A0A077ZJT8_TRITR Loading...

Cytochrome b5

AlphaFold DB , UniProt , Accession A0A077ZJT8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 106 aa.

						>A0A077ZJT8_TRITR|A0A077ZJT8
MSPALRTFTRSEVEEHNAKSSTWLVIENKVYDVTGFLEEHPGGIEVLLEHAGRDATEGFEDAGHSNDAKEIREQYLIGEIVEVCISDLPVLVFNNRTFFAEREKIL
					

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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	37.9	Very low	77.6	Confident	240 Å²	240	101 Å²	101	100%	1.182	56%	0.56	S	S	*	*				0	111.9	0	-73	-173.3	-179.7	0	0	106.4
2	S	50.5	Low	79.1	Confident	112 Å²	112	99.2 Å²	99.2	78%	0.783	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-61.3	133.4	165.9	-29.6	0	0	0	0	106.8	A4	S2-A4 PolarHBondContact O-N 3.18Å
3	P	57.7	Low	80.5	Confident	118 Å²	118	91.6 Å²	91.6	77%	0.766	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-51.4	135.6	171.3	21.3	-30.7	0	0	0	108.6	L5	P3-L5 PolarHBondContact O-N 2.91Å
4	A	71	Confident	81.7	Confident	99 Å²	99	93.1 Å²	93.1	82%	0.818	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-53.8	124.9	-178.6	0	0	0	0	0	109.1	S2	S2-A4 PolarHBondContact O-N 3.18Å
5	L	80.3	Confident	82.7	Confident	77 Å²	77	96.6 Å²	96.6	40%	0.403	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-60	143.8	174.6	-72	175.8	0	0	0	108.7	P3 L76	P3-L5 PolarHBondContact O-N 2.91Å; L5-L76 HydrophobicContact CD1-CD2 4.2Å; L5-L76 HydrophobicContact CD2-CD2 4.12Å; L5-L76 HydrophobicContact CD2-CG 4.26Å
6	R	90	Very high	83.7	Confident	181 Å²	181	93.3 Å²	93.3	68%	0.683	50%	0.497	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.2	148.6	173.2	-61.3	-175.2	74	158.1	0.3	108.3	F8 G78 E79	R6-F8 HydrophobicContact CB-CD2 4.49Å; R6-F8 HydrophobicContact CB-CE2 3.69Å; R6-F8 HydrophobicContact CB-CZ 3.82Å; R6-G78 CarbonylContact O-C 3.46Å; R6-G78 WeakPolarHBondContact O-CA 3.46Å; R6-E79 PolarHBondContact O-N 3.44Å
7	T	91.6	Very high	84.5	Confident	57 Å²	57	93.5 Å²	93.5	35%	0.35	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	141	174.8	48.7	0	0	0	0	108.7	E79 V81	T7-E79 WeakPolarHBondContact CA-O 3.44Å; T7-E79 HydrophobicContact CG2-CG 4.02Å; T7-V81 HydrophobicContact CG2-CG1 3.63Å
8	F	94.1	Very high	85.2	Confident	20 Å²	20	90.5 Å²	90.5	9%	0.088	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	146.7	-179.3	-61.5	-81.3	0	0	0	109.7	R6 E12 V13 W23 V30 I77 E79 I80 V81	R6-F8 HydrophobicContact CB-CD2 4.49Å; R6-F8 HydrophobicContact CB-CE2 3.69Å; R6-F8 HydrophobicContact CB-CZ 3.82Å; F8-E12 WeakPolarHBondContact CA-OE2 3.49Å; F8-V13 HydrophobicContact CB-CG2 4.07Å; F8-W23 HydrophobicContact CD1-CH2 4.27Å; F8-W23 AromaticContact CD1-CZ3 3.82Å; F8-W23 HydrophobicContact CD1-CZ3 3.82Å; F8-W23 AromaticContact CE1-CH2 3.68Å; F8-W23 HydrophobicContact CE1-CH2 3.68Å; F8-W23 AromaticContact CE1-CZ3 3.69Å; F8-W23 HydrophobicContact CE1-CZ3 3.69Å; F8-W23 HydrophobicContact CG-CZ3 4.44Å; F8-W23 HydrophobicContact CZ-CH2 4.09Å; F8-W23 HydrophobicContact CZ-CZ3 4.22Å; F8-V30 HydrophobicContact CB-CG2 4.15Å; F8-V30 HydrophobicContact CD2-CB 4.09Å; F8-V30 HydrophobicContact CD2-CG1 4.36Å; F8-V30 HydrophobicContact CD2-CG2 3.94Å; F8-V30 HydrophobicContact CG-CG2 4.39Å; F8-I77 HydrophobicContact CE2-CD1 4.02Å; F8-I77 HydrophobicContact CE2-CG1 4.09Å; F8-I77 HydrophobicContact CZ-CD1 3.96Å; F8-I77 HydrophobicContact CZ-CG1 4.45Å; F8-E79 PolarHBondContact N-O 3.08Å; F8-I80 CarbonylContact O-C 3.55Å; F8-I80 VanDerWaalsContact O-CA 3.27Å; F8-I80 WeakPolarHBondContact O-CA 3.26Å; F8-V81 PolarHBondContact O-N 3.4Å
