A0A087Y0Z8_POEFO Loading...

Cytochrome b5

AlphaFold DB (A0A3B3U4R3), UniProt , Accession A0A087Y0Z8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 138 aa.

						>A0A087Y0Z8_POEFO|A0A087Y0Z8
MGEKQEKSPEGVKYFRLSEIEEQNSFKSTWIIIHNKVYDVTKFLDEHPGGEEVLREQAGGNATESFEDVGHSTDAREMAASMVIGELHPDDRHKIAKPVETLVTTAKEEASWWSNLIIPSLAAGIVTLMYRIYTADSE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	37.5	Very low	47.2	Very low	238 Å²	238	145.1 Å²	145.1	100%	1.172	77%	0.769	S	S	*	*				0	96.6	0	-101.4	58.6	174.5	0	0	107.1
2	G	41.8	Very low	49.4	Very low	77 Å²	77	137.4 Å²	137.4	79%	0.794	73%	0.732	S	S	*	*			trans	-85	120.3	175.8	0	0	0	0	0	108.9	K4	G2-K4 PolarHBondContact O-N 3.16Å
3	E	48.8	Very low	52.5	Low	190 Å²	190	131.8 Å²	131.8	89%	0.888	70%	0.697	S	S	*	*			trans	-65.1	122.7	-180	-63.3	178.6	110.6	0	0	109.1	Q5	E3-Q5 PolarHBondContact O-N 3.32Å; E3-Q5 VanDerWaalsContact O-N 3.16Å
4	K	42.3	Very low	55.2	Low	198 Å²	198	128.5 Å²	128.5	86%	0.861	67%	0.671	S	S	*	*			trans	-68.9	110.8	-179.1	-73.8	177.5	176	-178.9	0	108.1	G2 E6	G2-K4 PolarHBondContact O-N 3.16Å; K4-E6 PolarHBondContact O-N 3.15Å
5	Q	46.6	Very low	57.7	Low	132 Å²	132	120.2 Å²	120.2	62%	0.617	63%	0.628	S	S	*	*			trans	-64.9	103.2	165.1	-74.8	169.6	12.7	0	0	108.2	E3 K7 K13	E3-Q5 PolarHBondContact O-N 3.32Å; E3-Q5 VanDerWaalsContact O-N 3.16Å; Q5-K7 PolarHBondContact O-N 3.3Å; Q5-K7 VanDerWaalsContact O-N 3.16Å; Q5-K13 VanDerWaalsContact OE1-CE 3.29Å
6	E	49.2	Very low	59.8	Low	172 Å²	172	119.3 Å²	119.3	80%	0.804	61%	0.613	S	S	*	*			trans	-77.8	98.7	-179.9	-154	168.2	101.6	0	0	108.8	K4 S8	K4-E6 PolarHBondContact O-N 3.15Å; E6-S8 PolarHBondContact O-N 3.38Å
7	K	37.8	Very low	61.6	Low	174 Å²	174	113.5 Å²	113.5	76%	0.757	58%	0.583	S	S	*	*			trans	-78.9	105.3	-179	-165.2	179	-175.8	-179	0	109.2	Q5	Q5-K7 PolarHBondContact O-N 3.3Å; Q5-K7 VanDerWaalsContact O-N 3.16Å
8	S	48	Very low	63.1	Low	45 Å²	45	111.1 Å²	111.1	32%	0.315	58%	0.578	S	S	.	*			trans	-70.2	159.2	172.5	-70.4	0	0	0	0	111.6	E6 E10 G11	E6-S8 PolarHBondContact O-N 3.38Å; S8-E10 PolarHBondContact O-N 3.04Å; S8-G11 PolarHBondContact O-N 3.16Å; S8-G11 VanDerWaalsContact O-N 3.15Å
9	P	49.6	Very low	64.6	Low	139 Å²	139	108.6 Å²	108.6	90%	0.903	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	11.3	-157.8	30.1	-34	0	0	0	116.4
10	E	54	Low	65.9	Low	183 Å²	183	103.2 Å²	103.2	86%	0.855	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.6	20.9	169.5	-70.9	-155.3	108.7	0	0	113.8	S8 V12	S8-E10 PolarHBondContact O-N 3.04Å; E10-V12 PolarHBondContact O-N 3.27Å
11	G	63.3	Low	67	Low	48 Å²	48	101.6 Å²	101.6	50%	0.495	53%	0.525	S	S	.	.			trans	72.4	-0.4	170.3	0	0	0	0	0	115.8	S8 K13	S8-G11 PolarHBondContact O-N 3.16Å; S8-G11 VanDerWaalsContact O-N 3.15Å; G11-K13 PolarHBondContact O-N 2.85Å
12	V	73.4	Confident	69.5	Low	53 Å²	53	96.9 Å²	96.9	32%	0.321	50%	0.501	S	S	.	.	P	Polyproline II helix	trans	-71.8	121	171.7	-175	0	0	0	0	109.2	E10 E86	E10-V12 PolarHBondContact O-N 3.27Å; V12-E86 HydrophobicContact CG1-CB 4.1Å; V12-E86 HydrophobicContact CG1-CG 3.72Å
13	K	89.7	Confident	71.8	Confident	64 Å²	64	95.3 Å²	95.3	28%	0.278	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-86.3	134.5	176.4	-174.6	170.9	169.4	-175.4	0	109.5	Q5 G11 F15 G85 E86	Q5-K13 VanDerWaalsContact OE1-CE 3.29Å; G11-K13 PolarHBondContact O-N 2.85Å; K13-F15 HydrophobicContact CB-CE2 4.06Å; K13-F15 HydrophobicContact CB-CZ 4.38Å; K13-F15 HydrophobicContact CD-CE1 3.93Å; K13-F15 HydrophobicContact CD-CE2 3.99Å; K13-F15 HydrophobicContact CD-CZ 3.44Å; K13-F15 VanDerWaalsContact CD-CZ 3.44Å; K13-F15 VanDerWaalsContact CE-CZ 3.42Å; K13-F15 HydrophobicContact CG-CD2 4.45Å; K13-F15 HydrophobicContact CG-CE1 4.32Å; K13-F15 HydrophobicContact CG-CE2 3.85Å; K13-F15 HydrophobicContact CG-CZ 3.81Å; K13-G85 CarbonylContact O-C 3.49Å; K13-G85 WeakPolarHBondContact O-CA 3.28Å; K13-E86 PolarHBondContact O-N 3.04Å
14	Y	91.1	Very high	73.7	Confident	86 Å²	86	90.9 Å²	90.9	34%	0.337	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	137.6	174	-67.6	-74.9	0	0	0	110.9	E86	Y14-E86 VanDerWaalsContact CA-O 3.28Å; Y14-E86 WeakPolarHBondContact CA-O 3.12Å; Y14-E86 HydrophobicContact CD1-CB 4.01Å; Y14-E86 HydrophobicContact CE1-CB 3.9Å
15	F	92.4	Very high	75.8	Confident	4 Å²	4	84.4 Å²	84.4	2%	0.018	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.3	177.4	-64	-84.8	0	0	0	110.2	K13 E19 I20 W30 V37 I84 E86 H88	K13-F15 HydrophobicContact CB-CE2 4.06Å; K13-F15 HydrophobicContact CB-CZ 4.38Å; K13-F15 HydrophobicContact CD-CE1 3.93Å; K13-F15 HydrophobicContact CD-CE2 3.99Å; K13-F15 HydrophobicContact CD-CZ 3.44Å; K13-F15 VanDerWaalsContact CD-CZ 3.44Å; K13-F15 VanDerWaalsContact CE-CZ 3.42Å; K13-F15 HydrophobicContact CG-CD2 4.45Å; K13-F15 HydrophobicContact CG-CE1 4.32Å; K13-F15 HydrophobicContact CG-CE2 3.85Å; K13-F15 HydrophobicContact CG-CZ 3.81Å; F15-E19 WeakPolarHBondContact CD1-OE1 3.4Å; F15-I20 HydrophobicContact CB-CD1 3.92Å; F15-I20 HydrophobicContact CB-CG1 3.92Å; F15-W30 HydrophobicContact CD1-CH2 4.15Å; F15-W30 AromaticContact CD1-CZ3 3.65Å; F15-W30 HydrophobicContact CD1-CZ3 3.65Å; F15-W30 AromaticContact CE1-CH2 3.63Å; F15-W30 HydrophobicContact CE1-CH2 3.63Å; F15-W30 AromaticContact CE1-CZ3 3.6Å; F15-W30 HydrophobicContact CE1-CZ3 3.6Å; F15-W30 HydrophobicContact CG-CZ3 4.31Å; F15-W30 HydrophobicContact CZ-CH2 4.2Å; F15-W30 HydrophobicContact CZ-CZ3 4.26Å; F15-V37 HydrophobicContact CB-CG2 4.32Å; F15-V37 HydrophobicContact CD2-CB 4.24Å; F15-V37 HydrophobicContact CD2-CG1 4.37Å; F15-V37 HydrophobicContact CD2-CG2 4.18Å; F15-I84 HydrophobicContact CE2-CB 4.4Å; F15-I84 HydrophobicContact CE2-CD1 3.95Å; F15-I84 HydrophobicContact CE2-CG1 3.96Å; F15-I84 HydrophobicContact CZ-CD1 3.9Å; F15-I84 HydrophobicContact CZ-CG1 4.32Å; F15-E86 PolarHBondContact N-O 3.15Å; F15-H88 WeakPolarHBondContact O-CB 3.44Å; F15-H88 PolarHBondContact O-N 2.93Å
16	R	92.1	Very high	77.4	Confident	106 Å²	106	84.7 Å²	84.7	40%	0.4	43%	0.434	S	S	.	.			trans	-78.7	154.3	173.9	-71.8	-72.3	-176.1	169.5	-8	109.9	S18 E19 I20 H88 D90 D91	R16-S18 VanDerWaalsContact C-N 3.27Å; R16-S18 PolarHBondContact O-N 3.42Å; R16-E19 PolarHBondContact O-N 3.16Å; R16-I20 WeakPolarHBondContact O-CG1 3.35Å; R16-I20 PolarHBondContact O-N 2.97Å; R16-H88 PolarHBondContact NH2-CE1 3.28Å; R16-H88 PolarHBondContact NH2-NE2 2.84Å; R16-D90 IonicContact CZ-OD2 3.9Å; R16-D90 VanDerWaalsContact NH1-CB 3.33Å; R16-D90 IonicContact NH1-OD2 2.75Å; R16-D90 PolarHBondContact NH1-OD2 3.26Å; R16-D90 IonicContact NH2-OD2 2.74Å; R16-D90 PolarHBondContact NH2-OD2 3.39Å; R16-D91 WeakPolarHBondContact CA-OD2 3.38Å; R16-D91 WeakPolarHBondContact CD-OD2 3.48Å; R16-D91 IonicContact NH1-OD2 3.79Å
17	L	88.9	Confident	79	Confident	20 Å²	20	85.4 Å²	85.4	11%	0.105	44%	0.435	C	S	.	.	H	α-helix	trans	-55.8	-45.9	177.5	-169.4	72.6	0	0	0	111.4	E19 I20 E21 I32 L87 D91 K94 I95	L17-E19 VanDerWaalsContact C-N 3.31Å; L17-E19 PolarHBondContact O-N 3.25Å; L17-I20 WeakPolarHBondContact O-CB 3.4Å; L17-I20 PolarHBondContact O-N 3.15Å; L17-E21 HydrophobicContact CG-CG 4.3Å; L17-E21 WeakPolarHBondContact O-CG 3.12Å; L17-E21 PolarHBondContact O-N 3.03Å; L17-I32 HydrophobicContact CD1-CD1 3.94Å; L17-L87 HydrophobicContact CB-CD1 4.43Å; L17-L87 HydrophobicContact CD1-CD1 4.32Å; L17-D91 HydrophobicContact CB-CB 3.94Å; L17-D91 PolarHBondContact N-OD2 3.3Å; L17-K94 HydrophobicContact CD2-CB 4.17Å; L17-K94 HydrophobicContact CD2-CD 4.19Å; L17-I95 HydrophobicContact CD1-CG2 3.63Å
18	S	89.4	Confident	81.4	Confident	70 Å²	70	79 Å²	79	49%	0.49	41%	0.412	S	S	.	.	H	α-helix	trans	-61.1	-37.2	-178.6	-52.2	0	0	0	0	113.2	R16 I20 E21 E22	R16-S18 VanDerWaalsContact C-N 3.27Å; R16-S18 PolarHBondContact O-N 3.42Å; S18-I20 VanDerWaalsContact C-N 3.31Å; S18-I20 PolarHBondContact O-N 2.88Å; S18-E21 WeakPolarHBondContact CA-OE2 3.42Å; S18-E21 PolarHBondContact O-N 2.68Å; S18-E22 WeakPolarHBondContact O-CG 3.47Å; S18-E22 PolarHBondContact O-N 2.85Å
19	E	90.9	Very high	83.5	Confident	64 Å²	64	76.9 Å²	76.9	30%	0.299	40%	0.397	S	S	.	.	H	α-helix	trans	-67.1	-36.1	176.4	-176.2	179.3	171.6	0	0	111.2	F15 R16 L17 Q23	F15-E19 WeakPolarHBondContact CD1-OE1 3.4Å; R16-E19 PolarHBondContact O-N 3.16Å; L17-E19 VanDerWaalsContact C-N 3.31Å; L17-E19 PolarHBondContact O-N 3.25Å; E19-Q23 WeakPolarHBondContact O-CG 3.5Å
