A0A5K4FCA6_SCHMA Loading...

Chemotaxis protein

AlphaFold DB , UniProt , Accession A0A5K4FCA6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 116 aa.

						>A0A5K4FCA6_SCHMA|A0A5K4FCA6
MNHLYEINQTSATHNKQWDLLKLLCKDKNVDEVNKKLDEIALQHKKEITVQQDIAKQRVIDQLYEIHKVAEEIDRTQIELQEKINKFCDDISEFIKNSLNIDDKVVAGDALSISIS
					

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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	49.4	Very low	57.7	Low	188 Å²	188	106.5 Å²	106.5	93%	0.926	54%	0.535	S	S	*	.				0	130.8	0	-133.2	89.6	-176.7	0	0	107.7	H3 E6	M1-H3 PolarHBondContact O-N 2.93Å; M1-E6 WeakPolarHBondContact CB-OE1 3.01Å
2	N	63.5	Low	58.6	Low	111 Å²	111	101.6 Å²	101.6	59%	0.594	52%	0.523	S	S	*	.			trans	-74.9	114.2	-176.9	-166.5	-8.2	0	0	0	109.1	L4 Y5	N2-L4 PolarHBondContact O-N 2.96Å; N2-Y5 VanDerWaalsContact O-CB 3.29Å; N2-Y5 WeakPolarHBondContact O-CB 3.38Å; N2-Y5 PolarHBondContact O-N 3.24Å
3	H	58.6	Low	59.7	Low	135 Å²	135	98.8 Å²	98.8	63%	0.625	51%	0.514	S	S	*	.	H	α-helix	trans	-51.6	-31.8	-177.4	-73.9	-62.7	0	0	0	113.2	M1 Y5 E6 I7	M1-H3 PolarHBondContact O-N 2.93Å; H3-Y5 VanDerWaalsContact C-N 3.3Å; H3-Y5 PolarHBondContact O-N 3.31Å; H3-E6 PolarHBondContact O-N 2.97Å; H3-I7 VanDerWaalsContact O-CG1 3.31Å; H3-I7 WeakPolarHBondContact O-CG1 3.46Å; H3-I7 PolarHBondContact O-N 3.3Å; H3-I7 VanDerWaalsContact O-N 3.1Å
4	L	46.9	Very low	60.8	Low	112 Å²	112	99.6 Å²	99.6	59%	0.586	51%	0.513	S	S	*	.	H	α-helix	trans	-63	-34.5	175.5	-69.3	170.1	0	0	0	113.1	N2 N8	N2-L4 PolarHBondContact O-N 2.96Å; L4-N8 WeakPolarHBondContact O-CB 3.46Å; L4-N8 VanDerWaalsContact O-CG 3.23Å; L4-N8 PolarHBondContact O-N 3.29Å; L4-N8 PolarHBondContact O-ND2 3.34Å
5	Y	56.9	Low	62.1	Low	135 Å²	135	99.9 Å²	99.9	53%	0.529	52%	0.516	S	S	.	.	H	α-helix	trans	-68.6	-43.2	177.5	-175	-102.3	0	0	0	111.4	N2 H3 N8 Q9	N2-Y5 VanDerWaalsContact O-CB 3.29Å; N2-Y5 WeakPolarHBondContact O-CB 3.38Å; N2-Y5 PolarHBondContact O-N 3.24Å; H3-Y5 VanDerWaalsContact C-N 3.3Å; H3-Y5 PolarHBondContact O-N 3.31Å; Y5-N8 PolarHBondContact O-N 3.22Å; Y5-Q9 HydrophobicContact CD1-CG 4.47Å; Y5-Q9 HydrophobicContact CE1-CG 4.2Å; Y5-Q9 WeakPolarHBondContact O-CG 3.43Å; Y5-Q9 PolarHBondContact O-N 3.31Å; Y5-Q9 PolarHBondContact OH-NE2 3.03Å
6	E	61.3	Low	63.3	Low	65 Å²	65	103.5 Å²	103.5	30%	0.304	53%	0.527	S	S	.	.	H	α-helix	trans	-62.7	-42.6	176.7	-67.9	177.7	-176.1	0	0	111.5	M1 H3 Q9 T10	M1-E6 WeakPolarHBondContact CB-OE1 3.01Å; H3-E6 PolarHBondContact O-N 2.97Å; E6-Q9 PolarHBondContact O-N 2.96Å; E6-T10 WeakPolarHBondContact O-CB 3.47Å; E6-T10 PolarHBondContact O-N 3.14Å; E6-T10 PolarHBondContact O-OG1 3.06Å
7	I	57.8	Low	64.2	Low	104 Å²	104	99.8 Å²	99.8	53%	0.533	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-45.5	177.1	-67.3	166.3	0	0	0	111	H3 Q9 T10 S11	H3-I7 VanDerWaalsContact O-CG1 3.31Å; H3-I7 WeakPolarHBondContact O-CG1 3.46Å; H3-I7 PolarHBondContact O-N 3.3Å; H3-I7 VanDerWaalsContact O-N 3.1Å; I7-Q9 PolarHBondContact O-N 3.23Å; I7-T10 PolarHBondContact O-N 3.43Å; I7-S11 PolarHBondContact O-N 3.06Å; I7-S11 PolarHBondContact O-OG 3Å
8	N	45	Very low	65.2	Low	104 Å²	104	103.2 Å²	103.2	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-66.6	-35.1	-179.7	-75.5	-18.7	0	0	0	112.9	L4 Y5 S11 A12	L4-N8 WeakPolarHBondContact O-CB 3.46Å; L4-N8 VanDerWaalsContact O-CG 3.23Å; L4-N8 PolarHBondContact O-N 3.29Å; L4-N8 PolarHBondContact O-ND2 3.34Å; Y5-N8 PolarHBondContact O-N 3.22Å; N8-S11 PolarHBondContact O-OG 3Å; N8-A12 WeakPolarHBondContact O-CB 3.43Å; N8-A12 PolarHBondContact O-N 3.1Å
9	Q	64.5	Low	66.3	Low	101 Å²	101	102 Å²	102	47%	0.472	51%	0.508	S	S	.	.	H	α-helix	trans	-69.7	-39.8	173.9	-73.5	-155	-2.5	0	0	112.5	Y5 E6 I7 A12 T13	Y5-Q9 HydrophobicContact CD1-CG 4.47Å; Y5-Q9 HydrophobicContact CE1-CG 4.2Å; Y5-Q9 WeakPolarHBondContact O-CG 3.43Å; Y5-Q9 PolarHBondContact O-N 3.31Å; Y5-Q9 PolarHBondContact OH-NE2 3.03Å; E6-Q9 PolarHBondContact O-N 2.96Å; I7-Q9 PolarHBondContact O-N 3.23Å; Q9-A12 PolarHBondContact O-N 3.38Å; Q9-T13 PolarHBondContact O-N 3.35Å; Q9-T13 VanDerWaalsContact O-N 3.11Å; Q9-T13 PolarHBondContact O-OG1 3.07Å
10	T	69.2	Low	67.2	Low	63 Å²	63	101.2 Å²	101.2	39%	0.387	51%	0.505	S	S	.	.	H	α-helix	trans	-62.9	-44.9	178.3	-53.9	0	0	0	0	110.7	E6 I7 T13 H14	E6-T10 WeakPolarHBondContact O-CB 3.47Å; E6-T10 PolarHBondContact O-N 3.14Å; E6-T10 PolarHBondContact O-OG1 3.06Å; I7-T10 PolarHBondContact O-N 3.43Å; T10-T13 PolarHBondContact O-N 3.07Å; T10-H14 PolarHBondContact O-N 3.39Å
11	S	62.3	Low	68	Low	53 Å²	53	98.7 Å²	98.7	37%	0.371	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-41.2	179.1	67.2	0	0	0	0	113	I7 N8 T13 H14 N15	I7-S11 PolarHBondContact O-N 3.06Å; I7-S11 PolarHBondContact O-OG 3Å; N8-S11 PolarHBondContact O-OG 3Å; S11-T13 VanDerWaalsContact C-N 3.27Å; S11-T13 PolarHBondContact O-N 2.84Å; S11-H14 PolarHBondContact O-N 3.45Å; S11-N15 PolarHBondContact O-N 2.82Å
12	A	67.6	Low	69.7	Low	48 Å²	48	94.4 Å²	94.4	40%	0.397	47%	0.47	S	S	.	.	H	α-helix	trans	-61.8	-36.4	175.5	0	0	0	0	0	112.3	N8 Q9 K16	N8-A12 WeakPolarHBondContact O-CB 3.43Å; N8-A12 PolarHBondContact O-N 3.1Å; Q9-A12 PolarHBondContact O-N 3.38Å; A12-K16 WeakPolarHBondContact O-CG 3.45Å; A12-K16 PolarHBondContact O-N 3.05Å
13	T	73.9	Confident	70.8	Confident	65 Å²	65	94.6 Å²	94.6	40%	0.399	47%	0.47	S	S	.	.	H	α-helix	trans	-71	-45.5	178.8	-54.7	0	0	0	0	111.3	Q9 T10 S11 N15 K16 Q17	Q9-T13 PolarHBondContact O-N 3.35Å; Q9-T13 VanDerWaalsContact O-N 3.11Å; Q9-T13 PolarHBondContact O-OG1 3.07Å; T10-T13 PolarHBondContact O-N 3.07Å; S11-T13 VanDerWaalsContact C-N 3.27Å; S11-T13 PolarHBondContact O-N 2.84Å; T13-N15 VanDerWaalsContact C-N 3.34Å; T13-N15 PolarHBondContact O-N 3.25Å; T13-K16 PolarHBondContact O-N 2.89Å; T13-Q17 WeakPolarHBondContact O-CG 3.47Å; T13-Q17 PolarHBondContact O-N 3.33Å
14	H	74.9	Confident	72.2	Confident	110 Å²	110	88.7 Å²	88.7	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-59.6	-42	175.5	-71	169	0	0	0	112.6	T10 S11 K16 Q17 W18	T10-H14 PolarHBondContact O-N 3.39Å; S11-H14 PolarHBondContact O-N 3.45Å; H14-K16 PolarHBondContact O-N 3.46Å; H14-Q17 PolarHBondContact O-N 3.02Å; H14-W18 WeakPolarHBondContact O-CB 3.43Å; H14-W18 PolarHBondContact O-N 3.41Å
15	N	79.5	Confident	73.9	Confident	104 Å²	104	88.7 Å²	88.7	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-61.8	-43.8	178	-74.7	-17.7	0	0	0	112.1	S11 T13 Q17 W18 D19	S11-N15 PolarHBondContact O-N 2.82Å; T13-N15 VanDerWaalsContact C-N 3.34Å; T13-N15 PolarHBondContact O-N 3.25Å; N15-Q17 PolarHBondContact O-N 3.33Å; N15-W18 PolarHBondContact O-N 2.84Å; N15-D19 PolarHBondContact O-N 3.27Å
16	K	81.8	Confident	75.3	Confident	158 Å²	158	90.3 Å²	90.3	69%	0.687	46%	0.461	S	S	*	.	H	α-helix	trans	-61.9	-43	176.3	-73	177.4	-179.8	-179.5	0	112.4	A12 T13 H14 W18 D19 L20	A12-K16 WeakPolarHBondContact O-CG 3.45Å; A12-K16 PolarHBondContact O-N 3.05Å; T13-K16 PolarHBondContact O-N 2.89Å; H14-K16 PolarHBondContact O-N 3.46Å; K16-W18 VanDerWaalsContact C-N 3.34Å; K16-D19 PolarHBondContact O-N 2.89Å; K16-L20 PolarHBondContact O-N 3.06Å