9	T	93.6	Very high	85.8	Confident	27 Å²	27	93 Å²	93	17%	0.166	49%	0.494	C	S	.	.			trans	-85.2	159	166.6	61.3	0	0	0	0	110.4	S11 E12 V13 C84	T9-S11 PolarHBondContact O-N 3.35Å; T9-E12 PolarHBondContact N-OE2 3.26Å; T9-E12 PolarHBondContact O-N 2.82Å; T9-E12 WeakPolarHBondContact OG1-CG 3.46Å; T9-E12 PolarHBondContact OG1-N 3.16Å; T9-E12 PolarHBondContact OG1-OE2 3.03Å; T9-E12 VanDerWaalsContact OG1-OE2 3.09Å; T9-V13 PolarHBondContact O-N 3.03Å; T9-C84 WeakPolarHBondContact CG2-SG 3.42Å
10	R	93.5	Very high	86.4	Confident	104 Å²	104	93.8 Å²	93.8	39%	0.392	51%	0.507	S	S	.	.	H	α-helix	trans	-58.2	-38.4	172.2	-67.3	-164.8	-175.9	91.1	8.5	111.9	E12 V13 E14 I80 E82	R10-E12 VanDerWaalsContact C-N 3.32Å; R10-E12 PolarHBondContact O-N 2.95Å; R10-V13 PolarHBondContact O-N 3.46Å; R10-V13 VanDerWaalsContact O-N 3.16Å; R10-E14 WeakPolarHBondContact O-CG 3.43Å; R10-E14 PolarHBondContact O-N 2.94Å; R10-I80 HydrophobicContact CG-CD1 4.33Å; R10-I80 HydrophobicContact CG-CG2 3.99Å; R10-E82 IonicContact CZ-OE1 2.74Å; R10-E82 IonicContact NH1-OE1 3.37Å; R10-E82 PolarHBondContact NH1-OE1 2.93Å; R10-E82 IonicContact NH1-OE2 2.8Å; R10-E82 PolarHBondContact NH1-OE2 3Å; R10-E82 IonicContact NH2-OE1 3.83Å; R10-E82 PolarHBondContact NH2-OE1 3.21Å
11	S	93.6	Very high	86.9	Confident	76 Å²	76	90.9 Å²	90.9	53%	0.531	49%	0.494	S	S	.	.	H	α-helix	trans	-61.2	-39.1	177.9	-171	0	0	0	0	112.5	T9	T9-S11 PolarHBondContact O-N 3.35Å
12	E	95	Very high	89.8	Confident	79 Å²	79	79.4 Å²	79.4	37%	0.369	44%	0.438	S	S	.	.	H	α-helix	trans	-65.9	-43.9	175.1	-74.2	166.4	138.1	0	0	110.6	F8 T9 R10 E14 E15 H16	F8-E12 WeakPolarHBondContact CA-OE2 3.49Å; T9-E12 PolarHBondContact N-OE2 3.26Å; T9-E12 PolarHBondContact O-N 2.82Å; T9-E12 WeakPolarHBondContact OG1-CG 3.46Å; T9-E12 PolarHBondContact OG1-N 3.16Å; T9-E12 PolarHBondContact OG1-OE2 3.03Å; T9-E12 VanDerWaalsContact OG1-OE2 3.09Å; R10-E12 VanDerWaalsContact C-N 3.32Å; R10-E12 PolarHBondContact O-N 2.95Å; E12-E14 VanDerWaalsContact C-N 3.3Å; E12-E14 PolarHBondContact O-N 3.28Å; E12-E15 WeakPolarHBondContact O-CB 3.47Å; E12-E15 PolarHBondContact O-N 2.96Å; E12-H16 PolarHBondContact O-CD2 3.43Å; E12-H16 VanDerWaalsContact O-CD2 3.23Å
13	V	97.3	Very high	92.1	Very high	1 Å²	1	75.4 Å²	75.4	1%	0.006	41%	0.405	C	S	.	.	H	α-helix	trans	-64.1	-35.1	179.2	-178.6	0	0	0	0	112.2	F8 T9 R10 E15 H16 W23 V25 V30 G52 I80	F8-V13 HydrophobicContact CB-CG2 4.07Å; T9-V13 PolarHBondContact O-N 3.03Å; R10-V13 PolarHBondContact O-N 3.46Å; R10-V13 VanDerWaalsContact O-N 3.16Å; V13-E15 PolarHBondContact O-N 3.29Å; V13-E15 VanDerWaalsContact O-N 3.17Å; V13-H16 PolarHBondContact O-N 2.9Å; V13-W23 HydrophobicContact CG1-CB 3.98Å; V13-W23 HydrophobicContact CG1-CE3 4.48Å; V13-W23 HydrophobicContact CG2-CE3 4.16Å; V13-V25 HydrophobicContact CB-CG2 4.36Å; V13-V25 HydrophobicContact CG1-CG2 3.79Å; V13-V25 HydrophobicContact CG2-CG2 4.38Å; V13-V30 HydrophobicContact CG1-CG1 4.42Å; V13-V30 HydrophobicContact CG2-CG1 3.78Å; V13-V30 HydrophobicContact CG2-CG2 3.9Å; V13-G52 VanDerWaalsContact O-CA 3.22Å; V13-G52 WeakPolarHBondContact O-CA 3.39Å; V13-I80 HydrophobicContact CG2-CD1 3.69Å
14	E	97.2	Very high	94	Very high	112 Å²	112	70 Å²	70	52%	0.523	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-23.7	177	-77.3	173.2	-172.6	0	0	113.8	R10 E12 H16 N17 G52	R10-E14 WeakPolarHBondContact O-CG 3.43Å; R10-E14 PolarHBondContact O-N 2.94Å; E12-E14 VanDerWaalsContact C-N 3.3Å; E12-E14 PolarHBondContact O-N 3.28Å; E14-H16 VanDerWaalsContact C-N 3.26Å; E14-H16 PolarHBondContact O-N 3.18Å; E14-N17 PolarHBondContact O-ND2 3.02Å; E14-G52 WeakPolarHBondContact CA-O 3Å; E14-G52 WeakPolarHBondContact CG-O 3.49Å