20	I	90.8	Very high	85.7	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-71.7	-41.8	178.1	-59.7	160.2	0	0	0	110.2	F15 R16 L17 S18 E22 Q23 W30 I32 V37 G59 L87	F15-I20 HydrophobicContact CB-CD1 3.92Å; F15-I20 HydrophobicContact CB-CG1 3.92Å; R16-I20 WeakPolarHBondContact O-CG1 3.35Å; R16-I20 PolarHBondContact O-N 2.97Å; L17-I20 WeakPolarHBondContact O-CB 3.4Å; L17-I20 PolarHBondContact O-N 3.15Å; S18-I20 VanDerWaalsContact C-N 3.31Å; S18-I20 PolarHBondContact O-N 2.88Å; I20-E22 PolarHBondContact O-N 2.74Å; I20-Q23 WeakPolarHBondContact O-CA 3.4Å; I20-Q23 WeakPolarHBondContact O-CB 3.46Å; I20-Q23 PolarHBondContact O-N 3.22Å; I20-W30 HydrophobicContact CG1-CE3 4.31Å; I20-W30 HydrophobicContact CG2-CB 4.21Å; I20-I32 HydrophobicContact CD1-CD1 3.79Å; I20-I32 HydrophobicContact CD1-CG1 4.03Å; I20-I32 HydrophobicContact CG2-CD1 4.05Å; I20-I32 HydrophobicContact CG2-CG1 4.02Å; I20-V37 HydrophobicContact CD1-CG1 4.37Å; I20-V37 HydrophobicContact CD1-CG2 3.67Å; I20-V37 HydrophobicContact CG1-CG1 4.28Å; I20-V37 HydrophobicContact CG1-CG2 4.41Å; I20-G59 WeakPolarHBondContact O-CA 3.44Å; I20-L87 HydrophobicContact CD1-CD1 3.48Å; I20-L87 VanDerWaalsContact CD1-CD1 3.48Å
21	E	89.6	Confident	87.6	Confident	70 Å²	70	63.3 Å²	63.3	33%	0.327	32%	0.32	S	S	.	.	H	α-helix	trans	-58.6	-31.7	176.5	-72.2	176.6	112.7	0	0	112.6	L17 S18 Q23 N24 G59 L102	L17-E21 HydrophobicContact CG-CG 4.3Å; L17-E21 WeakPolarHBondContact O-CG 3.12Å; L17-E21 PolarHBondContact O-N 3.03Å; S18-E21 WeakPolarHBondContact CA-OE2 3.42Å; S18-E21 PolarHBondContact O-N 2.68Å; E21-Q23 VanDerWaalsContact C-N 3.27Å; E21-Q23 PolarHBondContact O-N 2.87Å; E21-N24 PolarHBondContact O-ND2 3.04Å; E21-G59 WeakPolarHBondContact CG-O 3.37Å; E21-L102 WeakPolarHBondContact OE1-CD1 3.44Å
22	E	90.5	Very high	89.1	Confident	139 Å²	139	61 Å²	61	65%	0.65	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-20.4	174.1	-70.6	179.1	101.2	0	0	113.2	S18 I20 N24	S18-E22 WeakPolarHBondContact O-CG 3.47Å; S18-E22 PolarHBondContact O-N 2.85Å; I20-E22 PolarHBondContact O-N 2.74Å; E22-N24 VanDerWaalsContact C-N 3.29Å; E22-N24 PolarHBondContact O-N 3.31Å
23	Q	90.3	Very high	90	Very high	45 Å²	45	58.8 Å²	58.8	21%	0.21	28%	0.283	C	S	.	.			trans	-91.4	58.2	178	-52.2	-55.5	-45.1	0	0	111.6	E19 I20 E21 S28 W30	E19-Q23 WeakPolarHBondContact O-CG 3.5Å; I20-Q23 WeakPolarHBondContact O-CA 3.4Å; I20-Q23 WeakPolarHBondContact O-CB 3.46Å; I20-Q23 PolarHBondContact O-N 3.22Å; E21-Q23 VanDerWaalsContact C-N 3.27Å; E21-Q23 PolarHBondContact O-N 2.87Å; Q23-S28 CarbonylContact C-O 3.07Å; Q23-S28 PolarHBondContact OE1-OG 3.41Å; Q23-W30 HydrophobicContact CB-CB 3.95Å; Q23-W30 HydrophobicContact CB-CD2 3.79Å; Q23-W30 HydrophobicContact CB-CE3 4.12Å; Q23-W30 HydrophobicContact CB-CG 3.72Å; Q23-W30 HydrophobicContact CG-CD2 3.54Å; Q23-W30 HydrophobicContact CG-CE3 3.54Å; Q23-W30 HydrophobicContact CG-CG 4.06Å; Q23-W30 HydrophobicContact CG-CH2 4.1Å; Q23-W30 HydrophobicContact CG-CZ2 4.13Å; Q23-W30 HydrophobicContact CG-CZ3 3.82Å; Q23-W30 PolarHBondContact O-N 2.89Å; Q23-W30 VanDerWaalsContact O-N 3.13Å
24	N	88.2	Confident	90	Very high	97 Å²	97	60.5 Å²	60.5	52%	0.519	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	18.1	178.8	68.3	10.4	0	0	0	113.6	E21 E22 A58	E21-N24 PolarHBondContact O-ND2 3.04Å; E22-N24 VanDerWaalsContact C-N 3.29Å; E22-N24 PolarHBondContact O-N 3.31Å; N24-A58 HydrophobicContact CB-CB 4.25Å
25	S	86.1	Confident	90	Very high	62 Å²	62	59.2 Å²	59.2	43%	0.434	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	157.2	-171.6	-73.2	0	0	0	0	111.9	K27 S28 T29	S25-K27 PolarHBondContact O-N 3.36Å; S25-S28 PolarHBondContact N-O 3.24Å; S25-S28 VanDerWaalsContact N-O 3.13Å; S25-S28 CarbonylContact O-C 3.55Å; S25-S28 PolarHBondContact O-N 3.31Å; S25-T29 PolarHBondContact O-OG1 2.75Å
26	F	80.2	Confident	90	Very high	137 Å²	137	62.6 Å²	62.6	60%	0.601	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-26.1	176.4	-72.3	-88.2	0	0	0	115.6
27	K	83.4	Confident	90.1	Very high	188 Å²	188	57.5 Å²	57.5	82%	0.817	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-11.1	-178.4	-64.7	-176.2	179	-178.7	0	113.5	S25 T41	S25-K27 PolarHBondContact O-N 3.36Å; K27-T41 VanDerWaalsContact C-CG2 3.45Å; K27-T41 WeakPolarHBondContact O-CG2 3.44Å
28	S	88	Confident	90.3	Very high	39 Å²	39	57.7 Å²	57.7	27%	0.273	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	98.6	-178	-54.4	0	0	0	0	108.7	Q23 S25 T41	Q23-S28 CarbonylContact C-O 3.07Å; Q23-S28 PolarHBondContact OE1-OG 3.41Å; S25-S28 PolarHBondContact N-O 3.24Å; S25-S28 VanDerWaalsContact N-O 3.13Å; S25-S28 CarbonylContact O-C 3.55Å; S25-S28 PolarHBondContact O-N 3.31Å; S28-T41 WeakPolarHBondContact CA-OG1 3.38Å
29	T	92.6	Very high	90.5	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.006	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	108	177.2	-60.4	0	0	0	0	108.9	S25 V40 T41 L44 A58	S25-T29 PolarHBondContact O-OG1 2.75Å; T29-V40 HydrophobicContact CG2-CG2 3.69Å; T29-V40 WeakPolarHBondContact O-CG2 3.45Å; T29-V40 PolarHBondContact O-N 3.34Å; T29-V40 VanDerWaalsContact O-N 3.08Å; T29-T41 PolarHBondContact N-OG1 3.45Å; T29-L44 HydrophobicContact CG2-CD2 4.09Å; T29-A58 HydrophobicContact CG2-CB 3.65Å
30	W	94.8	Very high	90.6	Very high	31 Å²	31	54.4 Å²	54.4	12%	0.117	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	144.2	175.9	-63.9	-1.6	0	0	0	110.8	F15 I20 Q23 V37 Y38 G59 I84	F15-W30 HydrophobicContact CD1-CH2 4.15Å; F15-W30 AromaticContact CD1-CZ3 3.65Å; F15-W30 HydrophobicContact CD1-CZ3 3.65Å; F15-W30 AromaticContact CE1-CH2 3.63Å; F15-W30 HydrophobicContact CE1-CH2 3.63Å; F15-W30 AromaticContact CE1-CZ3 3.6Å; F15-W30 HydrophobicContact CE1-CZ3 3.6Å; F15-W30 HydrophobicContact CG-CZ3 4.31Å; F15-W30 HydrophobicContact CZ-CH2 4.2Å; F15-W30 HydrophobicContact CZ-CZ3 4.26Å; I20-W30 HydrophobicContact CG1-CE3 4.31Å; I20-W30 HydrophobicContact CG2-CB 4.21Å; Q23-W30 HydrophobicContact CB-CB 3.95Å; Q23-W30 HydrophobicContact CB-CD2 3.79Å; Q23-W30 HydrophobicContact CB-CE3 4.12Å; Q23-W30 HydrophobicContact CB-CG 3.72Å; Q23-W30 HydrophobicContact CG-CD2 3.54Å; Q23-W30 HydrophobicContact CG-CE3 3.54Å; Q23-W30 HydrophobicContact CG-CG 4.06Å; Q23-W30 HydrophobicContact CG-CH2 4.1Å; Q23-W30 HydrophobicContact CG-CZ2 4.13Å; Q23-W30 HydrophobicContact CG-CZ3 3.82Å; Q23-W30 PolarHBondContact O-N 2.89Å; Q23-W30 VanDerWaalsContact O-N 3.13Å; W30-V37 HydrophobicContact CB-CG1 4.38Å; W30-V37 HydrophobicContact CD2-CG1 4.48Å; W30-V37 HydrophobicContact CE3-CG1 4.1Å; W30-Y38 VanDerWaalsContact CA-O 3.3Å; W30-Y38 WeakPolarHBondContact CA-O 3.49Å; W30-G59 PolarHBondContact O-N 3.5Å; W30-I84 HydrophobicContact CD2-CD1 3.59Å; W30-I84 HydrophobicContact CE3-CD1 3.82Å; W30-I84 HydrophobicContact CG-CD1 4.22Å; W30-I84 HydrophobicContact CH2-CD1 3.96Å; W30-I84 HydrophobicContact CZ2-CD1 3.71Å; W30-I84 HydrophobicContact CZ3-CD1 4.01Å
31	I	93.9	Very high	90.6	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.026	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	152.1	178.2	64.3	176.7	0	0	0	110.3	I33 Y38 V40 L54 Q57 A62	I31-I33 HydrophobicContact CD1-CD1 3.83Å; I31-I33 HydrophobicContact CD1-CG1 4.33Å; I31-I33 HydrophobicContact CG1-CD1 4.37Å; I31-Y38 PolarHBondContact N-O 3.48Å; I31-Y38 PolarHBondContact O-N 3.24Å; I31-V40 HydrophobicContact CD1-CG1 3.69Å; I31-V40 HydrophobicContact CD1-CG2 4.28Å; I31-V40 HydrophobicContact CG1-CG1 3.97Å; I31-V40 HydrophobicContact CG1-CG2 4.33Å; I31-V40 HydrophobicContact CG2-CG2 4.2Å; I31-L54 HydrophobicContact CD1-CD2 4.24Å; I31-Q57 HydrophobicContact CG2-CB 4.49Å; I31-A62 HydrophobicContact CB-CB 4.26Å; I31-A62 HydrophobicContact CD1-CB 4.47Å
32	I	93.8	Very high	90.7	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	120.2	178.3	-52.9	162.6	0	0	0	109.3	L17 I20 K36 G60 N61 A62 L87 I95	L17-I32 HydrophobicContact CD1-CD1 3.94Å; I20-I32 HydrophobicContact CD1-CD1 3.79Å; I20-I32 HydrophobicContact CD1-CG1 4.03Å; I20-I32 HydrophobicContact CG2-CD1 4.05Å; I20-I32 HydrophobicContact CG2-CG1 4.02Å; I32-K36 VanDerWaalsContact CA-O 3.29Å; I32-K36 WeakPolarHBondContact CA-O 3.45Å; I32-G60 WeakPolarHBondContact CB-O 3.4Å; I32-G60 PolarHBondContact N-O 2.96Å; I32-N61 WeakPolarHBondContact O-CA 3.37Å; I32-A62 PolarHBondContact O-N 2.86Å; I32-L87 HydrophobicContact CD1-CD1 4.12Å; I32-I95 HydrophobicContact CG2-CD1 4.31Å