17	Q	78.3	Confident	76.5	Confident	40 Å²	40	90.4 Å²	90.4	19%	0.187	46%	0.463	C	S	.	.	H	α-helix	trans	-64.6	-40.6	177.8	-70.7	172.8	-11.9	0	0	111.3	T13 H14 N15 D19 L20 L21 H44	T13-Q17 WeakPolarHBondContact O-CG 3.47Å; T13-Q17 PolarHBondContact O-N 3.33Å; H14-Q17 PolarHBondContact O-N 3.02Å; N15-Q17 PolarHBondContact O-N 3.33Å; Q17-D19 PolarHBondContact O-N 3Å; Q17-L20 WeakPolarHBondContact O-CB 3.36Å; Q17-L20 PolarHBondContact O-N 3.48Å; Q17-L21 WeakPolarHBondContact O-CG 3.42Å; Q17-L21 PolarHBondContact O-N 3.29Å; Q17-H44 PolarHBondContact NE2-NE2 3.19Å; Q17-H44 PolarHBondContact OE1-NE2 3.01Å
18	W	81.7	Confident	77.9	Confident	161 Å²	161	95 Å²	95	61%	0.61	48%	0.479	S	S	*	.	H	α-helix	trans	-63.1	-41.3	176.1	-169.7	-120.9	0	0	0	112.5	H14 N15 K16 L21 K22	H14-W18 WeakPolarHBondContact O-CB 3.43Å; H14-W18 PolarHBondContact O-N 3.41Å; N15-W18 PolarHBondContact O-N 2.84Å; K16-W18 VanDerWaalsContact C-N 3.34Å; W18-L21 HydrophobicContact CE3-CD1 4.06Å; W18-L21 HydrophobicContact CZ3-CD1 4.38Å; W18-L21 PolarHBondContact O-N 3.46Å; W18-K22 WeakPolarHBondContact O-CG 3.34Å; W18-K22 PolarHBondContact O-N 3.42Å; W18-K22 VanDerWaalsContact O-N 3.07Å
19	D	86.1	Confident	80.1	Confident	81 Å²	81	94 Å²	94	43%	0.433	47%	0.474	S	S	.	.	H	α-helix	trans	-68.6	-35.2	176.5	-70.5	-24.4	0	0	0	112.5	N15 K16 Q17 K22 L23	N15-D19 PolarHBondContact O-N 3.27Å; K16-D19 PolarHBondContact O-N 2.89Å; Q17-D19 PolarHBondContact O-N 3Å; D19-K22 PolarHBondContact O-N 3.38Å; D19-K22 IonicContact OD1-NZ 2.82Å; D19-K22 PolarHBondContact OD1-NZ 3.29Å; D19-L23 WeakPolarHBondContact O-CG 3.4Å; D19-L23 PolarHBondContact O-N 3.11Å; D19-L23 VanDerWaalsContact O-N 3.1Å
20	L	84.2	Confident	81.2	Confident	85 Å²	85	93.6 Å²	93.6	45%	0.445	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-44.8	171.9	-176.8	65.8	0	0	0	111.5	K16 Q17 K22 L23 L24 I40	K16-L20 PolarHBondContact O-N 3.06Å; Q17-L20 WeakPolarHBondContact O-CB 3.36Å; Q17-L20 PolarHBondContact O-N 3.48Å; L20-K22 VanDerWaalsContact C-N 3.33Å; L20-K22 PolarHBondContact O-N 3.3Å; L20-L23 WeakPolarHBondContact O-CB 3.44Å; L20-L23 PolarHBondContact O-N 3.39Å; L20-L23 VanDerWaalsContact O-N 3.14Å; L20-L24 HydrophobicContact CG-CD1 4.46Å; L20-L24 WeakPolarHBondContact O-CG 3.48Å; L20-L24 PolarHBondContact O-N 3.32Å; L20-I40 HydrophobicContact CD2-CD1 3.85Å; L20-I40 HydrophobicContact CD2-CG1 4.35Å; L20-I40 HydrophobicContact CG-CD1 4.4Å
21	L	83.8	Confident	82.2	Confident	49 Å²	49	96.7 Å²	96.7	26%	0.257	49%	0.493	S	S	.	.	H	α-helix	trans	-60	-42.5	176.1	-72.3	169.7	0	0	0	111.7	Q17 W18 L23 L24 C25 L37 I40	Q17-L21 WeakPolarHBondContact O-CG 3.42Å; Q17-L21 PolarHBondContact O-N 3.29Å; W18-L21 HydrophobicContact CE3-CD1 4.06Å; W18-L21 HydrophobicContact CZ3-CD1 4.38Å; W18-L21 PolarHBondContact O-N 3.46Å; L21-L23 VanDerWaalsContact C-N 3.28Å; L21-L23 PolarHBondContact O-N 3Å; L21-L24 HydrophobicContact CD2-CD1 4.43Å; L21-L24 WeakPolarHBondContact O-CB 3.43Å; L21-L24 PolarHBondContact O-N 3.4Å; L21-C25 PolarHBondContact O-N 3.31Å; L21-C25 PolarHBondContact O-SG 2.92Å; L21-L37 HydrophobicContact CD2-CD2 3.73Å; L21-I40 HydrophobicContact CD2-CD1 4.18Å
22	K	86.1	Confident	83.4	Confident	99 Å²	99	97.2 Å²	97.2	43%	0.43	49%	0.489	S	S	.	.	H	α-helix	trans	-61	-35.8	175.1	-69	173.8	-164.6	156	0	113	W18 D19 L20	W18-K22 WeakPolarHBondContact O-CG 3.34Å; W18-K22 PolarHBondContact O-N 3.42Å; W18-K22 VanDerWaalsContact O-N 3.07Å; D19-K22 PolarHBondContact O-N 3.38Å; D19-K22 IonicContact OD1-NZ 2.82Å; D19-K22 PolarHBondContact OD1-NZ 3.29Å; L20-K22 VanDerWaalsContact C-N 3.33Å; L20-K22 PolarHBondContact O-N 3.3Å
23	L	87.1	Confident	84.5	Confident	114 Å²	114	96 Å²	96	60%	0.597	48%	0.477	S	S	*	.	H	α-helix	trans	-70	-42.8	176.5	-72.2	170.5	0	0	0	111	D19 L20 L21 C25 K26	D19-L23 WeakPolarHBondContact O-CG 3.4Å; D19-L23 PolarHBondContact O-N 3.11Å; D19-L23 VanDerWaalsContact O-N 3.1Å; L20-L23 WeakPolarHBondContact O-CB 3.44Å; L20-L23 PolarHBondContact O-N 3.39Å; L20-L23 VanDerWaalsContact O-N 3.14Å; L21-L23 VanDerWaalsContact C-N 3.28Å; L21-L23 PolarHBondContact O-N 3Å; L23-C25 VanDerWaalsContact C-N 3.3Å; L23-C25 PolarHBondContact O-N 3.35Å; L23-K26 WeakPolarHBondContact O-CB 3.46Å; L23-K26 PolarHBondContact O-N 3.49Å
24	L	86.9	Confident	85.3	Confident	11 Å²	11	96.7 Å²	96.7	6%	0.058	48%	0.478	C	S	.	.	H	α-helix	trans	-58.2	-40.6	176.2	-75	174.9	0	0	0	112.5	L20 L21 K26 D27 V33 K36 L37 I40	L20-L24 HydrophobicContact CG-CD1 4.46Å; L20-L24 WeakPolarHBondContact O-CG 3.48Å; L20-L24 PolarHBondContact O-N 3.32Å; L21-L24 HydrophobicContact CD2-CD1 4.43Å; L21-L24 WeakPolarHBondContact O-CB 3.43Å; L21-L24 PolarHBondContact O-N 3.4Å; L24-K26 PolarHBondContact O-N 3.04Å; L24-D27 WeakPolarHBondContact O-CB 3.47Å; L24-D27 PolarHBondContact O-N 3.26Å; L24-V33 WeakPolarHBondContact O-CG2 3.48Å; L24-K36 HydrophobicContact CD1-CB 4.17Å; L24-K36 HydrophobicContact CD2-CB 3.8Å; L24-K36 HydrophobicContact CD2-CD 3.42Å; L24-K36 VanDerWaalsContact CD2-CD 3.42Å; L24-K36 HydrophobicContact CD2-CG 4.26Å; L24-L37 HydrophobicContact CD1-CD2 4.29Å; L24-I40 HydrophobicContact CD1-CD1 3.58Å
25	C	82.5	Confident	86	Confident	112 Å²	112	97 Å²	97	76%	0.757	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-14.5	176.5	-64.6	0	0	0	0	114.4	L21 L23	L21-C25 PolarHBondContact O-N 3.31Å; L21-C25 PolarHBondContact O-SG 2.92Å; L23-C25 VanDerWaalsContact C-N 3.3Å; L23-C25 PolarHBondContact O-N 3.35Å
26	K	87.4	Confident	86.5	Confident	169 Å²	169	95.2 Å²	95.2	74%	0.735	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-10.9	177.5	-62.7	177.5	-177.6	179.1	0	113.1	L23 L24	L23-K26 WeakPolarHBondContact O-CB 3.46Å; L23-K26 PolarHBondContact O-N 3.49Å; L24-K26 PolarHBondContact O-N 3.04Å
27	D	85.1	Confident	86.8	Confident	67 Å²	67	91 Å²	91	36%	0.358	45%	0.45	S	S	.	.			trans	-74.5	135.5	179.3	-165.6	-21.7	0	0	0	109.6	L24 N29 V33	L24-D27 WeakPolarHBondContact O-CB 3.47Å; L24-D27 PolarHBondContact O-N 3.26Å; D27-N29 PolarHBondContact OD1-N 2.88Å; D27-V33 HydrophobicContact CB-CG2 3.6Å
28	K	87.1	Confident	87.5	Confident	200 Å²	200	94.6 Å²	94.6	87%	0.87	47%	0.47	S	S	*	.	S	Bend	trans	-88.3	-16.1	-178.2	-65.4	-176.5	179.8	-179.4	0	112.1	V30	K28-V30 PolarHBondContact O-N 3.34Å
29	N	91.4	Very high	87.8	Confident	84 Å²	84	92 Å²	92	45%	0.449	47%	0.465	S	S	.	.			trans	-84.9	93.7	178.9	-173.9	-13.2	0	0	0	109.8	D27 D31 E32 V33	D27-N29 PolarHBondContact OD1-N 2.88Å; N29-D31 VanDerWaalsContact C-N 3.27Å; N29-D31 PolarHBondContact O-N 2.89Å; N29-D31 PolarHBondContact OD1-N 2.98Å; N29-E32 HydrophobicContact CB-CB 3.95Å; N29-E32 PolarHBondContact O-N 3.2Å; N29-E32 PolarHBondContact OD1-N 3.44Å; N29-V33 WeakPolarHBondContact O-CG2 3.37Å; N29-V33 PolarHBondContact O-N 3.43Å
