.4	-46.6	173.7	-67.4	166.1	0	0	0	110.2	K68 L69 K70 S74 R75 N76	K68-I72 HydrophobicContact CG-CD1 4.08Å; K68-I72 WeakPolarHBondContact O-CG1 3.42Å; K68-I72 PolarHBondContact O-N 3.22Å; L69-I72 PolarHBondContact O-N 3.22Å; K70-I72 PolarHBondContact O-N 2.93Å; I72-S74 PolarHBondContact O-N 3.46Å; I72-R75 PolarHBondContact O-N 3.49Å; I72-N76 PolarHBondContact O-N 3.43Å
73	G	98.2	Very high	98	Very high	40 Å²	40	99.6 Å²	99.6	41%	0.412	51%	0.513	S	S	.	.	H	α-helix	trans	-57.4	-48.1	176.6	0	0	0	0	0	112.6	L69 K70 R75 N76 L77	L69-G73 PolarHBondContact O-N 2.94Å; K70-G73 PolarHBondContact O-N 3.47Å; G73-R75 PolarHBondContact O-N 3.35Å; G73-N76 PolarHBondContact O-N 2.94Å; G73-L77 PolarHBondContact O-N 3.18Å
74	S	98.1	Very high	98	Very high	72 Å²	72	98.8 Å²	98.8	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-61.3	-41.4	175.7	-61.5	0	0	0	0	112.4	K70 A71 I72 L77 L78	K70-S74 PolarHBondContact O-N 3.38Å; K70-S74 PolarHBondContact O-OG 3.48Å; A71-S74 PolarHBondContact O-N 2.94Å; I72-S74 PolarHBondContact O-N 3.46Å; S74-L77 PolarHBondContact O-N 2.76Å; S74-L78 WeakPolarHBondContact O-CG 3.38Å; S74-L78 PolarHBondContact O-N 3.03Å
75	R	98.1	Very high	98	Very high	188 Å²	188	101.5 Å²	101.5	71%	0.709	51%	0.512	S	S	*	.	H	α-helix	trans	-63.6	-42.7	177.9	-165.1	176	87.9	152.8	5.1	111.9	A71 I72 G73 L78 A79	A71-R75 WeakPolarHBondContact O-CB 3.43Å; A71-R75 PolarHBondContact O-N 3.43Å; I72-R75 PolarHBondContact O-N 3.49Å; G73-R75 PolarHBondContact O-N 3.35Å; R75-L78 PolarHBondContact O-N 2.97Å; R75-A79 PolarHBondContact O-N 3.38Å
76	N	98	Very high	98	Very high	95 Å²	95	100.8 Å²	100.8	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-65.6	-40.6	177.5	-70.2	-7.4	0	0	0	111.5	I72 G73 A79 S80	I72-N76 PolarHBondContact O-N 3.43Å; G73-N76 PolarHBondContact O-N 2.94Å; N76-A79 PolarHBondContact O-N 3.4Å; N76-S80 PolarHBondContact O-N 2.88Å; N76-S80 PolarHBondContact O-OG 3.22Å
77	L	97.9	Very high	97.9	Very high	94 Å²	94	102.8 Å²	102.8	49%	0.492	52%	0.515	S	S	.	.	H	α-helix	trans	-60.3	-47.9	175.2	-178.7	62	0	0	0	111.1	G73 S74 A79 S80 M81	G73-L77 PolarHBondContact O-N 3.18Å; S74-L77 PolarHBondContact O-N 2.76Å; L77-A79 PolarHBondContact O-N 2.86Å; L77-S80 PolarHBondContact O-N 3.45Å; L77-S80 PolarHBondContact O-OG 2.88Å; L77-M81 HydrophobicContact CD1-CE 4.19Å; L77-M81 HydrophobicContact CD1-CG 4.38Å; L77-M81 HydrophobicContact CD1-SD 4.48Å; L77-M81 HydrophobicContact CD2-CE 4.42Å; L77-M81 HydrophobicContact CG-CE 4.23Å; L77-M81 HydrophobicContact CG-SD 4.16Å; L77-M81 WeakPolarHBondContact O-CB 3.36Å; L77-M81 WeakPolarHBondContact O-CG 3.39Å; L77-M81 PolarHBondContact O-N 2.71Å
78	L	97.8	Very high	97.9	Very high	116 Å²	116	98.4 Å²	98.4	61%	0.607	50%	0.503	S	S	*	.	H	α-helix	trans	-59.4	-44.9	177.6	-72	172.9	0	0	0	112.3	S74 R75 S80 M81 E82	S74-L78 WeakPolarHBondContact O-CG 3.38Å; S74-L78 PolarHBondContact O-N 3.03Å; R75-L78 PolarHBondContact O-N 2.97Å; L78-S80 VanDerWaalsContact C-N 3.34Å; L78-S80 PolarHBondContact O-N 3.2Å; L78-M81 PolarHBondContact O-N 2.93Å; L78-E82 WeakPolarHBondContact O-CB 3.47Å; L78-E82 PolarHBondContact O-N 3.43Å
79	A	97.2	Very high	97.9	Very high	56 Å²	56	98.4 Å²	98.4	46%	0.463	50%	0.504	S	S	.	.	H	α-helix	trans	-62.1	-40.8	176.7	0	0	0	0	0	112	R75 N76 L77 K83	R75-A79 PolarHBondContact O-N 3.38Å; N76-A79 PolarHBondContact O-N 3.4Å; L77-A79 PolarHBondContact O-N 2.86Å; A79-K83 PolarHBondContact O-N 3.29Å
80	S	97.5	Very high	97.9	Very high	61 Å²	61	98.7 Å²	98.7	43%	0.427	50%	0.501	S	S	.	.	H	α-helix	trans	-66.5	-39.5	175.9	71.2	0	0	0	0	112.7	N76 L77 L78 K83 Q84	N76-S80 PolarHBondContact O-N 2.88Å; N76-S80 PolarHBondContact O-OG 3.22Å; L77-S80 PolarHBondContact O-N 3.45Å; L77-S80 PolarHBondContact O-OG 2.88Å; L78-S80 VanDerWaalsContact C-N 3.34Å; L78-S80 PolarHBondContact O-N 3.2Å; S80-K83 PolarHBondContact O-N 3.06Å; S80-Q84 WeakPolarHBondContact O-CB 3.5Å; S80-Q84 PolarHBondContact O-N 3.28Å
