Y1845_STAAM Loading...

UPF0342 protein SAV1845

AlphaFold DB (Q2FXA0), UniProt , Accession Q99T33, Species STAAM (Staphylococcus aureus (strain Mu50 / ATCC 700699)), Gene n/a, Length 114 aa.

						>Y1845_STAAM|Q99T33
MAVNLYDYANQLEQALRESEEYKAIKEAFANVKANEESKKLFDEFRETQINFQQKQMQGEEIAEEDLQKAQEQAQAIEKDENISALMNAEQKMSQVFQEINQIIVKPLDEIYAD
					

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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	52.6	Low	87.2	Confident	242 Å²	242	120.1 Å²	120.1	100%	1.192	63%	0.63	S	S	*	*				0	129.9	0	-75.1	-176.4	-98.9	0	0	106.9
2	A	79	Confident	87.9	Confident	101 Å²	101	115.1 Å²	115.1	84%	0.835	60%	0.604	S	S	*	*			trans	-65	139.9	176.7	0	0	0	0	0	109.1	N4	A2-N4 PolarHBondContact O-N 3.45Å
3	V	83.5	Confident	88.5	Confident	102 Å²	102	112.3 Å²	112.3	62%	0.618	59%	0.586	S	S	*	*			trans	-64.2	119.6	172.3	178	0	0	0	0	107.6	L5 Y8	V3-L5 HydrophobicContact CG1-CD2 4.42Å; V3-Y8 HydrophobicContact CG1-CD2 4.16Å; V3-Y8 HydrophobicContact CG1-CE2 3.53Å
4	N	91.1	Very high	89.1	Confident	69 Å²	69	112.1 Å²	112.1	37%	0.369	58%	0.581	S	S	.	*			trans	-90.9	104.8	175	-179.1	11.1	0	0	0	109.5	A2 Y6 D7 Y8	A2-N4 PolarHBondContact O-N 3.45Å; N4-Y6 PolarHBondContact O-N 3.27Å; N4-Y6 VanDerWaalsContact O-N 3.17Å; N4-Y6 WeakPolarHBondContact OD1-CB 3.45Å; N4-Y6 WeakPolarHBondContact OD1-CD2 3.33Å; N4-Y6 PolarHBondContact OD1-N 3.02Å; N4-D7 WeakPolarHBondContact CB-OD2 3.46Å; N4-D7 PolarHBondContact ND2-OD1 3.18Å; N4-D7 VanDerWaalsContact ND2-OD1 3.09Å; N4-D7 PolarHBondContact ND2-OD2 3.27Å; N4-D7 WeakPolarHBondContact O-CB 3.48Å; N4-D7 PolarHBondContact O-N 3.17Å; N4-Y8 WeakPolarHBondContact O-CD2 3.24Å
5	L	91.1	Very high	89.5	Confident	134 Å²	134	108.3 Å²	108.3	70%	0.702	57%	0.572	S	S	*	*	H	α-helix	trans	-59.5	-27.4	-179.2	-62.4	177.2	0	0	0	112.9	V3 D7 Y8 A9	V3-L5 HydrophobicContact CG1-CD2 4.42Å; L5-D7 VanDerWaalsContact C-N 3.28Å; L5-D7 PolarHBondContact O-N 3.09Å; L5-Y8 PolarHBondContact O-N 3.03Å; L5-A9 PolarHBondContact O-N 3.17Å
6	Y	93.3	Very high	89.9	Confident	177 Å²	177	103.2 Å²	103.2	69%	0.694	55%	0.545	S	S	*	.	H	α-helix	trans	-65.8	-29.9	176.2	-65.2	-71.5	0	0	0	112.8	N4 Y8 A9 N10	N4-Y6 PolarHBondContact O-N 3.27Å; N4-Y6 VanDerWaalsContact O-N 3.17Å; N4-Y6 WeakPolarHBondContact OD1-CB 3.45Å; N4-Y6 WeakPolarHBondContact OD1-CD2 3.33Å; N4-Y6 PolarHBondContact OD1-N 3.02Å; Y6-Y8 VanDerWaalsContact C-N 3.35Å; Y6-A9 PolarHBondContact O-N 3.09Å; Y6-N10 WeakPolarHBondContact O-CB 3.38Å; Y6-N10 VanDerWaalsContact O-CG 3.25Å; Y6-N10 PolarHBondContact O-N 3.38Å; Y6-N10 PolarHBondContact O-ND2 3.27Å; Y6-N10 VanDerWaalsContact O-ND2 3.09Å
7	D	93.5	Very high	90.3	Very high	83 Å²	83	104.8 Å²	104.8	44%	0.444	54%	0.542	S	S	.	.	H	α-helix	trans	-67	-40.3	176.5	-64.9	-17.3	0	0	0	110.5	N4 L5 N10 Q11	N4-D7 WeakPolarHBondContact CB-OD2 3.46Å; N4-D7 PolarHBondContact ND2-OD1 3.18Å; N4-D7 VanDerWaalsContact ND2-OD1 3.09Å; N4-D7 PolarHBondContact ND2-OD2 3.27Å; N4-D7 WeakPolarHBondContact O-CB 3.48Å; N4-D7 PolarHBondContact O-N 3.17Å; L5-D7 VanDerWaalsContact C-N 3.28Å; L5-D7 PolarHBondContact O-N 3.09Å; D7-N10 PolarHBondContact O-N 3.03Å; D7-Q11 WeakPolarHBondContact O-CG 3.48Å; D7-Q11 PolarHBondContact O-N 3.4Å
8	Y	92.5	Very high	90.6	Very high	139 Å²	139	105.4 Å²	105.4	55%	0.545	54%	0.542	S	S	.	.	H	α-helix	trans	-69.6	-38.3	174.8	-68.4	-89.3	0	0	0	112.2	V3 N4 L5 Y6 N10 Q11 L12	V3-Y8 HydrophobicContact CG1-CD2 4.16Å; V3-Y8 HydrophobicContact CG1-CE2 3.53Å; N4-Y8 WeakPolarHBondContact O-CD2 3.24Å; L5-Y8 PolarHBondContact O-N 3.03Å; Y6-Y8 VanDerWaalsContact C-N 3.35Å; Y8-N10 VanDerWaalsContact C-N 3.33Å; Y8-N10 PolarHBondContact O-N 3.48Å; Y8-Q11 PolarHBondContact O-N 3.38Å; Y8-L12 WeakPolarHBondContact O-CB 3.34Å; Y8-L12 PolarHBondContact O-N 2.96Å
9	A	93.5	Very high	90.9	Very high	51 Å²	51	101.1 Å²	101.1	42%	0.421	52%	0.522	S	S	.	.	H	α-helix	trans	-61.4	-41.8	174.4	0	0	0	0	0	111.7	L5 Y6 L12 E13	L5-A9 PolarHBondContact O-N 3.17Å; Y6-A9 PolarHBondContact O-N 3.09Å; A9-L12 PolarHBondContact O-N 3.25Å; A9-E13 WeakPolarHBondContact O-CB 3.37Å; A9-E13 PolarHBondContact O-N 3.16Å
10	N	94.3	Very high	91.2	Very high	104 Å²	104	104 Å²	104	56%	0.556	53%	0.533	S	S	*	.	H	α-helix	trans	-66.8	-38.3	175.3	-70.5	-34.2	0	0	0	112.3	Y6 D7 Y8 E13 Q14	Y6-N10 WeakPolarHBondContact O-CB 3.38Å; Y6-N10 VanDerWaalsContact O-CG 3.25Å; Y6-N10 PolarHBondContact O-N 3.38Å; Y6-N10 PolarHBondContact O-ND2 3.27Å; Y6-N10 VanDerWaalsContact O-ND2 3.09Å; D7-N10 PolarHBondContact O-N 3.03Å; Y8-N10 VanDerWaalsContact C-N 3.33Å; Y8-N10 PolarHBondContact O-N 3.48Å; N10-E13 WeakPolarHBondContact O-CB 3.46Å; N10-E13 PolarHBondContact O-N 3.45Å; N10-Q14 PolarHBondContact O-N 2.95Å
11	Q	95.3	Very high	91.4	Very high	119 Å²	119	102.2 Å²	102.2	56%	0.556	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-41.9	173.9	-73.7	174.6	10.3	0	0	112.1	D7 Y8 E13 Q14 A15	D7-Q11 WeakPolarHBondContact O-CG 3.48Å; D7-Q11 PolarHBondContact O-N 3.4Å; Y8-Q11 PolarHBondContact O-N 3.38Å; Q11-E13 VanDerWaalsContact C-N 3.34Å; Q11-Q14 PolarHBondContact O-N 3.05Å; Q11-A15 WeakPolarHBondContact O-CB 3.5Å; Q11-A15 PolarHBondContact O-N 3.46Å
12	L	95.1	Very high	93.5	Very high	60 Å²	60	94.7 Å²	94.7	31%	0.314	48%	0.481	S	S	.	.	H	α-helix	trans	-62.7	-43	175.3	177.3	63.2	0	0	0	111.1	Y8 A9 Q14 A15 L16 I100	Y8-L12 WeakPolarHBondContact O-CB 3.34Å; Y8-L12 PolarHBondContact O-N 2.96Å; A9-L12 PolarHBondContact O-N 3.25Å; L12-Q14 VanDerWaalsContact C-N 3.34Å; L12-Q14 PolarHBondContact O-N 3.26Å; L12-A15 PolarHBondContact O-N 3.35Å; L12-L16 HydrophobicContact CD1-CD1 4.42Å; L12-L16 HydrophobicContact CD1-CG 4.34Å; L12-L16 HydrophobicContact CG-CD1 4.07Å; L12-L16 HydrophobicContact CG-CG 4.46Å; L12-L16 WeakPolarHBondContact O-CB 3.47Å; L12-L16 VanDerWaalsContact O-CG 3.26Å; L12-L16 WeakPolarHBondContact O-CG 3.48Å; L12-L16 PolarHBondContact O-N 3.17Å; L12-I100 HydrophobicContact CD1-CD1 4.1Å; L12-I100 HydrophobicContact CD2-CG2 3.71Å
13	E	95.6	Very high	94.4	Very high	79 Å²	79	95.2 Å²	95.2	37%	0.369	47%	0.465	S	S	.	.	H	α-helix	trans	-57.8	-45.7	175.4	-172.9	-90.2	-177.4	0	0	112	A9 N10 Q11 L16 R17	A9-E13 WeakPolarHBondContact O-CB 3.37Å; A9-E13 PolarHBondContact O-N 3.16Å; N10-E13 WeakPolarHBondContact O-CB 3.46Å; N10-E13 PolarHBondContact O-N 3.45Å; Q11-E13 VanDerWaalsContact C-N 3.34Å; E13-L16 PolarHBondContact O-N 3.15Å; E13-R17 VanDerWaalsContact CD-NE 3.34Å; E13-R17 WeakPolarHBondContact O-CG 3.26Å; E13-R17 PolarHBondContact O-N 3.34Å; E13-R17 IonicContact OE1-CZ 3.04Å; E13-R17 IonicContact OE1-NE 2.63Å; E13-R17 PolarHBondContact OE1-NE 2.86Å; E13-R17 IonicContact OE1-NH2 2.66Å; E13-R17 PolarHBondContact OE1-NH2 3.38Å; E13-R17 IonicContact OE2-NE 3.56Å
14	Q	96.7	Very high	95.1	Very high	110 Å²	110	92.4 Å²	92.4	51%	0.514	45%	0.452	S	S	.	.	H	α-helix	trans	-63.2	-45.5	176.2	-175.8	179.2	-7.5	0	0	111.4	N10 Q11 L12 L16 R17 E18	N10-Q14 PolarHBondContact O-N 2.95Å; Q11-Q14 PolarHBondContact O-N 3.05Å; L12-Q14 VanDerWaalsContact C-N 3.34Å; L12-Q14 PolarHBondContact O-N 3.26Å; Q14-L16 VanDerWaalsContact C-N 3.29Å; Q14-L16 PolarHBondContact O-N 2.95Å; Q14-R17 WeakPolarHBondContact O-CB 3.42Å; Q14-R17 PolarHBondContact O-N 2.92Å; Q14-R17 VanDerWaalsContact O-N 3.15Å; Q14-E18 PolarHBondContact NE2-OE1 3.39Å; Q14-E18 VanDerWaalsContact NE2-OE1 3.17Å; Q14-E18 PolarHBondContact O-N 2.88Å; Q14-E18 VanDerWaalsContact O-N 3.16Å
15	A	96.1	Very high	95.4	Very high	55 Å²	55	90.7 Å²	90.7	46%	0.455	44%	0.442	S	S	.	.	H	α-helix	trans	-60.6	-39.8	177.9	0	0	0	0	0	111.9	Q11 L12 E18 S19	Q11-A15 WeakPolarHBondContact O-CB 3.5Å; Q11-A15 PolarHBondContact O-N 3.46Å; L12-A15 PolarHBondContact O-N 3.35Å; A15-E18 CarbonylContact O-C 3.57Å; A15-E18 PolarHBondContact O-N 2.76Å; A15-E18 VanDerWaalsContact O-N 3.17Å; A15-S19 PolarHBondContact O-N 3.2Å
16	L	95.6	Very high	95.7	Very high	26 Å²	26	91 Å²	91	14%	0.136	44%	0.438	C	S	.	.	H	α-helix	trans	-62.1	-42.4	174.6	-74.2	166.7	0	0	0	111.6	L12 E13 Q14 E18 S19 Y22 M93 V96 F97 I100	L12-L16 HydrophobicContact CD1-CD1 4.42Å; L12-L16 HydrophobicContact CD1-CG 4.34Å; L12-L16 HydrophobicContact CG-CD1 4.07Å; L12-L16 HydrophobicContact CG-CG 4.46Å; L12-L16 WeakPolarHBondContact O-CB 3.47Å; L12-L16 VanDerWaalsContact O-CG 3.26Å; L12-L16 WeakPolarHBondContact O-CG 3.48Å; L12-L16 PolarHBondContact O-N 3.17Å; E13-L16 PolarHBondContact O-N 3.15Å; Q14-L16 VanDerWaalsContact C-N 3.29Å; Q14-L16 PolarHBondContact O-N 2.95Å; L16-E18 PolarHBondContact O-N 3.31Å; L16-S19 WeakPolarHBondContact O-CB 3.41Å; L16-S19 PolarHBondContact O-N 3.32Å; L16-S19 VanDerWaalsContact O-N 3.1Å; L16-S19 PolarHBondContact O-OG 3.22Å; L16-Y22 WeakPolarHBondContact O-CB 3.45Å; L16-M93 HydrophobicContact CD2-SD 4.27Å; L16-V96 HydrophobicContact CD2-CG1 4.44Å; L16-F97 HydrophobicContact CD1-CE1 3.57Å; L16-F97 HydrophobicContact CD1-CZ 4.11Å; L16-F97 HydrophobicContact CD2-CE1 4.25Å; L16-I100 HydrophobicContact CD2-CD1 4.1Å