30	V	88.4	Confident	87.8	Confident	93 Å²	93	89.5 Å²	89.5	56%	0.564	45%	0.452	S	S	*	.	H	α-helix	trans	-57.8	-39	-177.3	176.7	0	0	0	0	112.2	K28 V33 N34	K28-V30 PolarHBondContact O-N 3.34Å; V30-V33 PolarHBondContact O-N 3.34Å; V30-N34 WeakPolarHBondContact O-CB 3.45Å; V30-N34 VanDerWaalsContact O-CG 3.25Å; V30-N34 PolarHBondContact O-N 3.18Å; V30-N34 PolarHBondContact O-ND2 2.97Å
31	D	89.8	Confident	88	Confident	127 Å²	127	88.2 Å²	88.2	68%	0.679	45%	0.453	S	S	*	.	H	α-helix	trans	-65.8	-41.5	-179.4	-65.7	-26.6	0	0	0	111.5	N29 N34 K35	N29-D31 VanDerWaalsContact C-N 3.27Å; N29-D31 PolarHBondContact O-N 2.89Å; N29-D31 PolarHBondContact OD1-N 2.98Å; D31-N34 PolarHBondContact O-N 3.03Å; D31-K35 WeakPolarHBondContact O-CB 3.39Å; D31-K35 PolarHBondContact O-N 3.4Å
32	E	88.5	Confident	88.3	Confident	65 Å²	65	90.4 Å²	90.4	30%	0.304	46%	0.464	S	S	.	.	H	α-helix	trans	-68.5	-38.2	176.3	-177.6	65.5	-172.5	0	0	111.9	N29 K36	N29-E32 HydrophobicContact CB-CB 3.95Å; N29-E32 PolarHBondContact O-N 3.2Å; N29-E32 PolarHBondContact OD1-N 3.44Å; E32-K36 HydrophobicContact CG-CD 4.46Å; E32-K36 WeakPolarHBondContact O-CG 3.35Å; E32-K36 PolarHBondContact O-N 2.83Å; E32-K36 WeakPolarHBondContact OE1-CE 3.41Å; E32-K36 IonicContact OE1-NZ 2.93Å; E32-K36 PolarHBondContact OE1-NZ 3.03Å
33	V	89.6	Confident	88.4	Confident	22 Å²	22	90 Å²	90	13%	0.133	46%	0.464	C	S	.	.	H	α-helix	trans	-61.5	-48.9	173.5	171.7	0	0	0	0	110.6	L24 D27 N29 V30 K35 K36 L37	L24-V33 WeakPolarHBondContact O-CG2 3.48Å; D27-V33 HydrophobicContact CB-CG2 3.6Å; N29-V33 WeakPolarHBondContact O-CG2 3.37Å; N29-V33 PolarHBondContact O-N 3.43Å; V30-V33 PolarHBondContact O-N 3.34Å; V33-K35 PolarHBondContact O-N 2.95Å; V33-K36 PolarHBondContact O-N 3.35Å; V33-L37 HydrophobicContact CG1-CD1 3.88Å; V33-L37 HydrophobicContact CG1-CG 4.3Å; V33-L37 WeakPolarHBondContact O-CG 3.44Å; V33-L37 PolarHBondContact O-N 2.87Å
34	N	90	Very high	88.4	Confident	80 Å²	80	87.4 Å²	87.4	43%	0.428	45%	0.449	S	S	.	.	H	α-helix	trans	-59.9	-46.5	179.8	-73.9	-22.7	0	0	0	111.4	V30 D31 K36 L37 D38	V30-N34 WeakPolarHBondContact O-CB 3.45Å; V30-N34 VanDerWaalsContact O-CG 3.25Å; V30-N34 PolarHBondContact O-N 3.18Å; V30-N34 PolarHBondContact O-ND2 2.97Å; D31-N34 PolarHBondContact O-N 3.03Å; N34-K36 VanDerWaalsContact C-N 3.34Å; N34-K36 PolarHBondContact O-N 3.37Å; N34-L37 PolarHBondContact O-N 3Å; N34-D38 PolarHBondContact O-N 2.74Å
35	K	91.2	Very high	88.6	Confident	117 Å²	117	93.7 Å²	93.7	51%	0.509	48%	0.476	S	S	.	.	H	α-helix	trans	-57.6	-45.5	176.4	-176.2	-175.8	173.2	-169	0	112.2	D31 V33 D38 E39	D31-K35 WeakPolarHBondContact O-CB 3.39Å; D31-K35 PolarHBondContact O-N 3.4Å; V33-K35 PolarHBondContact O-N 2.95Å; K35-D38 PolarHBondContact O-N 3.03Å; K35-E39 WeakPolarHBondContact CE-OE1 3.26Å; K35-E39 WeakPolarHBondContact O-CG 3.45Å; K35-E39 PolarHBondContact O-N 3.29Å
36	K	89	Confident	88.9	Confident	66 Å²	66	93.8 Å²	93.8	29%	0.287	46%	0.463	S	S	.	.	H	α-helix	trans	-67.3	-35.9	178.1	-75	177.1	179.5	142.9	0	112.5	L24 E32 V33 N34 E39 I40	L24-K36 HydrophobicContact CD1-CB 4.17Å; L24-K36 HydrophobicContact CD2-CB 3.8Å; L24-K36 HydrophobicContact CD2-CD 3.42Å; L24-K36 VanDerWaalsContact CD2-CD 3.42Å; L24-K36 HydrophobicContact CD2-CG 4.26Å; E32-K36 HydrophobicContact CG-CD 4.46Å; E32-K36 WeakPolarHBondContact O-CG 3.35Å; E32-K36 PolarHBondContact O-N 2.83Å; E32-K36 WeakPolarHBondContact OE1-CE 3.41Å; E32-K36 IonicContact OE1-NZ 2.93Å; E32-K36 PolarHBondContact OE1-NZ 3.03Å; V33-K36 PolarHBondContact O-N 3.35Å; N34-K36 VanDerWaalsContact C-N 3.34Å; N34-K36 PolarHBondContact O-N 3.37Å; K36-E39 PolarHBondContact O-N 3.47Å; K36-I40 VanDerWaalsContact O-CG1 3.26Å; K36-I40 WeakPolarHBondContact O-CG1 3.46Å; K36-I40 PolarHBondContact O-N 2.9Å
37	L	89.4	Confident	88.9	Confident	68 Å²	68	88.7 Å²	88.7	36%	0.356	44%	0.442	S	S	.	.	H	α-helix	trans	-64.2	-41.3	174.1	-73.3	173.8	0	0	0	111.5	L21 L24 V33 N34 I40 A41	L21-L37 HydrophobicContact CD2-CD2 3.73Å; L24-L37 HydrophobicContact CD1-CD2 4.29Å; V33-L37 HydrophobicContact CG1-CD1 3.88Å; V33-L37 HydrophobicContact CG1-CG 4.3Å; V33-L37 WeakPolarHBondContact O-CG 3.44Å; V33-L37 PolarHBondContact O-N 2.87Å; N34-L37 PolarHBondContact O-N 3Å; L37-I40 PolarHBondContact O-N 3.2Å; L37-A41 WeakPolarHBondContact O-CB 3.29Å; L37-A41 PolarHBondContact O-N 3.4Å
38	D	91.3	Very high	89.1	Confident	116 Å²	116	89.8 Å²	89.8	62%	0.62	45%	0.447	S	S	*	.	H	α-helix	trans	-63.4	-41.3	175	-73.2	-24.5	0	0	0	111.9	N34 K35 A41 L42	N34-D38 PolarHBondContact O-N 2.74Å; K35-D38 PolarHBondContact O-N 3.03Å; D38-A41 PolarHBondContact O-N 3.28Å; D38-L42 WeakPolarHBondContact O-CB 3.42Å; D38-L42 PolarHBondContact O-N 2.96Å
39	E	89.3	Confident	89.3	Confident	106 Å²	106	83 Å²	83	50%	0.495	42%	0.423	S	S	.	.	H	α-helix	trans	-61.8	-44.7	174.8	-73.4	173.2	-173.6	0	0	111.8	K35 K36 L42 Q43	K35-E39 WeakPolarHBondContact CE-OE1 3.26Å; K35-E39 WeakPolarHBondContact O-CG 3.45Å; K35-E39 PolarHBondContact O-N 3.29Å; K36-E39 PolarHBondContact O-N 3.47Å; E39-L42 PolarHBondContact O-N 3.44Å; E39-Q43 WeakPolarHBondContact O-CB 3.35Å; E39-Q43 PolarHBondContact O-N 3.47Å
40	I	85.7	Confident	89.1	Confident	30 Å²	30	83 Å²	83	15%	0.154	43%	0.425	C	S	.	.	H	α-helix	trans	-62.5	-47	175.7	-69.2	165.8	0	0	0	110.5	L20 L21 L24 K36 L37 L42 Q43 H44	L20-I40 HydrophobicContact CD2-CD1 3.85Å; L20-I40 HydrophobicContact CD2-CG1 4.35Å; L20-I40 HydrophobicContact CG-CD1 4.4Å; L21-I40 HydrophobicContact CD2-CD1 4.18Å; L24-I40 HydrophobicContact CD1-CD1 3.58Å; K36-I40 VanDerWaalsContact O-CG1 3.26Å; K36-I40 WeakPolarHBondContact O-CG1 3.46Å; K36-I40 PolarHBondContact O-N 2.9Å; L37-I40 PolarHBondContact O-N 3.2Å; I40-L42 VanDerWaalsContact C-N 3.33Å; I40-L42 PolarHBondContact O-N 3.1Å; I40-Q43 PolarHBondContact O-N 3.04Å; I40-H44 PolarHBondContact O-N 2.99Å
41	A	88.4	Confident	89.1	Confident	57 Å²	57	84.2 Å²	84.2	47%	0.471	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-41.5	179.6	0	0	0	0	0	111.8	L37 D38 K45	L37-A41 WeakPolarHBondContact O-CB 3.29Å; L37-A41 PolarHBondContact O-N 3.4Å; D38-A41 PolarHBondContact O-N 3.28Å; A41-K45 WeakPolarHBondContact O-CB 3.49Å; A41-K45 PolarHBondContact O-N 3.11Å
42	L	91	Very high	89.3	Confident	95 Å²	95	83.1 Å²	83.1	50%	0.497	42%	0.415	S	S	.	.	H	α-helix	trans	-64.1	-41.7	175.4	-179.7	61.8	0	0	0	111.8	D38 E39 I40 K45 K46	D38-L42 WeakPolarHBondContact O-CB 3.42Å; D38-L42 PolarHBondContact O-N 2.96Å; E39-L42 PolarHBondContact O-N 3.44Å; I40-L42 VanDerWaalsContact C-N 3.33Å; I40-L42 PolarHBondContact O-N 3.1Å; L42-K45 PolarHBondContact O-N 2.9Å; L42-K46 WeakPolarHBondContact O-CG 3.31Å; L42-K46 PolarHBondContact O-N 2.94Å; L42-K46 VanDerWaalsContact O-N 3.11Å
43	Q	87.6	Confident	89.5	Confident	90 Å²	90	83.9 Å²	83.9	42%	0.421	42%	0.422	S	S	.	.	H	α-helix	trans	-64.6	-47.1	178	-178.3	56.9	28.9	0	0	111.5	E39 I40 K45 K46 E47	E39-Q43 WeakPolarHBondContact O-CB 3.35Å; E39-Q43 PolarHBondContact O-N 3.47Å; I40-Q43 PolarHBondContact O-N 3.04Å; Q43-K45 VanDerWaalsContact C-N 3.32Å; Q43-K45 PolarHBondContact O-N 3.42Å; Q43-K46 WeakPolarHBondContact O-CB 3.44Å; Q43-K46 PolarHBondContact O-N 3.17Å; Q43-K46 VanDerWaalsContact O-N 3.17Å; Q43-E47 WeakPolarHBondContact CG-OE1 3.4Å; Q43-E47 PolarHBondContact NE2-OE1 3.4Å; Q43-E47 WeakPolarHBondContact O-CG 3.31Å; Q43-E47 PolarHBondContact O-N 3.4Å