15	E	97.8	Very high	95.3	Very high	146 Å²	146	65.6 Å²	65.6	68%	0.682	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-20.2	175.5	-60.6	-175.4	176.8	0	0	112.6	E12 V13 N17	E12-E15 WeakPolarHBondContact O-CB 3.47Å; E12-E15 PolarHBondContact O-N 2.96Å; V13-E15 PolarHBondContact O-N 3.29Å; V13-E15 VanDerWaalsContact O-N 3.17Å; E15-N17 PolarHBondContact O-N 3.48Å
16	H	98.2	Very high	96.2	Very high	44 Å²	44	62.3 Å²	62.3	20%	0.204	32%	0.316	C	S	.	.			trans	-97.8	58.1	-177.9	-62.9	-82.9	0	0	0	111.4	E12 V13 E14 S21 T22 W23 G52	E12-H16 PolarHBondContact O-CD2 3.43Å; E12-H16 VanDerWaalsContact O-CD2 3.23Å; V13-H16 PolarHBondContact O-N 2.9Å; E14-H16 VanDerWaalsContact C-N 3.26Å; E14-H16 PolarHBondContact O-N 3.18Å; H16-S21 CarbonylContact C-O 3.53Å; H16-S21 WeakPolarHBondContact CA-O 3.48Å; H16-S21 PolarHBondContact ND1-OG 3.4Å; H16-S21 VanDerWaalsContact O-O 3.07Å; H16-T22 WeakPolarHBondContact O-CA 3.32Å; H16-W23 HydrophobicContact CB-CB 3.65Å; H16-W23 HydrophobicContact CB-CD2 3.58Å; H16-W23 HydrophobicContact CB-CE3 4.02Å; H16-W23 HydrophobicContact CB-CG 3.4Å; H16-W23 AromaticContact CD2-CD2 3.5Å; H16-W23 VanDerWaalsContact CD2-CD2 3.5Å; H16-W23 AromaticContact CD2-CE2 3.82Å; H16-W23 AromaticContact CD2-CE3 3.22Å; H16-W23 AromaticContact CD2-CH2 3.66Å; H16-W23 AromaticContact CD2-CZ2 3.92Å; H16-W23 AromaticContact CD2-CZ3 3.31Å; H16-W23 WeakPolarHBondContact CD2-CZ3 3.22Å; H16-W23 AromaticContact CE1-CE2 3.77Å; H16-W23 AromaticContact CE1-CH2 3.71Å; H16-W23 AromaticContact CE1-CZ2 3.5Å; H16-W23 AromaticContact CG-CD2 3.37Å; H16-W23 AromaticContact CG-CE2 3.61Å; H16-W23 AromaticContact CG-CE3 3.62Å; H16-W23 AromaticContact CG-CG 3.76Å; H16-W23 AromaticContact ND1-CD2 3.87Å; H16-W23 AromaticContact ND1-CE2 3.58Å; H16-W23 AromaticContact ND1-CZ2 3.82Å; H16-W23 AromaticContact ND1-NE1 3.87Å; H16-W23 AromaticContact NE2-CE2 3.93Å; H16-W23 AromaticContact NE2-CE3 3.81Å; H16-W23 AromaticContact NE2-CH2 3.27Å; H16-W23 VanDerWaalsContact NE2-CH2 3.27Å; H16-W23 WeakPolarHBondContact NE2-CH2 3.44Å; H16-W23 AromaticContact NE2-CZ2 3.57Å; H16-W23 AromaticContact NE2-CZ3 3.41Å; H16-W23 WeakPolarHBondContact NE2-CZ3 3.41Å; H16-W23 PolarHBondContact O-N 3.16Å; H16-G52 PolarHBondContact O-N 2.87Å
17	N	97.8	Very high	96.5	Very high	96 Å²	96	58.7 Å²	58.7	51%	0.513	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	18	-170.8	66.3	25.8	0	0	0	115.2	E14 E15 S21 A51	E14-N17 PolarHBondContact O-ND2 3.02Å; E15-N17 PolarHBondContact O-N 3.48Å; N17-S21 PolarHBondContact N-O 3.31Å; N17-A51 HydrophobicContact CB-CB 4.36Å; N17-A51 WeakPolarHBondContact CB-O 3.25Å
18	A	96.6	Very high	96.7	Very high	40 Å²	40	59.9 Å²	59.9	33%	0.331	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	161.4	-171.9	0	0	0	0	0	112.6	S20 S21 T22	A18-S20 PolarHBondContact O-N 3.09Å; A18-S20 VanDerWaalsContact O-N 3.07Å; A18-S21 PolarHBondContact N-O 3.3Å; A18-S21 CarbonylContact O-C 3.55Å; A18-S21 WeakPolarHBondContact O-CA 3.41Å; A18-S21 PolarHBondContact O-N 3.5Å; A18-T22 PolarHBondContact O-N 3.21Å; A18-T22 PolarHBondContact O-OG1 2.93Å
19	K	96.9	Very high	96.8	Very high	138 Å²	138	62 Å²	62	60%	0.6	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-31.6	178	-74.5	-174.2	174.7	-171.8	0	114.4	S21 L37 L48	K19-S21 VanDerWaalsContact C-N 3.31Å; K19-L37 WeakPolarHBondContact O-CD1 3.36Å; K19-L48 HydrophobicContact CD-CD1 4.05Å; K19-L48 HydrophobicContact CG-CD1 3.53Å; K19-L48 HydrophobicContact CG-CD2 3.84Å; K19-L48 HydrophobicContact CG-CG 4.35Å