17	R	96	Very high	95.9	Very high	131 Å²	131	88.8 Å²	88.8	49%	0.494	43%	0.434	S	S	.	.	H	α-helix	trans	-62.2	-28.4	175.6	-70.3	-177.8	-177.8	-74.3	-6.4	113.3	E13 Q14 Y22	E13-R17 VanDerWaalsContact CD-NE 3.34Å; E13-R17 WeakPolarHBondContact O-CG 3.26Å; E13-R17 PolarHBondContact O-N 3.34Å; E13-R17 IonicContact OE1-CZ 3.04Å; E13-R17 IonicContact OE1-NE 2.63Å; E13-R17 PolarHBondContact OE1-NE 2.86Å; E13-R17 IonicContact OE1-NH2 2.66Å; E13-R17 PolarHBondContact OE1-NH2 3.38Å; E13-R17 IonicContact OE2-NE 3.56Å; Q14-R17 WeakPolarHBondContact O-CB 3.42Å; Q14-R17 PolarHBondContact O-N 2.92Å; Q14-R17 VanDerWaalsContact O-N 3.15Å; R17-Y22 HydrophobicContact CB-CE1 4.5Å; R17-Y22 WeakPolarHBondContact O-CD1 3.47Å
18	E	96.1	Very high	96.1	Very high	116 Å²	116	85.2 Å²	85.2	54%	0.542	42%	0.416	S	S	.	.	H	α-helix	trans	-87.6	-12.9	178.4	-67.2	178.4	-163.5	0	0	112.9	Q14 A15 L16 K23	Q14-E18 PolarHBondContact NE2-OE1 3.39Å; Q14-E18 VanDerWaalsContact NE2-OE1 3.17Å; Q14-E18 PolarHBondContact O-N 2.88Å; Q14-E18 VanDerWaalsContact O-N 3.16Å; A15-E18 CarbonylContact O-C 3.57Å; A15-E18 PolarHBondContact O-N 2.76Å; A15-E18 VanDerWaalsContact O-N 3.17Å; L16-E18 PolarHBondContact O-N 3.31Å; E18-K23 VanDerWaalsContact O-CE 3.32Å; E18-K23 WeakPolarHBondContact O-CE 3.48Å; E18-K23 PolarHBondContact O-NZ 3.17Å
19	S	96.4	Very high	96.3	Very high	22 Å²	22	82.2 Å²	82.2	15%	0.154	41%	0.406	C	S	.	.	S	Bend	trans	-67.4	154.4	-176.9	105.7	0	0	0	0	113.1	A15 L16 E21 Y22 K23	A15-S19 PolarHBondContact O-N 3.2Å; L16-S19 WeakPolarHBondContact O-CB 3.41Å; L16-S19 PolarHBondContact O-N 3.32Å; L16-S19 VanDerWaalsContact O-N 3.1Å; L16-S19 PolarHBondContact O-OG 3.22Å; S19-E21 VanDerWaalsContact C-N 3.32Å; S19-E21 WeakPolarHBondContact CB-OE2 3.32Å; S19-E21 PolarHBondContact OG-N 3.1Å; S19-E21 PolarHBondContact OG-OE2 3Å; S19-Y22 PolarHBondContact OG-N 3.44Å; S19-K23 WeakPolarHBondContact O-CD 3Å; S19-K23 WeakPolarHBondContact O-CG 3.2Å; S19-K23 PolarHBondContact O-N 2.67Å
20	E	96.3	Very high	96.5	Very high	160 Å²	160	82.1 Å²	82.1	75%	0.748	41%	0.406	S	S	*	.	H	α-helix	trans	-67.4	-36.1	177.4	-65.8	-171.6	166.7	0	0	111.3	Y22 K23 A24	E20-Y22 PolarHBondContact O-N 3.17Å; E20-K23 PolarHBondContact O-N 3.49Å; E20-A24 VanDerWaalsContact O-CB 3.3Å; E20-A24 WeakPolarHBondContact O-CB 3.34Å; E20-A24 PolarHBondContact O-N 3.43Å
21	E	96.1	Very high	96.6	Very high	67 Å²	67	80.7 Å²	80.7	31%	0.313	40%	0.398	S	S	.	.	H	α-helix	trans	-62.8	-43.2	178.6	-56.8	78	-169.3	0	0	111.3	S19 A24 I25 M93 V96	S19-E21 VanDerWaalsContact C-N 3.32Å; S19-E21 WeakPolarHBondContact CB-OE2 3.32Å; S19-E21 PolarHBondContact OG-N 3.1Å; S19-E21 PolarHBondContact OG-OE2 3Å; E21-A24 PolarHBondContact O-N 3.03Å; E21-I25 WeakPolarHBondContact O-CG1 3.49Å; E21-I25 PolarHBondContact O-N 2.97Å; E21-I25 VanDerWaalsContact O-N 3.07Å; E21-M93 VanDerWaalsContact C-CE 3.45Å; E21-M93 HydrophobicContact CB-CE 3.45Å; E21-M93 VanDerWaalsContact CB-CE 3.45Å; E21-M93 HydrophobicContact CB-SD 4.24Å; E21-V96 HydrophobicContact CG-CG2 4.1Å
22	Y	97.1	Very high	96.7	Very high	83 Å²	83	75 Å²	75	33%	0.325	37%	0.372	S	S	.	.	H	α-helix	trans	-68.2	-42.4	178.2	178.1	-98.8	0	0	0	111.5	L16 R17 S19 E20 A24 I25 K26 M93	L16-Y22 WeakPolarHBondContact O-CB 3.45Å; R17-Y22 HydrophobicContact CB-CE1 4.5Å; R17-Y22 WeakPolarHBondContact O-CD1 3.47Å; S19-Y22 PolarHBondContact OG-N 3.44Å; E20-Y22 PolarHBondContact O-N 3.17Å; Y22-A24 VanDerWaalsContact C-N 3.31Å; Y22-A24 PolarHBondContact O-N 3.31Å; Y22-I25 PolarHBondContact O-N 3.45Å; Y22-K26 WeakPolarHBondContact O-CB 3.34Å; Y22-K26 PolarHBondContact O-N 3.08Å; Y22-M93 VanDerWaalsContact CA-CE 3.43Å
23	K	97.6	Very high	96.7	Very high	113 Å²	113	77.9 Å²	77.9	49%	0.491	38%	0.381	S	S	.	.	H	α-helix	trans	-61.1	-41.3	175.5	-72	167.3	-179.9	158.3	0	111.2	E18 S19 E20 K26 E27	E18-K23 VanDerWaalsContact O-CE 3.32Å; E18-K23 WeakPolarHBondContact O-CE 3.48Å; E18-K23 PolarHBondContact O-NZ 3.17Å; S19-K23 WeakPolarHBondContact O-CD 3Å; S19-K23 WeakPolarHBondContact O-CG 3.2Å; S19-K23 PolarHBondContact O-N 2.67Å; E20-K23 PolarHBondContact O-N 3.49Å; K23-K26 PolarHBondContact O-N 2.97Å; K23-E27 WeakPolarHBondContact O-CB 3.34Å; K23-E27 PolarHBondContact O-N 3.5Å
24	A	97.2	Very high	96.8	Very high	42 Å²	42	78.3 Å²	78.3	35%	0.347	40%	0.398	S	S	.	.	H	α-helix	trans	-61.8	-43.8	176.7	0	0	0	0	0	112.2	E20 E21 Y22 E27 A28 A89	E20-A24 VanDerWaalsContact O-CB 3.3Å; E20-A24 WeakPolarHBondContact O-CB 3.34Å; E20-A24 PolarHBondContact O-N 3.43Å; E21-A24 PolarHBondContact O-N 3.03Å; Y22-A24 VanDerWaalsContact C-N 3.31Å; Y22-A24 PolarHBondContact O-N 3.31Å; A24-E27 PolarHBondContact O-N 2.81Å; A24-A28 VanDerWaalsContact O-CB 3.29Å; A24-A28 WeakPolarHBondContact O-CB 3.37Å; A24-A28 PolarHBondContact O-N 3.27Å; A24-A89 HydrophobicContact CB-CB 4.28Å
25	I	97.8	Very high	96.8	Very high	33 Å²	33	75.8 Å²	75.8	17%	0.169	39%	0.388	C	S	.	.	H	α-helix	trans	-60.9	-47.5	173.7	-69.1	165.8	0	0	0	110.5	E21 Y22 E27 A28 F29 L86 A89 E90 M93	E21-I25 WeakPolarHBondContact O-CG1 3.49Å; E21-I25 PolarHBondContact O-N 2.97Å; E21-I25 VanDerWaalsContact O-N 3.07Å; Y22-I25 PolarHBondContact O-N 3.45Å; I25-E27 VanDerWaalsContact C-N 3.3Å; I25-E27 PolarHBondContact O-N 2.95Å; I25-A28 PolarHBondContact O-N 3.18Å; I25-F29 VanDerWaalsContact O-CB 3.24Å; I25-F29 WeakPolarHBondContact O-CB 3.42Å; I25-F29 PolarHBondContact O-N 3.1Å; I25-L86 HydrophobicContact CG2-CD1 4.12Å; I25-A89 HydrophobicContact CG1-CB 3.75Å; I25-E90 HydrophobicContact CD1-CG 4.45Å; I25-E90 HydrophobicContact CG1-CG 4.34Å; I25-M93 HydrophobicContact CD1-CB 3.44Å; I25-M93 VanDerWaalsContact CD1-CB 3.44Å; I25-M93 HydrophobicContact CD1-CE 4.1Å; I25-M93 HydrophobicContact CD1-CG 3.73Å
26	K	97.6	Very high	96.8	Very high	142 Å²	142	81.6 Å²	81.6	62%	0.617	41%	0.406	S	S	*	.	H	α-helix	trans	-59.8	-42.4	-178.4	-175	-178.8	177.5	-176.6	0	111.7	Y22 K23 A30	Y22-K26 WeakPolarHBondContact O-CB 3.34Å; Y22-K26 PolarHBondContact O-N 3.08Å; K23-K26 PolarHBondContact O-N 2.97Å; K26-A30 WeakPolarHBondContact O-CB 3.48Å; K26-A30 PolarHBondContact O-N 3.27Å; K26-A30 VanDerWaalsContact O-N 3.1Å
27	E	97.5	Very high	96.7	Very high	130 Å²	130	87.4 Å²	87.4	61%	0.607	43%	0.432	S	S	*	.	H	α-helix	trans	-68.5	-50.1	177.6	-176	174.3	-173	0	0	111.8	K23 A24 I25 F29 A30 N31	K23-E27 WeakPolarHBondContact O-CB 3.34Å; K23-E27 PolarHBondContact O-N 3.5Å; A24-E27 PolarHBondContact O-N 2.81Å; I25-E27 VanDerWaalsContact C-N 3.3Å; I25-E27 PolarHBondContact O-N 2.95Å; E27-F29 VanDerWaalsContact C-N 3.28Å; E27-F29 PolarHBondContact O-N 3.23Å; E27-A30 WeakPolarHBondContact O-CA 3.39Å; E27-A30 WeakPolarHBondContact O-CB 3.44Å; E27-A30 PolarHBondContact O-N 3.08Å; E27-N31 PolarHBondContact O-N 3.44Å
28	A	97.2	Very high	96.7	Very high	8 Å²	8	81.1 Å²	81.1	7%	0.066	41%	0.409	C	S	.	.	H	α-helix	trans	-59.5	-40.8	178.8	0	0	0	0	0	111.8	A24 I25 A30 N31 V32 A85 L86	A24-A28 VanDerWaalsContact O-CB 3.29Å; A24-A28 WeakPolarHBondContact O-CB 3.37Å; A24-A28 PolarHBondContact O-N 3.27Å; I25-A28 PolarHBondContact O-N 3.18Å; A28-A30 VanDerWaalsContact C-N 3.34Å; A28-A30 PolarHBondContact O-N 3.47Å; A28-N31 WeakPolarHBondContact O-CB 3.4Å; A28-N31 PolarHBondContact O-N 3.49Å; A28-V32 WeakPolarHBondContact O-CG2 3.46Å; A28-V32 PolarHBondContact O-N 3.34Å; A28-A85 HydrophobicContact CB-CB 4.48Å; A28-L86 HydrophobicContact CB-CB 3.93Å; A28-L86 HydrophobicContact CB-CD1 4.15Å
29	F	96.5	Very high	96.7	Very high	75 Å²	75	80.3 Å²	80.3	33%	0.329	40%	0.403	S	S	.	.	H	α-helix	trans	-67	-34.4	175.7	-173	-130.2	0	0	0	112.8	I25 E27 N31 K33 F42 L86	I25-F29 VanDerWaalsContact O-CB 3.24Å; I25-F29 WeakPolarHBondContact O-CB 3.42Å; I25-F29 PolarHBondContact O-N 3.1Å; E27-F29 VanDerWaalsContact C-N 3.28Å; E27-F29 PolarHBondContact O-N 3.23Å; F29-N31 VanDerWaalsContact C-N 3.34Å; F29-K33 HydrophobicContact CD1-CD 4.28Å; F29-K33 HydrophobicContact CE1-CD 4.07Å; F29-K33 HydrophobicContact CZ-CD 4.25Å; F29-K33 WeakPolarHBondContact O-CB 3.33Å; F29-K33 WeakPolarHBondContact O-CG 3.25Å; F29-K33 PolarHBondContact O-N 2.66Å; F29-F42 HydrophobicContact CE2-CE1 4.09Å; F29-F42 HydrophobicContact CE2-CZ 4.42Å; F29-L86 HydrophobicContact CB-CD1 3.95Å; F29-L86 HydrophobicContact CB-CD2 4.45Å; F29-L86 HydrophobicContact CD2-CD2 3.86Å