44	H	86.8	Confident	89.7	Confident	60 Å²	60	86.7 Å²	86.7	28%	0.278	44%	0.435	S	S	.	.	H	α-helix	trans	-59.3	-41.5	174.7	-75.6	172.4	0	0	0	112.4	Q17 I40 K46 E47 I48	Q17-H44 PolarHBondContact NE2-NE2 3.19Å; Q17-H44 PolarHBondContact OE1-NE2 3.01Å; I40-H44 PolarHBondContact O-N 2.99Å; H44-K46 VanDerWaalsContact C-N 3.33Å; H44-K46 PolarHBondContact O-N 3.42Å; H44-E47 IonicContact CD2-OE2 3.63Å; H44-E47 PolarHBondContact O-N 3.32Å; H44-I48 VanDerWaalsContact O-CG1 3.31Å; H44-I48 WeakPolarHBondContact O-CG1 3.48Å; H44-I48 PolarHBondContact O-N 2.96Å
45	K	90.7	Very high	89.8	Confident	144 Å²	144	85.3 Å²	85.3	63%	0.626	44%	0.435	S	S	*	.	H	α-helix	trans	-58.3	-45.5	175.4	-175.9	178	179.5	178.9	0	111.6	A41 L42 Q43 I48 T49	A41-K45 WeakPolarHBondContact O-CB 3.49Å; A41-K45 PolarHBondContact O-N 3.11Å; L42-K45 PolarHBondContact O-N 2.9Å; Q43-K45 VanDerWaalsContact C-N 3.32Å; Q43-K45 PolarHBondContact O-N 3.42Å; K45-I48 PolarHBondContact O-N 3.43Å; K45-T49 PolarHBondContact O-N 3.3Å; K45-T49 PolarHBondContact O-OG1 2.96Å; K45-T49 VanDerWaalsContact O-OG1 3.05Å
46	K	90	Very high	89.9	Confident	113 Å²	113	85.6 Å²	85.6	49%	0.491	44%	0.436	S	S	.	.	H	α-helix	trans	-63.5	-43.7	177	-70.6	173	-178.4	175.4	0	111.9	L42 Q43 H44 T49 V50	L42-K46 WeakPolarHBondContact O-CG 3.31Å; L42-K46 PolarHBondContact O-N 2.94Å; L42-K46 VanDerWaalsContact O-N 3.11Å; Q43-K46 WeakPolarHBondContact O-CB 3.44Å; Q43-K46 PolarHBondContact O-N 3.17Å; Q43-K46 VanDerWaalsContact O-N 3.17Å; H44-K46 VanDerWaalsContact C-N 3.33Å; H44-K46 PolarHBondContact O-N 3.42Å; K46-T49 PolarHBondContact O-N 3.46Å; K46-V50 WeakPolarHBondContact O-CG2 3.48Å; K46-V50 PolarHBondContact O-N 3.32Å
47	E	87.2	Confident	90.2	Very high	62 Å²	62	87.1 Å²	87.1	29%	0.29	44%	0.444	S	S	.	.	H	α-helix	trans	-60.1	-45.4	177.6	-74.1	169.2	-170.8	0	0	111.7	Q43 H44 T49 V50 Q51	Q43-E47 WeakPolarHBondContact CG-OE1 3.4Å; Q43-E47 PolarHBondContact NE2-OE1 3.4Å; Q43-E47 WeakPolarHBondContact O-CG 3.31Å; Q43-E47 PolarHBondContact O-N 3.4Å; H44-E47 IonicContact CD2-OE2 3.63Å; H44-E47 PolarHBondContact O-N 3.32Å; E47-T49 PolarHBondContact O-N 2.96Å; E47-V50 PolarHBondContact O-N 3.47Å; E47-Q51 WeakPolarHBondContact O-CG 3.4Å; E47-Q51 PolarHBondContact O-N 3.04Å
48	I	88.1	Confident	90.5	Very high	90 Å²	90	90 Å²	90	46%	0.462	45%	0.451	S	S	.	.	H	α-helix	trans	-60.9	-45	175.5	-68.7	166.2	0	0	0	110.8	H44 K45 V50 Q51 Q52	H44-I48 VanDerWaalsContact O-CG1 3.31Å; H44-I48 WeakPolarHBondContact O-CG1 3.48Å; H44-I48 PolarHBondContact O-N 2.96Å; K45-I48 PolarHBondContact O-N 3.43Å; I48-V50 PolarHBondContact O-N 2.96Å; I48-Q51 PolarHBondContact O-N 2.9Å; I48-Q52 HydrophobicContact CG2-CG 4.34Å; I48-Q52 WeakPolarHBondContact O-CB 3.31Å; I48-Q52 VanDerWaalsContact O-CG 3.3Å; I48-Q52 WeakPolarHBondContact O-CG 3.36Å; I48-Q52 PolarHBondContact O-N 3.28Å
49	T	91.7	Very high	90.7	Very high	59 Å²	59	88.2 Å²	88.2	36%	0.362	44%	0.444	S	S	.	.	H	α-helix	trans	-59.1	-46.6	177.2	-59.6	0	0	0	0	111.6	K45 K46 E47 Q51 Q52 D53	K45-T49 PolarHBondContact O-N 3.3Å; K45-T49 PolarHBondContact O-OG1 2.96Å; K45-T49 VanDerWaalsContact O-OG1 3.05Å; K46-T49 PolarHBondContact O-N 3.46Å; E47-T49 PolarHBondContact O-N 2.96Å; T49-Q51 PolarHBondContact O-N 3.47Å; T49-Q52 WeakPolarHBondContact O-CB 3.37Å; T49-Q52 PolarHBondContact O-N 3.48Å; T49-D53 PolarHBondContact O-N 3.34Å
50	V	88.3	Confident	91.1	Very high	84 Å²	84	87.7 Å²	87.7	51%	0.509	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-44.1	177.1	170.9	0	0	0	0	111.4	K46 E47 I48 Q52 D53 I54	K46-V50 WeakPolarHBondContact O-CG2 3.48Å; K46-V50 PolarHBondContact O-N 3.32Å; E47-V50 PolarHBondContact O-N 3.47Å; I48-V50 PolarHBondContact O-N 2.96Å; V50-Q52 VanDerWaalsContact C-N 3.33Å; V50-Q52 PolarHBondContact O-N 3.49Å; V50-D53 PolarHBondContact O-N 3.05Å; V50-I54 HydrophobicContact CG1-CD1 3.87Å; V50-I54 VanDerWaalsContact O-CG1 3.31Å; V50-I54 WeakPolarHBondContact O-CG1 3.31Å; V50-I54 PolarHBondContact O-N 3.26Å
51	Q	88.5	Confident	91.6	Very high	118 Å²	118	90.2 Å²	90.2	55%	0.551	46%	0.457	S	S	*	.	H	α-helix	trans	-62.9	-40	177	-72.8	177.3	0.8	0	0	112.3	E47 I48 T49 I54 A55	E47-Q51 WeakPolarHBondContact O-CG 3.4Å; E47-Q51 PolarHBondContact O-N 3.04Å; I48-Q51 PolarHBondContact O-N 2.9Å; T49-Q51 PolarHBondContact O-N 3.47Å; Q51-I54 PolarHBondContact O-N 3.38Å; Q51-A55 WeakPolarHBondContact O-CB 3.3Å; Q51-A55 PolarHBondContact O-N 3.47Å
52	Q	92.6	Very high	92	Very high	103 Å²	103	93.4 Å²	93.4	48%	0.481	46%	0.462	S	S	.	.	H	α-helix	trans	-63.9	-41.5	175.6	-74.6	175.3	-17.9	0	0	111.8	I48 T49 V50 A55 K56	I48-Q52 HydrophobicContact CG2-CG 4.34Å; I48-Q52 WeakPolarHBondContact O-CB 3.31Å; I48-Q52 VanDerWaalsContact O-CG 3.3Å; I48-Q52 WeakPolarHBondContact O-CG 3.36Å; I48-Q52 PolarHBondContact O-N 3.28Å; T49-Q52 WeakPolarHBondContact O-CB 3.37Å; T49-Q52 PolarHBondContact O-N 3.48Å; V50-Q52 VanDerWaalsContact C-N 3.33Å; V50-Q52 PolarHBondContact O-N 3.49Å; Q52-A55 PolarHBondContact O-N 2.92Å; Q52-K56 VanDerWaalsContact O-CG 3.31Å; Q52-K56 WeakPolarHBondContact O-CG 3.48Å; Q52-K56 PolarHBondContact O-N 3.47Å
53	D	94.1	Very high	92.3	Very high	81 Å²	81	93.9 Å²	93.9	43%	0.433	47%	0.465	S	S	.	.	H	α-helix	trans	-67.7	-40.5	178.2	-69.7	-19.4	0	0	0	111.7	T49 V50 A55 K56 Q57	T49-D53 PolarHBondContact O-N 3.34Å; V50-D53 PolarHBondContact O-N 3.05Å; D53-A55 VanDerWaalsContact C-N 3.34Å; D53-A55 PolarHBondContact O-N 3.3Å; D53-K56 PolarHBondContact O-N 2.93Å; D53-K56 IonicContact OD1-NZ 3.5Å; D53-Q57 WeakPolarHBondContact O-CB 3.46Å; D53-Q57 PolarHBondContact O-N 2.97Å
54	I	92.7	Very high	92.8	Very high	82 Å²	82	96.9 Å²	96.9	42%	0.421	47%	0.473	S	S	.	.	H	α-helix	trans	-60	-44.6	171.3	-68.8	167.1	0	0	0	110.8	V50 Q51 Q57 R58	V50-I54 HydrophobicContact CG1-CD1 3.87Å; V50-I54 VanDerWaalsContact O-CG1 3.31Å; V50-I54 WeakPolarHBondContact O-CG1 3.31Å; V50-I54 PolarHBondContact O-N 3.26Å; Q51-I54 PolarHBondContact O-N 3.38Å; I54-Q57 PolarHBondContact O-N 2.89Å; I54-R58 WeakPolarHBondContact O-CG 3.38Å; I54-R58 PolarHBondContact O-N 3.43Å
55	A	91.6	Very high	93.4	Very high	51 Å²	51	98.7 Å²	98.7	42%	0.421	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-43	179.3	0	0	0	0	0	112	Q51 Q52 D53 Q57 R58 V59	Q51-A55 WeakPolarHBondContact O-CB 3.3Å; Q51-A55 PolarHBondContact O-N 3.47Å; Q52-A55 PolarHBondContact O-N 2.92Å; D53-A55 VanDerWaalsContact C-N 3.34Å; D53-A55 PolarHBondContact O-N 3.3Å; A55-Q57 VanDerWaalsContact C-N 3.34Å; A55-Q57 PolarHBondContact O-N 3.22Å; A55-R58 PolarHBondContact O-N 3.35Å; A55-V59 WeakPolarHBondContact O-CG2 3.49Å; A55-V59 PolarHBondContact O-N 3.33Å; A55-V59 VanDerWaalsContact O-N 3.11Å