81	M	97.7	Very high	97.9	Very high	97 Å²	97	97.3 Å²	97.3	48%	0.478	50%	0.496	S	S	.	.	H	α-helix	trans	-65.7	-41.8	177	-77.6	178.8	158.1	0	0	111.8	L77 L78 K83 Q84 R85	L77-M81 HydrophobicContact CD1-CE 4.19Å; L77-M81 HydrophobicContact CD1-CG 4.38Å; L77-M81 HydrophobicContact CD1-SD 4.48Å; L77-M81 HydrophobicContact CD2-CE 4.42Å; L77-M81 HydrophobicContact CG-CE 4.23Å; L77-M81 HydrophobicContact CG-SD 4.16Å; L77-M81 WeakPolarHBondContact O-CB 3.36Å; L77-M81 WeakPolarHBondContact O-CG 3.39Å; L77-M81 PolarHBondContact O-N 2.71Å; L78-M81 PolarHBondContact O-N 2.93Å; M81-K83 VanDerWaalsContact C-N 3.33Å; M81-Q84 PolarHBondContact O-N 3.04Å; M81-R85 WeakPolarHBondContact O-CB 3.47Å; M81-R85 PolarHBondContact O-N 3.31Å
82	E	96.8	Very high	97.9	Very high	117 Å²	117	99 Å²	99	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-59.8	-45.3	173.4	174.9	165.6	-142.1	0	0	111.2	L78 R85 E86	L78-E82 WeakPolarHBondContact O-CB 3.47Å; L78-E82 PolarHBondContact O-N 3.43Å; E82-R85 PolarHBondContact O-N 3.35Å; E82-R85 IonicContact OE1-NH2 3.87Å; E82-E86 PolarHBondContact O-N 3.49Å
83	K	97.4	Very high	97.9	Very high	104 Å²	104	100.1 Å²	100.1	45%	0.452	50%	0.5	S	S	.	.	H	α-helix	trans	-64.6	-42.5	177.7	-172.5	59.6	-178.2	176.5	0	112.6	A79 S80 M81 R85 E86 L87	A79-K83 PolarHBondContact O-N 3.29Å; S80-K83 PolarHBondContact O-N 3.06Å; M81-K83 VanDerWaalsContact C-N 3.33Å; K83-R85 VanDerWaalsContact C-N 3.32Å; K83-R85 PolarHBondContact O-N 2.98Å; K83-E86 WeakPolarHBondContact CD-OE2 3.29Å; K83-E86 IonicContact NZ-OE1 3.59Å; K83-E86 IonicContact NZ-OE2 3.36Å; K83-E86 PolarHBondContact NZ-OE2 2.69Å; K83-E86 PolarHBondContact O-N 3.3Å; K83-L87 HydrophobicContact CG-CD1 4.4Å; K83-L87 WeakPolarHBondContact O-CG 3.43Å; K83-L87 PolarHBondContact O-N 2.89Å
84	Q	98	Very high	98	Very high	109 Å²	109	101.8 Å²	101.8	51%	0.509	51%	0.505	S	S	.	.	H	α-helix	trans	-61.3	-42.8	176.4	-178	178.6	-15.4	0	0	111.1	S80 M81 L87 Q88	S80-Q84 WeakPolarHBondContact O-CB 3.5Å; S80-Q84 PolarHBondContact O-N 3.28Å; M81-Q84 PolarHBondContact O-N 3.04Å; Q84-L87 PolarHBondContact O-N 3.39Å; Q84-Q88 HydrophobicContact CG-CG 4.43Å; Q84-Q88 WeakPolarHBondContact O-CB 3.5Å; Q84-Q88 VanDerWaalsContact O-CG 3.29Å; Q84-Q88 WeakPolarHBondContact O-CG 3.37Å; Q84-Q88 PolarHBondContact O-N 3.46Å
85	R	98.1	Very high	98	Very high	145 Å²	145	102.8 Å²	102.8	55%	0.547	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-44.5	176.9	-175.9	178.3	63.8	-124	-1.1	111.8	M81 E82 K83 L87 Q88 Q89	M81-R85 WeakPolarHBondContact O-CB 3.47Å; M81-R85 PolarHBondContact O-N 3.31Å; E82-R85 PolarHBondContact O-N 3.35Å; E82-R85 IonicContact OE1-NH2 3.87Å; K83-R85 VanDerWaalsContact C-N 3.32Å; K83-R85 PolarHBondContact O-N 2.98Å; R85-L87 VanDerWaalsContact C-N 3.34Å; R85-L87 PolarHBondContact O-N 2.88Å; R85-Q88 PolarHBondContact O-N 2.99Å; R85-Q89 WeakPolarHBondContact O-CB 3.48Å; R85-Q89 PolarHBondContact O-N 3.41Å
86	E	98	Very high	98	Very high	68 Å²	68	98.4 Å²	98.4	32%	0.318	49%	0.492	S	S	.	.	H	α-helix	trans	-59.6	-44.2	176.1	-167.6	-154.3	157.6	0	0	111.5	E82 K83 Q89 K90	E82-E86 PolarHBondContact O-N 3.49Å; K83-E86 WeakPolarHBondContact CD-OE2 3.29Å; K83-E86 IonicContact NZ-OE1 3.59Å; K83-E86 IonicContact NZ-OE2 3.36Å; K83-E86 PolarHBondContact NZ-OE2 2.69Å; K83-E86 PolarHBondContact O-N 3.3Å; E86-Q89 PolarHBondContact O-N 3.04Å; E86-K90 WeakPolarHBondContact O-CG 3.34Å; E86-K90 PolarHBondContact O-N 3.34Å; E86-K90 WeakPolarHBondContact OE1-CE 3.32Å; E86-K90 IonicContact OE1-NZ 2.76Å; E86-K90 PolarHBondContact OE1-NZ 2.94Å
87	L	98	Very high	98	Very high	100 Å²	100	98.5 Å²	98.5	52%	0.524	49%	0.492	S	S	.	.	H	α-helix	trans	-65.3	-43.7	177.6	-71.3	173.1	0	0	0	112	K83 Q84 R85 Q89 K90 H91	K83-L87 HydrophobicContact CG-CD1 4.4Å; K83-L87 WeakPolarHBondContact O-CG 3.43Å; K83-L87 PolarHBondContact O-N 2.89Å; Q84-L87 PolarHBondContact O-N 3.39Å; R85-L87 VanDerWaalsContact C-N 3.34Å; R85-L87 PolarHBondContact O-N 2.88Å; L87-Q89 VanDerWaalsContact C-N 3.34Å; L87-K90 PolarHBondContact O-N 3.32Å; L87-H91 WeakPolarHBondContact O-CB 3.38Å; L87-H91 PolarHBondContact O-N 2.82Å