30	A	97.8	Very high	96.7	Very high	50 Å²	50	85.6 Å²	85.6	41%	0.413	42%	0.424	S	S	.	.	H	α-helix	trans	-64.9	-39.9	172.6	0	0	0	0	0	111.4	K26 E27 A28 K33 A34	K26-A30 WeakPolarHBondContact O-CB 3.48Å; K26-A30 PolarHBondContact O-N 3.27Å; K26-A30 VanDerWaalsContact O-N 3.1Å; E27-A30 WeakPolarHBondContact O-CA 3.39Å; E27-A30 WeakPolarHBondContact O-CB 3.44Å; E27-A30 PolarHBondContact O-N 3.08Å; A28-A30 VanDerWaalsContact C-N 3.34Å; A28-A30 PolarHBondContact O-N 3.47Å; A30-K33 PolarHBondContact O-N 2.63Å; A30-A34 WeakPolarHBondContact O-CB 3.43Å; A30-A34 PolarHBondContact O-N 3.24Å
31	N	97.5	Very high	96.6	Very high	73 Å²	73	79.2 Å²	79.2	39%	0.39	40%	0.395	S	S	.	.	H	α-helix	trans	-64.2	-44.6	176.2	-66.4	-22.8	0	0	0	111.9	E27 A28 F29 K33 A34 N35	E27-N31 PolarHBondContact O-N 3.44Å; A28-N31 WeakPolarHBondContact O-CB 3.4Å; A28-N31 PolarHBondContact O-N 3.49Å; F29-N31 VanDerWaalsContact C-N 3.34Å; N31-K33 VanDerWaalsContact C-N 3.3Å; N31-K33 PolarHBondContact O-N 2.9Å; N31-A34 PolarHBondContact O-N 3.35Å; N31-N35 PolarHBondContact O-N 3.33Å
32	V	97.1	Very high	96.5	Very high	1 Å²	1	77.2 Å²	77.2	1%	0.006	39%	0.385	C	S	.	.	H	α-helix	trans	-57	-45.4	172.9	172.3	0	0	0	0	110.8	A28 A34 N35 K39 F42 N82 I83 L86	A28-V32 WeakPolarHBondContact O-CG2 3.46Å; A28-V32 PolarHBondContact O-N 3.34Å; V32-A34 VanDerWaalsContact C-N 3.32Å; V32-A34 PolarHBondContact O-N 2.98Å; V32-N35 PolarHBondContact O-N 3.47Å; V32-K39 PolarHBondContact O-N 2.98Å; V32-F42 HydrophobicContact CG1-CB 3.93Å; V32-F42 HydrophobicContact CG1-CG 4.14Å; V32-N82 HydrophobicContact CG2-CB 3.83Å; V32-N82 WeakPolarHBondContact CG2-O 3.2Å; V32-I83 HydrophobicContact CG1-CG1 4.38Å; V32-I83 HydrophobicContact CG2-CG1 4.06Å; V32-L86 HydrophobicContact CG2-CB 4.22Å; V32-L86 HydrophobicContact CG2-CD2 4.05Å
33	K	95.6	Very high	96.4	Very high	120 Å²	120	77.2 Å²	77.2	52%	0.522	39%	0.39	S	S	.	.	H	α-helix	trans	-68	-29.3	179.7	-78.4	179.9	169.5	175.8	0	114.2	F29 A30 N31 N35	F29-K33 HydrophobicContact CD1-CD 4.28Å; F29-K33 HydrophobicContact CE1-CD 4.07Å; F29-K33 HydrophobicContact CZ-CD 4.25Å; F29-K33 WeakPolarHBondContact O-CB 3.33Å; F29-K33 WeakPolarHBondContact O-CG 3.25Å; F29-K33 PolarHBondContact O-N 2.66Å; A30-K33 PolarHBondContact O-N 2.63Å; N31-K33 VanDerWaalsContact C-N 3.3Å; N31-K33 PolarHBondContact O-N 2.9Å; K33-N35 VanDerWaalsContact C-N 3.33Å
34	A	97.1	Very high	96.2	Very high	87 Å²	87	75.4 Å²	75.4	72%	0.719	38%	0.384	S	S	*	.	H	α-helix	trans	-77.7	-20.8	180	0	0	0	0	0	112.4	A30 N31 V32	A30-A34 WeakPolarHBondContact O-CB 3.43Å; A30-A34 PolarHBondContact O-N 3.24Å; N31-A34 PolarHBondContact O-N 3.35Å; V32-A34 VanDerWaalsContact C-N 3.32Å; V32-A34 PolarHBondContact O-N 2.98Å
35	N	96.3	Very high	95.9	Very high	58 Å²	58	74.6 Å²	74.6	31%	0.31	37%	0.372	S	S	.	.			trans	-101.2	118.4	176.4	-176.2	-52.8	0	0	0	110.6	N31 V32 K33 E37 S38 K39	N31-N35 PolarHBondContact O-N 3.33Å; V32-N35 PolarHBondContact O-N 3.47Å; K33-N35 VanDerWaalsContact C-N 3.33Å; N35-E37 VanDerWaalsContact C-N 3.34Å; N35-E37 PolarHBondContact O-N 3.48Å; N35-E37 WeakPolarHBondContact OD1-CA 3.48Å; N35-E37 WeakPolarHBondContact OD1-CB 3.28Å; N35-E37 PolarHBondContact OD1-N 3.4Å; N35-S38 VanDerWaalsContact CG-OG 3.25Å; N35-S38 PolarHBondContact O-N 3.42Å; N35-S38 PolarHBondContact OD1-N 2.83Å; N35-S38 PolarHBondContact OD1-OG 3.07Å; N35-K39 WeakPolarHBondContact O-CB 3.29Å; N35-K39 PolarHBondContact O-N 3.3Å
36	E	95.5	Very high	95.5	Very high	176 Å²	176	77.1 Å²	77.1	82%	0.822	38%	0.38	S	S	*	.	H	α-helix	trans	-63.3	-36.9	-177.2	-65.7	-173.6	164.1	0	0	113.4	K40	E36-K40 VanDerWaalsContact O-CB 3.32Å; E36-K40 WeakPolarHBondContact O-CB 3.36Å; E36-K40 PolarHBondContact O-N 3.28Å
37	E	94.6	Very high	95.3	Very high	148 Å²	148	77 Å²	77	69%	0.692	38%	0.382	S	S	*	.	H	α-helix	trans	-69.7	-50.8	178.6	-176.1	174.9	-169.2	0	0	110.8	N35 K39 K40 L41	N35-E37 VanDerWaalsContact C-N 3.34Å; N35-E37 PolarHBondContact O-N 3.48Å; N35-E37 WeakPolarHBondContact OD1-CA 3.48Å; N35-E37 WeakPolarHBondContact OD1-CB 3.28Å; N35-E37 PolarHBondContact OD1-N 3.4Å; E37-K39 VanDerWaalsContact C-N 3.31Å; E37-K39 PolarHBondContact O-N 3.35Å; E37-K40 PolarHBondContact O-N 2.88Å; E37-L41 WeakPolarHBondContact O-CB 3.44Å; E37-L41 PolarHBondContact O-N 3.24Å
38	S	96.3	Very high	95	Very high	0 Å²	0	72 Å²	72	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.7	-43.1	177.1	-52.7	0	0	0	0	111.2	N35 L41 F42 D80 N82 I83	N35-S38 VanDerWaalsContact CG-OG 3.25Å; N35-S38 PolarHBondContact O-N 3.42Å; N35-S38 PolarHBondContact OD1-N 2.83Å; N35-S38 PolarHBondContact OD1-OG 3.07Å; S38-L41 PolarHBondContact O-N 3.2Å; S38-F42 VanDerWaalsContact O-CB 3.25Å; S38-F42 WeakPolarHBondContact O-CB 3.23Å; S38-F42 PolarHBondContact O-N 2.91Å; S38-D80 WeakPolarHBondContact CA-OD2 3.3Å; S38-D80 VanDerWaalsContact CB-OD2 3.28Å; S38-D80 WeakPolarHBondContact CB-OD2 3.48Å; S38-D80 VanDerWaalsContact OG-CG 3.25Å; S38-D80 PolarHBondContact OG-OD1 3.46Å; S38-D80 VanDerWaalsContact OG-OD1 3.11Å; S38-D80 PolarHBondContact OG-OD2 2.96Å; S38-N82 PolarHBondContact OG-ND2 3.09Å; S38-I83 VanDerWaalsContact O-CD1 3.3Å; S38-I83 WeakPolarHBondContact O-CD1 3.45Å
39	K	96.3	Very high	94.6	Very high	99 Å²	99	76 Å²	76	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-60.7	-48.9	176.6	-178	-176.9	173.1	-168.6	0	111.6	V32 N35 E37 L41 F42 D43	V32-K39 PolarHBondContact O-N 2.98Å; N35-K39 WeakPolarHBondContact O-CB 3.29Å; N35-K39 PolarHBondContact O-N 3.3Å; E37-K39 VanDerWaalsContact C-N 3.31Å; E37-K39 PolarHBondContact O-N 3.35Å; K39-L41 VanDerWaalsContact C-N 3.34Å; K39-L41 PolarHBondContact O-N 3.34Å; K39-F42 PolarHBondContact O-N 2.93Å; K39-D43 WeakPolarHBondContact O-CB 3.43Å; K39-D43 VanDerWaalsContact O-CG 3.29Å; K39-D43 PolarHBondContact O-N 2.96Å
40	K	95.7	Very high	94.4	Very high	133 Å²	133	76.7 Å²	76.7	58%	0.578	38%	0.383	S	S	*	.	H	α-helix	trans	-59.4	-47.9	-180	179	-179.5	167.7	-175.2	0	110.8	E36 E37 F42 D43 E44	E36-K40 VanDerWaalsContact O-CB 3.32Å; E36-K40 WeakPolarHBondContact O-CB 3.36Å; E36-K40 PolarHBondContact O-N 3.28Å; E37-K40 PolarHBondContact O-N 2.88Å; K40-F42 VanDerWaalsContact C-N 3.34Å; K40-F42 PolarHBondContact O-N 3Å; K40-D43 PolarHBondContact O-N 3.44Å; K40-E44 WeakPolarHBondContact CE-OE1 3.44Å; K40-E44 IonicContact NZ-OE1 3.99Å; K40-E44 WeakPolarHBondContact O-CB 3.39Å; K40-E44 WeakPolarHBondContact O-CG 3.39Å; K40-E44 PolarHBondContact O-N 3.32Å
41	L	94.6	Very high	94.1	Very high	26 Å²	26	77.5 Å²	77.5	14%	0.136	38%	0.381	C	S	.	.	H	α-helix	trans	-62.6	-41.5	179.4	177.4	60.7	0	0	0	112	E37 S38 K39 F45 A76 I77 D80 I83	E37-L41 WeakPolarHBondContact O-CB 3.44Å; E37-L41 PolarHBondContact O-N 3.24Å; S38-L41 PolarHBondContact O-N 3.2Å; K39-L41 VanDerWaalsContact C-N 3.34Å; K39-L41 PolarHBondContact O-N 3.34Å; L41-F45 WeakPolarHBondContact O-CB 3.43Å; L41-F45 PolarHBondContact O-N 3.05Å; L41-F45 VanDerWaalsContact O-N 3.11Å; L41-A76 HydrophobicContact CD1-CB 3.75Å; L41-A76 HydrophobicContact CD2-CB 3.89Å; L41-A76 HydrophobicContact CG-CB 4.48Å; L41-I77 HydrophobicContact CD1-CG1 4.08Å; L41-I77 HydrophobicContact CD2-CG1 3.88Å; L41-I77 HydrophobicContact CG-CD1 4.42Å; L41-I77 HydrophobicContact CG-CG1 3.63Å; L41-D80 HydrophobicContact CD2-CB 4.17Å; L41-I83 HydrophobicContact CB-CD1 3.96Å; L41-I83 HydrophobicContact CD2-CD1 3.74Å; L41-I83 HydrophobicContact CG-CD1 3.81Å
42	F	93.8	Very high	93.8	Very high	25 Å²	25	77.4 Å²	77.4	11%	0.11	38%	0.377	C	S	.	.	H	α-helix	trans	-62.2	-48.3	175.4	-178.7	-98.4	0	0	0	112.1	F29 V32 S38 K39 K40 E44 F45 R46 I83 L86	F29-F42 HydrophobicContact CE2-CE1 4.09Å; F29-F42 HydrophobicContact CE2-CZ 4.42Å; V32-F42 HydrophobicContact CG1-CB 3.93Å; V32-F42 HydrophobicContact CG1-CG 4.14Å; S38-F42 VanDerWaalsContact O-CB 3.25Å; S38-F42 WeakPolarHBondContact O-CB 3.23Å; S38-F42 PolarHBondContact O-N 2.91Å; K39-F42 PolarHBondContact O-N 2.93Å; K40-F42 VanDerWaalsContact C-N 3.34Å; K40-F42 PolarHBondContact O-N 3Å; F42-E44 PolarHBondContact O-N 2.9Å; F42-F45 PolarHBondContact O-N 2.97Å; F42-R46 HydrophobicContact CD1-CG 4.07Å; F42-R46 HydrophobicContact CE1-CG 3.73Å; F42-R46 HydrophobicContact CE2-CG 4.42Å; F42-R46 HydrophobicContact CZ-CG 3.94Å; F42-R46 VanDerWaalsContact O-CG 3.3Å; F42-R46 WeakPolarHBondContact O-CG 3.38Å; F42-R46 PolarHBondContact O-N 3.38Å; F42-I83 HydrophobicContact CB-CD1 4.1Å; F42-I83 HydrophobicContact CB-CG1 4.37Å; F42-I83 HydrophobicContact CD2-CG2 4Å; F42-L86 HydrophobicContact CD2-CD2 4.3Å; F42-L86 HydrophobicContact CE2-CD2 3.74Å; F42-L86 HydrophobicContact CZ-CD2 4.13Å