56	K	95.1	Very high	93.7	Very high	123 Å²	123	97.1 Å²	97.1	54%	0.535	48%	0.479	S	S	.	.	H	α-helix	trans	-59.6	-44.9	173.6	-73.2	170.8	-170.8	163.8	0	111.4	Q52 D53 R58 V59 I60	Q52-K56 VanDerWaalsContact O-CG 3.31Å; Q52-K56 WeakPolarHBondContact O-CG 3.48Å; Q52-K56 PolarHBondContact O-N 3.47Å; D53-K56 PolarHBondContact O-N 2.93Å; D53-K56 IonicContact OD1-NZ 3.5Å; K56-R58 PolarHBondContact O-N 3.01Å; K56-V59 PolarHBondContact O-N 2.94Å; K56-I60 WeakPolarHBondContact O-CG1 3.41Å; K56-I60 PolarHBondContact O-N 3.35Å
57	Q	93.8	Very high	94.1	Very high	98 Å²	98	97.1 Å²	97.1	46%	0.458	48%	0.481	S	S	.	.	H	α-helix	trans	-61.6	-44	178.4	-171.1	59.7	50.8	0	0	111.5	D53 I54 A55 V59 I60 D61	D53-Q57 WeakPolarHBondContact O-CB 3.46Å; D53-Q57 PolarHBondContact O-N 2.97Å; I54-Q57 PolarHBondContact O-N 2.89Å; A55-Q57 VanDerWaalsContact C-N 3.34Å; A55-Q57 PolarHBondContact O-N 3.22Å; Q57-V59 VanDerWaalsContact C-N 3.27Å; Q57-V59 PolarHBondContact O-N 3.11Å; Q57-I60 WeakPolarHBondContact O-CB 3.45Å; Q57-I60 PolarHBondContact O-N 2.9Å; Q57-I60 VanDerWaalsContact O-N 3.09Å; Q57-D61 PolarHBondContact NE2-OD1 2.85Å; Q57-D61 PolarHBondContact O-N 2.99Å
58	R	95.8	Very high	94.6	Very high	129 Å²	129	98.4 Å²	98.4	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-57.6	-39.6	175	-72.6	174.8	-177.7	-178.4	-1.2	112.5	I54 A55 K56 Q62	I54-R58 WeakPolarHBondContact O-CG 3.38Å; I54-R58 PolarHBondContact O-N 3.43Å; A55-R58 PolarHBondContact O-N 3.35Å; K56-R58 PolarHBondContact O-N 3.01Å; R58-Q62 WeakPolarHBondContact O-CB 3.48Å; R58-Q62 VanDerWaalsContact O-CG 3.28Å; R58-Q62 WeakPolarHBondContact O-CG 3.33Å; R58-Q62 PolarHBondContact O-N 3.18Å
59	V	96.3	Very high	95.1	Very high	78 Å²	78	97.5 Å²	97.5	47%	0.473	48%	0.484	S	S	.	.	H	α-helix	trans	-66.5	-41.6	176	172	0	0	0	0	111.2	A55 K56 Q57 Q62 L63	A55-V59 WeakPolarHBondContact O-CG2 3.49Å; A55-V59 PolarHBondContact O-N 3.33Å; A55-V59 VanDerWaalsContact O-N 3.11Å; K56-V59 PolarHBondContact O-N 2.94Å; Q57-V59 VanDerWaalsContact C-N 3.27Å; Q57-V59 PolarHBondContact O-N 3.11Å; V59-Q62 PolarHBondContact O-N 2.93Å; V59-L63 HydrophobicContact CG1-CD1 4.11Å; V59-L63 HydrophobicContact CG1-CG 4.46Å; V59-L63 WeakPolarHBondContact O-CG 3.49Å; V59-L63 PolarHBondContact O-N 3.12Å
60	I	96.6	Very high	95.4	Very high	95 Å²	95	96.6 Å²	96.6	49%	0.487	48%	0.482	S	S	.	.	H	α-helix	trans	-60.8	-46.6	175.8	-68.5	166.1	0	0	0	110.7	K56 Q57 Q62 L63 Y64	K56-I60 WeakPolarHBondContact O-CG1 3.41Å; K56-I60 PolarHBondContact O-N 3.35Å; Q57-I60 WeakPolarHBondContact O-CB 3.45Å; Q57-I60 PolarHBondContact O-N 2.9Å; Q57-I60 VanDerWaalsContact O-N 3.09Å; I60-Q62 VanDerWaalsContact C-N 3.32Å; I60-Q62 PolarHBondContact O-N 3.36Å; I60-L63 PolarHBondContact O-N 3.09Å; I60-Y64 PolarHBondContact O-N 2.99Å
61	D	96.4	Very high	95.9	Very high	82 Å²	82	97.7 Å²	97.7	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-61.9	-41.3	178.8	-59.8	-17.8	0	0	0	111.1	Q57 Y64 E65	Q57-D61 PolarHBondContact NE2-OD1 2.85Å; Q57-D61 PolarHBondContact O-N 2.99Å; D61-Y64 WeakPolarHBondContact O-CB 3.28Å; D61-Y64 PolarHBondContact O-N 3.3Å; D61-E65 PolarHBondContact O-N 3.49Å; D61-E65 VanDerWaalsContact O-N 3.12Å
62	Q	97.4	Very high	96.3	Very high	124 Å²	124	96 Å²	96	58%	0.579	47%	0.474	S	S	*	.	H	α-helix	trans	-63.6	-42.5	174.9	-76.4	175.2	-19.4	0	0	112.5	R58 V59 I60 Y64 E65 I66	R58-Q62 WeakPolarHBondContact O-CB 3.48Å; R58-Q62 VanDerWaalsContact O-CG 3.28Å; R58-Q62 WeakPolarHBondContact O-CG 3.33Å; R58-Q62 PolarHBondContact O-N 3.18Å; V59-Q62 PolarHBondContact O-N 2.93Å; I60-Q62 VanDerWaalsContact C-N 3.32Å; I60-Q62 PolarHBondContact O-N 3.36Å; Q62-Y64 VanDerWaalsContact C-N 3.3Å; Q62-Y64 PolarHBondContact O-N 3.47Å; Q62-E65 PolarHBondContact O-N 3.22Å; Q62-I66 VanDerWaalsContact O-CG1 3.28Å; Q62-I66 WeakPolarHBondContact O-CG1 3.38Å; Q62-I66 PolarHBondContact O-N 3.37Å
63	L	98.1	Very high	96.6	Very high	106 Å²	106	95.1 Å²	95.1	56%	0.555	47%	0.472	S	S	*	.	H	α-helix	trans	-62.8	-39	176.8	-75.1	170.7	0	0	0	111.6	V59 I60 I66 H67	V59-L63 HydrophobicContact CG1-CD1 4.11Å; V59-L63 HydrophobicContact CG1-CG 4.46Å; V59-L63 WeakPolarHBondContact O-CG 3.49Å; V59-L63 PolarHBondContact O-N 3.12Å; I60-L63 PolarHBondContact O-N 3.09Å; L63-I66 PolarHBondContact O-N 3.25Å; L63-H67 WeakPolarHBondContact O-CB 3.46Å; L63-H67 PolarHBondContact O-N 3.48Å
64	Y	97.8	Very high	96.8	Very high	152 Å²	152	95.6 Å²	95.6	60%	0.596	47%	0.474	S	S	*	.	H	α-helix	trans	-61.3	-47.3	175.5	179	-99.9	0	0	0	111.9	I60 D61 Q62 I66 H67 K68	I60-Y64 PolarHBondContact O-N 2.99Å; D61-Y64 WeakPolarHBondContact O-CB 3.28Å; D61-Y64 PolarHBondContact O-N 3.3Å; Q62-Y64 VanDerWaalsContact C-N 3.3Å; Q62-Y64 PolarHBondContact O-N 3.47Å; Y64-I66 PolarHBondContact O-N 2.97Å; Y64-H67 PolarHBondContact O-N 2.95Å; Y64-K68 PolarHBondContact O-N 3.41Å
65	E	98	Very high	97	Very high	98 Å²	98	98.2 Å²	98.2	46%	0.458	48%	0.479	S	S	.	.	H	α-helix	trans	-64.7	-39.5	177.1	-68.2	-57.4	132.7	0	0	112.4	D61 Q62 H67 K68 V69	D61-E65 PolarHBondContact O-N 3.49Å; D61-E65 VanDerWaalsContact O-N 3.12Å; Q62-E65 PolarHBondContact O-N 3.22Å; E65-H67 VanDerWaalsContact C-N 3.32Å; E65-H67 PolarHBondContact O-N 2.99Å; E65-K68 PolarHBondContact O-N 3.41Å; E65-V69 WeakPolarHBondContact O-CG2 3.44Å; E65-V69 PolarHBondContact O-N 3.47Å
66	I	98.1	Very high	97.3	Very high	112 Å²	112	99 Å²	99	57%	0.574	48%	0.479	S	S	*	.	H	α-helix	trans	-60	-44.4	174.4	-70.9	165.6	0	0	0	110.6	Q62 L63 Y64 V69 A70	Q62-I66 VanDerWaalsContact O-CG1 3.28Å; Q62-I66 WeakPolarHBondContact O-CG1 3.38Å; Q62-I66 PolarHBondContact O-N 3.37Å; L63-I66 PolarHBondContact O-N 3.25Å; Y64-I66 PolarHBondContact O-N 2.97Å; I66-V69 PolarHBondContact O-N 3.36Å; I66-A70 WeakPolarHBondContact O-CB 3.4Å; I66-A70 PolarHBondContact O-N 2.98Å
67	H	98.2	Very high	97.4	Very high	113 Å²	113	98.7 Å²	98.7	52%	0.523	48%	0.479	S	S	.	.	H	α-helix	trans	-63	-44.8	179.2	-172.5	51.2	0	0	0	111.8	L63 Y64 E65 V69 A70 E71	L63-H67 WeakPolarHBondContact O-CB 3.46Å; L63-H67 PolarHBondContact O-N 3.48Å; Y64-H67 PolarHBondContact O-N 2.95Å; E65-H67 VanDerWaalsContact C-N 3.32Å; E65-H67 PolarHBondContact O-N 2.99Å; H67-V69 PolarHBondContact O-N 3.45Å; H67-A70 WeakPolarHBondContact O-CB 3.28Å; H67-A70 PolarHBondContact O-N 2.97Å; H67-A70 VanDerWaalsContact O-N 3.14Å; H67-E71 IonicContact NE2-OE1 3.52Å; H67-E71 PolarHBondContact O-N 3.3Å
68	K	98	Very high	97.6	Very high	88 Å²	88	98.9 Å²	98.9	38%	0.383	48%	0.482	S	S	.	.	H	α-helix	trans	-58.4	-45.4	175.7	-179.1	-175.6	171.9	-168.7	0	112.3	Y64 E65 A70 E71 E72	Y64-K68 PolarHBondContact O-N 3.41Å; E65-K68 PolarHBondContact O-N 3.41Å; K68-A70 VanDerWaalsContact C-N 3.31Å; K68-A70 PolarHBondContact O-N 3.07Å; K68-E71 PolarHBondContact O-N 3.33Å; K68-E72 WeakPolarHBondContact O-CG 3.48Å; K68-E72 PolarHBondContact O-N 3Å; K68-E72 VanDerWaalsContact O-N 3.07Å
69	V	98.3	Very high	97.7	Very high	71 Å²	71	96.8 Å²	96.8	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-64.2	-38.2	176.8	171.9	0	0	0	0	111.1	E65 I66 H67 E72 I73	E65-V69 WeakPolarHBondContact O-CG2 3.44Å; E65-V69 PolarHBondContact O-N 3.47Å; I66-V69 PolarHBondContact O-N 3.36Å; H67-V69 PolarHBondContact O-N 3.45Å; V69-E72 PolarHBondContact O-N 3.19Å; V69-I73 HydrophobicContact CG1-CD1 4.02Å; V69-I73 WeakPolarHBondContact O-CG1 3.48Å; V69-I73 PolarHBondContact O-N 2.96Å