88	Q	98.3	Very high	98	Very high	104 Å²	104	96.3 Å²	96.3	49%	0.486	49%	0.487	S	S	.	.	H	α-helix	trans	-62.1	-42.6	176.7	-76.1	175.9	-24.2	0	0	111.5	Q84 R85 H91 L92	Q84-Q88 HydrophobicContact CG-CG 4.43Å; Q84-Q88 WeakPolarHBondContact O-CB 3.5Å; Q84-Q88 VanDerWaalsContact O-CG 3.29Å; Q84-Q88 WeakPolarHBondContact O-CG 3.37Å; Q84-Q88 PolarHBondContact O-N 3.46Å; R85-Q88 PolarHBondContact O-N 2.99Å; Q88-H91 PolarHBondContact O-N 3.26Å; Q88-L92 WeakPolarHBondContact O-CG 3.45Å; Q88-L92 PolarHBondContact O-N 3.02Å
89	Q	98.4	Very high	98.1	Very high	109 Å²	109	97.3 Å²	97.3	51%	0.509	49%	0.487	S	S	.	.	H	α-helix	trans	-60.8	-50.8	176.3	-179.2	179.6	-9.5	0	0	111.2	R85 E86 L87 H91 L92 E93	R85-Q89 WeakPolarHBondContact O-CB 3.48Å; R85-Q89 PolarHBondContact O-N 3.41Å; E86-Q89 PolarHBondContact O-N 3.04Å; L87-Q89 VanDerWaalsContact C-N 3.34Å; Q89-H91 VanDerWaalsContact C-N 3.25Å; Q89-H91 PolarHBondContact O-N 3.45Å; Q89-L92 PolarHBondContact O-N 2.9Å; Q89-L92 VanDerWaalsContact O-N 3.17Å; Q89-E93 HydrophobicContact CG-CG 4.47Å; Q89-E93 WeakPolarHBondContact CG-OE1 3.44Å; Q89-E93 PolarHBondContact NE2-OE1 3.04Å; Q89-E93 WeakPolarHBondContact O-CG 3.3Å; Q89-E93 PolarHBondContact O-N 2.88Å
90	K	98.3	Very high	98.1	Very high	114 Å²	114	100.7 Å²	100.7	50%	0.496	49%	0.491	S	S	.	.	H	α-helix	trans	-58.3	-39.3	177	-76.6	176.3	170.9	170.5	0	112.3	E86 L87 S94	E86-K90 WeakPolarHBondContact O-CG 3.34Å; E86-K90 PolarHBondContact O-N 3.34Å; E86-K90 WeakPolarHBondContact OE1-CE 3.32Å; E86-K90 IonicContact OE1-NZ 2.76Å; E86-K90 PolarHBondContact OE1-NZ 2.94Å; L87-K90 PolarHBondContact O-N 3.32Å; K90-S94 WeakPolarHBondContact O-CB 3.42Å; K90-S94 PolarHBondContact O-N 2.92Å
91	H	98.3	Very high	98.2	Very high	115 Å²	115	104.2 Å²	104.2	53%	0.532	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-46.6	176.7	-175.3	60	0	0	0	111.8	L87 Q88 Q89 S94 Q95	L87-H91 WeakPolarHBondContact O-CB 3.38Å; L87-H91 PolarHBondContact O-N 2.82Å; Q88-H91 PolarHBondContact O-N 3.26Å; Q89-H91 VanDerWaalsContact C-N 3.25Å; Q89-H91 PolarHBondContact O-N 3.45Å; H91-S94 PolarHBondContact O-N 3.48Å; H91-Q95 PolarHBondContact CD2-NE2 2.89Å; H91-Q95 VanDerWaalsContact CD2-NE2 3.26Å; H91-Q95 PolarHBondContact NE2-NE2 3.39Å; H91-Q95 WeakPolarHBondContact O-CG 3.38Å; H91-Q95 PolarHBondContact O-N 3.33Å
92	L	98.6	Very high	98.2	Very high	96 Å²	96	102.1 Å²	102.1	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-63.4	-43.6	176.6	-72.9	169.8	0	0	0	112	Q88 Q89 S94 Q95 I96	Q88-L92 WeakPolarHBondContact O-CG 3.45Å; Q88-L92 PolarHBondContact O-N 3.02Å; Q89-L92 PolarHBondContact O-N 2.9Å; Q89-L92 VanDerWaalsContact O-N 3.17Å; L92-S94 VanDerWaalsContact C-N 3.3Å; L92-S94 PolarHBondContact O-N 3.15Å; L92-Q95 PolarHBondContact O-N 2.88Å; L92-Q95 VanDerWaalsContact O-N 3.15Å; L92-I96 VanDerWaalsContact O-CG1 3.3Å; L92-I96 WeakPolarHBondContact O-CG1 3.41Å; L92-I96 PolarHBondContact O-N 2.94Å
93	E	98.5	Very high	98.3	Very high	102 Å²	102	101 Å²	101	48%	0.477	49%	0.486	S	S	.	.	H	α-helix	trans	-58.6	-42.6	175.8	-74.8	172.7	-173.2	0	0	111.7	Q89 I96 L97	Q89-E93 HydrophobicContact CG-CG 4.47Å; Q89-E93 WeakPolarHBondContact CG-OE1 3.44Å; Q89-E93 PolarHBondContact NE2-OE1 3.04Å; Q89-E93 WeakPolarHBondContact O-CG 3.3Å; Q89-E93 PolarHBondContact O-N 2.88Å; E93-I96 PolarHBondContact O-N 3.17Å; E93-L97 WeakPolarHBondContact O-CB 3.44Å; E93-L97 PolarHBondContact O-N 3.31Å
94	S	98.4	Very high	98.3	Very high	75 Å²	75	100.7 Å²	100.7	52%	0.524	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-40.9	174.9	-175.2	0	0	0	0	112.4	K90 H91 L92 L97 A98	K90-S94 WeakPolarHBondContact O-CB 3.42Å; K90-S94 PolarHBondContact O-N 2.92Å; H91-S94 PolarHBondContact O-N 3.48Å; L92-S94 VanDerWaalsContact C-N 3.3Å; L92-S94 PolarHBondContact O-N 3.15Å; S94-L97 PolarHBondContact O-N 3.03Å; S94-A98 PolarHBondContact O-N 3.4Å