20	S	96.8	Very high	97	Very high	108 Å²	108	60.8 Å²	60.8	76%	0.755	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-12.6	177.5	54.6	0	0	0	0	113.6	A18	A18-S20 PolarHBondContact O-N 3.09Å; A18-S20 VanDerWaalsContact O-N 3.07Å
21	S	98	Very high	97.3	Very high	33 Å²	33	55.9 Å²	55.9	23%	0.231	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	97.2	177	-163	0	0	0	0	109.5	H16 N17 A18 K19 T34	H16-S21 CarbonylContact C-O 3.53Å; H16-S21 WeakPolarHBondContact CA-O 3.48Å; H16-S21 PolarHBondContact ND1-OG 3.4Å; H16-S21 VanDerWaalsContact O-O 3.07Å; N17-S21 PolarHBondContact N-O 3.31Å; A18-S21 PolarHBondContact N-O 3.3Å; A18-S21 CarbonylContact O-C 3.55Å; A18-S21 WeakPolarHBondContact O-CA 3.41Å; A18-S21 PolarHBondContact O-N 3.5Å; K19-S21 VanDerWaalsContact C-N 3.31Å; S21-T34 WeakPolarHBondContact CA-OG1 3.4Å
22	T	98.4	Very high	97.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	105.8	-175.2	-59.6	0	0	0	0	109.4	H16 A18 V33 T34 L37 L48 A51	H16-T22 WeakPolarHBondContact O-CA 3.32Å; A18-T22 PolarHBondContact O-N 3.21Å; A18-T22 PolarHBondContact O-OG1 2.93Å; T22-V33 HydrophobicContact CG2-CG2 3.71Å; T22-V33 WeakPolarHBondContact O-CG2 3.31Å; T22-V33 PolarHBondContact O-N 3.33Å; T22-T34 PolarHBondContact N-OG1 3.2Å; T22-T34 PolarHBondContact O-N 2.96Å; T22-L37 HydrophobicContact CG2-CD2 4.02Å; T22-L48 HydrophobicContact CG2-CD2 4.36Å; T22-A51 HydrophobicContact CG2-CB 3.76Å
23	W	98.6	Very high	97.6	Very high	27 Å²	27	51.5 Å²	51.5	10%	0.102	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	149.2	171.3	-64.7	0.5	0	0	0	110.9	F8 V13 H16 V30 Y31 D32 G52 I77	F8-W23 HydrophobicContact CD1-CH2 4.27Å; F8-W23 AromaticContact CD1-CZ3 3.82Å; F8-W23 HydrophobicContact CD1-CZ3 3.82Å; F8-W23 AromaticContact CE1-CH2 3.68Å; F8-W23 HydrophobicContact CE1-CH2 3.68Å; F8-W23 AromaticContact CE1-CZ3 3.69Å; F8-W23 HydrophobicContact CE1-CZ3 3.69Å; F8-W23 HydrophobicContact CG-CZ3 4.44Å; F8-W23 HydrophobicContact CZ-CH2 4.09Å; F8-W23 HydrophobicContact CZ-CZ3 4.22Å; V13-W23 HydrophobicContact CG1-CB 3.98Å; V13-W23 HydrophobicContact CG1-CE3 4.48Å; V13-W23 HydrophobicContact CG2-CE3 4.16Å; H16-W23 HydrophobicContact CB-CB 3.65Å; H16-W23 HydrophobicContact CB-CD2 3.58Å; H16-W23 HydrophobicContact CB-CE3 4.02Å; H16-W23 HydrophobicContact CB-CG 3.4Å; H16-W23 AromaticContact CD2-CD2 3.5Å; H16-W23 VanDerWaalsContact CD2-CD2 3.5Å; H16-W23 AromaticContact CD2-CE2 3.82Å; H16-W23 AromaticContact CD2-CE3 3.22Å; H16-W23 AromaticContact CD2-CH2 3.66Å; H16-W23 AromaticContact CD2-CZ2 3.92Å; H16-W23 AromaticContact CD2-CZ3 3.31Å; H16-W23 WeakPolarHBondContact CD2-CZ3 3.22Å; H16-W23 AromaticContact CE1-CE2 3.77Å; H16-W23 AromaticContact CE1-CH2 3.71Å; H16-W23 AromaticContact CE1-CZ2 3.5Å; H16-W23 AromaticContact CG-CD2 3.37Å; H16-W23 AromaticContact CG-CE2 3.61Å; H16-W23 AromaticContact CG-CE3 3.62Å; H16-W23 AromaticContact CG-CG 3.76Å; H16-W23 AromaticContact ND1-CD2 3.87Å; H16-W23 AromaticContact ND1-CE2 3.58Å; H16-W23 AromaticContact ND1-CZ2 3.82Å; H16-W23 AromaticContact ND1-NE1 3.87Å; H16-W23 AromaticContact NE2-CE2 3.93Å; H16-W23 AromaticContact NE2-CE3 3.81Å; H16-W23 AromaticContact NE2-CH2 3.27Å; H16-W23 VanDerWaalsContact NE2-CH2 3.27Å; H16-W23 WeakPolarHBondContact NE2-CH2 3.44Å; H16-W23 AromaticContact NE2-CZ2 3.57Å; H16-W23 