70	A	98.2	Very high	97.8	Very high	40 Å²	40	97.4 Å²	97.4	33%	0.331	48%	0.478	S	S	.	.	H	α-helix	trans	-61.7	-44.6	175.6	0	0	0	0	0	111.9	I66 H67 K68 E72 I73 D74	I66-A70 WeakPolarHBondContact O-CB 3.4Å; I66-A70 PolarHBondContact O-N 2.98Å; H67-A70 WeakPolarHBondContact O-CB 3.28Å; H67-A70 PolarHBondContact O-N 2.97Å; H67-A70 VanDerWaalsContact O-N 3.14Å; K68-A70 VanDerWaalsContact C-N 3.31Å; K68-A70 PolarHBondContact O-N 3.07Å; A70-E72 VanDerWaalsContact C-N 3.32Å; A70-E72 PolarHBondContact O-N 3.06Å; A70-I73 WeakPolarHBondContact O-CB 3.46Å; A70-I73 PolarHBondContact O-N 3Å; A70-D74 PolarHBondContact O-N 3.14Å
71	E	97.9	Very high	97.8	Very high	108 Å²	108	97.7 Å²	97.7	51%	0.505	48%	0.477	S	S	.	.	H	α-helix	trans	-61.7	-38.1	175.3	-68.6	-178.7	149.7	0	0	112.6	H67 K68 D74 R75	H67-E71 IonicContact NE2-OE1 3.52Å; H67-E71 PolarHBondContact O-N 3.3Å; K68-E71 PolarHBondContact O-N 3.33Å; E71-D74 PolarHBondContact O-N 3.43Å; E71-R75 WeakPolarHBondContact O-CB 3.47Å; E71-R75 PolarHBondContact O-N 2.76Å
72	E	98.2	Very high	97.9	Very high	81 Å²	81	99.8 Å²	99.8	38%	0.379	48%	0.484	S	S	.	.	H	α-helix	trans	-65.9	-37.9	175.5	-71.7	179.4	178.6	0	0	112.3	K68 V69 A70 T76	K68-E72 WeakPolarHBondContact O-CG 3.48Å; K68-E72 PolarHBondContact O-N 3Å; K68-E72 VanDerWaalsContact O-N 3.07Å; V69-E72 PolarHBondContact O-N 3.19Å; A70-E72 VanDerWaalsContact C-N 3.32Å; A70-E72 PolarHBondContact O-N 3.06Å; E72-T76 WeakPolarHBondContact O-CB 3.34Å; E72-T76 PolarHBondContact O-N 2.97Å; E72-T76 PolarHBondContact O-OG1 3.09Å
73	I	98.3	Very high	97.9	Very high	86 Å²	86	100 Å²	100	44%	0.441	48%	0.484	S	S	.	.	H	α-helix	trans	-64	-48.5	174.4	-70.8	167	0	0	0	110.1	V69 A70 R75 T76 Q77	V69-I73 HydrophobicContact CG1-CD1 4.02Å; V69-I73 WeakPolarHBondContact O-CG1 3.48Å; V69-I73 PolarHBondContact O-N 2.96Å; A70-I73 WeakPolarHBondContact O-CB 3.46Å; A70-I73 PolarHBondContact O-N 3Å; I73-R75 VanDerWaalsContact C-N 3.34Å; I73-R75 PolarHBondContact O-N 3.44Å; I73-T76 WeakPolarHBondContact O-CB 3.47Å; I73-T76 PolarHBondContact O-N 3.46Å; I73-T76 VanDerWaalsContact O-N 3.13Å; I73-Q77 HydrophobicContact CG2-CG 4.42Å; I73-Q77 WeakPolarHBondContact O-CG 3.5Å; I73-Q77 PolarHBondContact O-N 3.3Å
74	D	98.2	Very high	97.9	Very high	91 Å²	91	99.2 Å²	99.2	49%	0.487	48%	0.479	S	S	.	.	H	α-helix	trans	-60.2	-44.3	-179.8	-73	-12.1	0	0	0	111.4	A70 E71 T76 Q77 I78	A70-D74 PolarHBondContact O-N 3.14Å; E71-D74 PolarHBondContact O-N 3.43Å; D74-T76 VanDerWaalsContact C-N 3.33Å; D74-T76 PolarHBondContact O-N 3Å; D74-Q77 PolarHBondContact O-N 3.42Å; D74-I78 WeakPolarHBondContact O-CG1 3.34Å; D74-I78 PolarHBondContact O-N 3.44Å; D74-I78 VanDerWaalsContact O-N 3.11Å
75	R	97.7	Very high	97.8	Very high	136 Å²	136	95.7 Å²	95.7	51%	0.513	47%	0.47	S	S	.	.	H	α-helix	trans	-58.6	-45.2	174.3	-175.2	178.3	66.3	-131.9	-4.2	111.7	E71 I73 Q77 I78 E79	E71-R75 WeakPolarHBondContact O-CB 3.47Å; E71-R75 PolarHBondContact O-N 2.76Å; I73-R75 VanDerWaalsContact C-N 3.34Å; I73-R75 PolarHBondContact O-N 3.44Å; R75-Q77 VanDerWaalsContact C-N 3.32Å; R75-Q77 PolarHBondContact O-N 3.11Å; R75-I78 PolarHBondContact O-N 3.26Å; R75-E79 PolarHBondContact O-N 2.91Å; R75-E79 VanDerWaalsContact O-N 3.09Å
76	T	97.7	Very high	97.8	Very high	68 Å²	68	97.5 Å²	97.5	42%	0.417	48%	0.477	S	S	.	.	H	α-helix	trans	-64.2	-37.7	179.8	-56	0	0	0	0	111.8	E72 I73 D74 E79 L80	E72-T76 WeakPolarHBondContact O-CB 3.34Å; E72-T76 PolarHBondContact O-N 2.97Å; E72-T76 PolarHBondContact O-OG1 3.09Å; I73-T76 WeakPolarHBondContact O-CB 3.47Å; I73-T76 PolarHBondContact O-N 3.46Å; I73-T76 VanDerWaalsContact O-N 3.13Å; D74-T76 VanDerWaalsContact C-N 3.33Å; D74-T76 PolarHBondContact O-N 3Å; T76-E79 PolarHBondContact O-N 3.42Å; T76-L80 HydrophobicContact CG2-CD1 4.16Å; T76-L80 WeakPolarHBondContact O-CB 3.44Å; T76-L80 WeakPolarHBondContact O-CG 3.39Å; T76-L80 PolarHBondContact O-N 3.13Å
77	Q	97.3	Very high	97.7	Very high	116 Å²	116	98.2 Å²	98.2	54%	0.542	48%	0.476	S	S	.	.	H	α-helix	trans	-63.3	-43.5	176.1	-72.8	177.3	0.9	0	0	111.9	I73 D74 R75 L80 Q81	I73-Q77 HydrophobicContact CG2-CG 4.42Å; I73-Q77 WeakPolarHBondContact O-CG 3.5Å; I73-Q77 PolarHBondContact O-N 3.3Å; D74-Q77 PolarHBondContact O-N 3.42Å; R75-Q77 VanDerWaalsContact C-N 3.32Å; R75-Q77 PolarHBondContact O-N 3.11Å; Q77-L80 PolarHBondContact O-N 2.97Å; Q77-Q81 PolarHBondContact O-N 3.5Å
78	I	97.6	Very high	97.6	Very high	103 Å²	103	95.8 Å²	95.8	53%	0.528	47%	0.471	S	S	.	.	H	α-helix	trans	-60.5	-49.9	176.3	-67.1	167.6	0	0	0	110.6	D74 R75 L80 Q81 E82	D74-I78 WeakPolarHBondContact O-CG1 3.34Å; D74-I78 PolarHBondContact O-N 3.44Å; D74-I78 VanDerWaalsContact O-N 3.11Å; R75-I78 PolarHBondContact O-N 3.26Å; I78-L80 VanDerWaalsContact C-N 3.28Å; I78-L80 PolarHBondContact O-N 3.18Å; I78-Q81 WeakPolarHBondContact O-CB 3.32Å; I78-Q81 PolarHBondContact O-N 3.26Å; I78-Q81 VanDerWaalsContact O-N 3.12Å; I78-E82 PolarHBondContact O-N 2.96Å
79	E	97.9	Very high	97.4	Very high	84 Å²	84	96.7 Å²	96.7	39%	0.393	48%	0.48	S	S	.	.	H	α-helix	trans	-59.8	-37.7	178.8	-72.1	179	-163.3	0	0	112.8	R75 T76 K83	R75-E79 PolarHBondContact O-N 2.91Å; R75-E79 VanDerWaalsContact O-N 3.09Å; T76-E79 PolarHBondContact O-N 3.42Å; E79-K83 WeakPolarHBondContact O-CG 3.49Å; E79-K83 PolarHBondContact O-N 2.92Å
80	L	98	Very high	97.2	Very high	92 Å²	92	97.3 Å²	97.3	48%	0.482	48%	0.481	S	S	.	.	H	α-helix	trans	-67.9	-41.1	175.6	-76.8	170.9	0	0	0	111.7	T76 Q77 I78 E82 K83 I84	T76-L80 HydrophobicContact CG2-CD1 4.16Å; T76-L80 WeakPolarHBondContact O-CB 3.44Å; T76-L80 WeakPolarHBondContact O-CG 3.39Å; T76-L80 PolarHBondContact O-N 3.13Å; Q77-L80 PolarHBondContact O-N 2.97Å; I78-L80 VanDerWaalsContact C-N 3.28Å; I78-L80 PolarHBondContact O-N 3.18Å; L80-E82 VanDerWaalsContact C-N 3.34Å; L80-E82 PolarHBondContact O-N 3.31Å; L80-K83 PolarHBondContact O-N 2.89Å; L80-I84 WeakPolarHBondContact O-CG1 3.32Å; L80-I84 PolarHBondContact O-N 2.97Å
81	Q	97.4	Very high	97	Very high	100 Å²	100	98.7 Å²	98.7	47%	0.467	48%	0.482	S	S	.	.	H	α-helix	trans	-62.4	-41.9	177.9	-172.4	61	59.7	0	0	111.6	Q77 I78 K83 I84 N85	Q77-Q81 PolarHBondContact O-N 3.5Å; I78-Q81 WeakPolarHBondContact O-CB 3.32Å; I78-Q81 PolarHBondContact O-N 3.26Å; I78-Q81 VanDerWaalsContact O-N 3.12Å; Q81-K83 PolarHBondContact O-N 3.25Å; Q81-I84 PolarHBondContact O-N 3.47Å; Q81-N85 PolarHBondContact NE2-OD1 3.37Å; Q81-N85 PolarHBondContact O-N 3.03Å; Q81-N85 PolarHBondContact O-OD1 3.12Å
82	E	97.6	Very high	96.6	Very high	126 Å²	126	96.5 Å²	96.5	59%	0.589	48%	0.479	S	S	*	.	H	α-helix	trans	-61.7	-42.6	175.1	-70.5	179.2	167.8	0	0	112	I78 L80 N85 K86	I78-E82 PolarHBondContact O-N 2.96Å; L80-E82 VanDerWaalsContact C-N 3.34Å; L80-E82 PolarHBondContact O-N 3.31Å; E82-N85 PolarHBondContact O-N 3.34Å; E82-K86 WeakPolarHBondContact O-CB 3.5Å; E82-K86 PolarHBondContact O-N 3.37Å