95	Q	98.6	Very high	98.4	Very high	94 Å²	94	102 Å²	102	44%	0.439	49%	0.49	S	S	.	.	H	α-helix	trans	-65.9	-43.9	176.8	-70.9	-174.5	27.9	0	0	111.6	H91 L92 L97 A98 K99	H91-Q95 PolarHBondContact CD2-NE2 2.89Å; H91-Q95 VanDerWaalsContact CD2-NE2 3.26Å; H91-Q95 PolarHBondContact NE2-NE2 3.39Å; H91-Q95 WeakPolarHBondContact O-CG 3.38Å; H91-Q95 PolarHBondContact O-N 3.33Å; L92-Q95 PolarHBondContact O-N 2.88Å; L92-Q95 VanDerWaalsContact O-N 3.15Å; Q95-L97 VanDerWaalsContact C-N 3.31Å; Q95-L97 PolarHBondContact O-N 3.03Å; Q95-A98 PolarHBondContact O-N 2.95Å; Q95-K99 WeakPolarHBondContact O-CG 3.48Å; Q95-K99 PolarHBondContact O-N 3.44Å
96	I	98.6	Very high	98.4	Very high	95 Å²	95	99.6 Å²	99.6	49%	0.487	49%	0.487	S	S	.	.	H	α-helix	trans	-59.6	-45.1	177	-69.8	166.4	0	0	0	110	L92 E93 A98 K99 K100	L92-I96 VanDerWaalsContact O-CG1 3.3Å; L92-I96 WeakPolarHBondContact O-CG1 3.41Å; L92-I96 PolarHBondContact O-N 2.94Å; E93-I96 PolarHBondContact O-N 3.17Å; I96-A98 PolarHBondContact O-N 3.49Å; I96-K99 PolarHBondContact O-N 2.92Å; I96-K100 HydrophobicContact CG2-CD 4.26Å; I96-K100 WeakPolarHBondContact O-CG 3.5Å; I96-K100 PolarHBondContact O-N 3.26Å
97	L	98.4	Very high	98.4	Very high	97 Å²	97	100.1 Å²	100.1	51%	0.508	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-43.6	177.6	-178.4	64.3	0	0	0	112	E93 S94 Q95 K100 K101	E93-L97 WeakPolarHBondContact O-CB 3.44Å; E93-L97 PolarHBondContact O-N 3.31Å; S94-L97 PolarHBondContact O-N 3.03Å; Q95-L97 VanDerWaalsContact C-N 3.31Å; Q95-L97 PolarHBondContact O-N 3.03Å; L97-K100 PolarHBondContact O-N 3.48Å; L97-K101 WeakPolarHBondContact O-CG 3.48Å; L97-K101 PolarHBondContact O-N 3.32Å; L97-K101 VanDerWaalsContact O-N 3.14Å
98	A	98.3	Very high	98.4	Very high	48 Å²	48	100 Å²	100	40%	0.397	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-45.1	176.6	0	0	0	0	0	111.5	S94 Q95 I96 K100 K101 D102	S94-A98 PolarHBondContact O-N 3.4Å; Q95-A98 PolarHBondContact O-N 2.95Å; I96-A98 PolarHBondContact O-N 3.49Å; A98-K100 PolarHBondContact O-N 3.26Å; A98-K101 WeakPolarHBondContact O-CB 3.4Å; A98-K101 PolarHBondContact O-N 3.4Å; A98-D102 PolarHBondContact O-N 3.14Å
99	K	98.6	Very high	98.4	Very high	138 Å²	138	99.7 Å²	99.7	60%	0.6	49%	0.494	S	S	*	.	H	α-helix	trans	-65.5	-37.3	178	-69.5	-62.9	-179	-170.2	0	113.2	Q95 I96 D102 I103	Q95-K99 WeakPolarHBondContact O-CG 3.48Å; Q95-K99 PolarHBondContact O-N 3.44Å; I96-K99 PolarHBondContact O-N 2.92Å; K99-D102 PolarHBondContact O-N 3.43Å; K99-I103 WeakPolarHBondContact O-CG1 3.34Å; K99-I103 PolarHBondContact O-N 3.48Å
100	K	98.5	Very high	98.4	Very high	126 Å²	126	98.9 Å²	98.9	55%	0.548	49%	0.493	S	S	.	.	H	α-helix	trans	-60	-45.4	173	-76.1	-179.8	176.6	-174.8	0	111.6	I96 L97 A98 D102 I103 D104	I96-K100 HydrophobicContact CG2-CD 4.26Å; I96-K100 WeakPolarHBondContact O-CG 3.5Å; I96-K100 PolarHBondContact O-N 3.26Å; L97-K100 PolarHBondContact O-N 3.48Å; A98-K100 PolarHBondContact O-N 3.26Å; K100-D102 VanDerWaalsContact C-N 3.32Å; K100-D102 PolarHBondContact O-N 2.8Å; K100-I103 WeakPolarHBondContact O-CB 3.39Å; K100-I103 PolarHBondContact O-N 3.35Å; K100-I103 VanDerWaalsContact O-N 3.16Å; K100-D104 VanDerWaalsContact O-CG 3.26Å; K100-D104 PolarHBondContact O-N 2.92Å
101	K	98.4	Very high	98.4	Very high	135 Å²	135	99.5 Å²	99.5	59%	0.587	50%	0.497	S	S	*	.	H	α-helix	trans	-61.1	-39.5	175.5	-70	179.1	178.5	-175.9	0	112.8	L97 A98 I103 D104 R105	L97-K101 WeakPolarHBondContact O-CG 3.48Å; L97-K101 PolarHBondContact O-N 3.32Å; L97-K101 VanDerWaalsContact O-N 3.14Å; A98-K101 WeakPolarHBondContact O-CB 3.4Å; A98-K101 PolarHBondContact O-N 3.4Å; K101-I103 VanDerWaalsContact C-N 3.35Å; K101-D104 PolarHBondContact O-N 3.16Å; K101-R105 WeakPolarHBondContact O-CB 3.5Å; K101-R105 PolarHBondContact O-N 2.96Å