AromaticContact NE2-CZ3 3.41Å; H16-W23 WeakPolarHBondContact NE2-CZ3 3.41Å; H16-W23 PolarHBondContact O-N 3.16Å; W23-V30 HydrophobicContact CB-CG1 4.4Å; W23-V30 HydrophobicContact CD2-CG1 4.31Å; W23-V30 HydrophobicContact CE3-CG1 3.81Å; W23-V30 HydrophobicContact CZ3-CG1 4.45Å; W23-Y31 CarbonylContact C-O 2.87Å; W23-Y31 WeakPolarHBondContact CA-O 3.29Å; W23-D32 VanDerWaalsContact CD1-CG 3.4Å; W23-D32 PolarHBondContact NE1-OD2 3.09Å; W23-G52 WeakPolarHBondContact O-CA 3.31Å; W23-G52 PolarHBondContact O-N 2.79Å; W23-I77 HydrophobicContact CD2-CD1 3.73Å; W23-I77 VanDerWaalsContact CE2-CD1 3.5Å; W23-I77 HydrophobicContact CE3-CD1 3.9Å; W23-I77 HydrophobicContact CG-CD1 4.45Å; W23-I77 HydrophobicContact CH2-CD1 3.69Å; W23-I77 HydrophobicContact CZ2-CD1 3.48Å; W23-I77 VanDerWaalsContact CZ2-CD1 3.48Å; W23-I77 HydrophobicContact CZ3-CD1 3.89Å
24	L	98.5	Very high	97.7	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	144	175.7	-60.9	177.3	0	0	0	109.5	Y31 V33 L47 H50 A55	L24-Y31 PolarHBondContact N-O 2.76Å; L24-Y31 PolarHBondContact O-N 3.31Å; L24-V33 HydrophobicContact CD1-CG1 4.35Å; L24-V33 HydrophobicContact CD1-CG2 3.84Å; L24-V33 HydrophobicContact CG-CG2 3.97Å; L24-L47 HydrophobicContact CD1-CD2 3.92Å; L24-H50 HydrophobicContact CD2-CB 3.73Å; L24-H50 WeakPolarHBondContact CD2-O 3.39Å; L24-A55 HydrophobicContact CB-CB 4.47Å; L24-A55 HydrophobicContact CD2-CB 4.34Å
25	V	98.5	Very high	97.7	Very high	6 Å²	6	51 Å²	51	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126	167.2	-177.1	0	0	0	0	108.7	V13 K29 R53 D54 A55 I80	V13-V25 HydrophobicContact CB-CG2 4.36Å; V13-V25 HydrophobicContact CG1-CG2 3.79Å; V13-V25 HydrophobicContact CG2-CG2 4.38Å; V25-K29 CarbonylContact C-O 3.55Å; V25-K29 VanDerWaalsContact CA-O 3.25Å; V25-K29 WeakPolarHBondContact CA-O 3.27Å; V25-R53 PolarHBondContact N-O 2.92Å; V25-D54 HydrophobicContact CB-CB 4.43Å; V25-D54 CarbonylContact O-C 3.55Å; V25-D54 WeakPolarHBondContact O-CA 3.21Å; V25-A55 PolarHBondContact O-N 2.93Å; V25-I80 HydrophobicContact CB-CG1 4.49Å; V25-I80 HydrophobicContact CG1-CG1 3.72Å; V25-I80 HydrophobicContact CG2-CD1 3.82Å; V25-I80 HydrophobicContact CG2-CG1 3.91Å
26	I	98.1	Very high	97.7	Very high	7 Å²	7	45.7 Å²	45.7	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	121.7	171.4	-60.2	167.8	0	0	0	107.5	N28 K29 Y31 A55 T56 F59 R72	I26-N28 VanDerWaalsContact C-N 3.3Å; I26-N28 PolarHBondContact O-N 3.17Å; I26-K29 PolarHBondContact N-O 3.19Å; I26-K29 WeakPolarHBondContact O-CB 3.33Å; I26-K29 PolarHBondContact O-N 3.38Å; I26-Y31 HydrophobicContact CB-CD2 4.19Å; I26-Y31 HydrophobicContact CB-CE2 3.78Å; I26-Y31 HydrophobicContact CD1-CD2 4.43Å; I26-Y31 HydrophobicContact CG1-CD2 4.44Å; I26-Y31 HydrophobicContact CG1-CE2 4.48Å; I26-A55 HydrophobicContact CG1-CB 4.14Å; I26-T56 WeakPolarHBondContact CA-OG1 3.5Å; I26-F59 HydrophobicContact CD1-CB 4.12Å; I26-F59 HydrophobicContact CD1-CD2 3.88Å; I26-F59 HydrophobicContact CD1-CG 3.99Å; I26-F59 HydrophobicContact CG2-CB 4.49Å; I26-F59 HydrophobicContact CG2-CD1 4.33Å; I26-F59 HydrophobicContact CG2-CG 4.45Å; I26-R72 VanDerWaalsContact CG2-NH1 3.28Å
27	E	96.2	Very high	97.7	Very high	105 Å²	105	44.1 Å²	44.1	49%	0.491	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	44.1	-178.9	-55.8	175	128.9	0	0	112.7	K29 T56 R72	E27-K29 PolarHBondContact O-N 2.98Å; E27-K29 VanDerWaalsContact O-N 3.11Å; E27-T56 HydrophobicContact CG-CG2 3.85Å; E27-T56 PolarHBondContact N-OG1 3.49Å; E27-R72 IonicContact OE2-CZ 3.35Å; E27-R72 IonicContact OE2-NH1 2.89Å; E27-R72 PolarHBondContact OE2-NH1 2.85Å; E27-R72 IonicContact OE2-NH2 3.03Å; E27-R72 PolarHBondContact OE2-NH2 3.47Å