83	K	97.7	Very high	96.2	Very high	130 Å²	130	98.3 Å²	98.3	57%	0.565	49%	0.487	S	S	*	.	H	α-helix	trans	-64	-40.3	176	-73.1	169.2	-174.7	164.6	0	112.3	E79 L80 Q81 F87	E79-K83 WeakPolarHBondContact O-CG 3.49Å; E79-K83 PolarHBondContact O-N 2.92Å; L80-K83 PolarHBondContact O-N 2.89Å; Q81-K83 PolarHBondContact O-N 3.25Å; K83-F87 WeakPolarHBondContact O-CB 3.39Å; K83-F87 PolarHBondContact O-N 3.48Å
84	I	97.5	Very high	95.8	Very high	89 Å²	89	101 Å²	101	46%	0.456	50%	0.495	S	S	.	.	H	α-helix	trans	-63.9	-46.5	175.9	-71.4	166.1	0	0	0	110.3	L80 Q81 K86 F87 C88	L80-I84 WeakPolarHBondContact O-CG1 3.32Å; L80-I84 PolarHBondContact O-N 2.97Å; Q81-I84 PolarHBondContact O-N 3.47Å; I84-K86 PolarHBondContact O-N 3.4Å; I84-F87 WeakPolarHBondContact O-CB 3.42Å; I84-F87 PolarHBondContact O-N 3.45Å; I84-C88 PolarHBondContact O-N 3.2Å; I84-C88 PolarHBondContact O-SG 2.99Å; I84-C88 VanDerWaalsContact O-SG 3.34Å
85	N	96.3	Very high	95.3	Very high	77 Å²	77	100.3 Å²	100.3	41%	0.412	49%	0.491	S	S	.	.	H	α-helix	trans	-59.3	-47.8	178.4	-68.6	-10.6	0	0	0	110.9	Q81 E82 F87 C88 D89	Q81-N85 PolarHBondContact NE2-OD1 3.37Å; Q81-N85 PolarHBondContact O-N 3.03Å; Q81-N85 PolarHBondContact O-OD1 3.12Å; E82-N85 PolarHBondContact O-N 3.34Å; N85-F87 VanDerWaalsContact C-N 3.32Å; N85-F87 PolarHBondContact O-N 3.46Å; N85-C88 WeakPolarHBondContact O-CB 3.48Å; N85-C88 PolarHBondContact O-N 2.94Å; N85-C88 VanDerWaalsContact O-N 3.15Å; N85-D89 PolarHBondContact O-N 3.15Å
86	K	97	Very high	94.6	Very high	137 Å²	137	98.2 Å²	98.2	60%	0.596	49%	0.486	S	S	*	.	H	α-helix	trans	-58.5	-43.1	175.8	-175.7	178.7	178.3	-178.3	0	112.4	E82 I84 C88 D89 D90	E82-K86 WeakPolarHBondContact O-CB 3.5Å; E82-K86 PolarHBondContact O-N 3.37Å; I84-K86 PolarHBondContact O-N 3.4Å; K86-C88 VanDerWaalsContact C-N 3.34Å; K86-C88 PolarHBondContact O-N 2.93Å; K86-D89 PolarHBondContact O-N 3.32Å; K86-D90 WeakPolarHBondContact O-CB 3.42Å; K86-D90 PolarHBondContact O-N 3Å
87	F	97	Very high	93.9	Very high	127 Å²	127	100.6 Å²	100.6	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-62.9	-39.8	176.9	178.3	-107.9	0	0	0	112.5	K83 I84 N85 D90 I91	K83-F87 WeakPolarHBondContact O-CB 3.39Å; K83-F87 PolarHBondContact O-N 3.48Å; I84-F87 WeakPolarHBondContact O-CB 3.42Å; I84-F87 PolarHBondContact O-N 3.45Å; N85-F87 VanDerWaalsContact C-N 3.32Å; N85-F87 PolarHBondContact O-N 3.46Å; F87-D90 PolarHBondContact O-N 3.34Å; F87-I91 HydrophobicContact CD1-CD1 3.86Å; F87-I91 HydrophobicContact CD2-CD1 4.49Å; F87-I91 HydrophobicContact CE1-CD1 3.29Å; F87-I91 HydrophobicContact CE1-CG1 4.39Å; F87-I91 HydrophobicContact CE2-CD1 4.01Å; F87-I91 HydrophobicContact CE2-CG1 4.38Å; F87-I91 HydrophobicContact CG-CD1 4.44Å; F87-I91 HydrophobicContact CZ-CD1 3.4Å; F87-I91 HydrophobicContact CZ-CG1 4.24Å; F87-I91 WeakPolarHBondContact O-CG1 3.49Å; F87-I91 PolarHBondContact O-N 2.92Å
88	C	95.5	Very high	93.2	Very high	61 Å²	61	98.6 Å²	98.6	41%	0.412	50%	0.495	S	S	.	.	H	α-helix	trans	-64.1	-39.2	174.1	-70.3	0	0	0	0	112.3	I84 N85 K86 S92	I84-C88 PolarHBondContact O-N 3.2Å; I84-C88 PolarHBondContact O-SG 2.99Å; I84-C88 VanDerWaalsContact O-SG 3.34Å; N85-C88 WeakPolarHBondContact O-CB 3.48Å; N85-C88 PolarHBondContact O-N 2.94Å; N85-C88 VanDerWaalsContact O-N 3.15Å; K86-C88 VanDerWaalsContact C-N 3.34Å; K86-C88 PolarHBondContact O-N 2.93Å; C88-S92 WeakPolarHBondContact O-CB 3.37Å; C88-S92 PolarHBondContact O-N 3.39Å; C88-S92 PolarHBondContact O-OG 2.91Å
89	D	94.8	Very high	92.1	Very high	108 Å²	108	98.1 Å²	98.1	58%	0.578	49%	0.493	S	S	*	.	H	α-helix	trans	-65	-47.6	175.4	-67.7	-22.9	0	0	0	110.7	N85 K86 I91 S92 E93	N85-D89 PolarHBondContact O-N 3.15Å; K86-D89 PolarHBondContact O-N 3.32Å; D89-I91 VanDerWaalsContact C-N 3.34Å; D89-I91 PolarHBondContact O-N 3.37Å; D89-S92 WeakPolarHBondContact O-CB 3.48Å; D89-S92 PolarHBondContact O-N 3.45Å; D89-S92 VanDerWaalsContact O-N 3.11Å; D89-E93 PolarHBondContact O-N 2.92Å
90	D	94.5	Very high	90.4	Very high	83 Å²	83	101.4 Å²	101.4	44%	0.444	51%	0.513	S	S	.	.	H	α-helix	trans	-59	-42.1	178.1	-69.1	-18.3	0	0	0	111.5	K86 F87 F94	K86-D90 WeakPolarHBondContact O-CB 3.42Å; K86-D90 PolarHBondContact O-N 3Å; F87-D90 PolarHBondContact O-N 3.34Å; D90-F94 WeakPolarHBondContact O-CB 3.49Å; D90-F94 PolarHBondContact O-N 3Å
91	I	93.1	Very high	88.5	Confident	70 Å²	70	100.7 Å²	100.7	36%	0.359	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-44.8	174.4	-75	174.6	0	0	0	111.1	F87 D89 E93 F94 I95	F87-I91 HydrophobicContact CD1-CD1 3.86Å; F87-I91 HydrophobicContact CD2-CD1 4.49Å; F87-I91 HydrophobicContact CE1-CD1 3.29Å; F87-I91 HydrophobicContact CE1-CG1 4.39Å; F87-I91 HydrophobicContact CE2-CD1 4.01Å; F87-I91 HydrophobicContact CE2-CG1 4.38Å; F87-I91 HydrophobicContact CG-CD1 4.44Å; F87-I91 HydrophobicContact CZ-CD1 3.4Å; F87-I91 HydrophobicContact CZ-CG1 4.24Å; F87-I91 WeakPolarHBondContact O-CG1 3.49Å; F87-I91 PolarHBondContact O-N 2.92Å; D89-I91 VanDerWaalsContact C-N 3.34Å; D89-I91 PolarHBondContact O-N 3.37Å; I91-E93 VanDerWaalsContact C-N 3.31Å; I91-E93 PolarHBondContact O-N 2.74Å; I91-F94 WeakPolarHBondContact O-CB 3.38Å; I91-F94 PolarHBondContact O-N 3.33Å; I91-I95 HydrophobicContact CG2-CD1 3.68Å; I91-I95 HydrophobicContact CG2-CG1 4.3Å; I91-I95 WeakPolarHBondContact O-CG1 3.25Å; I91-I95 PolarHBondContact O-N 2.8Å
92	S	89.3	Confident	86.6	Confident	62 Å²	62	100.8 Å²	100.8	43%	0.434	51%	0.512	S	S	.	.	H	α-helix	trans	-62.3	-42.7	-178.3	-62.8	0	0	0	0	110.9	C88 D89 I95 K96	C88-S92 WeakPolarHBondContact O-CB 3.37Å; C88-S92 PolarHBondContact O-N 3.39Å; C88-S92 PolarHBondContact O-OG 2.91Å; D89-S92 WeakPolarHBondContact O-CB 3.48Å; D89-S92 PolarHBondContact O-N 3.45Å; D89-S92 VanDerWaalsContact O-N 3.11Å; S92-I95 PolarHBondContact O-N 3.11Å; S92-K96 WeakPolarHBondContact O-CG 3.5Å; S92-K96 PolarHBondContact O-N 3.38Å
93	E	89.1	Confident	84.8	Confident	119 Å²	119	100.9 Å²	100.9	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-62.7	-45.4	173.3	-175.4	172.6	-174.9	0	0	111.7	D89 I91 I95 K96 N97	D89-E93 PolarHBondContact O-N 2.92Å; I91-E93 VanDerWaalsContact C-N 3.31Å; I91-E93 PolarHBondContact O-N 2.74Å; E93-I95 VanDerWaalsContact C-N 3.34Å; E93-I95 PolarHBondContact O-N 2.99Å; E93-K96 PolarHBondContact O-N 2.97Å; E93-N97 WeakPolarHBondContact O-CB 3.43Å; E93-N97 PolarHBondContact O-N 3.23Å; E93-N97 PolarHBondContact O-ND2 3.04Å
94	F	90.8	Very high	82.6	Confident	141 Å²	141	102.7 Å²	102.7	62%	0.618	53%	0.525	S	S	*	.	H	α-helix	trans	-57.5	-44.6	176.5	176	-96.9	0	0	0	112.5	D90 I91 S98	D90-F94 WeakPolarHBondContact O-CB 3.49Å; D90-F94 PolarHBondContact O-N 3Å; I91-F94 WeakPolarHBondContact O-CB 3.38Å; I91-F94 PolarHBondContact O-N 3.33Å; F94-S98 VanDerWaalsContact O-CB 3.25Å; F94-S98 WeakPolarHBondContact O-CB 3.33Å; F94-S98 PolarHBondContact O-N 3.46Å; F94-S98 PolarHBondContact O-OG 2.89Å