102	D	98.4	Very high	98.4	Very high	54 Å²	54	97.6 Å²	97.6	29%	0.289	50%	0.497	S	S	.	.	H	α-helix	trans	-63.2	-42	175.2	-77.6	-32.7	0	0	0	111.6	A98 K99 K100 R105 L106	A98-D102 PolarHBondContact O-N 3.14Å; K99-D102 PolarHBondContact O-N 3.43Å; K100-D102 VanDerWaalsContact C-N 3.32Å; K100-D102 PolarHBondContact O-N 2.8Å; D102-R105 PolarHBondContact O-N 3.28Å; D102-R105 IonicContact OD1-CZ 3.86Å; D102-R105 IonicContact OD1-NH1 2.69Å; D102-R105 IonicContact OD1-NH2 3.93Å; D102-R105 PolarHBondContact OD1-NH2 3.43Å; D102-L106 WeakPolarHBondContact O-CB 3.47Å; D102-L106 VanDerWaalsContact O-CG 3.27Å; D102-L106 WeakPolarHBondContact O-CG 3.27Å; D102-L106 PolarHBondContact O-N 3.03Å
103	I	98.5	Very high	98.4	Very high	93 Å²	93	98.1 Å²	98.1	48%	0.477	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-48.1	176.3	-70.2	166.2	0	0	0	110.6	K99 K100 K101 R105 L106 N107	K99-I103 WeakPolarHBondContact O-CG1 3.34Å; K99-I103 PolarHBondContact O-N 3.48Å; K100-I103 WeakPolarHBondContact O-CB 3.39Å; K100-I103 PolarHBondContact O-N 3.35Å; K100-I103 VanDerWaalsContact O-N 3.16Å; K101-I103 VanDerWaalsContact C-N 3.35Å; I103-R105 VanDerWaalsContact C-N 3.29Å; I103-R105 PolarHBondContact O-N 3.16Å; I103-L106 PolarHBondContact O-N 3.48Å; I103-L106 VanDerWaalsContact O-N 3.11Å; I103-N107 PolarHBondContact O-N 3.06Å; I103-N107 PolarHBondContact O-ND2 3.38Å
104	D	98.3	Very high	98.4	Very high	98 Å²	98	98.2 Å²	98.2	52%	0.524	50%	0.5	S	S	.	.	H	α-helix	trans	-58.5	-43.3	179	-63.9	-25.1	0	0	0	111	K100 K101 N107 V108	K100-D104 VanDerWaalsContact O-CG 3.26Å; K100-D104 PolarHBondContact O-N 2.92Å; K101-D104 PolarHBondContact O-N 3.16Å; D104-N107 PolarHBondContact O-N 3.4Å; D104-V108 WeakPolarHBondContact O-CG2 3.37Å; D104-V108 PolarHBondContact O-N 2.98Å; D104-V108 VanDerWaalsContact O-N 3.16Å
105	R	98.4	Very high	98.4	Very high	135 Å²	135	101.1 Å²	101.1	51%	0.509	50%	0.503	S	S	.	.	H	α-helix	trans	-61.1	-46.2	174.6	-177.5	-174.7	65.4	-150.2	-15.7	112	K101 D102 I103 N107 V108 Q109	K101-R105 WeakPolarHBondContact O-CB 3.5Å; K101-R105 PolarHBondContact O-N 2.96Å; D102-R105 PolarHBondContact O-N 3.28Å; D102-R105 IonicContact OD1-CZ 3.86Å; D102-R105 IonicContact OD1-NH1 2.69Å; D102-R105 IonicContact OD1-NH2 3.93Å; D102-R105 PolarHBondContact OD1-NH2 3.43Å; I103-R105 VanDerWaalsContact C-N 3.29Å; I103-R105 PolarHBondContact O-N 3.16Å; R105-N107 VanDerWaalsContact C-N 3.34Å; R105-V108 PolarHBondContact O-N 3.07Å; R105-Q109 WeakPolarHBondContact O-CG 3.42Å; R105-Q109 PolarHBondContact O-N 2.89Å
106	L	98.6	Very high	98.3	Very high	95 Å²	95	101.2 Å²	101.2	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-65.5	-36.9	-179	-74.5	168.3	0	0	0	111.9	D102 I103 Q109 L110	D102-L106 WeakPolarHBondContact O-CB 3.47Å; D102-L106 VanDerWaalsContact O-CG 3.27Å; D102-L106 WeakPolarHBondContact O-CG 3.27Å; D102-L106 PolarHBondContact O-N 3.03Å; I103-L106 PolarHBondContact O-N 3.48Å; I103-L106 VanDerWaalsContact O-N 3.11Å; L106-Q109 PolarHBondContact O-N 2.88Å; L106-L110 WeakPolarHBondContact O-CB 3.43Å; L106-L110 PolarHBondContact O-N 3.34Å
107	N	98.5	Very high	98.3	Very high	79 Å²	79	102.6 Å²	102.6	42%	0.422	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-46	175.5	-73.2	-22.8	0	0	0	111.5	I103 D104 R105 Q109 L110 E111	I103-N107 PolarHBondContact O-N 3.06Å; I103-N107 PolarHBondContact O-ND2 3.38Å; D104-N107 PolarHBondContact O-N 3.4Å; R105-N107 VanDerWaalsContact C-N 3.34Å; N107-Q109 VanDerWaalsContact C-N 3.3Å; N107-Q109 PolarHBondContact O-N 3.11Å; N107-L110 WeakPolarHBondContact O-CB 3.42Å; N107-L110 PolarHBondContact O-N 3.34Å; N107-E111 WeakPolarHBondContact O-CG 3.49Å; N107-E111 PolarHBondContact O-N 3.5Å
108	V	98.2	Very high	98.3	Very high	97 Å²	97	100.8 Å²	100.8	59%	0.588	51%	0.507	S	S	*	.	H	α-helix	trans	-61.2	-39.5	175.8	173	0	0	0	0	111.5	D104 R105 S112	D104-V108 WeakPolarHBondContact O-CG2 3.37Å; D104-V108 PolarHBondContact O-N 2.98Å; D104-V108 VanDerWaalsContact O-N 3.16Å; R105-V108 PolarHBondContact O-N 3.07Å; V108-S112 PolarHBondContact O-N 3.41Å; V108-S112 VanDerWaalsContact O-N 3.07Å