43	D	94	Very high	93.4	Very high	83 Å²	83	83.1 Å²	83.1	44%	0.444	40%	0.403	S	S	.	.	H	α-helix	trans	-61.3	-45	-179.8	-71.8	-20.6	0	0	0	111.1	K39 K40 F45 R46 E47	K39-D43 WeakPolarHBondContact O-CB 3.43Å; K39-D43 VanDerWaalsContact O-CG 3.29Å; K39-D43 PolarHBondContact O-N 2.96Å; K40-D43 PolarHBondContact O-N 3.44Å; D43-F45 VanDerWaalsContact C-N 3.34Å; D43-F45 PolarHBondContact O-N 3.1Å; D43-R46 PolarHBondContact O-N 2.88Å; D43-E47 PolarHBondContact O-N 3.4Å
44	E	93.4	Very high	93.2	Very high	75 Å²	75	82 Å²	82	35%	0.35	40%	0.4	S	S	.	.	H	α-helix	trans	-60.8	-40.1	177	-75.1	-179.9	-172.4	0	0	112.6	K40 F42 T48	K40-E44 WeakPolarHBondContact CE-OE1 3.44Å; K40-E44 IonicContact NZ-OE1 3.99Å; K40-E44 WeakPolarHBondContact O-CB 3.39Å; K40-E44 WeakPolarHBondContact O-CG 3.39Å; K40-E44 PolarHBondContact O-N 3.32Å; F42-E44 PolarHBondContact O-N 2.9Å; E44-T48 PolarHBondContact O-N 3.48Å; E44-T48 VanDerWaalsContact O-N 3.07Å; E44-T48 PolarHBondContact O-OG1 3.31Å; E44-T48 VanDerWaalsContact O-OG1 3.12Å
45	F	91.4	Very high	93	Very high	25 Å²	25	79.6 Å²	79.6	11%	0.11	37%	0.373	C	S	.	.	H	α-helix	trans	-71.2	-37.4	177.1	174.4	-108.9	0	0	0	113.3	L41 F42 D43 E47 T48 Q49 Q73 A74 I77	L41-F45 WeakPolarHBondContact O-CB 3.43Å; L41-F45 PolarHBondContact O-N 3.05Å; L41-F45 VanDerWaalsContact O-N 3.11Å; F42-F45 PolarHBondContact O-N 2.97Å; D43-F45 VanDerWaalsContact C-N 3.34Å; D43-F45 PolarHBondContact O-N 3.1Å; F45-E47 VanDerWaalsContact C-N 3.31Å; F45-T48 PolarHBondContact O-N 2.9Å; F45-Q49 HydrophobicContact CE1-CG 4.21Å; F45-Q49 HydrophobicContact CE2-CG 4.27Å; F45-Q49 HydrophobicContact CZ-CG 4.11Å; F45-Q49 PolarHBondContact O-N 3.31Å; F45-Q73 HydrophobicContact CD2-CB 4.28Å; F45-A74 HydrophobicContact CE2-CB 4.32Å; F45-I77 HydrophobicContact CB-CD1 3.14Å; F45-I77 HydrophobicContact CD1-CD1 3.43Å; F45-I77 VanDerWaalsContact CD1-CD1 3.43Å; F45-I77 HydrophobicContact CD2-CD1 3.64Å; F45-I77 HydrophobicContact CE1-CD1 4.08Å; F45-I77 HydrophobicContact CE2-CD1 4.27Å; F45-I77 HydrophobicContact CG-CD1 3.13Å; F45-I77 HydrophobicContact CZ-CD1 4.44Å
46	R	89.6	Confident	92.7	Very high	86 Å²	86	83.3 Å²	83.3	33%	0.325	39%	0.389	S	S	.	.	H	α-helix	trans	-60.1	-43.9	173.5	-69.3	-71.9	78.6	174.6	1.4	110.8	F42 D43 Q49 I50	F42-R46 HydrophobicContact CD1-CG 4.07Å; F42-R46 HydrophobicContact CE1-CG 3.73Å; F42-R46 HydrophobicContact CE2-CG 4.42Å; F42-R46 HydrophobicContact CZ-CG 3.94Å; F42-R46 VanDerWaalsContact O-CG 3.3Å; F42-R46 WeakPolarHBondContact O-CG 3.38Å; F42-R46 PolarHBondContact O-N 3.38Å; D43-R46 PolarHBondContact O-N 2.88Å; R46-Q49 PolarHBondContact O-N 3.38Å; R46-I50 WeakPolarHBondContact O-CG1 3.29Å; R46-I50 PolarHBondContact O-N 3.07Å
47	E	92.8	Very high	92.5	Very high	140 Å²	140	82.4 Å²	82.4	65%	0.654	39%	0.387	S	S	*	.	H	α-helix	trans	-60.5	-48.5	175.8	-173.1	177.3	-170.6	0	0	111.6	D43 F45 Q49 I50 N51	D43-E47 PolarHBondContact O-N 3.4Å; F45-E47 VanDerWaalsContact C-N 3.31Å; E47-Q49 VanDerWaalsContact C-N 3.34Å; E47-Q49 PolarHBondContact O-N 2.84Å; E47-I50 PolarHBondContact O-N 3.22Å; E47-N51 WeakPolarHBondContact O-CB 3.44Å; E47-N51 PolarHBondContact O-N 3.48Å
48	T	91.9	Very high	92.4	Very high	24 Å²	24	81.3 Å²	81.3	15%	0.147	38%	0.381	C	S	.	.	H	α-helix	trans	-58.9	-43.6	176.7	-61.7	0	0	0	0	111.9	E44 F45 N51 F52 A70 Q73	E44-T48 PolarHBondContact O-N 3.48Å; E44-T48 VanDerWaalsContact O-N 3.07Å; E44-T48 PolarHBondContact O-OG1 3.31Å; E44-T48 VanDerWaalsContact O-OG1 3.12Å; F45-T48 PolarHBondContact O-N 2.9Å; T48-N51 PolarHBondContact O-N 3.02Å; T48-F52 WeakPolarHBondContact O-CB 3.24Å; T48-F52 PolarHBondContact O-N 2.93Å; T48-A70 HydrophobicContact CG2-CB 3.71Å; T48-Q73 PolarHBondContact OG1-NE2 3.28Å; T48-Q73 PolarHBondContact OG1-OE1 3.46Å
49	Q	88.4	Confident	92.1	Very high	91 Å²	91	84.5 Å²	84.5	43%	0.425	42%	0.415	S	S	.	.	H	α-helix	trans	-62.9	-43.5	177.4	-79.4	-154.3	0.2	0	0	113	F45 R46 E47 N51 F52 Q53	F45-Q49 HydrophobicContact CE1-CG 4.21Å; F45-Q49 HydrophobicContact CE2-CG 4.27Å; F45-Q49 HydrophobicContact CZ-CG 4.11Å; F45-Q49 PolarHBondContact O-N 3.31Å; R46-Q49 PolarHBondContact O-N 3.38Å; E47-Q49 VanDerWaalsContact C-N 3.34Å; E47-Q49 PolarHBondContact O-N 2.84Å; Q49-N51 VanDerWaalsContact C-N 3.34Å; Q49-F52 PolarHBondContact O-N 3.42Å; Q49-Q53 WeakPolarHBondContact O-CB 3.34Å; Q49-Q53 PolarHBondContact O-N 3.02Å
50	I	91.7	Very high	91.8	Very high	90 Å²	90	84.7 Å²	84.7	46%	0.462	42%	0.417	S	S	.	.	H	α-helix	trans	-63.5	-44.1	177.9	-68.9	166.3	0	0	0	110.1	R46 E47 F52 Q53 Q54	R46-I50 WeakPolarHBondContact O-CG1 3.29Å; R46-I50 PolarHBondContact O-N 3.07Å; E47-I50 PolarHBondContact O-N 3.22Å; I50-F52 VanDerWaalsContact C-N 3.34Å; I50-F52 PolarHBondContact O-N 3.44Å; I50-Q53 PolarHBondContact O-N 3.13Å; I50-Q54 HydrophobicContact CG2-CG 4.48Å; I50-Q54 VanDerWaalsContact O-CG 3.32Å; I50-Q54 WeakPolarHBondContact O-CG 3.38Å; I50-Q54 PolarHBondContact O-N 3.39Å
51	N	91.6	Very high	91.4	Very high	68 Å²	68	87.3 Å²	87.3	36%	0.364	43%	0.432	S	S	.	.	H	α-helix	trans	-59.8	-45.5	177.1	-174.4	-94.9	0	0	0	111.6	E47 T48 Q49 Q53 Q54 K55	E47-N51 WeakPolarHBondContact O-CB 3.44Å; E47-N51 PolarHBondContact O-N 3.48Å; T48-N51 PolarHBondContact O-N 3.02Å; Q49-N51 VanDerWaalsContact C-N 3.34Å; N51-Q53 PolarHBondContact O-N 3.04Å; N51-Q54 PolarHBondContact O-N 2.95Å; N51-K55 WeakPolarHBondContact O-CG 3.49Å; N51-K55 PolarHBondContact O-N 2.88Å; N51-K55 WeakPolarHBondContact OD1-CE 3.44Å
52	F	91.1	Very high	91	Very high	71 Å²	71	88.6 Å²	88.6	31%	0.311	44%	0.438	S	S	.	.	H	α-helix	trans	-61	-45.1	178.1	-164.2	-88.1	0	0	0	111.7	T48 Q49 I50 Q54 K55 Q56 I62 L67	T48-F52 WeakPolarHBondContact O-CB 3.24Å; T48-F52 PolarHBondContact O-N 2.93Å; Q49-F52 PolarHBondContact O-N 3.42Å; I50-F52 VanDerWaalsContact C-N 3.34Å; I50-F52 PolarHBondContact O-N 3.44Å; F52-Q54 VanDerWaalsContact C-N 3.34Å; F52-Q54 PolarHBondContact O-N 3.21Å; F52-K55 PolarHBondContact O-N 3.2Å; F52-Q56 WeakPolarHBondContact O-CB 3.45Å; F52-Q56 PolarHBondContact O-N 3.27Å; F52-I62 HydrophobicContact CD1-CD1 3.77Å; F52-I62 HydrophobicContact CD2-CD1 3.57Å; F52-I62 HydrophobicContact CD2-CG1 4.2Å; F52-I62 HydrophobicContact CD2-CG2 3.65Å; F52-I62 HydrophobicContact CE1-CD1 3.41Å; F52-I62 VanDerWaalsContact CE1-CD1 3.41Å; F52-I62 HydrophobicContact CE2-CB 4.11Å; F52-I62 HydrophobicContact CE2-CD1 3.23Å; F52-I62 HydrophobicContact CE2-CG1 4.04Å; F52-I62 HydrophobicContact CE2-CG2 3.36Å; F52-I62 HydrophobicContact CG-CD1 3.84Å; F52-I62 HydrophobicContact CZ-CD1 3.13Å; F52-I62 HydrophobicContact CZ-CG1 4.35Å; F52-I62 HydrophobicContact CZ-CG2 4.31Å; F52-L67 HydrophobicContact CE2-CD1 4.37Å
53	Q	89.9	Confident	90.8	Very high	120 Å²	120	89.7 Å²	89.7	56%	0.561	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-41.8	176.1	-174.9	177.7	54.2	0	0	111.7	Q49 I50 N51 Q56 M57	Q49-Q53 WeakPolarHBondContact O-CB 3.34Å; Q49-Q53 PolarHBondContact O-N 3.02Å; I50-Q53 PolarHBondContact O-N 3.13Å; N51-Q53 PolarHBondContact O-N 3.04Å; Q53-Q56 PolarHBondContact O-N 3.41Å; Q53-M57 HydrophobicContact CG-SD 4.46Å; Q53-M57 WeakPolarHBondContact O-CG 3.17Å; Q53-M57 PolarHBondContact O-N 2.89Å
54	Q	92.2	Very high	90.5	Very high	96 Å²	96	93.6 Å²	93.6	45%	0.449	47%	0.467	S	S	.	.	H	α-helix	trans	-63.7	-45.8	177.3	-74.2	175.3	-1.7	0	0	112.2	I50 N51 F52 Q56 M57 Q58	I50-Q54 HydrophobicContact CG2-CG 4.48Å; I50-Q54 VanDerWaalsContact O-CG 3.32Å; I50-Q54 WeakPolarHBondContact O-CG 3.38Å; I50-Q54 PolarHBondContact O-N 3.39Å; N51-Q54 PolarHBondContact O-N 2.95Å; F52-Q54 VanDerWaalsContact C-N 3.34Å; F52-Q54 PolarHBondContact O-N 3.21Å; Q54-Q56 VanDerWaalsContact C-N 3.33Å; Q54-Q56 PolarHBondContact O-N 3.04Å; Q54-M57 PolarHBondContact O-N 3.46Å; Q54-Q58 VanDerWaalsContact O-CG 3.31Å; Q54-Q58 WeakPolarHBondContact O-CG 3.39Å; Q54-Q58 PolarHBondContact O-N 2.96Å
55	K	92.5	Very high	90.3	Very high	37 Å²	37	97.6 Å²	97.6	16%	0.161	49%	0.486	C	S	.	.	H	α-helix	trans	-59.4	-44.5	176.1	-73.2	-176.7	175.5	-178.7	0	111.6	N51 F52 M57 Q58 G59 E60 I62 D66	N51-K55 WeakPolarHBondContact O-CG 3.49Å; N51-K55 PolarHBondContact O-N 2.88Å; N51-K55 WeakPolarHBondContact OD1-CE 3.44Å; F52-K55 PolarHBondContact O-N 3.2Å; K55-M57 VanDerWaalsContact C-N 3.34Å; K55-M57 PolarHBondContact O-N 3.31Å; K55-Q58 PolarHBondContact O-N 3.47Å; K55-Q58 VanDerWaalsContact O-N 3.15Å; K55-G59 PolarHBondContact O-N 2.83Å; K55-E60 HydrophobicContact CB-CB 4.23Å; K55-E60 HydrophobicContact CG-CB 4.48Å; K55-E60 PolarHBondContact O-N 2.98Å; K55-I62 HydrophobicContact CB-CG1 4.18Å; K55-D66 IonicContact NZ-OD1 2.6Å; K55-D66 IonicContact NZ-OD2 3.92Å; K55-D66 PolarHBondContact NZ-OD2 2.98Å