33	I	92.7	Very high	90.7	Very high	7 Å²	7	56.7 Å²	56.7	4%	0.036	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.5	173.8	-56.2	166.3	0	0	0	107.8	I31 N35 K36 Y38 A62 T63 F66	I31-I33 HydrophobicContact CD1-CD1 3.83Å; I31-I33 HydrophobicContact CD1-CG1 4.33Å; I31-I33 HydrophobicContact CG1-CD1 4.37Å; I33-N35 VanDerWaalsContact C-N 3.25Å; I33-N35 PolarHBondContact O-N 3.14Å; I33-N35 VanDerWaalsContact O-N 3.16Å; I33-K36 PolarHBondContact N-O 3.04Å; I33-K36 WeakPolarHBondContact O-CB 3.38Å; I33-K36 PolarHBondContact O-N 3.48Å; I33-Y38 HydrophobicContact CB-CD2 4Å; I33-Y38 HydrophobicContact CB-CE2 3.55Å; I33-Y38 HydrophobicContact CD1-CD2 4.21Å; I33-Y38 HydrophobicContact CD1-CE2 4.31Å; I33-Y38 HydrophobicContact CG1-CD2 4.21Å; I33-Y38 HydrophobicContact CG1-CE2 4.23Å; I33-Y38 WeakPolarHBondContact O-CE2 3.38Å; I33-A62 HydrophobicContact CG1-CB 4.28Å; I33-T63 WeakPolarHBondContact CA-OG1 3.45Å; I33-F66 HydrophobicContact CD1-CB 4.37Å; I33-F66 HydrophobicContact CD1-CD2 3.91Å; I33-F66 HydrophobicContact CD1-CE2 4.37Å; I33-F66 HydrophobicContact CD1-CG 4.07Å; I33-F66 HydrophobicContact CG1-CB 4.5Å; I33-F66 HydrophobicContact CG2-CB 4.35Å; I33-F66 HydrophobicContact CG2-CD1 3.89Å; I33-F66 HydrophobicContact CG2-CE1 4.44Å; I33-F66 HydrophobicContact CG2-CG 4.15Å
34	H	90.8	Very high	90.7	Very high	99 Å²	99	54.8 Å²	54.8	46%	0.458	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	43.4	179.5	-63.7	-60.9	0	0	0	113.6	K36 T63 E67	H34-K36 PolarHBondContact O-N 2.88Å; H34-K36 VanDerWaalsContact O-N 3.14Å; H34-T63 WeakPolarHBondContact CE1-CG2 3.46Å; H34-T63 PolarHBondContact N-OG1 2.96Å; H34-T63 WeakPolarHBondContact ND1-CG2 3.35Å; H34-E67 IonicContact CD2-OE1 3.27Å; H34-E67 IonicContact CE1-OE1 3.99Å; H34-E67 IonicContact NE2-OE1 2.83Å; H34-E67 PolarHBondContact NE2-OE1 3.2Å
35	N	90.6	Very high	90.8	Very high	59 Å²	59	57 Å²	57	32%	0.316	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	7.8	-176.2	-47.6	114.7	0	0	0	116.1	I33 L87 I95	I33-N35 VanDerWaalsContact C-N 3.25Å; I33-N35 PolarHBondContact O-N 3.14Å; I33-N35 VanDerWaalsContact O-N 3.16Å; N35-L87 PolarHBondContact O-N 2.83Å; N35-I95 WeakPolarHBondContact ND2-CD1 3.46Å
36	K	92.3	Very high	91	Very high	75 Å²	75	60.7 Å²	60.7	33%	0.326	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	145.7	172.5	-64	178	-178.5	-68.1	0	109.8	I32 I33 H34 Y38 V83 E86	I32-K36 VanDerWaalsContact CA-O 3.29Å; I32-K36 WeakPolarHBondContact CA-O 3.45Å; I33-K36 PolarHBondContact N-O 3.04Å; I33-K36 WeakPolarHBondContact O-CB 3.38Å; I33-K36 PolarHBondContact O-N 3.48Å; H34-K36 PolarHBondContact O-N 2.88Å; H34-K36 VanDerWaalsContact O-N 3.14Å; K36-Y38 HydrophobicContact CB-CD2 4.36Å; K36-Y38 HydrophobicContact CB-CE2 3.51Å; K36-Y38 WeakPolarHBondContact O-CD2 3.49Å; K36-Y38 WeakPolarHBondContact O-CE2 3.37Å; K36-V83 HydrophobicContact CB-CG1 4.47Å; K36-E86 HydrophobicContact CG-CG 4.17Å; K36-E86 IonicContact NZ-OE1 3.64Å; K36-E86 PolarHBondContact NZ-OE1 3.33Å
37	V	93.6	Very high	91.5	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.4	-179	-173.8	0	0	0	0	108.4	F15 I20 W30 I84 G85	F15-V37 HydrophobicContact CB-CG2 4.32Å; F15-V37 HydrophobicContact CD2-CB 4.24Å; F15-V37 HydrophobicContact CD2-CG1 4.37Å; F15-V37 HydrophobicContact CD2-CG2 4.18Å; I20-V37 HydrophobicContact CD1-CG1 4.37Å; I20-V37 HydrophobicContact CD1-CG2 3.67Å; I20-V37 HydrophobicContact CG1-CG1 4.28Å; I20-V37 HydrophobicContact CG1-CG2 4.41Å; W30-V37 HydrophobicContact CB-CG1 4.38Å; W30-V37 HydrophobicContact CD2-CG1 4.48Å; W30-V37 HydrophobicContact CE3-CG1 4.1Å; V37-I84 HydrophobicContact CB-CG1 4.15Å; V37-I84 HydrophobicContact CG1-CD1 3.78Å; V37-I84 HydrophobicContact CG1-CG1 3.86Å; V37-I84 WeakPolarHBondContact O-CG1 3.12Å; V37-I84 PolarHBondContact O-N 3.21Å; V37-G85 PolarHBondContact N-O 2.93Å
38	Y	93.6	Very high	91.9	Very high	24 Å²	24	52.4 Å²	52.4	9%	0.094	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.2	-177.8	-62.5	-103.3	0	0	0	109.4	W30 I31 I33 K36 A79 V83	W30-Y38 VanDerWaalsContact CA-O 3.3Å; W30-Y38 WeakPolarHBondContact CA-O 3.49Å; I31-Y38 PolarHBondContact N-O 3.48Å; I31-Y38 PolarHBondContact O-N 3.24Å; I33-Y38 HydrophobicContact CB-CD2 4Å; I33-Y38 HydrophobicContact CB-CE2 3.55Å; I33-Y38 HydrophobicContact CD1-CD2 4.21Å; I33-Y38 HydrophobicContact CD1-CE2 4.31Å; I33-Y38 HydrophobicContact CG1-CD2 4.21Å; I33-Y38 HydrophobicContact CG1-CE2 4.23Å; I33-Y38 WeakPolarHBondContact O-CE2 3.38Å; K36-Y38 HydrophobicContact CB-CD2 4.36Å; K36-Y38 HydrophobicContact CB-CE2 3.51Å; K36-Y38 WeakPolarHBondContact O-CD2 3.49Å; K36-Y38 WeakPolarHBondContact O-CE2 3.37Å; Y38-A79 HydrophobicContact CD1-CB 4.38Å; Y38-A79 WeakPolarHBondContact CD1-O 3.48Å; Y38-A79 HydrophobicContact CE1-CB 4.07Å; Y38-A79 WeakPolarHBondContact CE1-O 3.21Å; Y38-V83 HydrophobicContact CD1-CG2 3.66Å; Y38-V83 HydrophobicContact CE1-CG2 3.23Å; Y38-V83 HydrophobicContact CE2-CG2 4.31Å; Y38-V83 HydrophobicContact CG-CG2 4.39Å
39	D	93.9	Very high	91.8	Very high	57 Å²	57	53 Å²	53	31%	0.305	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	101.8	169.9	-176.8	-3.1	0	0	0	109.1	T41 M82 I84	D39-T41 WeakPolarHBondContact OD1-CB 3.48Å; D39-T41 PolarHBondContact OD1-N 3.34Å; D39-T41 VanDerWaalsContact OD1-N 3.07Å; D39-T41 PolarHBondContact OD1-OG1 3.43Å; D39-M82 PolarHBondContact N-O 3.41Å; D39-I84 HydrophobicContact CB-CD1 4.21Å; D39-I84 HydrophobicContact CB-CG1 4.45Å; D39-I84 HydrophobicContact CB-CG2 3.6Å
40	V	92.9	Very high	91.8	Very high	7 Å²	7	54.5 Å²	54.5	4%	0.042	29%	0.292	C	S	.	.			trans	-98.2	7.9	-178.7	-62.6	0	0	0	0	112.5	T29 I31 K42 F43 L44 L54	T29-V40 HydrophobicContact CG2-CG2 3.69Å; T29-V40 WeakPolarHBondContact O-CG2 3.45Å; T29-V40 PolarHBondContact O-N 3.34Å; T29-V40 VanDerWaalsContact O-N 3.08Å; I31-V40 HydrophobicContact CD1-CG1 3.69Å; I31-V40 HydrophobicContact CD1-CG2 4.28Å; I31-V40 HydrophobicContact CG1-CG1 3.97Å; I31-V40 HydrophobicContact CG1-CG2 4.33Å; I31-V40 HydrophobicContact CG2-CG2 4.2Å; V40-K42 VanDerWaalsContact C-N 3.26Å; V40-K42 PolarHBondContact O-N 2.89Å; V40-K42 VanDerWaalsContact O-N 3.15Å; V40-F43 HydrophobicContact CB-CB 4.48Å; V40-F43 CarbonylContact O-C 3.04Å; V40-F43 WeakPolarHBondContact O-CA 3.46Å; V40-F43 PolarHBondContact O-N 3.22Å; V40-L44 HydrophobicContact CG2-CD2 4.37Å; V40-L44 PolarHBondContact O-N 3.26Å; V40-L44 VanDerWaalsContact O-N 3.1Å; V40-L54 HydrophobicContact CB-CD1 4.48Å
41	T	91.4	Very high	91.6	Very high	30 Å²	30	56.5 Å²	56.5	18%	0.184	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-43.1	-175.2	-54.2	0	0	0	0	112.9	K27 S28 T29 D39 F43	K27-T41 VanDerWaalsContact C-CG2 3.45Å; K27-T41 WeakPolarHBondContact O-CG2 3.44Å; S28-T41 WeakPolarHBondContact CA-OG1 3.38Å; T29-T41 PolarHBondContact N-OG1 3.45Å; D39-T41 WeakPolarHBondContact OD1-CB 3.48Å; D39-T41 PolarHBondContact OD1-N 3.34Å; D39-T41 VanDerWaalsContact OD1-N 3.07Å; D39-T41 PolarHBondContact OD1-OG1 3.43Å; T41-F43 VanDerWaalsContact C-N 3.33Å
42	K	90.1	Very high	91.5	Very high	188 Å²	188	61.8 Å²	61.8	82%	0.817	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-19.1	179.8	-63.4	-176.9	-177.6	175.3	0	113.2	V40	V40-K42 VanDerWaalsContact C-N 3.26Å; V40-K42 PolarHBondContact O-N 2.89Å; V40-K42 VanDerWaalsContact O-N 3.15Å
43	F	90.9	Very high	91.3	Very high	39 Å²	39	65 Å²	65	17%	0.171	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-5.7	-174.6	-172.8	-112.4	0	0	0	112.8	V40 T41 D45 E46 H47 L54 M82	V40-F43 HydrophobicContact CB-CB 4.48Å; V40-F43 CarbonylContact O-C 3.04Å; V40-F43 WeakPolarHBondContact O-CA 3.46Å; V40-F43 PolarHBondContact O-N 3.22Å; T41-F43 VanDerWaalsContact C-N 3.33Å; F43-D45 PolarHBondContact O-N 2.91Å; F43-E46 HydrophobicContact CD2-CB 3.71Å; F43-E46 HydrophobicContact CE2-CB 3.95Å; F43-E46 CarbonylContact O-C 3.57Å; F43-E46 PolarHBondContact O-N 3.19Å; F43-E46 VanDerWaalsContact O-N 3.1Å; F43-H47 HydrophobicContact CD1-CB 4.13Å; F43-H47 HydrophobicContact CE1-CB 3.82Å; F43-H47 AromaticContact CE1-CD2 3.59Å; F43-H47 HydrophobicContact CZ-CB 4.31Å; F43-H47 WeakPolarHBondContact O-CB 3.43Å; F43-H47 PolarHBondContact O-N 3.24Å; F43-L54 HydrophobicContact CD1-CD1 4.16Å; F43-M82 HydrophobicContact CB-CE 4Å; F43-M82 HydrophobicContact CB-SD 3.95Å; F43-M82 HydrophobicContact CD1-CE 4.45Å; F43-M82 HydrophobicContact CD1-SD 4.42Å; F43-M82 HydrophobicContact CD2-CE 3.64Å; F43-M82 HydrophobicContact CE2-CE 4.23Å; F43-M82 HydrophobicContact CG-CE 3.77Å; F43-M82 HydrophobicContact CG-SD 4.05Å