28	N	95.3	Very high	97.6	Very high	82 Å²	82	47.9 Å²	47.9	44%	0.439	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	10.9	-173.7	-64.4	-40	0	0	0	115.5	I26 E79 I80	I26-N28 VanDerWaalsContact C-N 3.3Å; I26-N28 PolarHBondContact O-N 3.17Å; N28-E79 CarbonylContact O-C 3.58Å; N28-E79 WeakPolarHBondContact O-CA 3.41Å; N28-I80 HydrophobicContact CB-CB 4.32Å; N28-I80 PolarHBondContact O-N 3.21Å
29	K	97.2	Very high	97.6	Very high	66 Å²	66	52.1 Å²	52.1	29%	0.287	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	145.8	169.2	-71.3	175.5	173.7	-176	0	110.3	V25 I26 E27 Y31 E73 L76	V25-K29 CarbonylContact C-O 3.55Å; V25-K29 VanDerWaalsContact CA-O 3.25Å; V25-K29 WeakPolarHBondContact CA-O 3.27Å; I26-K29 PolarHBondContact N-O 3.19Å; I26-K29 WeakPolarHBondContact O-CB 3.33Å; I26-K29 PolarHBondContact O-N 3.38Å; E27-K29 PolarHBondContact O-N 2.98Å; E27-K29 VanDerWaalsContact O-N 3.11Å; K29-Y31 HydrophobicContact CB-CD2 4.36Å; K29-Y31 HydrophobicContact CB-CE2 3.48Å; K29-Y31 VanDerWaalsContact CB-CE2 3.48Å; K29-Y31 WeakPolarHBondContact CD-OH 3.44Å; K29-E73 IonicContact NZ-OE1 3.56Å; K29-E73 IonicContact NZ-OE2 2.86Å; K29-E73 PolarHBondContact NZ-OE2 3.32Å; K29-L76 HydrophobicContact CB-CD1 3.66Å; K29-L76 HydrophobicContact CD-CD1 3.96Å; K29-L76 HydrophobicContact CD-CD2 4.44Å; K29-L76 HydrophobicContact CG-CD1 3.98Å
30	V	98.1	Very high	97.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.1	-179.4	-171.4	0	0	0	0	109.6	F8 V13 W23 I77 G78 I80	F8-V30 HydrophobicContact CB-CG2 4.15Å; F8-V30 HydrophobicContact CD2-CB 4.09Å; F8-V30 HydrophobicContact CD2-CG1 4.36Å; F8-V30 HydrophobicContact CD2-CG2 3.94Å; F8-V30 HydrophobicContact CG-CG2 4.39Å; V13-V30 HydrophobicContact CG1-CG1 4.42Å; V13-V30 HydrophobicContact CG2-CG1 3.78Å; V13-V30 HydrophobicContact CG2-CG2 3.9Å; W23-V30 HydrophobicContact CB-CG1 4.4Å; W23-V30 HydrophobicContact CD2-CG1 4.31Å; W23-V30 HydrophobicContact CE3-CG1 3.81Å; W23-V30 HydrophobicContact CZ3-CG1 4.45Å; V30-I77 HydrophobicContact CB-CG1 4.12Å; V30-I77 HydrophobicContact CG1-CD1 3.88Å; V30-I77 HydrophobicContact CG1-CG1 3.9Å; V30-I77 VanDerWaalsContact O-CG1 3.26Å; V30-I77 WeakPolarHBondContact O-CG1 3.48Å; V30-I77 PolarHBondContact O-N 2.99Å; V30-G78 PolarHBondContact N-O 3.23Å; V30-G78 PolarHBondContact O-N 3.3Å; V30-I80 HydrophobicContact CG2-CD1 3.62Å; V30-I80 HydrophobicContact CG2-CG1 3.84Å
31	Y	98.5	Very high	97.6	Very high	1 Å²	1	47.9 Å²	47.9	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	127.7	-177.9	-60.3	-89.8	0	0	0	110.7	W23 L24 I26 K29 V33 R72 E73 Y75 L76	W23-Y31 CarbonylContact C-O 2.87Å; W23-Y31 WeakPolarHBondContact CA-O 3.29Å; L24-Y31 PolarHBondContact N-O 2.76Å; L24-Y31 PolarHBondContact O-N 3.31Å; I26-Y31 HydrophobicContact CB-CD2 4.19Å; I26-Y31 HydrophobicContact CB-CE2 3.78Å; I26-Y31 HydrophobicContact CD1-CD2 4.43Å; I26-Y31 HydrophobicContact CG1-CD2 4.44Å; I26-Y31 HydrophobicContact CG1-CE2 4.48Å; K29-Y31 HydrophobicContact CB-CD2 4.36Å; K29-Y31 HydrophobicContact CB-CE2 3.48Å; K29-Y31 VanDerWaalsContact CB-CE2 3.48Å; K29-Y31 WeakPolarHBondContact CD-OH 3.44Å; Y31-V33 PolarHBondContact O-N 2.8Å; Y31-R72 HydrophobicContact CD1-CG 3.9Å; Y31-R72 WeakPolarHBondContact CD1-O 3.05Å; Y31-R72 HydrophobicContact CE1-CG 3.58Å; Y31-R72 VanDerWaalsContact CE1-O 3.29Å; Y31-R72 WeakPolarHBondContact CE1-O 3.48Å; Y31-R72 HydrophobicContact CE2-CG 4.4Å; Y31-R72 HydrophobicContact CG-CG 4.43Å; Y31-R72 PolarHBondContact OH-NE 2.74Å; Y31-R72 PolarHBondContact OH-NH2 2.85Å; Y31-E73 PolarHBondContact OH-OE1 2.88Å; Y31-Y75 CarbonylContact C-O 3.53Å; Y31-Y75 WeakPolarHBondContact CA-O 3.4Å; Y31-L76 HydrophobicContact CD1-CB 4.07Å; Y31-L76 HydrophobicContact CD1-CD1 4.41Å; Y31-L76 HydrophobicContact CE1-CB 3.84Å; Y31-L76 HydrophobicContact CE1-CD1 3.98Å; Y31-L76 HydrophobicContact CE1-CG 4.49Å