109	Q	98.2	Very high	98.2	Very high	99 Å²	99	103.6 Å²	103.6	46%	0.463	51%	0.512	S	S	.	.	H	α-helix	trans	-64.9	-42.5	175.5	-73.7	176.9	-20.9	0	0	112	R105 L106 N107 S112 L113	R105-Q109 WeakPolarHBondContact O-CG 3.42Å; R105-Q109 PolarHBondContact O-N 2.89Å; L106-Q109 PolarHBondContact O-N 2.88Å; N107-Q109 VanDerWaalsContact C-N 3.3Å; N107-Q109 PolarHBondContact O-N 3.11Å; Q109-S112 PolarHBondContact O-N 3.19Å; Q109-L113 WeakPolarHBondContact O-CG 3.37Å; Q109-L113 PolarHBondContact O-N 3.13Å
110	L	98.4	Very high	98.1	Very high	92 Å²	92	102 Å²	102	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-61.9	-47	177	-179.5	64.9	0	0	0	111.4	L106 N107 S112 L113 Q114	L106-L110 WeakPolarHBondContact O-CB 3.43Å; L106-L110 PolarHBondContact O-N 3.34Å; N107-L110 WeakPolarHBondContact O-CB 3.42Å; N107-L110 PolarHBondContact O-N 3.34Å; L110-S112 VanDerWaalsContact C-N 3.29Å; L110-S112 PolarHBondContact O-N 3.19Å; L110-L113 PolarHBondContact O-N 3.38Å; L110-Q114 HydrophobicContact CD1-CG 4.38Å; L110-Q114 HydrophobicContact CG-CG 4.47Å; L110-Q114 WeakPolarHBondContact O-CB 3.49Å; L110-Q114 WeakPolarHBondContact O-CG 3.33Å; L110-Q114 PolarHBondContact O-N 3.07Å
111	E	98.3	Very high	98	Very high	126 Å²	126	99.1 Å²	99.1	59%	0.589	50%	0.5	S	S	*	.	H	α-helix	trans	-58.8	-41.4	176.7	-73.1	174.4	-173.2	0	0	111.7	N107 Q114 K115	N107-E111 WeakPolarHBondContact O-CG 3.49Å; N107-E111 PolarHBondContact O-N 3.5Å; E111-Q114 PolarHBondContact O-N 2.93Å; E111-K115 PolarHBondContact O-N 2.89Å; E111-K115 VanDerWaalsContact O-N 3.07Å
112	S	98.3	Very high	97.8	Very high	76 Å²	76	97.1 Å²	97.1	53%	0.531	49%	0.493	S	S	.	.	H	α-helix	trans	-63.4	-42.8	176.1	-172.6	0	0	0	0	112.4	V108 Q109 L110 K115 E116	V108-S112 PolarHBondContact O-N 3.41Å; V108-S112 VanDerWaalsContact O-N 3.07Å; Q109-S112 PolarHBondContact O-N 3.19Å; L110-S112 VanDerWaalsContact C-N 3.29Å; L110-S112 PolarHBondContact O-N 3.19Å; S112-K115 PolarHBondContact O-N 3.42Å; S112-E116 PolarHBondContact O-N 3.01Å; S112-E116 VanDerWaalsContact O-N 3.13Å
113	L	98.2	Very high	97.6	Very high	106 Å²	106	101.2 Å²	101.2	56%	0.555	51%	0.508	S	S	*	.	H	α-helix	trans	-69.1	-39.8	179.2	-72.2	170.3	0	0	0	111.9	Q109 L110 K115 E116 E117	Q109-L113 WeakPolarHBondContact O-CG 3.37Å; Q109-L113 PolarHBondContact O-N 3.13Å; L110-L113 PolarHBondContact O-N 3.38Å; L113-K115 VanDerWaalsContact C-N 3.27Å; L113-K115 PolarHBondContact O-N 3.42Å; L113-E116 PolarHBondContact O-N 2.92Å; L113-E117 WeakPolarHBondContact O-CB 3.42Å; L113-E117 PolarHBondContact O-N 3.03Å
114	Q	98.3	Very high	97.4	Very high	104 Å²	104	101.2 Å²	101.2	49%	0.486	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-37.1	175.2	-75.1	177.1	-29.9	0	0	111.8	L110 E111 A118	L110-Q114 HydrophobicContact CD1-CG 4.38Å; L110-Q114 HydrophobicContact CG-CG 4.47Å; L110-Q114 WeakPolarHBondContact O-CB 3.49Å; L110-Q114 WeakPolarHBondContact O-CG 3.33Å; L110-Q114 PolarHBondContact O-N 3.07Å; E111-Q114 PolarHBondContact O-N 2.93Å; Q114-A118 WeakPolarHBondContact O-CB 3.18Å; Q114-A118 PolarHBondContact O-N 3.31Å
115	K	98	Very high	97.2	Very high	136 Å²	136	101.4 Å²	101.4	59%	0.591	51%	0.506	S	S	*	.	H	α-helix	trans	-64.4	-46.1	173.7	-173.7	-175.7	175.4	-163.4	0	111.6	E111 S112 L113 A118 E119	E111-K115 PolarHBondContact O-N 2.89Å; E111-K115 VanDerWaalsContact O-N 3.07Å; S112-K115 PolarHBondContact O-N 3.42Å; L113-K115 VanDerWaalsContact C-N 3.27Å; L113-K115 PolarHBondContact O-N 3.42Å; K115-A118 PolarHBondContact O-N 2.85Å; K115-E119 WeakPolarHBondContact CE-OE1 3.38Å; K115-E119 IonicContact NZ-OE1 2.63Å; K115-E119 WeakPolarHBondContact O-CG 3.43Å; K115-E119 PolarHBondContact O-N 3.45Å
116	E	97.9	Very high	97	Very high	96 Å²	96	103.1 Å²	103.1	45%	0.449	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-42	177.5	-172.7	177.1	177.9	0	0	111.8	S112 L113 A118 E119 Q120	S112-E116 PolarHBondContact O-N 3.01Å; S112-E116 VanDerWaalsContact O-N 3.13Å; L113-E116 PolarHBondContact O-N 2.92Å; E116-A118 VanDerWaalsContact C-N 3.34Å; E116-A118 PolarHBondContact O-N 3.32Å; E116-E119 PolarHBondContact O-N 3.22Å; E116-Q120 WeakPolarHBondContact O-CB 3.46Å; E116-Q120 VanDerWaalsContact O-CG 3.28Å; E116-Q120 WeakPolarHBondContact O-CG 3.28Å; E116-Q120 PolarHBondContact O-N 3.31Å; E116-Q120 PolarHBondContact OE1-NE2 3.03Å