44	L	90.7	Very high	91.3	Very high	5 Å²	5	65.6 Å²	65.6	3%	0.026	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-53.9	-179.8	-67.4	175.2	0	0	0	112.1	T29 V40 E46 E51 L54 R55	T29-L44 HydrophobicContact CG2-CD2 4.09Å; V40-L44 HydrophobicContact CG2-CD2 4.37Å; V40-L44 PolarHBondContact O-N 3.26Å; V40-L44 VanDerWaalsContact O-N 3.1Å; L44-E46 VanDerWaalsContact C-N 3.33Å; L44-E51 HydrophobicContact CB-CB 3.99Å; L44-E51 WeakPolarHBondContact O-CA 3.29Å; L44-E51 WeakPolarHBondContact O-CB 3.35Å; L44-L54 HydrophobicContact CD2-CB 3.84Å; L44-L54 HydrophobicContact CD2-CD1 4.09Å; L44-R55 HydrophobicContact CD2-CG 4.23Å
45	D	89.9	Confident	91.3	Very high	143 Å²	143	64.6 Å²	64.6	77%	0.765	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-21.2	179.6	-66	-85.7	0	0	0	113.8	F43	F43-D45 PolarHBondContact O-N 2.91Å
46	E	90.6	Very high	91.3	Very high	141 Å²	141	68 Å²	68	66%	0.659	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-9.5	-179.3	-63.6	-168	110.4	0	0	112.5	F43 L44 P48	F43-E46 HydrophobicContact CD2-CB 3.71Å; F43-E46 HydrophobicContact CE2-CB 3.95Å; F43-E46 CarbonylContact O-C 3.57Å; F43-E46 PolarHBondContact O-N 3.19Å; F43-E46 VanDerWaalsContact O-N 3.1Å; L44-E46 VanDerWaalsContact C-N 3.33Å; E46-P48 VanDerWaalsContact O-CD 3.29Å; E46-P48 WeakPolarHBondContact O-CD 3.3Å
47	H	91.8	Very high	91.2	Very high	26 Å²	26	67.1 Å²	67.1	12%	0.12	35%	0.353	C	S	.	.			trans	-70	119.2	-177.9	-176.5	-131.3	0	0	0	111.2	F43 G49 G50 V53 L54	F43-H47 HydrophobicContact CD1-CB 4.13Å; F43-H47 HydrophobicContact CE1-CB 3.82Å; F43-H47 AromaticContact CE1-CD2 3.59Å; F43-H47 HydrophobicContact CZ-CB 4.31Å; F43-H47 WeakPolarHBondContact O-CB 3.43Å; F43-H47 PolarHBondContact O-N 3.24Å; H47-G49 PolarHBondContact O-N 3.14Å; H47-G49 VanDerWaalsContact O-N 3.11Å; H47-G50 PolarHBondContact ND1-O 3.43Å; H47-G50 PolarHBondContact O-N 2.9Å; H47-V53 VanDerWaalsContact CE1-CG2 3.45Å; H47-V53 WeakPolarHBondContact CE1-CG2 3.38Å; H47-L54 HydrophobicContact CB-CD1 3.6Å; H47-L54 HydrophobicContact CB-CG 4.47Å
48	P	90.4	Very high	91.1	Very high	125 Å²	125	68.1 Å²	68.1	81%	0.812	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-23.4	-178	-24.8	35.2	0	0	0	114.5	E46 G50	E46-P48 VanDerWaalsContact O-CD 3.29Å; E46-P48 WeakPolarHBondContact O-CD 3.3Å; P48-G50 VanDerWaalsContact C-N 3.31Å
49	G	87.4	Confident	91	Very high	51 Å²	51	67.2 Å²	67.2	53%	0.526	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-0.9	174.5	0	0	0	0	0	114.5	H47	H47-G49 PolarHBondContact O-N 3.14Å; H47-G49 VanDerWaalsContact O-N 3.11Å
50	G	91.6	Very high	90.8	Very high	33 Å²	33	65.6 Å²	65.6	34%	0.34	36%	0.357	S	S	.	.			trans	89.1	158.8	-175.5	0	0	0	0	0	113.7	H47 P48 E52 V53	H47-G50 PolarHBondContact ND1-O 3.43Å; H47-G50 PolarHBondContact O-N 2.9Å; P48-G50 VanDerWaalsContact C-N 3.31Å; G50-E52 VanDerWaalsContact C-N 3.35Å; G50-V53 WeakPolarHBondContact O-CG2 3.17Å
51	E	91.6	Very high	90.7	Very high	72 Å²	72	67.7 Å²	67.7	34%	0.336	37%	0.367	S	S	.	.	H	α-helix	trans	-70.4	-29.3	-179.9	59.5	169.1	173.6	0	0	113.3	L44 V53 L54 R55	L44-E51 HydrophobicContact CB-CB 3.99Å; L44-E51 WeakPolarHBondContact O-CA 3.29Å; L44-E51 WeakPolarHBondContact O-CB 3.35Å; E51-V53 VanDerWaalsContact C-N 3.35Å; E51-V53 PolarHBondContact O-N 3.16Å; E51-L54 PolarHBondContact O-N 3.33Å; E51-L54 VanDerWaalsContact O-N 3.1Å; E51-R55 WeakPolarHBondContact O-CG 3.34Å; E51-R55 PolarHBondContact O-N 3.41Å
52	E	90.1	Very high	90.7	Very high	117 Å²	117	66.5 Å²	66.5	55%	0.547	36%	0.361	S	S	.	.	H	α-helix	trans	-57.9	-46.5	-173.5	-171.7	71.5	91.1	0	0	111.3	G50 L54 R55 E56	G50-E52 VanDerWaalsContact C-N 3.35Å; E52-L54 PolarHBondContact O-N 2.97Å; E52-R55 CarbonylContact O-C 3.6Å; E52-R55 WeakPolarHBondContact O-CA 3.34Å; E52-R55 WeakPolarHBondContact O-CB 3.2Å; E52-R55 PolarHBondContact O-N 2.99Å; E52-E56 WeakPolarHBondContact O-CG 3.45Å; E52-E56 PolarHBondContact O-N 2.89Å
53	V	91.2	Very high	90.8	Very high	66 Å²	66	58.7 Å²	58.7	40%	0.4	33%	0.329	S	S	.	.	H	α-helix	trans	-65.9	-27.3	-178.7	-60.7	0	0	0	0	113.1	H47 G50 E51	H47-V53 VanDerWaalsContact CE1-CG2 3.45Å; H47-V53 WeakPolarHBondContact CE1-CG2 3.38Å; G50-V53 WeakPolarHBondContact O-CG2 3.17Å; E51-V53 VanDerWaalsContact C-N 3.35Å; E51-V53 PolarHBondContact O-N 3.16Å
54	L	91.7	Very high	90.8	Very high	21 Å²	21	64.8 Å²	64.8	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-77.1	-34.3	173.1	-65.8	177.7	0	0	0	111.1	I31 V40 F43 L44 H47 E51 E52 Q57 A58	I31-L54 HydrophobicContact CD1-CD2 4.24Å; V40-L54 HydrophobicContact CB-CD1 4.48Å; F43-L54 HydrophobicContact CD1-CD1 4.16Å; L44-L54 HydrophobicContact CD2-CB 3.84Å; L44-L54 HydrophobicContact CD2-CD1 4.09Å; H47-L54 HydrophobicContact CB-CD1 3.6Å; H47-L54 HydrophobicContact CB-CG 4.47Å; E51-L54 PolarHBondContact O-N 3.33Å; E51-L54 VanDerWaalsContact O-N 3.1Å; E52-L54 PolarHBondContact O-N 2.97Å; L54-Q57 CarbonylContact O-C 3.6Å; L54-Q57 PolarHBondContact O-N 3.01Å; L54-A58 PolarHBondContact O-N 2.74Å
55	R	90.7	Very high	90.8	Very high	78 Å²	78	66.9 Å²	66.9	29%	0.294	37%	0.373	S	S	.	.	H	α-helix	trans	-74.1	-35.3	179.9	-72.6	-176.3	62.9	-155.6	-11.4	113.1	L44 E51 E52 Q57 A58	L44-R55 HydrophobicContact CD2-CG 4.23Å; E51-R55 WeakPolarHBondContact O-CG 3.34Å; E51-R55 PolarHBondContact O-N 3.41Å; E52-R55 CarbonylContact O-C 3.6Å; E52-R55 WeakPolarHBondContact O-CA 3.34Å; E52-R55 WeakPolarHBondContact O-CB 3.2Å; E52-R55 PolarHBondContact O-N 2.99Å; R55-Q57 PolarHBondContact O-N 2.88Å; R55-A58 WeakPolarHBondContact O-CB 3.48Å; R55-A58 PolarHBondContact O-N 3.11Å; R55-A58 VanDerWaalsContact O-N 3.1Å
56	E	89.9	Confident	90.8	Very high	131 Å²	131	61.3 Å²	61.3	61%	0.612	34%	0.342	S	S	*	.	H	α-helix	trans	-59.9	-29.3	172.5	-72.7	-179.9	141.5	0	0	112.1	E52	E52-E56 WeakPolarHBondContact O-CG 3.45Å; E52-E56 PolarHBondContact O-N 2.89Å
57	Q	91.6	Very high	90.9	Very high	56 Å²	56	58.4 Å²	58.4	26%	0.262	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	5.2	178.7	-55.8	-56.5	-51.6	0	0	113.4	I31 L54 R55 G59 G60 N61 A62	I31-Q57 HydrophobicContact CG2-CB 4.49Å; L54-Q57 CarbonylContact O-C 3.6Å; L54-Q57 PolarHBondContact O-N 3.01Å; R55-Q57 PolarHBondContact O-N 2.88Å; Q57-G59 PolarHBondContact O-N 3.07Å; Q57-G60 PolarHBondContact O-N 3.11Å; Q57-G60 VanDerWaalsContact O-N 3.11Å; Q57-N61 PolarHBondContact OE1-O 2.78Å; Q57-A62 HydrophobicContact CB-CB 3.7Å; Q57-A62 HydrophobicContact CG-CB 4.04Å
58	A	91.6	Very high	90.9	Very high	20 Å²	20	63.9 Å²	63.9	17%	0.165	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	134.4	-177.3	0	0	0	0	0	111.7	N24 T29 L54 R55 G60	N24-A58 HydrophobicContact CB-CB 4.25Å; T29-A58 HydrophobicContact CG2-CB 3.65Å; L54-A58 PolarHBondContact O-N 2.74Å; R55-A58 WeakPolarHBondContact O-CB 3.48Å; R55-A58 PolarHBondContact O-N 3.11Å; R55-A58 VanDerWaalsContact O-N 3.1Å; A58-G60 PolarHBondContact O-N 3.31Å
59	G	90.3	Very high	90.9	Very high	6 Å²	6	62.7 Å²	62.7	6%	0.062	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	6.2	-176.5	0	0	0	0	0	114.6	I20 E21 W30 Q57	I20-G59 WeakPolarHBondContact O-CA 3.44Å; E21-G59 WeakPolarHBondContact CG-O 3.37Å; W30-G59 PolarHBondContact O-N 3.5Å; Q57-G59 PolarHBondContact O-N 3.07Å
60	G	89.6	Confident	91.1	Very high	23 Å²	23	62.8 Å²	62.8	24%	0.237	35%	0.35	C	S	.	.	S	Bend	trans	-125.7	-172.5	-172.6	0	0	0	0	0	114.7	I32 Q57 A58	I32-G60 WeakPolarHBondContact CB-O 3.4Å; I32-G60 PolarHBondContact N-O 2.96Å; Q57-G60 PolarHBondContact O-N 3.11Å; Q57-G60 VanDerWaalsContact O-N 3.11Å; A58-G60 PolarHBondContact O-N 3.31Å
61	N	92.2	Very high	91.2	Very high	50 Å²	50	63.5 Å²	63.5	27%	0.267	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-91.3	113.6	172.3	-171.1	-69.7	0	0	0	110.4	I32 Q57 T63 I95	I32-N61 WeakPolarHBondContact O-CA 3.37Å; Q57-N61 PolarHBondContact OE1-O 2.78Å; N61-T63 PolarHBondContact ND2-OG1 3.07Å; N61-T63 WeakPolarHBondContact OD1-CB 3.36Å; N61-T63 PolarHBondContact OD1-N 3.13Å; N61-T63 PolarHBondContact OD1-OG1 3.08Å; N61-I95 HydrophobicContact CB-CB 4.26Å; N61-I95 HydrophobicContact CB-CG2 4.08Å
62	A	92.1	Very high	91.3	Very high	6 Å²	6	64.2 Å²	64.2	5%	0.05	36%	0.357	C	S	.	.			trans	-101.1	13.2	179.8	0	0	0	0	0	112.4	I31 I32 I33 Q57 E64 S65 F66	I31-A62 HydrophobicContact CB-CB 4.26Å; I31-A62 HydrophobicContact CD1-CB 4.47Å; I32-A62 PolarHBondContact O-N 2.86Å; I33-A62 HydrophobicContact CG1-CB 4.28Å; Q57-A62 HydrophobicContact CB-CB 3.7Å; Q57-A62 HydrophobicContact CG-CB 4.04Å; A62-E64 PolarHBondContact O-N 3.13Å; A62-S65 PolarHBondContact O-N 3.42Å; A62-F66 VanDerWaalsContact O-CB 3.24Å; A62-F66 WeakPolarHBondContact O-CB 3.35Å; A62-F66 PolarHBondContact O-N 2.76Å