32	D	98.5	Very high	97.5	Very high	52 Å²	52	48.7 Å²	48.7	28%	0.278	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	98.7	170	-171.7	-17.5	0	0	0	109.8	W23 T34 Y75 I77	W23-D32 VanDerWaalsContact CD1-CG 3.4Å; W23-D32 PolarHBondContact NE1-OD2 3.09Å; D32-T34 WeakPolarHBondContact OD1-CB 3.2Å; D32-T34 PolarHBondContact OD1-N 3.31Å; D32-T34 PolarHBondContact OD1-OG1 2.97Å; D32-Y75 PolarHBondContact N-O 2.88Å; D32-Y75 VanDerWaalsContact O-CD1 3.23Å; D32-Y75 WeakPolarHBondContact O-CD1 3.49Å; D32-I77 HydrophobicContact CB-CD1 4.18Å; D32-I77 HydrophobicContact CB-CG2 3.89Å
33	V	98.1	Very high	97.5	Very high	12 Å²	12	49.8 Å²	49.8	7%	0.073	29%	0.286	C	S	.	.			trans	-97.8	12.5	-177.4	-59.2	0	0	0	0	112.7	T22 L24 Y31 G35 F36 L37 Y75	T22-V33 HydrophobicContact CG2-CG2 3.71Å; T22-V33 WeakPolarHBondContact O-CG2 3.31Å; T22-V33 PolarHBondContact O-N 3.33Å; L24-V33 HydrophobicContact CD1-CG1 4.35Å; L24-V33 HydrophobicContact CD1-CG2 3.84Å; L24-V33 HydrophobicContact CG-CG2 3.97Å; Y31-V33 PolarHBondContact O-N 2.8Å; V33-G35 PolarHBondContact O-N 3.47Å; V33-F36 HydrophobicContact CB-CB 4.34Å; V33-F36 WeakPolarHBondContact O-CB 3.41Å; V33-F36 PolarHBondContact O-N 3.13Å; V33-L37 HydrophobicContact CG2-CD2 4.39Å; V33-L37 PolarHBondContact O-N 3.21Å; V33-Y75 HydrophobicContact CG1-CG 4.45Å
34	T	98.3	Very high	97.4	Very high	39 Å²	39	50.4 Å²	50.4	24%	0.239	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-54.5	-41.2	-176	-52.4	0	0	0	0	112.2	S21 T22 D32 F36 L37	S21-T34 WeakPolarHBondContact CA-OG1 3.4Å; T22-T34 PolarHBondContact N-OG1 3.2Å; T22-T34 PolarHBondContact O-N 2.96Å; D32-T34 WeakPolarHBondContact OD1-CB 3.2Å; D32-T34 PolarHBondContact OD1-N 3.31Å; D32-T34 PolarHBondContact OD1-OG1 2.97Å; T34-F36 VanDerWaalsContact C-N 3.33Å; T34-L37 WeakPolarHBondContact O-CG 3.36Å
35	G	97.1	Very high	97.3	Very high	63 Å²	63	56.6 Å²	56.6	65%	0.649	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-77.9	-13.1	177.7	0	0	0	0	0	114.8	V33	V33-G35 PolarHBondContact O-N 3.47Å
36	F	98	Very high	97.2	Very high	34 Å²	34	59.4 Å²	59.4	15%	0.149	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-97.5	-10	-176.4	-174.2	-119	0	0	0	113.4	V33 T34 E38 E39 H40 L47 I71 Y75	V33-F36 HydrophobicContact CB-CB 4.34Å; V33-F36 WeakPolarHBondContact O-CB 3.41Å; V33-F36 PolarHBondContact O-N 3.13Å; T34-F36 VanDerWaalsContact C-N 3.33Å; F36-E38 VanDerWaalsContact C-N 3.35Å; F36-E38 PolarHBondContact O-N 3.2Å; F36-E39 HydrophobicContact CD2-CB 3.62Å; F36-E39 HydrophobicContact CE2-CB 3.73Å; F36-E39 WeakPolarHBondContact O-CA 3.27Å; F36-E39 PolarHBondContact O-N 3.3Å; F36-H40 HydrophobicContact CD1-CB 4.18Å; F36-H40 HydrophobicContact CE1-CB 3.79Å; F36-H40 AromaticContact CE1-CD2 3.75Å; F36-H40 HydrophobicContact CZ-CB 4.27Å; F36-H40 PolarHBondContact O-N 3.3Å; F36-H40 VanDerWaalsContact O-N 3.08Å; F36-L47 HydrophobicContact CD1-CD1 4.39Å; F36-I71 HydrophobicContact CE2-CG2 4.3Å; F36-I71 HydrophobicContact CZ-CG2 4.44Å; F36-Y75 HydrophobicContact CB-CD1 4.43Å; F36-Y75 HydrophobicContact CB-CE1 3.74Å; F36-Y75 HydrophobicContact CB-CE2 4.07Å; F36-Y75 HydrophobicContact CD2-CE2 4.01Å; F36-Y75 AromaticContact CD2-CZ 3.78Å; F36-Y75 WeakPolarHBondContact CD2-OH 3.41Å; F36-Y75 HydrophobicContact CG-CE1 4.47Å; F36-Y75 AromaticContact CG-CE2 3.94Å; F36-Y75 HydrophobicContact CG-CE2 3.94Å; F36-Y75 AromaticContact CG-CZ 3.79Å