56	Q	89	Confident	90.2	Very high	136 Å²	136	98.8 Å²	98.8	64%	0.636	49%	0.493	S	S	*	.	H	α-helix	trans	-61.1	-41.5	176.1	-169	-176.5	11.5	0	0	112.1	F52 Q53 Q54 Q58 G59	F52-Q56 WeakPolarHBondContact O-CB 3.45Å; F52-Q56 PolarHBondContact O-N 3.27Å; Q53-Q56 PolarHBondContact O-N 3.41Å; Q54-Q56 VanDerWaalsContact C-N 3.33Å; Q54-Q56 PolarHBondContact O-N 3.04Å; Q56-Q58 VanDerWaalsContact C-N 3.31Å; Q56-Q58 PolarHBondContact O-N 3.09Å; Q56-G59 PolarHBondContact O-N 3.14Å
57	M	91.2	Very high	90.2	Very high	157 Å²	157	98.2 Å²	98.2	77%	0.773	50%	0.496	S	S	*	.	H	α-helix	trans	-65.6	-32.9	175.8	-74.2	179.6	67.5	0	0	113.1	Q53 Q54 K55 G59	Q53-M57 HydrophobicContact CG-SD 4.46Å; Q53-M57 WeakPolarHBondContact O-CG 3.17Å; Q53-M57 PolarHBondContact O-N 2.89Å; Q54-M57 PolarHBondContact O-N 3.46Å; K55-M57 VanDerWaalsContact C-N 3.34Å; K55-M57 PolarHBondContact O-N 3.31Å; M57-G59 VanDerWaalsContact C-N 3.28Å
58	Q	92.5	Very high	90.2	Very high	125 Å²	125	96.4 Å²	96.4	58%	0.584	49%	0.488	S	S	*	.	H	α-helix	trans	-81.3	-9	178.3	-67.9	173.9	26.6	0	0	112.8	Q54 K55 Q56 E60	Q54-Q58 VanDerWaalsContact O-CG 3.31Å; Q54-Q58 WeakPolarHBondContact O-CG 3.39Å; Q54-Q58 PolarHBondContact O-N 2.96Å; K55-Q58 PolarHBondContact O-N 3.47Å; K55-Q58 VanDerWaalsContact O-N 3.15Å; Q56-Q58 VanDerWaalsContact C-N 3.31Å; Q56-Q58 PolarHBondContact O-N 3.09Å; Q58-E60 HydrophobicContact CB-CG 3.97Å; Q58-E60 PolarHBondContact O-N 3.07Å; Q58-E60 PolarHBondContact OE1-OE1 3.39Å
59	G	90.8	Very high	90.1	Very high	68 Å²	68	100.7 Å²	100.7	70%	0.701	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	19.9	-173.5	0	0	0	0	0	112.9	K55 Q56 M57	K55-G59 PolarHBondContact O-N 2.83Å; Q56-G59 PolarHBondContact O-N 3.14Å; M57-G59 VanDerWaalsContact C-N 3.28Å
60	E	89.6	Confident	90.2	Very high	102 Å²	102	97.3 Å²	97.3	48%	0.477	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-76.5	138.4	174.5	-66.1	-171.7	169.2	0	0	110	K55 Q58 I62	K55-E60 HydrophobicContact CB-CB 4.23Å; K55-E60 HydrophobicContact CG-CB 4.48Å; K55-E60 PolarHBondContact O-N 2.98Å; Q58-E60 HydrophobicContact CB-CG 3.97Å; Q58-E60 PolarHBondContact O-N 3.07Å; Q58-E60 PolarHBondContact OE1-OE1 3.39Å; E60-I62 PolarHBondContact O-N 3.42Å
61	E	88.1	Confident	90.2	Very high	189 Å²	189	98 Å²	98	88%	0.883	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-66.2	130.9	169.4	-73	-175.3	174.5	0	0	109.5	A63	E61-A63 PolarHBondContact O-N 2.82Å
62	I	85.9	Confident	90.3	Very high	52 Å²	52	100 Å²	100	27%	0.267	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-80.3	119.3	176.2	-60.6	164.5	0	0	0	106.2	F52 K55 E60 D66	F52-I62 HydrophobicContact CD1-CD1 3.77Å; F52-I62 HydrophobicContact CD2-CD1 3.57Å; F52-I62 HydrophobicContact CD2-CG1 4.2Å; F52-I62 HydrophobicContact CD2-CG2 3.65Å; F52-I62 HydrophobicContact CE1-CD1 3.41Å; F52-I62 VanDerWaalsContact CE1-CD1 3.41Å; F52-I62 HydrophobicContact CE2-CB 4.11Å; F52-I62 HydrophobicContact CE2-CD1 3.23Å; F52-I62 HydrophobicContact CE2-CG1 4.04Å; F52-I62 HydrophobicContact CE2-CG2 3.36Å; F52-I62 HydrophobicContact CG-CD1 3.84Å; F52-I62 HydrophobicContact CZ-CD1 3.13Å; F52-I62 HydrophobicContact CZ-CG1 4.35Å; F52-I62 HydrophobicContact CZ-CG2 4.31Å; K55-I62 HydrophobicContact CB-CG1 4.18Å; E60-I62 PolarHBondContact O-N 3.42Å; I62-D66 HydrophobicContact CG2-CB 4.1Å
63	A	88.3	Confident	90.3	Very high	48 Å²	48	97.2 Å²	97.2	40%	0.397	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-61.6	147.3	180	0	0	0	0	0	110.9	E61 E65 D66 L67	E61-A63 PolarHBondContact O-N 2.82Å; A63-E65 PolarHBondContact O-N 2.85Å; A63-D66 WeakPolarHBondContact O-CB 3.47Å; A63-D66 PolarHBondContact O-N 3.21Å; A63-L67 PolarHBondContact O-N 2.93Å; A63-L67 VanDerWaalsContact O-N 3.07Å
64	E	89.5	Confident	90.3	Very high	165 Å²	165	93 Å²	93	77%	0.771	47%	0.474	S	S	*	.	H	α-helix	trans	-57.7	-36.3	177.1	-171.3	174.9	-175.3	0	0	111.7	D66 L67 Q68	E64-D66 PolarHBondContact O-N 3.36Å; E64-L67 PolarHBondContact O-N 3.31Å; E64-Q68 WeakPolarHBondContact O-CB 3.37Å; E64-Q68 PolarHBondContact O-N 2.92Å
65	E	89.1	Confident	90.4	Very high	159 Å²	159	93.3 Å²	93.3	74%	0.743	48%	0.476	S	S	*	.	H	α-helix	trans	-61.1	-40.9	175.2	-64.4	-175.7	171.3	0	0	112.5	A63 Q68 K69	A63-E65 PolarHBondContact O-N 2.85Å; E65-Q68 PolarHBondContact O-N 3.35Å; E65-K69 WeakPolarHBondContact O-CB 3.5Å; E65-K69 PolarHBondContact O-N 2.9Å
66	D	88	Confident	90.4	Very high	50 Å²	50	93.5 Å²	93.5	27%	0.267	48%	0.484	S	S	.	.	H	α-helix	trans	-68.4	-40.5	177.3	-67.6	-42.5	0	0	0	111	K55 I62 A63 E64 K69 A70	K55-D66 IonicContact NZ-OD1 2.6Å; K55-D66 IonicContact NZ-OD2 3.92Å; K55-D66 PolarHBondContact NZ-OD2 2.98Å; I62-D66 HydrophobicContact CG2-CB 4.1Å; A63-D66 WeakPolarHBondContact O-CB 3.47Å; A63-D66 PolarHBondContact O-N 3.21Å; E64-D66 PolarHBondContact O-N 3.36Å; D66-K69 PolarHBondContact O-N 3.4Å; D66-A70 WeakPolarHBondContact O-CB 3.49Å; D66-A70 PolarHBondContact O-N 3.11Å
67	L	89.9	Confident	90.6	Very high	75 Å²	75	87 Å²	87	39%	0.393	45%	0.454	S	S	.	.	H	α-helix	trans	-62.9	-45.1	176.3	-177.1	66.4	0	0	0	110.9	F52 A63 E64 A70 Q71	F52-L67 HydrophobicContact CE2-CD1 4.37Å; A63-L67 PolarHBondContact O-N 2.93Å; A63-L67 VanDerWaalsContact O-N 3.07Å; E64-L67 PolarHBondContact O-N 3.31Å; L67-A70 PolarHBondContact O-N 3.03Å; L67-Q71 VanDerWaalsContact O-CG 3.32Å; L67-Q71 WeakPolarHBondContact O-CG 3.47Å; L67-Q71 PolarHBondContact O-N 3.49Å
68	Q	92.3	Very high	90.6	Very high	102 Å²	102	86 Å²	86	48%	0.477	45%	0.447	S	S	.	.	H	α-helix	trans	-61.9	-47.2	177.2	-176.8	179.3	-9.5	0	0	111	E64 E65 A70 Q71 E72	E64-Q68 WeakPolarHBondContact O-CB 3.37Å; E64-Q68 PolarHBondContact O-N 2.92Å; E65-Q68 PolarHBondContact O-N 3.35Å; Q68-A70 VanDerWaalsContact C-N 3.31Å; Q68-A70 PolarHBondContact O-N 3.47Å; Q68-Q71 WeakPolarHBondContact O-CB 3.47Å; Q68-Q71 PolarHBondContact O-N 3.41Å; Q68-Q71 VanDerWaalsContact O-N 3.15Å; Q68-E72 PolarHBondContact NE2-OE1 3.21Å; Q68-E72 WeakPolarHBondContact O-CG 3.4Å; Q68-E72 PolarHBondContact O-N 3.46Å
69	K	90.8	Very high	90.7	Very high	113 Å²	113	87.9 Å²	87.9	49%	0.491	45%	0.453	S	S	.	.	H	α-helix	trans	-58.5	-43.7	176.7	-174.6	-176.3	177	-170.7	0	111.7	E65 D66 Q71 E72 Q73	E65-K69 WeakPolarHBondContact O-CB 3.5Å; E65-K69 PolarHBondContact O-N 2.9Å; D66-K69 PolarHBondContact O-N 3.4Å; K69-Q71 VanDerWaalsContact C-N 3.34Å; K69-Q71 PolarHBondContact O-N 2.89Å; K69-E72 PolarHBondContact O-N 3.39Å; K69-Q73 WeakPolarHBondContact O-CB 3.45Å; K69-Q73 WeakPolarHBondContact O-CG 3.33Å; K69-Q73 PolarHBondContact O-N 2.61Å
70	A	90.5	Very high	90.9	Very high	21 Å²	21	85.7 Å²	85.7	17%	0.174	43%	0.426	C	S	.	.	H	α-helix	trans	-62.7	-39.9	177	0	0	0	0	0	112.1	T48 D66 L67 Q68 A74	T48-A70 HydrophobicContact CG2-CB 3.71Å; D66-A70 WeakPolarHBondContact O-CB 3.49Å; D66-A70 PolarHBondContact O-N 3.11Å; L67-A70 PolarHBondContact O-N 3.03Å; Q68-A70 VanDerWaalsContact C-N 3.31Å; Q68-A70 PolarHBondContact O-N 3.47Å; A70-A74 WeakPolarHBondContact O-CB 3.4Å; A70-A74 PolarHBondContact O-N 2.9Å
71	Q	91.3	Very high	91.2	Very high	104 Å²	104	89 Å²	89	49%	0.486	44%	0.441	S	S	.	.	H	α-helix	trans	-65.2	-43.5	175.7	-73.6	175.3	-1.8	0	0	112.3	L67 Q68 K69 A74 Q75	L67-Q71 VanDerWaalsContact O-CG 3.32Å; L67-Q71 WeakPolarHBondContact O-CG 3.47Å; L67-Q71 PolarHBondContact O-N 3.49Å; Q68-Q71 WeakPolarHBondContact O-CB 3.47Å; Q68-Q71 PolarHBondContact O-N 3.41Å; Q68-Q71 VanDerWaalsContact O-N 3.15Å; K69-Q71 VanDerWaalsContact C-N 3.34Å; K69-Q71 PolarHBondContact O-N 2.89Å; Q71-A74 PolarHBondContact O-N 3.29Å; Q71-Q75 WeakPolarHBondContact O-CG 3.42Å; Q71-Q75 PolarHBondContact O-N 2.94Å
72	E	93.4	Very high	91.6	Very high	109 Å²	109	82 Å²	82	51%	0.509	41%	0.41	S	S	.	.	H	α-helix	trans	-62.5	-43.8	176.4	-72.4	176	-170.4	0	0	111.5	Q68 K69 Q75 A76	Q68-E72 PolarHBondContact NE2-OE1 3.21Å; Q68-E72 WeakPolarHBondContact O-CG 3.4Å; Q68-E72 PolarHBondContact O-N 3.46Å; K69-E72 PolarHBondContact O-N 3.39Å; E72-Q75 PolarHBondContact O-N 2.91Å; E72-A76 WeakPolarHBondContact O-CB 3.42Å; E72-A76 PolarHBondContact O-N 3.31Å