63	T	92	Very high	91.4	Very high	24 Å²	24	63.7 Å²	63.7	15%	0.147	36%	0.362	C	S	.	.	H	α-helix	trans	-63.4	-43.9	-171.4	-52.3	0	0	0	0	110.9	I33 H34 N61 F66 E67	I33-T63 WeakPolarHBondContact CA-OG1 3.45Å; H34-T63 WeakPolarHBondContact CE1-CG2 3.46Å; H34-T63 PolarHBondContact N-OG1 2.96Å; H34-T63 WeakPolarHBondContact ND1-CG2 3.35Å; N61-T63 PolarHBondContact ND2-OG1 3.07Å; N61-T63 WeakPolarHBondContact OD1-CB 3.36Å; N61-T63 PolarHBondContact OD1-N 3.13Å; N61-T63 PolarHBondContact OD1-OG1 3.08Å; T63-F66 PolarHBondContact O-N 2.57Å; T63-E67 HydrophobicContact CG2-CG 4.47Å; T63-E67 WeakPolarHBondContact O-CG 3.46Å; T63-E67 PolarHBondContact O-N 2.9Å
64	E	90	Very high	91.4	Very high	166 Å²	166	65.7 Å²	65.7	78%	0.776	37%	0.37	S	S	*	.	H	α-helix	trans	-62.6	-51.6	179.2	-171.3	176.1	114.9	0	0	111.2	A62 F66 E67 D68	A62-E64 PolarHBondContact O-N 3.13Å; E64-F66 VanDerWaalsContact C-N 3.27Å; E64-F66 PolarHBondContact O-N 2.91Å; E64-E67 PolarHBondContact O-N 3.18Å; E64-D68 WeakPolarHBondContact O-CB 3.43Å; E64-D68 PolarHBondContact O-N 2.94Å
65	S	90.1	Very high	91.3	Very high	49 Å²	49	65.9 Å²	65.9	34%	0.343	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-37.6	177.6	-51.1	0	0	0	0	112.6	A62 V69	A62-S65 PolarHBondContact O-N 3.42Å; S65-V69 VanDerWaalsContact O-CG2 3.26Å; S65-V69 WeakPolarHBondContact O-CG2 3.39Å; S65-V69 PolarHBondContact O-N 3Å
66	F	91.2	Very high	91.4	Very high	27 Å²	27	67.2 Å²	67.2	12%	0.118	38%	0.38	C	S	.	.	H	α-helix	trans	-67.8	-40.6	179.1	-175.7	-99	0	0	0	112.9	I33 A62 T63 E64 H71 R76	I33-F66 HydrophobicContact CD1-CB 4.37Å; I33-F66 HydrophobicContact CD1-CD2 3.91Å; I33-F66 HydrophobicContact CD1-CE2 4.37Å; I33-F66 HydrophobicContact CD1-CG 4.07Å; I33-F66 HydrophobicContact CG1-CB 4.5Å; I33-F66 HydrophobicContact CG2-CB 4.35Å; I33-F66 HydrophobicContact CG2-CD1 3.89Å; I33-F66 HydrophobicContact CG2-CE1 4.44Å; I33-F66 HydrophobicContact CG2-CG 4.15Å; A62-F66 VanDerWaalsContact O-CB 3.24Å; A62-F66 WeakPolarHBondContact O-CB 3.35Å; A62-F66 PolarHBondContact O-N 2.76Å; T63-F66 PolarHBondContact O-N 2.57Å; E64-F66 VanDerWaalsContact C-N 3.27Å; E64-F66 PolarHBondContact O-N 2.91Å; F66-H71 AromaticContact CD2-CE1 3.63Å; F66-H71 AromaticContact CD2-ND1 3.37Å; F66-H71 WeakPolarHBondContact CD2-ND1 3.3Å; F66-H71 HydrophobicContact CE1-CB 4.49Å; F66-H71 HydrophobicContact CE2-CB 3.99Å; F66-H71 AromaticContact CE2-CE1 3.87Å; F66-H71 AromaticContact CE2-CG 3.58Å; F66-H71 AromaticContact CE2-ND1 3.43Å; F66-H71 WeakPolarHBondContact CE2-ND1 3.42Å; F66-H71 AromaticContact CG-ND1 3.95Å; F66-H71 HydrophobicContact CZ-CB 3.87Å; F66-H71 AromaticContact CZ-CG 3.99Å; F66-H71 PolarHBondContact O-ND1 2.92Å; F66-H71 VanDerWaalsContact O-ND1 3.1Å; F66-R76 HydrophobicContact CE1-CG 3.85Å; F66-R76 HydrophobicContact CZ-CG 3.67Å
67	E	91.8	Very high	91.5	Very high	79 Å²	79	67.3 Å²	67.3	37%	0.369	38%	0.381	S	S	.	.	H	α-helix	trans	-75.2	-37.6	178	-65.9	-61	122.6	0	0	112.3	H34 T63 E64 V69 G70 R76	H34-E67 IonicContact CD2-OE1 3.27Å; H34-E67 IonicContact CE1-OE1 3.99Å; H34-E67 IonicContact NE2-OE1 2.83Å; H34-E67 PolarHBondContact NE2-OE1 3.2Å; T63-E67 HydrophobicContact CG2-CG 4.47Å; T63-E67 WeakPolarHBondContact O-CG 3.46Å; T63-E67 PolarHBondContact O-N 2.9Å; E64-E67 PolarHBondContact O-N 3.18Å; E67-V69 PolarHBondContact O-N 2.98Å; E67-G70 PolarHBondContact O-N 3.23Å; E67-G70 VanDerWaalsContact O-N 3.12Å; E67-R76 IonicContact OE1-CZ 3.04Å; E67-R76 IonicContact OE1-NH2 2.97Å; E67-R76 PolarHBondContact OE1-NH2 3.45Å; E67-R76 IonicContact OE2-NH2 2.68Å; E67-R76 PolarHBondContact OE2-NH2 3.4Å
68	D	91.9	Very high	91.4	Very high	142 Å²	142	68.8 Å²	68.8	76%	0.759	39%	0.389	S	S	*	.	H	α-helix	trans	-62.4	-41.5	179.5	-174.3	-105.8	0	0	0	112.2	E64 G70	E64-D68 WeakPolarHBondContact O-CB 3.43Å; E64-D68 PolarHBondContact O-N 2.94Å; D68-G70 PolarHBondContact O-N 3.01Å
69	V	91.4	Very high	91.3	Very high	100 Å²	100	68.8 Å²	68.8	61%	0.606	39%	0.389	S	S	*	.	H	α-helix	trans	-65.5	-28.9	175.8	172.8	0	0	0	0	112	S65 E67	S65-V69 VanDerWaalsContact O-CG2 3.26Å; S65-V69 WeakPolarHBondContact O-CG2 3.39Å; S65-V69 PolarHBondContact O-N 3Å; E67-V69 PolarHBondContact O-N 2.98Å
70	G	91.3	Very high	91.2	Very high	53 Å²	53	71.3 Å²	71.3	55%	0.546	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	51.8	178.5	0	0	0	0	0	113.9	E67 D68	E67-G70 PolarHBondContact O-N 3.23Å; E67-G70 VanDerWaalsContact O-N 3.12Å; D68-G70 PolarHBondContact O-N 3.01Å
71	H	92.2	Very high	91.2	Very high	47 Å²	47	74.8 Å²	74.8	22%	0.218	43%	0.429	C	S	.	.			trans	-55.6	138	178.5	-70.6	87.2	0	0	0	113.4	F66 A75	F66-H71 AromaticContact CD2-CE1 3.63Å; F66-H71 AromaticContact CD2-ND1 3.37Å; F66-H71 WeakPolarHBondContact CD2-ND1 3.3Å; F66-H71 HydrophobicContact CE1-CB 4.49Å; F66-H71 HydrophobicContact CE2-CB 3.99Å; F66-H71 AromaticContact CE2-CE1 3.87Å; F66-H71 AromaticContact CE2-CG 3.58Å; F66-H71 AromaticContact CE2-ND1 3.43Å; F66-H71 WeakPolarHBondContact CE2-ND1 3.42Å; F66-H71 AromaticContact CG-ND1 3.95Å; F66-H71 HydrophobicContact CZ-CB 3.87Å; F66-H71 AromaticContact CZ-CG 3.99Å; F66-H71 PolarHBondContact O-ND1 2.92Å; F66-H71 VanDerWaalsContact O-ND1 3.1Å; H71-A75 HydrophobicContact CB-CB 4.2Å
72	S	93.8	Very high	91.1	Very high	88 Å²	88	74.7 Å²	74.7	62%	0.615	43%	0.428	S	S	*	.			trans	-57.5	157.1	174.8	-59.1	0	0	0	0	112.7	D74 A75 R76	S72-D74 VanDerWaalsContact C-N 3.27Å; S72-D74 PolarHBondContact O-N 3Å; S72-A75 WeakPolarHBondContact O-CB 3.49Å; S72-A75 PolarHBondContact O-N 3.48Å; S72-A75 VanDerWaalsContact O-N 3.1Å; S72-R76 PolarHBondContact O-N 3.07Å; S72-R76 VanDerWaalsContact O-N 3.09Å
73	T	92.3	Very high	91.1	Very high	106 Å²	106	76.8 Å²	76.8	65%	0.65	44%	0.44	S	S	*	.	H	α-helix	trans	-54.6	-43	176.6	-50.1	0	0	0	0	112.4	A75 R76 E77	T73-A75 VanDerWaalsContact C-N 3.35Å; T73-A75 PolarHBondContact O-N 3.43Å; T73-R76 WeakPolarHBondContact O-CB 3.15Å; T73-R76 PolarHBondContact O-N 2.73Å; T73-R76 VanDerWaalsContact O-N 3.12Å; T73-E77 PolarHBondContact O-N 3.46Å
74	D	91.8	Very high	91.1	Very high	107 Å²	107	78.4 Å²	78.4	57%	0.572	45%	0.447	S	S	*	.	H	α-helix	trans	-61.1	-42	178.3	-172	-102.5	0	0	0	112.2	S72 R76 E77 M78	S72-D74 VanDerWaalsContact C-N 3.27Å; S72-D74 PolarHBondContact O-N 3Å; D74-R76 VanDerWaalsContact C-N 3.3Å; D74-R76 PolarHBondContact O-N 3.27Å; D74-E77 PolarHBondContact O-N 2.97Å; D74-M78 WeakPolarHBondContact O-CG 3.41Å; D74-M78 PolarHBondContact O-N 3.27Å
75	A	90.9	Very high	91.2	Very high	26 Å²	26	70.7 Å²	70.7	22%	0.215	41%	0.412	C	S	.	.	H	α-helix	trans	-63.8	-36.3	175.4	0	0	0	0	0	112.3	H71 S72 T73 M78 A79	H71-A75 HydrophobicContact CB-CB 4.2Å; S72-A75 WeakPolarHBondContact O-CB 3.49Å; S72-A75 PolarHBondContact O-N 3.48Å; S72-A75 VanDerWaalsContact O-N 3.1Å; T73-A75 VanDerWaalsContact C-N 3.35Å; T73-A75 PolarHBondContact O-N 3.43Å; A75-M78 HydrophobicContact CB-CE 4.34Å; A75-M78 PolarHBondContact O-N 3.45Å; A75-A79 WeakPolarHBondContact O-CB 3.48Å; A75-A79 PolarHBondContact O-N 3.01Å
76	R	91.6	Very high	91.4	Very high	105 Å²	105	70.1 Å²	70.1	40%	0.396	40%	0.404	S	S	.	.	H	α-helix	trans	-66.9	-38.5	174.1	-73.7	173.8	153.2	-178.9	-6.7	112.2	F66 E67 S72 T73 D74 A79 A80	F66-R76 HydrophobicContact CE1-CG 3.85Å; F66-R76 HydrophobicContact CZ-CG 3.67Å; E67-R76 IonicContact OE1-CZ 3.04Å; E67-R76 IonicContact OE1-NH2 2.97Å; E67-R76 PolarHBondContact OE1-NH2 3.45Å; E67-R76 IonicContact OE2-NH2 2.68Å; E67-R76 PolarHBondContact OE2-NH2 3.4Å; S72-R76 PolarHBondContact O-N 3.07Å; S72-R76 VanDerWaalsContact O-N 3.09Å; T73-R76 WeakPolarHBondContact O-CB 3.15Å; T73-R76 PolarHBondContact O-N 2.73Å; T73-R76 VanDerWaalsContact O-N 3.12Å; D74-R76 VanDerWaalsContact C-N 3.3Å; D74-R76 PolarHBondContact O-N 3.27Å; R76-A79 PolarHBondContact O-N 3.46Å; R76-A80 PolarHBondContact O-N 3.02Å
77	E	91.5	Very high	91.4	Very high	133 Å²	133	68.9 Å²	68.9	62%	0.621	40%	0.399	S	S	*	.	H	α-helix	trans	-67.2	-42.1	175	-70.1	-172.7	110.6	0	0	111.6	T73 D74 A79 A80 S81	T73-E77 PolarHBondContact O-N 3.46Å; D74-E77 PolarHBondContact O-N 2.97Å; E77-A79 PolarHBondContact O-N 3.43Å; E77-A80 WeakPolarHBondContact O-CB 3.41Å; E77-A80 PolarHBondContact O-N 3.39Å; E77-S81 PolarHBondContact O-N 2.95Å
78	M	90	Very high	91.4	Very high	88 Å²	88	67.2 Å²	67.2	43%	0.433	39%	0.391	S	S	.	.	H	α-helix	trans	-59.4	-46.5	172.3	-70.7	-166.2	-64	0	0	111.5	D74 A75 A80 S81	D74-M78 WeakPolarHBondContact O-CG 3.41Å; D74-M78 PolarHBondContact O-N 3.27Å; A75-M78 HydrophobicContact CB-CE 4.34Å; A75-M78 PolarHBondContact O-N 3.45Å; M78-A80 VanDerWaalsContact C-N 3.27Å; M78-A80 PolarHBondContact O-N 3.38Å; M78-S81 WeakPolarHBondContact O-CB 3.16Å; M78-S81 PolarHBondContact O-N 3.09Å; M78-S81 VanDerWaalsContact O-N 3.08Å; M78-S81 PolarHBondContact O-OG 3.37Å