117	E	97.9	Very high	96.7	Very high	125 Å²	125	103.6 Å²	103.6	58%	0.584	51%	0.511	S	S	*	.	H	α-helix	trans	-59.6	-42.8	174.6	-177.8	-178.4	-161.1	0	0	111.8	L113 Q120 T121	L113-E117 WeakPolarHBondContact O-CB 3.42Å; L113-E117 PolarHBondContact O-N 3.03Å; E117-Q120 PolarHBondContact O-N 2.77Å; E117-T121 WeakPolarHBondContact O-CB 3.44Å; E117-T121 PolarHBondContact O-N 3.48Å; E117-T121 PolarHBondContact O-OG1 3.41Å
118	A	97.4	Very high	96.2	Very high	59 Å²	59	105.3 Å²	105.3	49%	0.488	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-44.4	176.9	0	0	0	0	0	112.1	Q114 K115 E116 Q120 T121 E122	Q114-A118 WeakPolarHBondContact O-CB 3.18Å; Q114-A118 PolarHBondContact O-N 3.31Å; K115-A118 PolarHBondContact O-N 2.85Å; E116-A118 VanDerWaalsContact C-N 3.34Å; E116-A118 PolarHBondContact O-N 3.32Å; A118-Q120 VanDerWaalsContact C-N 3.34Å; A118-Q120 PolarHBondContact O-N 2.87Å; A118-T121 PolarHBondContact O-N 2.96Å; A118-E122 WeakPolarHBondContact O-CB 3.38Å; A118-E122 PolarHBondContact O-N 3.33Å
119	E	96.9	Very high	95.3	Very high	107 Å²	107	107.9 Å²	107.9	50%	0.5	53%	0.527	S	S	.	.	H	α-helix	trans	-61.8	-41.5	175.9	-72.2	175.8	-172.2	0	0	111.7	K115 E116 F123	K115-E119 WeakPolarHBondContact CE-OE1 3.38Å; K115-E119 IonicContact NZ-OE1 2.63Å; K115-E119 WeakPolarHBondContact O-CG 3.43Å; K115-E119 PolarHBondContact O-N 3.45Å; E116-E119 PolarHBondContact O-N 3.22Å; E119-F123 WeakPolarHBondContact O-CB 3.48Å; E119-F123 PolarHBondContact O-N 2.95Å
120	Q	96.3	Very high	94.1	Very high	104 Å²	104	106.5 Å²	106.5	49%	0.486	54%	0.539	S	S	.	.	H	α-helix	trans	-66.9	-41.5	176.2	-72	178.3	13.2	0	0	112	E116 E117 A118 F123 I124	E116-Q120 WeakPolarHBondContact O-CB 3.46Å; E116-Q120 VanDerWaalsContact O-CG 3.28Å; E116-Q120 WeakPolarHBondContact O-CG 3.28Å; E116-Q120 PolarHBondContact O-N 3.31Å; E116-Q120 PolarHBondContact OE1-NE2 3.03Å; E117-Q120 PolarHBondContact O-N 2.77Å; A118-Q120 VanDerWaalsContact C-N 3.34Å; A118-Q120 PolarHBondContact O-N 2.87Å; Q120-F123 PolarHBondContact O-N 2.9Å; Q120-I124 VanDerWaalsContact O-CG1 3.25Å; Q120-I124 WeakPolarHBondContact O-CG1 3.25Å; Q120-I124 PolarHBondContact O-N 3.29Å
121	T	96.2	Very high	92	Very high	66 Å²	66	113.6 Å²	113.6	41%	0.405	56%	0.559	S	S	.	*	H	α-helix	trans	-62.2	-46.8	177.2	-58.3	0	0	0	0	110.6	E117 A118 F123 I124 E125	E117-T121 WeakPolarHBondContact O-CB 3.44Å; E117-T121 PolarHBondContact O-N 3.48Å; E117-T121 PolarHBondContact O-OG1 3.41Å; A118-T121 PolarHBondContact O-N 2.96Å; T121-F123 VanDerWaalsContact C-N 3.33Å; T121-F123 PolarHBondContact O-N 3.43Å; T121-I124 PolarHBondContact O-N 3.46Å; T121-E125 WeakPolarHBondContact O-CG 3.28Å; T121-E125 PolarHBondContact O-N 2.93Å
122	E	94.7	Very high	91.7	Very high	92 Å²	92	113 Å²	113	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-61.2	-41.6	175.7	-175	179.9	-169.5	0	0	111.7	A118 E125 R126	A118-E122 WeakPolarHBondContact O-CB 3.38Å; A118-E122 PolarHBondContact O-N 3.33Å; E122-E125 PolarHBondContact O-N 2.63Å; E122-R126 WeakPolarHBondContact O-CB 3.46Å; E122-R126 VanDerWaalsContact O-CG 3.28Å; E122-R126 WeakPolarHBondContact O-CG 3.39Å; E122-R126 PolarHBondContact O-N 3.32Å; E122-R126 IonicContact OE1-CZ 3.26Å; E122-R126 VanDerWaalsContact OE1-CZ 3.26Å; E122-R126 IonicContact OE1-NE 3.32Å; E122-R126 PolarHBondContact OE1-NE 2.97Å; E122-R126 IonicContact OE1-NH2 3.5Å; E122-R126 PolarHBondContact OE1-NH2 2.86Å
123	F	94.7	Very high	91.3	Very high	141 Å²	141	114.9 Å²	114.9	62%	0.618	56%	0.559	S	S	*	*	H	α-helix	trans	-61	-44.8	175.4	177.3	-95.8	0	0	0	112	E119 Q120 T121 R126 F127	E119-F123 WeakPolarHBondContact O-CB 3.48Å; E119-F123 PolarHBondContact O-N 2.95Å; Q120-F123 PolarHBondContact O-N 2.9Å; T121-F123 VanDerWaalsContact C-N 3.33Å; T121-F123 PolarHBondContact O-N 3.43Å; F123-R126 PolarHBondContact O-N 3.43Å; F123-F127 WeakPolarHBondContact O-CB 3.35Å; F123-F127 PolarHBondContact O-N 3.23Å