73	Q	92	Very high	92	Very high	14 Å²	14	79.6 Å²	79.6	7%	0.065	40%	0.398	C	S	.	.	H	α-helix	trans	-62.3	-43.4	174.7	-73.4	177.1	-31.7	0	0	112.1	F45 T48 K69 Q75 A76 I77	F45-Q73 HydrophobicContact CD2-CB 4.28Å; T48-Q73 PolarHBondContact OG1-NE2 3.28Å; T48-Q73 PolarHBondContact OG1-OE1 3.46Å; K69-Q73 WeakPolarHBondContact O-CB 3.45Å; K69-Q73 WeakPolarHBondContact O-CG 3.33Å; K69-Q73 PolarHBondContact O-N 2.61Å; Q73-Q75 VanDerWaalsContact C-N 3.34Å; Q73-Q75 PolarHBondContact O-N 3.06Å; Q73-A76 PolarHBondContact O-N 3.12Å; Q73-I77 WeakPolarHBondContact O-CB 3.21Å; Q73-I77 WeakPolarHBondContact O-CG1 3.47Å; Q73-I77 PolarHBondContact O-N 3.47Å
74	A	90.2	Very high	92.3	Very high	31 Å²	31	79 Å²	79	26%	0.256	39%	0.391	S	S	.	.	H	α-helix	trans	-59.9	-44.2	176.9	0	0	0	0	0	111.6	F45 A70 Q71 I77 E78	F45-A74 HydrophobicContact CE2-CB 4.32Å; A70-A74 WeakPolarHBondContact O-CB 3.4Å; A70-A74 PolarHBondContact O-N 2.9Å; Q71-A74 PolarHBondContact O-N 3.29Å; A74-I77 WeakPolarHBondContact O-CB 3.39Å; A74-I77 PolarHBondContact O-N 3.04Å; A74-E78 WeakPolarHBondContact O-CG 3.25Å; A74-E78 PolarHBondContact O-N 3.02Å
75	Q	93.4	Very high	92.6	Very high	103 Å²	103	73.4 Å²	73.4	48%	0.481	37%	0.372	S	S	.	.	H	α-helix	trans	-65.7	-38.4	176.3	-71.3	177.3	33.1	0	0	113.1	Q71 E72 Q73 I77 K79	Q71-Q75 WeakPolarHBondContact O-CG 3.42Å; Q71-Q75 PolarHBondContact O-N 2.94Å; E72-Q75 PolarHBondContact O-N 2.91Å; Q73-Q75 VanDerWaalsContact C-N 3.34Å; Q73-Q75 PolarHBondContact O-N 3.06Å; Q75-I77 VanDerWaalsContact C-N 3.29Å; Q75-K79 WeakPolarHBondContact O-CG 3.41Å; Q75-K79 PolarHBondContact O-N 3.36Å
76	A	93.5	Very high	93	Very high	40 Å²	40	65.9 Å²	65.9	33%	0.331	34%	0.337	S	S	.	.	H	α-helix	trans	-63	-41.5	175.1	0	0	0	0	0	110.5	L41 E72 Q73 K79 D80	L41-A76 HydrophobicContact CD1-CB 3.75Å; L41-A76 HydrophobicContact CD2-CB 3.89Å; L41-A76 HydrophobicContact CG-CB 4.48Å; E72-A76 WeakPolarHBondContact O-CB 3.42Å; E72-A76 PolarHBondContact O-N 3.31Å; Q73-A76 PolarHBondContact O-N 3.12Å; A76-K79 PolarHBondContact O-N 2.95Å; A76-D80 PolarHBondContact O-N 3.23Å; A76-D80 VanDerWaalsContact O-N 3.12Å
77	I	91.8	Very high	93.2	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-44.7	177.4	-80.6	173.2	0	0	0	112.3	L41 F45 Q73 A74 Q75 K79 D80 I83 M87	L41-I77 HydrophobicContact CD1-CG1 4.08Å; L41-I77 HydrophobicContact CD2-CG1 3.88Å; L41-I77 HydrophobicContact CG-CD1 4.42Å; L41-I77 HydrophobicContact CG-CG1 3.63Å; F45-I77 HydrophobicContact CB-CD1 3.14Å; F45-I77 HydrophobicContact CD1-CD1 3.43Å; F45-I77 VanDerWaalsContact CD1-CD1 3.43Å; F45-I77 HydrophobicContact CD2-CD1 3.64Å; F45-I77 HydrophobicContact CE1-CD1 4.08Å; F45-I77 HydrophobicContact CE2-CD1 4.27Å; F45-I77 HydrophobicContact CG-CD1 3.13Å; F45-I77 HydrophobicContact CZ-CD1 4.44Å; Q73-I77 WeakPolarHBondContact O-CB 3.21Å; Q73-I77 WeakPolarHBondContact O-CG1 3.47Å; Q73-I77 PolarHBondContact O-N 3.47Å; A74-I77 WeakPolarHBondContact O-CB 3.39Å; A74-I77 PolarHBondContact O-N 3.04Å; Q75-I77 VanDerWaalsContact C-N 3.29Å; I77-K79 PolarHBondContact O-N 3.29Å; I77-D80 PolarHBondContact O-N 3.41Å; I77-I83 HydrophobicContact CB-CG2 4.31Å; I77-I83 HydrophobicContact CG1-CD1 3.86Å; I77-I83 HydrophobicContact CG1-CG2 4.19Å; I77-I83 HydrophobicContact CG2-CB 4.11Å; I77-I83 HydrophobicContact CG2-CG2 3.42Å; I77-I83 VanDerWaalsContact CG2-CG2 3.42Å; I77-M87 HydrophobicContact CG2-SD 3.29Å; I77-M87 WeakPolarHBondContact CG2-SD 3.3Å
78	E	91.1	Very high	93.5	Very high	135 Å²	135	67.3 Å²	67.3	63%	0.631	34%	0.344	S	S	*	.	H	α-helix	trans	-60	-29.6	177.9	-76.9	180	178.5	0	0	112.4	A74	A74-E78 WeakPolarHBondContact O-CG 3.25Å; A74-E78 PolarHBondContact O-N 3.02Å
79	K	94.3	Very high	93.7	Very high	164 Å²	164	62.9 Å²	62.9	71%	0.713	33%	0.325	S	S	*	.	H	α-helix	trans	-83.2	-20	176.9	-68.6	171.3	-174.3	170.1	0	113.5	Q75 A76 I77 E81	Q75-K79 WeakPolarHBondContact O-CG 3.41Å; Q75-K79 PolarHBondContact O-N 3.36Å; A76-K79 PolarHBondContact O-N 2.95Å; I77-K79 PolarHBondContact O-N 3.29Å; K79-E81 PolarHBondContact O-N 3.02Å
80	D	95.5	Very high	93.9	Very high	23 Å²	23	61.5 Å²	61.5	12%	0.123	32%	0.32	C	S	.	.			trans	-80.1	114.7	176.1	-175.4	-67	0	0	0	109.7	S38 L41 A76 I77 N82 I83 S84	S38-D80 WeakPolarHBondContact CA-OD2 3.3Å; S38-D80 VanDerWaalsContact CB-OD2 3.28Å; S38-D80 WeakPolarHBondContact CB-OD2 3.48Å; S38-D80 VanDerWaalsContact OG-CG 3.25Å; S38-D80 PolarHBondContact OG-OD1 3.46Å; S38-D80 VanDerWaalsContact OG-OD1 3.11Å; S38-D80 PolarHBondContact OG-OD2 2.96Å; L41-D80 HydrophobicContact CD2-CB 4.17Å; A76-D80 PolarHBondContact O-N 3.23Å; A76-D80 VanDerWaalsContact O-N 3.12Å; I77-D80 PolarHBondContact O-N 3.41Å; D80-N82 VanDerWaalsContact C-N 3.28Å; D80-N82 PolarHBondContact O-N 3Å; D80-N82 WeakPolarHBondContact OD1-CA 3.46Å; D80-N82 WeakPolarHBondContact OD1-CB 3.13Å; D80-N82 PolarHBondContact OD1-N 3.35Å; D80-I83 HydrophobicContact CB-CB 4.23Å; D80-I83 HydrophobicContact CB-CD1 3.94Å; D80-I83 HydrophobicContact CB-CG1 4.1Å; D80-I83 PolarHBondContact O-N 2.98Å; D80-I83 WeakPolarHBondContact OD1-CG1 3.39Å; D80-I83 PolarHBondContact OD1-N 3.29Å; D80-S84 WeakPolarHBondContact O-CB 3.28Å; D80-S84 PolarHBondContact O-N 3.11Å
81	E	95.6	Very high	94.2	Very high	170 Å²	170	66.8 Å²	66.8	79%	0.794	34%	0.341	S	S	*	.	H	α-helix	trans	-62	-34	-176.4	-65.2	-174.7	166.6	0	0	112.9	K79 A85	K79-E81 PolarHBondContact O-N 3.02Å; E81-A85 WeakPolarHBondContact O-CB 3.44Å; E81-A85 PolarHBondContact O-N 3.49Å
82	N	96.4	Very high	94.4	Very high	44 Å²	44	68.3 Å²	68.3	24%	0.235	35%	0.346	C	S	.	.	H	α-helix	trans	-71.2	-45.4	-179.8	-61	-54.8	0	0	0	110.7	V32 S38 D80 L86	V32-N82 HydrophobicContact CG2-CB 3.83Å; V32-N82 WeakPolarHBondContact CG2-O 3.2Å; S38-N82 PolarHBondContact OG-ND2 3.09Å; D80-N82 VanDerWaalsContact C-N 3.28Å; D80-N82 PolarHBondContact O-N 3Å; D80-N82 WeakPolarHBondContact OD1-CA 3.46Å; D80-N82 WeakPolarHBondContact OD1-CB 3.13Å; D80-N82 PolarHBondContact OD1-N 3.35Å; N82-L86 PolarHBondContact O-N 3.46Å
83	I	95.5	Very high	94.5	Very high	1 Å²	1	63.7 Å²	63.7	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-72.2	-42.4	-179.6	-52.5	170.8	0	0	0	110.2	V32 S38 L41 F42 I77 D80 A85 L86 M87	V32-I83 HydrophobicContact CG1-CG1 4.38Å; V32-I83 HydrophobicContact CG2-CG1 4.06Å; S38-I83 VanDerWaalsContact O-CD1 3.3Å; S38-I83 WeakPolarHBondContact O-CD1 3.45Å; L41-I83 HydrophobicContact CB-CD1 3.96Å; L41-I83 HydrophobicContact CD2-CD1 3.74Å; L41-I83 HydrophobicContact CG-CD1 3.81Å; F42-I83 HydrophobicContact CB-CD1 4.1Å; F42-I83 HydrophobicContact CB-CG1 4.37Å; F42-I83 HydrophobicContact CD2-CG2 4Å; I77-I83 HydrophobicContact CB-CG2 4.31Å; I77-I83 HydrophobicContact CG1-CD1 3.86Å; I77-I83 HydrophobicContact CG1-CG2 4.19Å; I77-I83 HydrophobicContact CG2-CB 4.11Å; I77-I83 HydrophobicContact CG2-CG2 3.42Å; I77-I83 VanDerWaalsContact CG2-CG2 3.42Å; D80-I83 HydrophobicContact CB-CB 4.23Å; D80-I83 HydrophobicContact CB-CD1 3.94Å; D80-I83 HydrophobicContact CB-CG1 4.1Å; D80-I83 PolarHBondContact O-N 2.98Å; D80-I83 WeakPolarHBondContact OD1-CG1 3.39Å; D80-I83 PolarHBondContact OD1-N 3.29Å; I83-A85 VanDerWaalsContact C-N 3.3Å; I83-A85 PolarHBondContact O-N 3.27Å; I83-L86 WeakPolarHBondContact O-CB 3.46Å; I83-L86 PolarHBondContact O-N 2.96Å; I83-L86 VanDerWaalsContact O-N 3.09Å; I83-M87 HydrophobicContact CG2-CG 4.36Å; I83-M87 HydrophobicContact CG2-SD 4.33Å; I83-M87 WeakPolarHBondContact O-CG 3.29Å; I83-M87 PolarHBondContact O-N 3.47Å
84	S	94.6	Very high	94.8	Very high	36 Å²	36	65.8 Å²	65.8	25%	0.252	34%	0.341	S	S	.	.	H	α-helix	trans	-58.6	-42	174.6	-176.6	0	0	0	0	111.3	D80 L86 M87 N88	D80-S84 WeakPolarHBondContact O-CB 3.28Å; D80-S84 PolarHBondContact O-N 3.11Å; S84-L86 PolarHBondContact O-N 3.01Å; S84-M87 PolarHBondContact O-N 3.36Å; S84-N88 WeakPolarHBondContact O-CB 3.3Å; S84-N88 VanDerWaalsContact O-CG 3.31Å; S84-N88 PolarHBondContact O-N 2.9Å; S84-N88 PolarHBondContact O-ND2 2.92Å
85	A	95.8	Very high	95.1	Very high	47 Å²	47	69.4 Å²	69.4	39%	0.388	35%	0.352	S	S	.	.	H	α-helix	trans	-61.4	-42.2	173.3	0	0	0	0	0	112.5	A28 E81 I83 A89	A28-A85 HydrophobicContact CB-CB 4.48Å; E81-A85 WeakPolarHBondContact O-CB 3.44Å; E81-A85 PolarHBondContact O-N 3.49Å; I83-A85 VanDerWaalsContact C-N 3.3Å; I83-A85 PolarHBondContact O-N 3.27Å; A85-A89 WeakPolarHBondContact O-CB 3.33Å; A85-A89 PolarHBondContact O-N 3.27Å