79	A	89.1	Confident	91.2	Very high	19 Å²	19	63.6 Å²	63.6	16%	0.157	38%	0.375	C	S	.	.	H	α-helix	trans	-58.6	-40.5	177	0	0	0	0	0	111.5	Y38 A75 R76 E77 S81 M82	Y38-A79 HydrophobicContact CD1-CB 4.38Å; Y38-A79 WeakPolarHBondContact CD1-O 3.48Å; Y38-A79 HydrophobicContact CE1-CB 4.07Å; Y38-A79 WeakPolarHBondContact CE1-O 3.21Å; A75-A79 WeakPolarHBondContact O-CB 3.48Å; A75-A79 PolarHBondContact O-N 3.01Å; R76-A79 PolarHBondContact O-N 3.46Å; E77-A79 PolarHBondContact O-N 3.43Å; A79-S81 PolarHBondContact O-N 3.27Å; A79-S81 VanDerWaalsContact O-N 3.15Å; A79-M82 WeakPolarHBondContact O-CB 3.43Å; A79-M82 PolarHBondContact O-N 3.48Å
80	A	88.9	Confident	91	Very high	59 Å²	59	62.6 Å²	62.6	49%	0.488	37%	0.367	S	S	.	.	H	α-helix	trans	-59.1	-27.7	178.5	0	0	0	0	0	113.3	R76 E77 M78 M82 V83	R76-A80 PolarHBondContact O-N 3.02Å; E77-A80 WeakPolarHBondContact O-CB 3.41Å; E77-A80 PolarHBondContact O-N 3.39Å; M78-A80 VanDerWaalsContact C-N 3.27Å; M78-A80 PolarHBondContact O-N 3.38Å; A80-M82 VanDerWaalsContact C-N 3.27Å; A80-M82 PolarHBondContact O-N 3.08Å; A80-V83 WeakPolarHBondContact O-CG2 3.45Å
81	S	89	Confident	90.8	Very high	96 Å²	96	60.3 Å²	60.3	67%	0.671	34%	0.342	S	S	*	.	H	α-helix	trans	-71.8	-19	175.1	77.6	0	0	0	0	114.1	E77 M78 A79	E77-S81 PolarHBondContact O-N 2.95Å; M78-S81 WeakPolarHBondContact O-CB 3.16Å; M78-S81 PolarHBondContact O-N 3.09Å; M78-S81 VanDerWaalsContact O-N 3.08Å; M78-S81 PolarHBondContact O-OG 3.37Å; A79-S81 PolarHBondContact O-N 3.27Å; A79-S81 VanDerWaalsContact O-N 3.15Å
82	M	90.3	Very high	90.4	Very high	49 Å²	49	62.2 Å²	62.2	24%	0.241	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	6.3	-179	-55.9	176.4	-172	0	0	112.9	D39 F43 A79 A80 I84	D39-M82 PolarHBondContact N-O 3.41Å; F43-M82 HydrophobicContact CB-CE 4Å; F43-M82 HydrophobicContact CB-SD 3.95Å; F43-M82 HydrophobicContact CD1-CE 4.45Å; F43-M82 HydrophobicContact CD1-SD 4.42Å; F43-M82 HydrophobicContact CD2-CE 3.64Å; F43-M82 HydrophobicContact CE2-CE 4.23Å; F43-M82 HydrophobicContact CG-CE 3.77Å; F43-M82 HydrophobicContact CG-SD 4.05Å; A79-M82 WeakPolarHBondContact O-CB 3.43Å; A79-M82 PolarHBondContact O-N 3.48Å; A80-M82 VanDerWaalsContact C-N 3.27Å; A80-M82 PolarHBondContact O-N 3.08Å; M82-I84 PolarHBondContact O-N 3.01Å
83	V	92.3	Very high	89.7	Confident	50 Å²	50	63.4 Å²	63.4	30%	0.303	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	120.6	178.1	176.9	0	0	0	0	109.7	K36 Y38 A80 G85	K36-V83 HydrophobicContact CB-CG1 4.47Å; Y38-V83 HydrophobicContact CD1-CG2 3.66Å; Y38-V83 HydrophobicContact CE1-CG2 3.23Å; Y38-V83 HydrophobicContact CE2-CG2 4.31Å; Y38-V83 HydrophobicContact CG-CG2 4.39Å; A80-V83 WeakPolarHBondContact O-CG2 3.45Å; V83-G85 WeakPolarHBondContact CG1-O 3.49Å
84	I	92.6	Very high	88.9	Confident	57 Å²	57	63.2 Å²	63.2	29%	0.292	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-16.7	175.5	56.7	165.7	0	0	0	112.3	F15 W30 V37 D39 M82	F15-I84 HydrophobicContact CE2-CB 4.4Å; F15-I84 HydrophobicContact CE2-CD1 3.95Å; F15-I84 HydrophobicContact CE2-CG1 3.96Å; F15-I84 HydrophobicContact CZ-CD1 3.9Å; F15-I84 HydrophobicContact CZ-CG1 4.32Å; W30-I84 HydrophobicContact CD2-CD1 3.59Å; W30-I84 HydrophobicContact CE3-CD1 3.82Å; W30-I84 HydrophobicContact CG-CD1 4.22Å; W30-I84 HydrophobicContact CH2-CD1 3.96Å; W30-I84 HydrophobicContact CZ2-CD1 3.71Å; W30-I84 HydrophobicContact CZ3-CD1 4.01Å; V37-I84 HydrophobicContact CB-CG1 4.15Å; V37-I84 HydrophobicContact CG1-CD1 3.78Å; V37-I84 HydrophobicContact CG1-CG1 3.86Å; V37-I84 WeakPolarHBondContact O-CG1 3.12Å; V37-I84 PolarHBondContact O-N 3.21Å; D39-I84 HydrophobicContact CB-CD1 4.21Å; D39-I84 HydrophobicContact CB-CG1 4.45Å; D39-I84 HydrophobicContact CB-CG2 3.6Å; M82-I84 PolarHBondContact O-N 3.01Å
85	G	92.2	Very high	88.1	Confident	4 Å²	4	59.6 Å²	59.6	4%	0.041	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.3	-158.9	-178.7	0	0	0	0	0	113.6	K13 V37 V83	K13-G85 CarbonylContact O-C 3.49Å; K13-G85 WeakPolarHBondContact O-CA 3.28Å; V37-G85 PolarHBondContact N-O 2.93Å; V83-G85 WeakPolarHBondContact CG1-O 3.49Å
86	E	92.8	Very high	86.7	Confident	38 Å²	38	62.3 Å²	62.3	18%	0.178	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154	179.9	-67.9	-164.8	176.9	0	0	112.1	V12 K13 Y14 F15 K36 H88 R92	V12-E86 HydrophobicContact CG1-CB 4.1Å; V12-E86 HydrophobicContact CG1-CG 3.72Å; K13-E86 PolarHBondContact O-N 3.04Å; Y14-E86 VanDerWaalsContact CA-O 3.28Å; Y14-E86 WeakPolarHBondContact CA-O 3.12Å; Y14-E86 HydrophobicContact CD1-CB 4.01Å; Y14-E86 HydrophobicContact CE1-CB 3.9Å; F15-E86 PolarHBondContact N-O 3.15Å; K36-E86 HydrophobicContact CG-CG 4.17Å; K36-E86 IonicContact NZ-OE1 3.64Å; K36-E86 PolarHBondContact NZ-OE1 3.33Å; E86-H88 PolarHBondContact O-N 3.08Å; E86-R92 IonicContact OE2-NH2 2.79Å; E86-R92 PolarHBondContact OE2-NH2 2.63Å
87	L	92.1	Very high	84.5	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	135.3	172.6	-175.5	72.5	0	0	0	109.5	L17 I20 I32 N35 D91 R92 I95	L17-L87 HydrophobicContact CB-CD1 4.43Å; L17-L87 HydrophobicContact CD1-CD1 4.32Å; I20-L87 HydrophobicContact CD1-CD1 3.48Å; I20-L87 VanDerWaalsContact CD1-CD1 3.48Å; I32-L87 HydrophobicContact CD1-CD1 4.12Å; N35-L87 PolarHBondContact O-N 2.83Å; L87-D91 HydrophobicContact CD1-CB 4.01Å; L87-D91 HydrophobicContact CD2-CB 4.13Å; L87-D91 HydrophobicContact CG-CB 4.06Å; L87-R92 HydrophobicContact CD2-CG 4.27Å; L87-R92 PolarHBondContact O-NE 3.27Å; L87-I95 HydrophobicContact CD2-CD1 3.24Å; L87-I95 HydrophobicContact CD2-CG1 3.75Å
88	H	91.6	Very high	82.2	Confident	44 Å²	44	63.3 Å²	63.3	20%	0.204	35%	0.352	C	S	.	.			trans	-52.7	134.4	176.2	-164.5	-78.8	0	0	0	110.8	F15 R16 E86 D90 D91 R92	F15-H88 WeakPolarHBondContact O-CB 3.44Å; F15-H88 PolarHBondContact O-N 2.93Å; R16-H88 PolarHBondContact NH2-CE1 3.28Å; R16-H88 PolarHBondContact NH2-NE2 2.84Å; E86-H88 PolarHBondContact O-N 3.08Å; H88-D90 VanDerWaalsContact CE1-CG 3.41Å; H88-D90 IonicContact CE1-OD1 3.91Å; H88-D90 IonicContact CE1-OD2 3.36Å; H88-D90 PolarHBondContact CE1-OD2 2.95Å; H88-D90 WeakPolarHBondContact ND1-CB 3.17Å; H88-D90 PolarHBondContact ND1-N 2.86Å; H88-D90 IonicContact ND1-OD2 3.36Å; H88-D90 PolarHBondContact ND1-OD2 3.1Å; H88-D90 PolarHBondContact O-N 3.1Å; H88-D90 VanDerWaalsContact O-N 3.16Å; H88-D91 PolarHBondContact O-N 3.19Å; H88-R92 PolarHBondContact O-N 3.2Å
89	P	86.9	Confident	80.2	Confident	66 Å²	66	64.3 Å²	64.3	43%	0.429	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-54.4	-37.9	-176.7	19.3	-32.7	0	0	0	113.4	D91 R92	P89-D91 PolarHBondContact O-N 3.48Å; P89-R92 WeakPolarHBondContact O-CB 3.26Å; P89-R92 PolarHBondContact O-N 3.47Å
90	D	87.4	Confident	78.3	Confident	80 Å²	80	71.8 Å²	71.8	43%	0.428	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-60.9	-23.1	174.9	-61.8	-22.2	0	0	0	114.3	R16 H88 H93	R16-D90 IonicContact CZ-OD2 3.9Å; R16-D90 VanDerWaalsContact NH1-CB 3.33Å; R16-D90 IonicContact NH1-OD2 2.75Å; R16-D90 PolarHBondContact NH1-OD2 3.26Å; R16-D90 IonicContact NH2-OD2 2.74Å; R16-D90 PolarHBondContact NH2-OD2 3.39Å; H88-D90 VanDerWaalsContact CE1-CG 3.41Å; H88-D90 IonicContact CE1-OD1 3.91Å; H88-D90 IonicContact CE1-OD2 3.36Å; H88-D90 PolarHBondContact CE1-OD2 2.95Å; H88-D90 WeakPolarHBondContact ND1-CB 3.17Å; H88-D90 PolarHBondContact ND1-N 2.86Å; H88-D90 IonicContact ND1-OD2 3.36Å; H88-D90 PolarHBondContact ND1-OD2 3.1Å; H88-D90 PolarHBondContact O-N 3.1Å; H88-D90 VanDerWaalsContact O-N 3.16Å; D90-H93 PolarHBondContact O-CE1 3.34Å; D90-H93 PolarHBondContact O-ND1 3.15Å
91	D	86.8	Confident	76.1	Confident	4 Å²	4	74 Å²	74	2%	0.021	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-99	-9.7	-177.5	-71.1	-46.8	0	0	0	112.6	R16 L17 L87 H88 P89 H93 K94	R16-D91 WeakPolarHBondContact CA-OD2 3.38Å; R16-D91 WeakPolarHBondContact CD-OD2 3.48Å; R16-D91 IonicContact NH1-OD2 3.79Å; L17-D91 HydrophobicContact CB-CB 3.94Å; L17-D91 PolarHBondContact N-OD2 3.3Å; L87-D91 HydrophobicContact CD1-CB 4.01Å; L87-D91 HydrophobicContact CD2-CB 4.13Å; L87-D91 HydrophobicContact CG-CB 4.06Å; H88-D91 PolarHBondContact O-N 3.19Å; P89-D91 PolarHBondContact O-N 3.48Å; D91-H93 PolarHBondContact O-N 3.04Å; D91-H93 VanDerWaalsContact O-N 3.14Å; D91-K94 WeakPolarHBondContact O-CB 3.48Å; D91-K94 PolarHBondContact O-N 2.92Å; D91-K94 WeakPolarHBondContact OD1-CD 3.49Å; D91-K94 WeakPolarHBondContact OD1-CE 3.41Å; D91-K94 IonicContact OD1-NZ 2.85Å; D91-K94 PolarHBondContact OD1-NZ 3.38Å