124	I	94.4	Very high	91	Very high	92 Å²	92	115.4 Å²	115.4	47%	0.472	56%	0.56	S	S	.	*	H	α-helix	trans	-63.4	-46.3	177.8	-70.3	165	0	0	0	110.5	Q120 T121 R126 F127 L128	Q120-I124 VanDerWaalsContact O-CG1 3.25Å; Q120-I124 WeakPolarHBondContact O-CG1 3.25Å; Q120-I124 PolarHBondContact O-N 3.29Å; T121-I124 PolarHBondContact O-N 3.46Å; I124-R126 VanDerWaalsContact C-N 3.35Å; I124-R126 PolarHBondContact O-N 2.89Å; I124-F127 PolarHBondContact O-N 3.43Å; I124-L128 HydrophobicContact CG2-CD1 3.73Å; I124-L128 HydrophobicContact CG2-CG 4.2Å; I124-L128 WeakPolarHBondContact O-CB 3.42Å; I124-L128 WeakPolarHBondContact O-CG 3.38Å; I124-L128 PolarHBondContact O-N 3.19Å
125	E	93.9	Very high	90.5	Very high	102 Å²	102	116.1 Å²	116.1	48%	0.477	56%	0.564	S	S	.	*	H	α-helix	trans	-58.1	-46.7	177.2	-75.8	179.8	177.6	0	0	111.5	T121 E122 F127 L128 M129	T121-E125 WeakPolarHBondContact O-CG 3.28Å; T121-E125 PolarHBondContact O-N 2.93Å; E122-E125 PolarHBondContact O-N 2.63Å; E125-F127 PolarHBondContact O-N 2.91Å; E125-L128 PolarHBondContact O-N 3.45Å; E125-M129 HydrophobicContact CB-CE 4.36Å; E125-M129 WeakPolarHBondContact O-CB 3.48Å; E125-M129 VanDerWaalsContact O-CG 3.31Å; E125-M129 WeakPolarHBondContact O-CG 3.31Å; E125-M129 PolarHBondContact O-N 2.87Å
126	R	92.9	Very high	90.1	Very high	171 Å²	171	114.9 Å²	114.9	65%	0.645	56%	0.562	S	S	*	*	H	α-helix	trans	-62.7	-39.7	176	-71.5	175.5	-178.6	-162.1	3	112.4	E122 F123 I124 G130	E122-R126 WeakPolarHBondContact O-CB 3.46Å; E122-R126 VanDerWaalsContact O-CG 3.28Å; E122-R126 WeakPolarHBondContact O-CG 3.39Å; E122-R126 PolarHBondContact O-N 3.32Å; E122-R126 IonicContact OE1-CZ 3.26Å; E122-R126 VanDerWaalsContact OE1-CZ 3.26Å; E122-R126 IonicContact OE1-NE 3.32Å; E122-R126 PolarHBondContact OE1-NE 2.97Å; E122-R126 IonicContact OE1-NH2 3.5Å; E122-R126 PolarHBondContact OE1-NH2 2.86Å; F123-R126 PolarHBondContact O-N 3.43Å; I124-R126 VanDerWaalsContact C-N 3.35Å; I124-R126 PolarHBondContact O-N 2.89Å; R126-G130 WeakPolarHBondContact O-CA 3.37Å; R126-G130 PolarHBondContact O-N 3.5Å
127	F	92.3	Very high	89.5	Confident	105 Å²	105	116.1 Å²	116.1	46%	0.461	57%	0.57	S	S	.	*	H	α-helix	trans	-70	-36.3	178.7	-173.4	-94.9	0	0	0	112.7	F123 I124 E125 R131	F123-F127 WeakPolarHBondContact O-CB 3.35Å; F123-F127 PolarHBondContact O-N 3.23Å; I124-F127 PolarHBondContact O-N 3.43Å; E125-F127 PolarHBondContact O-N 2.91Å; F127-R131 VanDerWaalsContact CZ-NH2 3.31Å
128	L	89.4	Confident	88.9	Confident	116 Å²	116	115.5 Å²	115.5	61%	0.607	57%	0.569	S	S	*	*	H	α-helix	trans	-75.7	-38	176.8	-71.2	176.1	0	0	0	112.7	I124 E125	I124-L128 HydrophobicContact CG2-CD1 3.73Å; I124-L128 HydrophobicContact CG2-CG 4.2Å; I124-L128 WeakPolarHBondContact O-CB 3.42Å; I124-L128 WeakPolarHBondContact O-CG 3.38Å; I124-L128 PolarHBondContact O-N 3.19Å; E125-L128 PolarHBondContact O-N 3.45Å
129	M	79.4	Confident	88.3	Confident	151 Å²	151	119.8 Å²	119.8	74%	0.744	58%	0.575	S	S	*	*	H	α-helix	trans	-77.6	-26.7	175.8	-67.9	-173.1	-155.8	0	0	113.1	E125 R131	E125-M129 HydrophobicContact CB-CE 4.36Å; E125-M129 WeakPolarHBondContact O-CB 3.48Å; E125-M129 VanDerWaalsContact O-CG 3.31Å; E125-M129 WeakPolarHBondContact O-CG 3.31Å; E125-M129 PolarHBondContact O-N 2.87Å; M129-R131 VanDerWaalsContact C-N 3.25Å; M129-R131 PolarHBondContact O-N 3.37Å
130	G	72.9	Confident	87.6	Confident	70 Å²	70	120.9 Å²	120.9	72%	0.722	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	1.2	176.7	0	0	0	0	0	114.5	R126	R126-G130 WeakPolarHBondContact O-CA 3.37Å; R126-G130 PolarHBondContact O-N 3.5Å
131	R	53.6	Low	86.8	Confident	241 Å²	241	122.5 Å²	122.5	91%	0.909	59%	0.59	S	S	*	*			trans	-110	0	167	-76.4	-173.2	178.4	-156.4	-2.1	109.6	F127 M129	F127-R131 VanDerWaalsContact CZ-NH2 3.31Å; M129-R131 VanDerWaalsContact C-N 3.25Å; M129-R131 PolarHBondContact O-N 3.37Å

Retrieved 131 of 131 residues in 52.7 ms (Link to these results)

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