95	I	88.1	Confident	80.4	Confident	78 Å²	78	102.4 Å²	102.4	40%	0.4	53%	0.527	S	S	.	.	H	α-helix	trans	-65.1	-46.8	178.9	-68.4	170	0	0	0	110.9	I91 S92 E93 N97 S98 L99	I91-I95 HydrophobicContact CG2-CD1 3.68Å; I91-I95 HydrophobicContact CG2-CG1 4.3Å; I91-I95 WeakPolarHBondContact O-CG1 3.25Å; I91-I95 PolarHBondContact O-N 2.8Å; S92-I95 PolarHBondContact O-N 3.11Å; E93-I95 VanDerWaalsContact C-N 3.34Å; E93-I95 PolarHBondContact O-N 2.99Å; I95-N97 VanDerWaalsContact C-N 3.33Å; I95-N97 PolarHBondContact O-N 3.28Å; I95-S98 PolarHBondContact O-N 3.07Å; I95-L99 HydrophobicContact CG2-CD1 3.83Å; I95-L99 WeakPolarHBondContact O-CB 3.48Å; I95-L99 PolarHBondContact O-N 2.99Å
96	K	82.7	Confident	78.2	Confident	92 Å²	92	103.7 Å²	103.7	40%	0.4	54%	0.538	S	S	.	.	H	α-helix	trans	-56.8	-47.4	177.5	-75.3	-173.1	-177.8	-158.7	0	111.6	S92 E93 N100 I101 D103	S92-K96 WeakPolarHBondContact O-CG 3.5Å; S92-K96 PolarHBondContact O-N 3.38Å; E93-K96 PolarHBondContact O-N 2.97Å; K96-N100 WeakPolarHBondContact O-CA 3.41Å; K96-N100 PolarHBondContact O-N 3.24Å; K96-I101 PolarHBondContact O-N 3.42Å; K96-D103 IonicContact NZ-OD1 2.74Å; K96-D103 PolarHBondContact NZ-OD1 2.74Å; K96-D103 IonicContact NZ-OD2 3.57Å
97	N	83.6	Confident	76.1	Confident	118 Å²	118	102.2 Å²	102.2	63%	0.631	55%	0.551	S	S	*	*	H	α-helix	trans	-67.9	-34.8	179.7	-70.8	-22.2	0	0	0	112.6	E93 I95	E93-N97 WeakPolarHBondContact O-CB 3.43Å; E93-N97 PolarHBondContact O-N 3.23Å; E93-N97 PolarHBondContact O-ND2 3.04Å; I95-N97 VanDerWaalsContact C-N 3.33Å; I95-N97 PolarHBondContact O-N 3.28Å
98	S	82.4	Confident	74.1	Confident	73 Å²	73	99.2 Å²	99.2	51%	0.51	56%	0.556	S	S	.	*	H	α-helix	trans	-75.7	-31.6	-179.5	-61.9	0	0	0	0	113.3	F94 I95	F94-S98 VanDerWaalsContact O-CB 3.25Å; F94-S98 WeakPolarHBondContact O-CB 3.33Å; F94-S98 PolarHBondContact O-N 3.46Å; F94-S98 PolarHBondContact O-OG 2.89Å; I95-S98 PolarHBondContact O-N 3.07Å
99	L	74	Confident	72	Confident	94 Å²	94	102.3 Å²	102.3	49%	0.492	57%	0.569	S	S	.	*	H	α-helix	trans	-103.6	0.3	-176.2	-66.5	175.1	0	0	0	113.6	I95 I101 I113	I95-L99 HydrophobicContact CG2-CD1 3.83Å; I95-L99 WeakPolarHBondContact O-CB 3.48Å; I95-L99 PolarHBondContact O-N 2.99Å; L99-I101 HydrophobicContact CB-CD1 3.54Å; L99-I101 HydrophobicContact CB-CG1 3.54Å; L99-I101 HydrophobicContact CD1-CD1 3.63Å; L99-I101 HydrophobicContact CG-CD1 4.23Å; L99-I101 PolarHBondContact O-N 3.13Å; L99-I113 HydrophobicContact CD1-CD1 4.5Å
100	N	62.4	Low	70	Confident	153 Å²	153	101.3 Å²	101.3	82%	0.818	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.5	39.4	-174.3	-156.1	34.7	0	0	0	112	K96 D102	K96-N100 WeakPolarHBondContact O-CA 3.41Å; K96-N100 PolarHBondContact O-N 3.24Å; N100-D102 PolarHBondContact O-N 3.45Å; N100-D102 VanDerWaalsContact O-N 3.13Å
101	I	58.7	Low	68	Low	76 Å²	76	104.9 Å²	104.9	39%	0.39	59%	0.594	S	S	.	*			trans	-77.3	101	-179.4	-63.2	167.4	0	0	0	107.1	K96 L99 V105	K96-I101 PolarHBondContact O-N 3.42Å; L99-I101 HydrophobicContact CB-CD1 3.54Å; L99-I101 HydrophobicContact CB-CG1 3.54Å; L99-I101 HydrophobicContact CD1-CD1 3.63Å; L99-I101 HydrophobicContact CG-CD1 4.23Å; L99-I101 PolarHBondContact O-N 3.13Å; I101-V105 HydrophobicContact CG2-CG2 4Å
102	D	56.4	Low	65.9	Low	102 Å²	102	106.3 Å²	106.3	55%	0.545	61%	0.609	S	S	.	*			trans	-67	139.2	168.7	-169.3	-5.2	0	0	0	108.8	N100 K104 V105	N100-D102 PolarHBondContact O-N 3.45Å; N100-D102 VanDerWaalsContact O-N 3.13Å; D102-K104 PolarHBondContact O-N 2.96Å; D102-V105 PolarHBondContact O-N 3.2Å
103	D	59.3	Low	64	Low	128 Å²	128	109.2 Å²	109.2	68%	0.684	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	0.4	179.3	-78	-30.5	0	0	0	112.7	K96	K96-D103 IonicContact NZ-OD1 2.74Å; K96-D103 PolarHBondContact NZ-OD1 2.74Å; K96-D103 IonicContact NZ-OD2 3.57Å
104	K	53.2	Low	61.5	Low	168 Å²	168	108.2 Å²	108.2	73%	0.73	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	16.9	175.6	-71.8	-173.4	178.5	176.8	0	115.6	D102 V106	D102-K104 PolarHBondContact O-N 2.96Å; K104-V106 PolarHBondContact O-N 3.1Å
105	V	50.7	Low	59.1	Low	84 Å²	84	108.7 Å²	108.7	51%	0.509	63%	0.632	S	S	.	*			trans	-62.5	98.6	172.9	-177	0	0	0	0	109.6	I101 D102 A107	I101-V105 HydrophobicContact CG2-CG2 4Å; D102-V105 PolarHBondContact O-N 3.2Å; V105-A107 PolarHBondContact O-N 3.45Å
106	V	49.3	Very low	56.7	Low	103 Å²	103	113.8 Å²	113.8	62%	0.624	68%	0.675	S	S	*	*			trans	-58.6	130.7	164.2	-179.4	0	0	0	0	105.9	K104 G108 D109	K104-V106 PolarHBondContact O-N 3.1Å; V106-G108 PolarHBondContact O-N 2.84Å; V106-D109 PolarHBondContact O-N 3.39Å
107	A	53.1	Low	55.4	Low	106 Å²	106	114.9 Å²	114.9	88%	0.876	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-5.4	-176.1	0	0	0	0	0	115.5	V105	V105-A107 PolarHBondContact O-N 3.45Å
108	G	54.7	Low	53.9	Low	65 Å²	65	114.7 Å²	114.7	67%	0.67	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-13.9	174.8	0	0	0	0	0	116.2	V106	V106-G108 PolarHBondContact O-N 2.84Å
109	D	52.4	Low	52.3	Low	126 Å²	126	117.1 Å²	117.1	67%	0.674	70%	0.702	S	S	*	*			trans	-113.6	29	-172.7	-69.5	-24.9	0	0	0	113.5	V106 L111	V106-D109 PolarHBondContact O-N 3.39Å; D109-L111 PolarHBondContact O-N 2.78Å
110	A	52.2	Low	51	Low	86 Å²	86	118.4 Å²	118.4	71%	0.711	72%	0.715	S	S	*	*			trans	-58.8	100	175.2	0	0	0	0	0	110.3	S112	A110-S112 PolarHBondContact O-N 3.43Å
111	L	52.2	Low	50.3	Low	159 Å²	159	116.3 Å²	116.3	83%	0.832	71%	0.708	S	S	*	*			trans	-51.8	111	173.5	-89.1	151.8	0	0	0	109.4	D109 I113	D109-L111 PolarHBondContact O-N 2.78Å; L111-I113 PolarHBondContact O-N 3.05Å
112	S	50.1	Low	49.8	Very low	99 Å²	99	118.9 Å²	118.9	69%	0.692	73%	0.729	S	S	*	*			trans	-60.5	96.5	163.2	169.4	0	0	0	0	108.8	A110 S114	A110-S112 PolarHBondContact O-N 3.43Å; S112-S114 VanDerWaalsContact C-N 3.34Å; S112-S114 PolarHBondContact O-N 2.99Å; S112-S114 VanDerWaalsContact O-N 3.1Å; S112-S114 PolarHBondContact OG-OG 3.38Å
113	I	49.3	Very low	49.3	Very low	123 Å²	123	120.1 Å²	120.1	63%	0.631	74%	0.742	S	S	*	*			trans	-76	93.6	163.6	-60.5	176.3	0	0	0	106.7	L99 L111 I115	L99-I113 HydrophobicContact CD1-CD1 4.5Å; L111-I113 PolarHBondContact O-N 3.05Å; I113-I115 HydrophobicContact CG2-CG1 4.14Å; I113-I115 PolarHBondContact O-N 2.79Å
114	S	36.9	Very low	48.5	Very low	98 Å²	98	119.5 Å²	119.5	69%	0.685	75%	0.747	S	S	*	*			trans	-79.1	111.9	164.5	-62.4	0	0	0	0	108.4	S112 S116	S112-S114 VanDerWaalsContact C-N 3.34Å; S112-S114 PolarHBondContact O-N 2.99Å; S112-S114 VanDerWaalsContact O-N 3.1Å; S112-S114 PolarHBondContact OG-OG 3.38Å; S114-S116 PolarHBondContact O-N 2.72Å
115	I	38.7	Very low	48.1	Very low	151 Å²	151	115.5 Å²	115.5	77%	0.774	75%	0.748	S	S	*	*			trans	-85.1	103.3	164.4	-58.5	175.4	0	0	0	106.1	I113	I113-I115 HydrophobicContact CG2-CG1 4.14Å; I113-I115 PolarHBondContact O-N 2.79Å
116	S	38	Very low	47.9	Very low	186 Å²	186	118.4 Å²	118.4	100%	1.301	77%	0.77	S	S	*	*			trans	41.3	0	171.6	-56.1	0	0	0	0	117.6	S114	S114-S116 PolarHBondContact O-N 2.72Å

Retrieved 116 of 116 residues in 64.2 ms (Link to these results)

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