92	R	83.7	Confident	74.2	Confident	88 Å²	88	75.4 Å²	75.4	33%	0.332	40%	0.402	S	S	.	.	H	α-helix	trans	-58.5	-30.4	-179.5	-64.1	-179.8	-176.1	-168.1	-5.3	113.1	E86 L87 H88 P89 K94 I95 A96	E86-R92 IonicContact OE2-NH2 2.79Å; E86-R92 PolarHBondContact OE2-NH2 2.63Å; L87-R92 HydrophobicContact CD2-CG 4.27Å; L87-R92 PolarHBondContact O-NE 3.27Å; H88-R92 PolarHBondContact O-N 3.2Å; P89-R92 WeakPolarHBondContact O-CB 3.26Å; P89-R92 PolarHBondContact O-N 3.47Å; R92-K94 VanDerWaalsContact C-N 3.33Å; R92-I95 WeakPolarHBondContact O-CG1 3.25Å; R92-A96 WeakPolarHBondContact O-CB 3.46Å; R92-A96 PolarHBondContact O-N 2.9Å
93	H	79.3	Confident	71.9	Confident	113 Å²	113	79.5 Å²	79.5	52%	0.523	43%	0.429	S	S	.	.	H	α-helix	trans	-77.8	-17.1	178.5	66.3	-100.7	0	0	0	113.7	D90 D91	D90-H93 PolarHBondContact O-CE1 3.34Å; D90-H93 PolarHBondContact O-ND1 3.15Å; D91-H93 PolarHBondContact O-N 3.04Å; D91-H93 VanDerWaalsContact O-N 3.14Å
94	K	76.4	Confident	69.5	Low	102 Å²	102	81.1 Å²	81.1	44%	0.443	44%	0.439	S	S	.	.	H	α-helix	trans	-80.3	-36.7	179.8	-62.7	178.8	-177.7	165.9	0	111.9	L17 D91 R92	L17-K94 HydrophobicContact CD2-CB 4.17Å; L17-K94 HydrophobicContact CD2-CD 4.19Å; D91-K94 WeakPolarHBondContact O-CB 3.48Å; D91-K94 PolarHBondContact O-N 2.92Å; D91-K94 WeakPolarHBondContact OD1-CD 3.49Å; D91-K94 WeakPolarHBondContact OD1-CE 3.41Å; D91-K94 IonicContact OD1-NZ 2.85Å; D91-K94 PolarHBondContact OD1-NZ 3.38Å; R92-K94 VanDerWaalsContact C-N 3.33Å
95	I	74.3	Confident	67.3	Low	30 Å²	30	85 Å²	85	15%	0.154	47%	0.466	C	S	.	.	H	α-helix	trans	-82.7	-19.2	176.2	46	158.2	0	0	0	113.8	L17 I32 N35 N61 L87 R92	L17-I95 HydrophobicContact CD1-CG2 3.63Å; I32-I95 HydrophobicContact CG2-CD1 4.31Å; N35-I95 WeakPolarHBondContact ND2-CD1 3.46Å; N61-I95 HydrophobicContact CB-CB 4.26Å; N61-I95 HydrophobicContact CB-CG2 4.08Å; L87-I95 HydrophobicContact CD2-CD1 3.24Å; L87-I95 HydrophobicContact CD2-CG1 3.75Å; R92-I95 WeakPolarHBondContact O-CG1 3.25Å
96	A	62.3	Low	65.2	Low	84 Å²	84	89.3 Å²	89.3	69%	0.694	50%	0.501	S	S	*	.	S	Bend	trans	-85	-11.8	178	0	0	0	0	0	113.6	R92	R92-A96 WeakPolarHBondContact O-CB 3.46Å; R92-A96 PolarHBondContact O-N 2.9Å
97	K	44.8	Very low	62.6	Low	146 Å²	146	95.7 Å²	95.7	64%	0.635	53%	0.528	S	S	*	.	S	Bend	trans	-100	138.2	170.7	-66.6	-172.6	177.3	-172.5	0	107.3	V99	K97-V99 PolarHBondContact O-N 2.9Å; K97-V99 VanDerWaalsContact O-N 3.11Å
98	P	44.1	Very low	60.3	Low	113 Å²	113	102.3 Å²	102.3	73%	0.734	56%	0.559	S	S	*	*			trans	-53	126.9	175	23.4	-31.2	0	0	0	107.5	E100	P98-E100 PolarHBondContact O-N 3.31Å
99	V	46.9	Very low	58.2	Low	109 Å²	109	107.5 Å²	107.5	66%	0.661	58%	0.584	S	S	*	*			trans	-66.7	79.2	-177.8	178.3	0	0	0	0	108.3	K97	K97-V99 PolarHBondContact O-N 2.9Å; K97-V99 VanDerWaalsContact O-N 3.11Å
100	E	48.6	Very low	56.6	Low	176 Å²	176	106.8 Å²	106.8	82%	0.822	58%	0.583	S	S	*	*			trans	-102.7	28.8	167	-85	-142	128.3	0	0	110.6	P98	P98-E100 PolarHBondContact O-N 3.31Å
101	T	44.5	Very low	55.2	Low	104 Å²	104	107.2 Å²	107.2	64%	0.638	59%	0.592	S	S	*	*	S	Bend	trans	-139.1	16	-173.3	-24.8	0	0	0	0	116.2
102	L	48.6	Very low	53.6	Low	126 Å²	126	117.2 Å²	117.2	66%	0.66	63%	0.63	S	S	*	*	S	Bend	trans	-119.6	3.1	166.3	-73.9	171.3	0	0	0	114.4	E21	E21-L102 WeakPolarHBondContact OE1-CD1 3.44Å
103	V	42.3	Very low	52	Low	136 Å²	136	120.5 Å²	120.5	82%	0.824	64%	0.642	S	S	*	*	S	Bend	trans	-104.2	46.2	160.6	-164.2	0	0	0	0	109.2
104	T	40.2	Very low	51	Low	83 Å²	83	117.3 Å²	117.3	51%	0.509	63%	0.633	S	S	.	*			trans	-136.2	79.9	167.8	-132.9	0	0	0	0	108.3
105	T	46.7	Very low	50.1	Low	139 Å²	139	118.5 Å²	118.5	85%	0.853	64%	0.644	S	S	*	*	S	Bend	trans	165.5	76.2	158.1	-71.9	0	0	0	0	105.7
106	A	48.2	Very low	49.3	Very low	94 Å²	94	122.9 Å²	122.9	78%	0.777	67%	0.667	S	S	*	*	S	Bend	trans	169.9	-10.7	154.9	0	0	0	0	0	113.3
107	K	37.9	Very low	49.3	Very low	172 Å²	172	122.5 Å²	122.5	75%	0.748	65%	0.653	S	S	*	*	S	Bend	trans	-135.7	23.4	-177.5	-150.2	178.2	176	175.3	0	115.9
108	E	43.8	Very low	50.2	Low	140 Å²	140	121.1 Å²	121.1	65%	0.654	65%	0.651	S	S	*	*	S	Bend	trans	-106.5	-2.5	169.3	-76.3	-102.3	111.8	0	0	112.3	A110	E108-A110 VanDerWaalsContact C-N 3.31Å
109	E	48.9	Very low	51.2	Low	153 Å²	153	119.3 Å²	119.3	72%	0.715	64%	0.639	S	S	*	*	S	Bend	trans	-77.8	-15.8	172.1	-44.6	-59.5	143	0	0	112.1	W113	E109-W113 PolarHBondContact O-NE1 2.93Å
110	A	52.3	Low	52.4	Low	51 Å²	51	117.6 Å²	117.6	42%	0.421	63%	0.632	S	S	.	*	S	Bend	trans	-88.6	-20.7	-168.1	0	0	0	0	0	114.8	E108 W113 S114	E108-A110 VanDerWaalsContact C-N 3.31Å; A110-W113 PolarHBondContact O-NE1 2.85Å; A110-S114 PolarHBondContact O-OG 3.04Å
111	S	58.3	Low	53.7	Low	89 Å²	89	114.5 Å²	114.5	62%	0.622	62%	0.621	S	S	*	*	S	Bend	trans	-105.5	-11.1	-165.4	-56.4	0	0	0	0	114.9
112	W	54.2	Low	55.2	Low	214 Å²	214	112 Å²	112	81%	0.811	61%	0.611	S	S	*	*	S	Bend	trans	-101.2	-40	-177.8	-173.8	15.9	0	0	0	115
113	W	49.5	Very low	56.7	Low	156 Å²	156	108.7 Å²	108.7	59%	0.591	60%	0.602	S	S	*	*	S	Bend	trans	-69.8	-30.7	174.8	63.8	-57	0	0	0	113.1	E109 A110 N115 L116 I117	E109-W113 PolarHBondContact O-NE1 2.93Å; A110-W113 PolarHBondContact O-NE1 2.85Å; W113-N115 VanDerWaalsContact C-N 3.31Å; W113-N115 PolarHBondContact O-N 3.45Å; W113-L116 PolarHBondContact O-N 3.4Å; W113-I117 HydrophobicContact CB-CD1 4.25Å; W113-I117 HydrophobicContact CD2-CD1 4.09Å; W113-I117 HydrophobicContact CE3-CD1 3.28Å; W113-I117 HydrophobicContact CZ3-CD1 3.96Å; W113-I117 WeakPolarHBondContact O-CG1 3.37Å; W113-I117 PolarHBondContact O-N 2.89Å
114	S	57.2	Low	58.7	Low	47 Å²	47	104.2 Å²	104.2	33%	0.329	58%	0.583	S	S	.	*	H	α-helix	trans	-61.7	-34.1	-177.5	-59.5	0	0	0	0	113.2	A110 L116 I118	A110-S114 PolarHBondContact O-OG 3.04Å; S114-L116 VanDerWaalsContact C-N 3.33Å; S114-L116 PolarHBondContact O-N 3.22Å; S114-I118 VanDerWaalsContact O-CD1 3.26Å; S114-I118 WeakPolarHBondContact O-CD1 3.37Å; S114-I118 VanDerWaalsContact O-CG1 3.25Å; S114-I118 WeakPolarHBondContact O-CG1 3.48Å
115	N	58.8	Low	60.7	Low	127 Å²	127	104.6 Å²	104.6	68%	0.679	58%	0.581	S	S	*	*	H	α-helix	trans	-79.4	-6.7	-179.9	-95.8	-8.9	0	0	0	115	W113 P119	W113-N115 VanDerWaalsContact C-N 3.31Å; W113-N115 PolarHBondContact O-N 3.45Å; N115-P119 WeakPolarHBondContact O-CD 3.44Å
116	L	57	Low	62.6	Low	121 Å²	121	102.9 Å²	102.9	63%	0.634	57%	0.57	S	S	*	*	H	α-helix	trans	-108.7	-22.6	175.1	-67.9	178.6	0	0	0	113.3	W113 S114 S120	W113-L116 PolarHBondContact O-N 3.4Å; S114-L116 VanDerWaalsContact C-N 3.33Å; S114-L116 PolarHBondContact O-N 3.22Å; L116-S120 PolarHBondContact O-OG 3.04Å
117	I	63.4	Low	64.3	Low	77 Å²	77	102.5 Å²	102.5	40%	0.395	56%	0.558	S	S	.	*	H	α-helix	trans	-78.4	-35.9	179.5	-64.6	172.6	0	0	0	111.3	W113 S120 L121	W113-I117 HydrophobicContact CB-CD1 4.25Å; W113-I117 HydrophobicContact CD2-CD1 4.09Å; W113-I117 HydrophobicContact CE3-CD1 3.28Å; W113-I117 HydrophobicContact CZ3-CD1 3.96Å; W113-I117 WeakPolarHBondContact O-CG1 3.37Å; W113-I117 PolarHBondContact O-N 2.89Å; I117-S120 WeakPolarHBondContact CA-OG 3.39Å; I117-S120 PolarHBondContact O-N 2.95Å; I117-S120 PolarHBondContact O-OG 3.38Å; I117-L121 WeakPolarHBondContact O-CB 3.33Å; I117-L121 PolarHBondContact O-N 3.42Å
118	I	62.8	Low	66.7	Low	116 Å²	116	99.6 Å²	99.6	60%	0.595	55%	0.55	S	S	*	*	H	α-helix	trans	-63.6	-48.2	-179.1	-59.5	166.5	0	0	0	112.7	S114 S120 A122	S114-I118 VanDerWaalsContact O-CD1 3.26Å; S114-I118 WeakPolarHBondContact O-CD1 3.37Å; S114-I118 VanDerWaalsContact O-CG1 3.25Å; S114-I118 WeakPolarHBondContact O-CG1 3.48Å; I118-S120 PolarHBondContact O-N 3.43Å; I118-A122 PolarHBondContact O-N 3.47Å
119	P	64.6	Low	68.5	Low	75 Å²	75	99.2 Å²	99.2	49%	0.487	55%	0.55	S	S	.	.	H	α-helix	trans	-69.2	-31.4	178	24.8	-33.1	0	0	0	113.5	N115 A123	N115-P119 WeakPolarHBondContact O-CD 3.44Å; P119-A123 PolarHBondContact O-N 3.17Å
120	S	71.6	Confident	70.3	Confident	73 Å²	73	99.5 Å²	99.5	51%	0.51	55%	0.546	S	S	.	.	H	α-helix	trans	-74	-37	179.3	56.9	0	0	0	0	112.7	L116 I117 I118 A123 G124	L116-S120 PolarHBondContact O-OG 3.04Å; I117-S120 WeakPolarHBondContact CA-OG 3.39Å; I117-S120 PolarHBondContact O-N 2.95Å; I117-S120 PolarHBondContact O-OG 3.38Å; I118-S120 PolarHBondContact O-N 3.43Å; S120-A123 PolarHBondContact O-N 3.01Å; S120-G124 PolarHBondContact O-N 3.09Å; S120-G124 VanDerWaalsContact O-N 3.07Å