86	L	96.4	Very high	95.2	Very high	1 Å²	1	66 Å²	66	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-62.1	-49.2	176.1	175.7	60.3	0	0	0	111.7	I25 A28 F29 V32 F42 N82 I83 S84 N88 A89 E90	I25-L86 HydrophobicContact CG2-CD1 4.12Å; A28-L86 HydrophobicContact CB-CB 3.93Å; A28-L86 HydrophobicContact CB-CD1 4.15Å; F29-L86 HydrophobicContact CB-CD1 3.95Å; F29-L86 HydrophobicContact CB-CD2 4.45Å; F29-L86 HydrophobicContact CD2-CD2 3.86Å; V32-L86 HydrophobicContact CG2-CB 4.22Å; V32-L86 HydrophobicContact CG2-CD2 4.05Å; F42-L86 HydrophobicContact CD2-CD2 4.3Å; F42-L86 HydrophobicContact CE2-CD2 3.74Å; F42-L86 HydrophobicContact CZ-CD2 4.13Å; N82-L86 PolarHBondContact O-N 3.46Å; I83-L86 WeakPolarHBondContact O-CB 3.46Å; I83-L86 PolarHBondContact O-N 2.96Å; I83-L86 VanDerWaalsContact O-N 3.09Å; S84-L86 PolarHBondContact O-N 3.01Å; L86-N88 VanDerWaalsContact C-N 3.34Å; L86-N88 PolarHBondContact O-N 3.36Å; L86-A89 WeakPolarHBondContact O-CB 3.42Å; L86-A89 PolarHBondContact O-N 3.34Å; L86-A89 VanDerWaalsContact O-N 3.14Å; L86-E90 HydrophobicContact CD1-CG 4.22Å; L86-E90 WeakPolarHBondContact O-CG 3.5Å; L86-E90 PolarHBondContact O-N 3.45Å
87	M	93	Very high	95.3	Very high	76 Å²	76	69 Å²	69	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-44.1	178.9	-71.8	179.4	64.9	0	0	112	I77 I83 S84 A89 E90 Q91	I77-M87 HydrophobicContact CG2-SD 3.29Å; I77-M87 WeakPolarHBondContact CG2-SD 3.3Å; I83-M87 HydrophobicContact CG2-CG 4.36Å; I83-M87 HydrophobicContact CG2-SD 4.33Å; I83-M87 WeakPolarHBondContact O-CG 3.29Å; I83-M87 PolarHBondContact O-N 3.47Å; S84-M87 PolarHBondContact O-N 3.36Å; M87-A89 VanDerWaalsContact C-N 3.32Å; M87-A89 PolarHBondContact O-N 3.27Å; M87-E90 PolarHBondContact O-N 3.23Å; M87-Q91 WeakPolarHBondContact O-CB 3.35Å; M87-Q91 PolarHBondContact O-N 3.34Å
88	N	95.5	Very high	95.6	Very high	78 Å²	78	74.4 Å²	74.4	42%	0.417	37%	0.37	S	S	.	.	H	α-helix	trans	-62.3	-39.6	176.5	-76.8	-52.1	0	0	0	111.9	S84 L86 Q91 K92	S84-N88 WeakPolarHBondContact O-CB 3.3Å; S84-N88 VanDerWaalsContact O-CG 3.31Å; S84-N88 PolarHBondContact O-N 2.9Å; S84-N88 PolarHBondContact O-ND2 2.92Å; L86-N88 VanDerWaalsContact C-N 3.34Å; L86-N88 PolarHBondContact O-N 3.36Å; N88-Q91 PolarHBondContact O-N 2.93Å; N88-K92 WeakPolarHBondContact O-CG 3.48Å; N88-K92 PolarHBondContact O-N 3.37Å; N88-K92 VanDerWaalsContact O-N 3.13Å
89	A	97	Very high	95.8	Very high	10 Å²	10	72.3 Å²	72.3	8%	0.083	36%	0.36	C	S	.	.	H	α-helix	trans	-66.3	-42.8	176.1	0	0	0	0	0	111.9	A24 I25 A85 L86 M87 K92 M93	A24-A89 HydrophobicContact CB-CB 4.28Å; I25-A89 HydrophobicContact CG1-CB 3.75Å; A85-A89 WeakPolarHBondContact O-CB 3.33Å; A85-A89 PolarHBondContact O-N 3.27Å; L86-A89 WeakPolarHBondContact O-CB 3.42Å; L86-A89 PolarHBondContact O-N 3.34Å; L86-A89 VanDerWaalsContact O-N 3.14Å; M87-A89 VanDerWaalsContact C-N 3.32Å; M87-A89 PolarHBondContact O-N 3.27Å; A89-K92 PolarHBondContact O-N 3.4Å; A89-M93 PolarHBondContact O-N 2.95Å
90	E	95.4	Very high	95.9	Very high	83 Å²	83	66 Å²	66	39%	0.388	33%	0.334	S	S	.	.	H	α-helix	trans	-62.3	-40.9	174.6	-71.8	-174.9	152.4	0	0	112.2	I25 L86 M87 M93 S94	I25-E90 HydrophobicContact CD1-CG 4.45Å; I25-E90 HydrophobicContact CG1-CG 4.34Å; L86-E90 HydrophobicContact CD1-CG 4.22Å; L86-E90 WeakPolarHBondContact O-CG 3.5Å; L86-E90 PolarHBondContact O-N 3.45Å; M87-E90 PolarHBondContact O-N 3.23Å; E90-M93 PolarHBondContact O-N 2.63Å; E90-S94 WeakPolarHBondContact O-CB 3.32Å; E90-S94 PolarHBondContact O-N 3.48Å
91	Q	95.9	Very high	95.8	Very high	133 Å²	133	69.3 Å²	69.3	62%	0.621	35%	0.351	S	S	*	.	H	α-helix	trans	-62.1	-45	176.7	-177.3	-179.8	-8.6	0	0	111.8	M87 N88 M93 S94 Q95	M87-Q91 WeakPolarHBondContact O-CB 3.35Å; M87-Q91 PolarHBondContact O-N 3.34Å; N88-Q91 PolarHBondContact O-N 2.93Å; Q91-M93 VanDerWaalsContact C-N 3.32Å; Q91-M93 PolarHBondContact O-N 3.07Å; Q91-S94 WeakPolarHBondContact O-CB 3.44Å; Q91-S94 PolarHBondContact O-N 3.38Å; Q91-Q95 PolarHBondContact O-N 3.47Å
92	K	96.3	Very high	95.8	Very high	136 Å²	136	67.3 Å²	67.3	59%	0.591	34%	0.342	S	S	*	.	H	α-helix	trans	-60.2	-44	176	-71.6	177.7	-176.1	-178.9	0	111.5	N88 A89 S94 Q95 V96	N88-K92 WeakPolarHBondContact O-CG 3.48Å; N88-K92 PolarHBondContact O-N 3.37Å; N88-K92 VanDerWaalsContact O-N 3.13Å; A89-K92 PolarHBondContact O-N 3.4Å; K92-S94 VanDerWaalsContact C-N 3.34Å; K92-S94 PolarHBondContact O-N 3Å; K92-Q95 WeakPolarHBondContact O-CB 3.49Å; K92-Q95 PolarHBondContact O-N 3.41Å; K92-V96 PolarHBondContact O-N 3.12Å
93	M	96.3	Very high	95.7	Very high	11 Å²	11	71.1 Å²	71.1	5%	0.054	36%	0.361	C	S	.	.	H	α-helix	trans	-64.3	-39	176.3	-178.4	60.9	78.8	0	0	112.2	L16 E21 Y22 I25 A89 E90 Q91 Q95 V96 F97	L16-M93 HydrophobicContact CD2-SD 4.27Å; E21-M93 VanDerWaalsContact C-CE 3.45Å; E21-M93 HydrophobicContact CB-CE 3.45Å; E21-M93 VanDerWaalsContact CB-CE 3.45Å; E21-M93 HydrophobicContact CB-SD 4.24Å; Y22-M93 VanDerWaalsContact CA-CE 3.43Å; I25-M93 HydrophobicContact CD1-CB 3.44Å; I25-M93 VanDerWaalsContact CD1-CB 3.44Å; I25-M93 HydrophobicContact CD1-CE 4.1Å; I25-M93 HydrophobicContact CD1-CG 3.73Å; A89-M93 PolarHBondContact O-N 2.95Å; E90-M93 PolarHBondContact O-N 2.63Å; Q91-M93 VanDerWaalsContact C-N 3.32Å; Q91-M93 PolarHBondContact O-N 3.07Å; M93-Q95 VanDerWaalsContact C-N 3.29Å; M93-Q95 PolarHBondContact O-N 3.37Å; M93-V96 PolarHBondContact O-N 2.93Å; M93-F97 HydrophobicContact CG-CD2 3.74Å; M93-F97 HydrophobicContact CG-CE2 3.39Å; M93-F97 HydrophobicContact CG-CZ 4.29Å; M93-F97 VanDerWaalsContact O-CD2 3.23Å; M93-F97 WeakPolarHBondContact O-CD2 3.4Å; M93-F97 PolarHBondContact O-N 2.96Å; M93-F97 HydrophobicContact SD-CD2 4.12Å; M93-F97 HydrophobicContact SD-CE2 3.68Å; M93-F97 HydrophobicContact SD-CZ 4.04Å
94	S	96.5	Very high	95.7	Very high	59 Å²	59	76.1 Å²	76.1	41%	0.413	39%	0.387	S	S	.	.	H	α-helix	trans	-58.6	-42.4	174.2	-173.6	0	0	0	0	111.5	E90 Q91 K92 F97 Q98	E90-S94 WeakPolarHBondContact O-CB 3.32Å; E90-S94 PolarHBondContact O-N 3.48Å; Q91-S94 WeakPolarHBondContact O-CB 3.44Å; Q91-S94 PolarHBondContact O-N 3.38Å; K92-S94 VanDerWaalsContact C-N 3.34Å; K92-S94 PolarHBondContact O-N 3Å; S94-F97 PolarHBondContact O-N 3.26Å; S94-Q98 WeakPolarHBondContact O-CG 3.48Å; S94-Q98 PolarHBondContact O-N 2.91Å
95	Q	96.6	Very high	95.6	Very high	106 Å²	106	76.4 Å²	76.4	50%	0.495	39%	0.387	S	S	.	.	H	α-helix	trans	-61.6	-46.4	174.1	-178.3	179.1	-2.5	0	0	111.8	Q91 K92 M93 F97 Q98 E99	Q91-Q95 PolarHBondContact O-N 3.47Å; K92-Q95 WeakPolarHBondContact O-CB 3.49Å; K92-Q95 PolarHBondContact O-N 3.41Å; M93-Q95 VanDerWaalsContact C-N 3.29Å; M93-Q95 PolarHBondContact O-N 3.37Å; Q95-F97 VanDerWaalsContact C-N 3.29Å; Q95-F97 PolarHBondContact O-N 3.43Å; Q95-Q98 WeakPolarHBondContact O-CB 3.5Å; Q95-Q98 PolarHBondContact O-N 3.38Å; Q95-Q98 VanDerWaalsContact O-N 3.09Å; Q95-E99 WeakPolarHBondContact CG-OE1 3.32Å; Q95-E99 PolarHBondContact NE2-OE1 3.47Å; Q95-E99 WeakPolarHBondContact O-CG 3.32Å; Q95-E99 PolarHBondContact O-N 2.95Å
96	V	96.1	Very high	95.6	Very high	33 Å²	33	79.9 Å²	79.9	20%	0.2	39%	0.393	C	S	.	.	H	α-helix	trans	-57.1	-43.8	175.8	170.1	0	0	0	0	111.1	L16 E21 K92 M93 Q98 E99 I100	L16-V96 HydrophobicContact CD2-CG1 4.44Å; E21-V96 HydrophobicContact CG-CG2 4.1Å; K92-V96 PolarHBondContact O-N 3.12Å; M93-V96 PolarHBondContact O-N 2.93Å; V96-Q98 PolarHBondContact O-N 2.92Å; V96-E99 PolarHBondContact O-N 2.97Å; V96-I100 HydrophobicContact CG1-CD1 3.66Å; V96-I100 HydrophobicContact CG1-CG1 4.4Å; V96-I100 WeakPolarHBondContact O-CB 3.33Å; V96-I100 WeakPolarHBondContact O-CD1 3.36Å; V96-I100 VanDerWaalsContact O-CG1 3.25Å; V96-I100 WeakPolarHBondContact O-CG1 2.89Å; V96-I100 PolarHBondContact O-N 3.42Å
97	F	96.5	Very high	95.4	Very high	102 Å²	102	83.4 Å²	83.4	45%	0.447	42%	0.416	S	S	.	.	H	α-helix	trans	-63.6	-38.1	175.7	-77.9	-55.6	0	0	0	113.3	L16 M93 S94 Q95 N101	L16-F97 HydrophobicContact CD1-CE1 3.57Å; L16-F97 HydrophobicContact CD1-CZ 4.11Å; L16-F97 HydrophobicContact CD2-CE1 4.25Å; M93-F97 HydrophobicContact CG-CD2 3.74Å; M93-F97 HydrophobicContact CG-CE2 3.39Å; M93-F97 HydrophobicContact CG-CZ 4.29Å; M93-F97 VanDerWaalsContact O-CD2 3.23Å; M93-F97 WeakPolarHBondContact O-CD2 3.4Å; M93-F97 PolarHBondContact O-N 2.96Å; M93-F97 HydrophobicContact SD-CD2 4.12Å; M93-F97 HydrophobicContact SD-CE2 3.68Å; M93-F97 HydrophobicContact SD-CZ 4.04Å; S94-F97 PolarHBondContact O-N 3.26Å; Q95-F97 VanDerWaalsContact C-N 3.29Å; Q95-F97 PolarHBondContact O-N 3.43Å; F97-N101 VanDerWaalsContact O-CB 3.29Å; F97-N101 WeakPolarHBondContact O-CB 3.48Å; F97-N101 PolarHBondContact O-N 3.3Å