121	L	76.3	Confident	71.9	Confident	111 Å²	111	105.9 Å²	105.9	58%	0.581	56%	0.559	S	S	*	*	H	α-helix	trans	-65.5	-41.4	174.7	-157.6	107.6	0	0	0	111.7	I117 G124 I125	I117-L121 WeakPolarHBondContact O-CB 3.33Å; I117-L121 PolarHBondContact O-N 3.42Å; L121-G124 PolarHBondContact O-N 3.46Å; L121-I125 HydrophobicContact CD2-CD1 3.93Å; L121-I125 HydrophobicContact CG-CD1 4.41Å; L121-I125 WeakPolarHBondContact O-CG1 3.34Å; L121-I125 PolarHBondContact O-N 3.12Å
122	A	76.3	Confident	73.2	Confident	53 Å²	53	106.8 Å²	106.8	44%	0.438	56%	0.555	S	S	.	*	H	α-helix	trans	-62.6	-43.3	176.6	0	0	0	0	0	112.2	I118 G124 I125 V126	I118-A122 PolarHBondContact O-N 3.47Å; A122-G124 VanDerWaalsContact C-N 3.33Å; A122-G124 PolarHBondContact O-N 2.88Å; A122-I125 PolarHBondContact O-N 2.79Å; A122-V126 WeakPolarHBondContact O-CG2 3.48Å; A122-V126 PolarHBondContact O-N 2.68Å
123	A	80.5	Confident	74.7	Confident	56 Å²	56	104.2 Å²	104.2	46%	0.463	55%	0.547	S	S	.	.	H	α-helix	trans	-63.3	-38.5	175.7	0	0	0	0	0	112.2	P119 S120 T127	P119-A123 PolarHBondContact O-N 3.17Å; S120-A123 PolarHBondContact O-N 3.01Å; A123-T127 WeakPolarHBondContact O-CB 3.24Å; A123-T127 PolarHBondContact O-N 2.83Å; A123-T127 PolarHBondContact O-OG1 2.93Å
124	G	83.8	Confident	76.4	Confident	42 Å²	42	99.2 Å²	99.2	43%	0.433	53%	0.534	S	S	.	.	H	α-helix	trans	-61.8	-45.7	174.3	0	0	0	0	0	113.1	S120 L121 A122 T127 L128	S120-G124 PolarHBondContact O-N 3.09Å; S120-G124 VanDerWaalsContact O-N 3.07Å; L121-G124 PolarHBondContact O-N 3.46Å; A122-G124 VanDerWaalsContact C-N 3.33Å; A122-G124 PolarHBondContact O-N 2.88Å; G124-T127 PolarHBondContact O-N 3.05Å; G124-L128 WeakPolarHBondContact O-CB 3.41Å; G124-L128 PolarHBondContact O-N 2.92Å
125	I	82.7	Confident	77.2	Confident	91 Å²	91	100.3 Å²	100.3	47%	0.467	55%	0.546	S	S	.	.	H	α-helix	trans	-64.4	-46.1	179	-66.1	166.4	0	0	0	111	L121 A122 T127 L128 M129	L121-I125 HydrophobicContact CD2-CD1 3.93Å; L121-I125 HydrophobicContact CG-CD1 4.41Å; L121-I125 WeakPolarHBondContact O-CG1 3.34Å; L121-I125 PolarHBondContact O-N 3.12Å; A122-I125 PolarHBondContact O-N 2.79Å; I125-T127 VanDerWaalsContact C-N 3.33Å; I125-T127 PolarHBondContact O-N 3.39Å; I125-L128 PolarHBondContact O-N 3.1Å; I125-M129 WeakPolarHBondContact O-CG 3.43Å; I125-M129 PolarHBondContact O-N 3.24Å
126	V	86.2	Confident	77.7	Confident	103 Å²	103	100.9 Å²	100.9	62%	0.624	55%	0.548	S	S	*	.	H	α-helix	trans	-61.5	-42.1	177.6	170.7	0	0	0	0	111.3	A122 M129 Y130	A122-V126 WeakPolarHBondContact O-CG2 3.48Å; A122-V126 PolarHBondContact O-N 2.68Å; V126-M129 PolarHBondContact O-N 3.3Å; V126-Y130 WeakPolarHBondContact O-CB 3.37Å; V126-Y130 PolarHBondContact O-N 3.44Å
127	T	85	Confident	78	Confident	85 Å²	85	98.6 Å²	98.6	52%	0.521	54%	0.543	S	S	.	.	H	α-helix	trans	-64.8	-40.7	177.9	-55.5	0	0	0	0	111.7	A123 G124 I125 Y130 R131	A123-T127 WeakPolarHBondContact O-CB 3.24Å; A123-T127 PolarHBondContact O-N 2.83Å; A123-T127 PolarHBondContact O-OG1 2.93Å; G124-T127 PolarHBondContact O-N 3.05Å; I125-T127 VanDerWaalsContact C-N 3.33Å; I125-T127 PolarHBondContact O-N 3.39Å; T127-Y130 PolarHBondContact O-N 2.91Å; T127-R131 WeakPolarHBondContact O-CB 3.38Å; T127-R131 WeakPolarHBondContact O-CG 3.48Å; T127-R131 PolarHBondContact O-N 2.82Å
128	L	86.5	Confident	77.8	Confident	111 Å²	111	106.1 Å²	106.1	58%	0.581	58%	0.576	S	S	*	*	H	α-helix	trans	-66.4	-42	176.4	-177.4	63.9	0	0	0	111.8	G124 I125 R131 I132	G124-L128 WeakPolarHBondContact O-CB 3.41Å; G124-L128 PolarHBondContact O-N 2.92Å; I125-L128 PolarHBondContact O-N 3.1Å; L128-R131 PolarHBondContact O-N 3.24Å; L128-I132 HydrophobicContact CD1-CD1 4.4Å; L128-I132 HydrophobicContact CG-CD1 4.18Å; L128-I132 WeakPolarHBondContact O-CG1 3.47Å; L128-I132 PolarHBondContact O-N 3.1Å
129	M	83.5	Confident	78.5	Confident	132 Å²	132	105.7 Å²	105.7	65%	0.65	58%	0.575	S	S	*	*	H	α-helix	trans	-64.3	-41	175.2	-71.8	-159.1	85.7	0	0	112.1	I125 V126 I132 Y133	I125-M129 WeakPolarHBondContact O-CG 3.43Å; I125-M129 PolarHBondContact O-N 3.24Å; V126-M129 PolarHBondContact O-N 3.3Å; M129-I132 PolarHBondContact O-N 3.35Å; M129-Y133 WeakPolarHBondContact O-CB 3.26Å; M129-Y133 PolarHBondContact O-N 3.37Å
130	Y	85.8	Confident	79.2	Confident	160 Å²	160	107.3 Å²	107.3	63%	0.627	58%	0.58	S	S	*	*	H	α-helix	trans	-63.7	-43.2	176	-173.5	-103.8	0	0	0	111.5	V126 T127 I132 Y133 T134	V126-Y130 WeakPolarHBondContact O-CB 3.37Å; V126-Y130 PolarHBondContact O-N 3.44Å; T127-Y130 PolarHBondContact O-N 2.91Å; Y130-I132 PolarHBondContact O-N 3.28Å; Y130-Y133 PolarHBondContact O-N 2.87Å; Y130-T134 HydrophobicContact CD1-CG2 4.13Å; Y130-T134 HydrophobicContact CD2-CG2 4.44Å; Y130-T134 HydrophobicContact CE1-CG2 3.73Å; Y130-T134 HydrophobicContact CE2-CG2 4.06Å; Y130-T134 HydrophobicContact CG-CG2 4.47Å; Y130-T134 WeakPolarHBondContact O-CG2 3.35Å; Y130-T134 PolarHBondContact O-N 2.99Å; Y130-T134 PolarHBondContact O-OG1 3Å; Y130-T134 VanDerWaalsContact O-OG1 3.04Å
131	R	86.6	Confident	79.7	Confident	184 Å²	184	109.2 Å²	109.2	69%	0.694	58%	0.584	S	S	*	*	H	α-helix	trans	-58.4	-43.6	174.5	-85.6	-103.6	-177.3	143.1	-0.9	113	T127 L128 T134 A135	T127-R131 WeakPolarHBondContact O-CB 3.38Å; T127-R131 WeakPolarHBondContact O-CG 3.48Å; T127-R131 PolarHBondContact O-N 2.82Å; L128-R131 PolarHBondContact O-N 3.24Å; R131-T134 PolarHBondContact O-OG1 3.29Å; R131-T134 VanDerWaalsContact O-OG1 3.08Å; R131-A135 VanDerWaalsContact O-CB 3.3Å; R131-A135 WeakPolarHBondContact O-CB 3.45Å; R131-A135 PolarHBondContact O-N 3.1Å; R131-A135 VanDerWaalsContact O-N 3.09Å
132	I	85.1	Confident	79.9	Confident	108 Å²	108	109.1 Å²	109.1	55%	0.554	58%	0.584	S	S	*	*	H	α-helix	trans	-67.1	-45.6	177.8	-68.2	168	0	0	0	110.2	L128 M129 Y130 T134 A135 D136	L128-I132 HydrophobicContact CD1-CD1 4.4Å; L128-I132 HydrophobicContact CG-CD1 4.18Å; L128-I132 WeakPolarHBondContact O-CG1 3.47Å; L128-I132 PolarHBondContact O-N 3.1Å; M129-I132 PolarHBondContact O-N 3.35Å; Y130-I132 PolarHBondContact O-N 3.28Å; I132-T134 PolarHBondContact O-N 3.34Å; I132-A135 PolarHBondContact O-N 2.9Å; I132-D136 WeakPolarHBondContact O-CB 3.29Å; I132-D136 PolarHBondContact O-N 3.12Å
133	Y	86.4	Confident	80.1	Confident	160 Å²	160	112.6 Å²	112.6	63%	0.627	59%	0.593	S	S	*	*	H	α-helix	trans	-60.7	-43.3	178.5	178.3	-100.8	0	0	0	112.6	M129 Y130 D136 S137	M129-Y133 WeakPolarHBondContact O-CB 3.26Å; M129-Y133 PolarHBondContact O-N 3.37Å; Y130-Y133 PolarHBondContact O-N 2.87Å; Y133-D136 PolarHBondContact O-N 3.48Å; Y133-S137 PolarHBondContact O-N 3.1Å; Y133-S137 PolarHBondContact O-OG 3.11Å
134	T	83.4	Confident	80.1	Confident	52 Å²	52	116.3 Å²	116.3	32%	0.319	60%	0.602	S	S	.	*	H	α-helix	trans	-70	-32.5	178.4	54.1	0	0	0	0	112.6	Y130 R131 I132 D136	Y130-T134 HydrophobicContact CD1-CG2 4.13Å; Y130-T134 HydrophobicContact CD2-CG2 4.44Å; Y130-T134 HydrophobicContact CE1-CG2 3.73Å; Y130-T134 HydrophobicContact CE2-CG2 4.06Å; Y130-T134 HydrophobicContact CG-CG2 4.47Å; Y130-T134 WeakPolarHBondContact O-CG2 3.35Å; Y130-T134 PolarHBondContact O-N 2.99Å; Y130-T134 PolarHBondContact O-OG1 3Å; Y130-T134 VanDerWaalsContact O-OG1 3.04Å; R131-T134 PolarHBondContact O-OG1 3.29Å; R131-T134 VanDerWaalsContact O-OG1 3.08Å; I132-T134 PolarHBondContact O-N 3.34Å; T134-D136 VanDerWaalsContact C-N 3.34Å
135	A	75.4	Confident	79.8	Confident	70 Å²	70	121.6 Å²	121.6	58%	0.579	61%	0.614	S	S	*	*	H	α-helix	trans	-75.4	-22.5	176.9	0	0	0	0	0	113.3	R131 I132	R131-A135 VanDerWaalsContact O-CB 3.3Å; R131-A135 WeakPolarHBondContact O-CB 3.45Å; R131-A135 PolarHBondContact O-N 3.1Å; R131-A135 VanDerWaalsContact O-N 3.09Å; I132-A135 PolarHBondContact O-N 2.9Å
136	D	69.3	Low	79.6	Confident	138 Å²	138	124 Å²	124	74%	0.738	63%	0.625	S	S	*	*	H	α-helix	trans	-86.1	-17.8	175.2	-166.8	-107.5	0	0	0	112.6	I132 Y133 T134	I132-D136 WeakPolarHBondContact O-CB 3.29Å; I132-D136 PolarHBondContact O-N 3.12Å; Y133-D136 PolarHBondContact O-N 3.48Å; T134-D136 VanDerWaalsContact C-N 3.34Å
137	S	63.6	Low	79	Confident	73 Å²	73	125.8 Å²	125.8	51%	0.51	63%	0.625	S	S	.	*			trans	-89.9	9.8	-178.2	-58.3	0	0	0	0	114.5	Y133	Y133-S137 PolarHBondContact O-N 3.1Å; Y133-S137 PolarHBondContact O-OG 3.11Å
138	E	57.8	Low	78.5	Confident	236 Å²	236	129.5 Å²	129.5	100%	1.103	64%	0.635	S	S	*	*			trans	-107.2	0	175.9	-68.8	-175.7	92.9	0	0	112.8

Retrieved 138 of 138 residues in 171.7 ms (Link to these results)

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