98	Q	96.6	Very high	95.4	Very high	115 Å²	115	84.4 Å²	84.4	54%	0.537	42%	0.422	S	S	.	.	H	α-helix	trans	-63.5	-44.4	175.6	-72.3	173.2	-4.8	0	0	111.5	S94 Q95 V96 N101 Q102	S94-Q98 WeakPolarHBondContact O-CG 3.48Å; S94-Q98 PolarHBondContact O-N 2.91Å; Q95-Q98 WeakPolarHBondContact O-CB 3.5Å; Q95-Q98 PolarHBondContact O-N 3.38Å; Q95-Q98 VanDerWaalsContact O-N 3.09Å; V96-Q98 PolarHBondContact O-N 2.92Å; Q98-N101 PolarHBondContact O-N 2.98Å; Q98-Q102 WeakPolarHBondContact O-CG 3.46Å; Q98-Q102 PolarHBondContact O-N 3.15Å
99	E	96	Very high	95.2	Very high	91 Å²	91	85.2 Å²	85.2	43%	0.425	43%	0.427	S	S	.	.	H	α-helix	trans	-63.9	-44.7	177.5	-68.8	172.6	-171.3	0	0	111.5	Q95 V96 N101 Q102 I103	Q95-E99 WeakPolarHBondContact CG-OE1 3.32Å; Q95-E99 PolarHBondContact NE2-OE1 3.47Å; Q95-E99 WeakPolarHBondContact O-CG 3.32Å; Q95-E99 PolarHBondContact O-N 2.95Å; V96-E99 PolarHBondContact O-N 2.97Å; E99-N101 VanDerWaalsContact C-N 3.33Å; E99-N101 PolarHBondContact O-N 3.34Å; E99-Q102 PolarHBondContact O-N 2.97Å; E99-I103 WeakPolarHBondContact O-CG1 3.33Å; E99-I103 PolarHBondContact O-N 3.36Å; E99-I103 VanDerWaalsContact O-N 3.08Å
100	I	96	Very high	95.1	Very high	32 Å²	32	89.8 Å²	89.8	16%	0.164	45%	0.446	C	S	.	.	H	α-helix	trans	-58.7	-46.2	173.3	-72	165.1	0	0	0	110.7	L12 L16 V96 Q102 I103 I104	L12-I100 HydrophobicContact CD1-CD1 4.1Å; L12-I100 HydrophobicContact CD2-CG2 3.71Å; L16-I100 HydrophobicContact CD2-CD1 4.1Å; V96-I100 HydrophobicContact CG1-CD1 3.66Å; V96-I100 HydrophobicContact CG1-CG1 4.4Å; V96-I100 WeakPolarHBondContact O-CB 3.33Å; V96-I100 WeakPolarHBondContact O-CD1 3.36Å; V96-I100 VanDerWaalsContact O-CG1 3.25Å; V96-I100 WeakPolarHBondContact O-CG1 2.89Å; V96-I100 PolarHBondContact O-N 3.42Å; I100-Q102 VanDerWaalsContact C-N 3.33Å; I100-Q102 PolarHBondContact O-N 2.92Å; I100-I103 WeakPolarHBondContact O-CB 3.47Å; I100-I103 PolarHBondContact O-N 3.15Å; I100-I104 HydrophobicContact CG2-CD1 3.71Å; I100-I104 HydrophobicContact CG2-CG1 4.41Å; I100-I104 WeakPolarHBondContact O-CG1 3.35Å; I100-I104 PolarHBondContact O-N 2.96Å
101	N	94.8	Very high	95	Very high	91 Å²	91	91.1 Å²	91.1	49%	0.487	46%	0.455	S	S	.	.	H	α-helix	trans	-62.1	-41.5	-179.8	-175.1	72.9	0	0	0	111.6	F97 Q98 E99 I103 I104 V105	F97-N101 VanDerWaalsContact O-CB 3.29Å; F97-N101 WeakPolarHBondContact O-CB 3.48Å; F97-N101 PolarHBondContact O-N 3.3Å; Q98-N101 PolarHBondContact O-N 2.98Å; E99-N101 VanDerWaalsContact C-N 3.33Å; E99-N101 PolarHBondContact O-N 3.34Å; N101-I103 VanDerWaalsContact C-N 3.32Å; N101-I103 PolarHBondContact O-N 3.2Å; N101-I104 PolarHBondContact O-N 3.46Å; N101-V105 WeakPolarHBondContact O-CG2 3.48Å; N101-V105 PolarHBondContact O-N 2.6Å
102	Q	95.4	Very high	94.7	Very high	128 Å²	128	94 Å²	94	60%	0.598	46%	0.462	S	S	*	.	H	α-helix	trans	-58.6	-42.2	174	-73.2	173.9	3.7	0	0	112	Q98 E99 I100 I104 V105 K106	Q98-Q102 WeakPolarHBondContact O-CG 3.46Å; Q98-Q102 PolarHBondContact O-N 3.15Å; E99-Q102 PolarHBondContact O-N 2.97Å; I100-Q102 VanDerWaalsContact C-N 3.33Å; I100-Q102 PolarHBondContact O-N 2.92Å; Q102-I104 VanDerWaalsContact C-N 3.35Å; Q102-I104 PolarHBondContact O-N 3.49Å; Q102-V105 PolarHBondContact O-N 3.43Å; Q102-K106 WeakPolarHBondContact O-CB 3.39Å; Q102-K106 PolarHBondContact O-N 3.47Å
103	I	94.5	Very high	94.1	Very high	125 Å²	125	91.6 Å²	91.6	64%	0.641	47%	0.467	S	S	*	.	H	α-helix	trans	-63	-42.6	175.8	-66.1	165.1	0	0	0	111	E99 I100 N101	E99-I103 WeakPolarHBondContact O-CG1 3.33Å; E99-I103 PolarHBondContact O-N 3.36Å; E99-I103 VanDerWaalsContact O-N 3.08Å; I100-I103 WeakPolarHBondContact O-CB 3.47Å; I100-I103 PolarHBondContact O-N 3.15Å; N101-I103 VanDerWaalsContact C-N 3.32Å; N101-I103 PolarHBondContact O-N 3.2Å
104	I	94	Very high	92.6	Very high	106 Å²	106	100.8 Å²	100.8	54%	0.544	52%	0.517	S	S	.	.	H	α-helix	trans	-65.1	-41.6	-179.1	-69.7	168.5	0	0	0	111.5	I100 N101 Q102 P107	I100-I104 HydrophobicContact CG2-CD1 3.71Å; I100-I104 HydrophobicContact CG2-CG1 4.41Å; I100-I104 WeakPolarHBondContact O-CG1 3.35Å; I100-I104 PolarHBondContact O-N 2.96Å; N101-I104 PolarHBondContact O-N 3.46Å; Q102-I104 VanDerWaalsContact C-N 3.35Å; Q102-I104 PolarHBondContact O-N 3.49Å; I104-P107 WeakPolarHBondContact O-CD 3.5Å
105	V	93.7	Very high	92.5	Very high	41 Å²	41	102.9 Å²	102.9	25%	0.248	52%	0.522	C	S	.	.	H	α-helix	trans	-85.1	-13.7	-177.3	-56.6	0	0	0	0	113.7	N101 Q102 P107 L108 D109	N101-V105 WeakPolarHBondContact O-CG2 3.48Å; N101-V105 PolarHBondContact O-N 2.6Å; Q102-V105 PolarHBondContact O-N 3.43Å; V105-P107 VanDerWaalsContact C-CD 3.43Å; V105-P107 VanDerWaalsContact C-N 3.33Å; V105-P107 VanDerWaalsContact O-N 3.16Å; V105-L108 WeakPolarHBondContact O-CA 3.36Å; V105-L108 VanDerWaalsContact O-CB 3.28Å; V105-L108 WeakPolarHBondContact O-CB 3.47Å; V105-L108 PolarHBondContact O-N 3.07Å; V105-D109 PolarHBondContact O-N 3.47Å; V105-D109 VanDerWaalsContact O-N 3.1Å
106	K	94.6	Very high	92.2	Very high	120 Å²	120	102.7 Å²	102.7	52%	0.522	52%	0.523	S	S	.	.	H	α-helix	trans	-48	-43.3	-178.4	-174.4	179.4	180	-174.2	0	114.7	Q102 L108 D109 E110	Q102-K106 WeakPolarHBondContact O-CB 3.39Å; Q102-K106 PolarHBondContact O-N 3.47Å; K106-L108 PolarHBondContact O-N 2.95Å; K106-D109 PolarHBondContact O-N 3.07Å; K106-E110 VanDerWaalsContact CE-OE1 3.24Å; K106-E110 WeakPolarHBondContact CE-OE1 3.21Å; K106-E110 WeakPolarHBondContact O-CG 3.31Å; K106-E110 PolarHBondContact O-N 2.98Å
107	P	93.5	Very high	92	Very high	75 Å²	75	106.6 Å²	106.6	49%	0.487	54%	0.541	S	S	.	.	H	α-helix	trans	-63.6	-26.1	176.7	-22.6	35.3	0	0	0	113.9	I104 V105 I111	I104-P107 WeakPolarHBondContact O-CD 3.5Å; V105-P107 VanDerWaalsContact C-CD 3.43Å; V105-P107 VanDerWaalsContact C-N 3.33Å; V105-P107 VanDerWaalsContact O-N 3.16Å; P107-I111 WeakPolarHBondContact O-CG1 3.47Å; P107-I111 PolarHBondContact O-N 3.05Å
108	L	93.1	Very high	91.8	Very high	97 Å²	97	106.9 Å²	106.9	51%	0.508	55%	0.547	S	S	.	.	H	α-helix	trans	-76.7	-42.7	173.3	-57.3	178	0	0	0	110.7	V105 K106 E110 I111 Y112	V105-L108 WeakPolarHBondContact O-CA 3.36Å; V105-L108 VanDerWaalsContact O-CB 3.28Å; V105-L108 WeakPolarHBondContact O-CB 3.47Å; V105-L108 PolarHBondContact O-N 3.07Å; K106-L108 PolarHBondContact O-N 2.95Å; L108-E110 PolarHBondContact O-N 3.27Å; L108-I111 HydrophobicContact CD2-CD1 4.46Å; L108-I111 WeakPolarHBondContact O-CB 3.37Å; L108-I111 PolarHBondContact O-N 3.46Å; L108-I111 VanDerWaalsContact O-N 3.08Å; L108-Y112 WeakPolarHBondContact O-CD2 3.32Å; L108-Y112 PolarHBondContact O-N 3.03Å
109	D	91.6	Very high	91.5	Very high	96 Å²	96	106.4 Å²	106.4	51%	0.513	55%	0.547	S	S	.	.	H	α-helix	trans	-58.2	-39	175.1	-66.1	-24.1	0	0	0	111	V105 K106 I111 Y112 A113	V105-D109 PolarHBondContact O-N 3.47Å; V105-D109 VanDerWaalsContact O-N 3.1Å; K106-D109 PolarHBondContact O-N 3.07Å; D109-I111 VanDerWaalsContact C-N 3.33Å; D109-I111 PolarHBondContact O-N 3.26Å; D109-Y112 PolarHBondContact O-N 2.86Å; D109-A113 WeakPolarHBondContact O-CB 3.45Å; D109-A113 PolarHBondContact O-N 3.41Å
110	E	93.4	Very high	91.2	Very high	105 Å²	105	107.4 Å²	107.4	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-62.9	-34.8	175.4	-73.4	172.4	-176.6	0	0	112.8	K106 L108 A113	K106-E110 VanDerWaalsContact CE-OE1 3.24Å; K106-E110 WeakPolarHBondContact CE-OE1 3.21Å; K106-E110 WeakPolarHBondContact O-CG 3.31Å; K106-E110 PolarHBondContact O-N 2.98Å; L108-E110 PolarHBondContact O-N 3.27Å; E110-A113 PolarHBondContact O-N 3.43Å
111	I	93.1	Very high	90.8	Very high	112 Å²	112	112.8 Å²	112.8	57%	0.574	58%	0.583	S	S	*	*	H	α-helix	trans	-68.6	-37.6	176.1	-67.8	165.3	0	0	0	111.6	P107 L108 D109	P107-I111 WeakPolarHBondContact O-CG1 3.47Å; P107-I111 PolarHBondContact O-N 3.05Å; L108-I111 HydrophobicContact CD2-CD1 4.46Å; L108-I111 WeakPolarHBondContact O-CB 3.37Å; L108-I111 PolarHBondContact O-N 3.46Å; L108-I111 VanDerWaalsContact O-N 3.08Å; D109-I111 VanDerWaalsContact C-N 3.33Å; D109-I111 PolarHBondContact O-N 3.26Å
112	Y	89.9	Confident	90.5	Very high	194 Å²	194	114.5 Å²	114.5	76%	0.761	59%	0.591	S	S	*	*	H	α-helix	trans	-86.4	-8.4	-179.8	-68	-68.6	0	0	0	113.7	L108 D109	L108-Y112 WeakPolarHBondContact O-CD2 3.32Å; L108-Y112 PolarHBondContact O-N 3.03Å; D109-Y112 PolarHBondContact O-N 2.86Å
113	A	83.7	Confident	90.1	Very high	85 Å²	85	113.3 Å²	113.3	70%	0.702	59%	0.59	S	S	*	*			trans	-83.4	-15.2	175.9	0	0	0	0	0	113.4	D109 E110	D109-A113 WeakPolarHBondContact O-CB 3.45Å; D109-A113 PolarHBondContact O-N 3.41Å; E110-A113 PolarHBondContact O-N 3.43Å
114	D	66.2	Low	89.7	Confident	204 Å²	204	112.3 Å²	112.3	100%	1.091	59%	0.586	S	S	*	*			trans	-88.5	0	170.6	-76.4	-23.3	0	0	0	111.9

Retrieved 114 of 114 residues in 375 ms (Link to these results)

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