37	L	97.6	Very high	97.2	Very high	11 Å²	11	60.1 Å²	60.1	6%	0.058	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-49.1	-53.2	-171.7	-65.7	179	0	0	0	112.6	K19 T22 V33 T34 E39 H40 I44 L47 L48	K19-L37 WeakPolarHBondContact O-CD1 3.36Å; T22-L37 HydrophobicContact CG2-CD2 4.02Å; V33-L37 HydrophobicContact CG2-CD2 4.39Å; V33-L37 PolarHBondContact O-N 3.21Å; T34-L37 WeakPolarHBondContact O-CG 3.36Å; L37-E39 VanDerWaalsContact C-N 3.27Å; L37-E39 PolarHBondContact O-N 2.78Å; L37-H40 PolarHBondContact O-N 3.22Å; L37-I44 HydrophobicContact CB-CG1 4.41Å; L37-I44 HydrophobicContact CB-CG2 4.33Å; L37-I44 WeakPolarHBondContact O-CG1 3.44Å; L37-L47 HydrophobicContact CD2-CB 4.01Å; L37-L47 HydrophobicContact CD2-CD1 3.86Å; L37-L48 HydrophobicContact CD1-CD2 4.36Å; L37-L48 HydrophobicContact CD2-CD2 4.4Å
38	E	96.9	Very high	97.3	Very high	176 Å²	176	57.3 Å²	57.3	82%	0.822	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-75.6	-15	-177.8	-55.7	-165	164.4	0	0	113.8	F36 I44	F36-E38 VanDerWaalsContact C-N 3.35Å; F36-E38 PolarHBondContact O-N 3.2Å; E38-I44 HydrophobicContact CB-CD1 4.49Å; E38-I44 HydrophobicContact CG-CD1 3.97Å
39	E	96.6	Very high	97.4	Very high	129 Å²	129	59.7 Å²	59.7	60%	0.603	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-90.3	-13	179.2	-62.8	-178	-170.7	0	0	112.2	F36 L37 P41	F36-E39 HydrophobicContact CD2-CB 3.62Å; F36-E39 HydrophobicContact CE2-CB 3.73Å; F36-E39 WeakPolarHBondContact O-CA 3.27Å; F36-E39 PolarHBondContact O-N 3.3Å; L37-E39 VanDerWaalsContact C-N 3.27Å; L37-E39 PolarHBondContact O-N 2.78Å; E39-P41 WeakPolarHBondContact O-CD 3.49Å
40	H	97.4	Very high	97.4	Very high	27 Å²	27	59.2 Å²	59.2	13%	0.125	34%	0.336	C	S	.	.			trans	-69.6	114.1	-177.3	-177.6	-126.5	0	0	0	112.1	F36 L37 G42 G43 V46 L47	F36-H40 HydrophobicContact CD1-CB 4.18Å; F36-H40 HydrophobicContact CE1-CB 3.79Å; F36-H40 AromaticContact CE1-CD2 3.75Å; F36-H40 HydrophobicContact CZ-CB 4.27Å; F36-H40 PolarHBondContact O-N 3.3Å; F36-H40 VanDerWaalsContact O-N 3.08Å; L37-H40 PolarHBondContact O-N 3.22Å; H40-G42 VanDerWaalsContact CE1-CA 3.49Å; H40-G42 WeakPolarHBondContact CE1-CA 3.45Å; H40-G42 PolarHBondContact O-N 3.43Å; H40-G42 VanDerWaalsContact O-N 3.13Å; H40-G43 PolarHBondContact ND1-O 3.27Å; H40-G43 PolarHBondContact O-N 2.9Å; H40-V46 VanDerWaalsContact CE1-CG2 3.49Å; H40-V46 WeakPolarHBondContact CE1-CG2 3.48Å; H40-L47 HydrophobicContact CB-CD1 3.59Å; H40-L47 HydrophobicContact CB-CG 4.37Å
41	P	96.6	Very high	97.4	Very high	130 Å²	130	59.5 Å²	59.5	84%	0.844	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.9	-177.1	-24	36	0	0	0	114.3	E39 G43	E39-P41 WeakPolarHBondContact O-CD 3.49Å; P41-G43 PolarHBondContact O-N 2.66Å
42	G	95.8	Very high	97.4	Very high	49 Å²	49	59.6 Å²	59.6	51%	0.505	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-1.7	175.1	0	0	0	0	0	114.5	H40 V46	H40-G42 VanDerWaalsContact CE1-CA 3.49Å; H40-G42 WeakPolarHBondContact CE1-CA 3.45Å; H40-G42 PolarHBondContact O-N 3.43Å; H40-G42 VanDerWaalsContact O-N 3.13Å; G42-V46 WeakPolarHBondContact O-CG2 3.43Å
43	G	96.6	Very high	97.4	Very high	23 Å²	23	64.9 Å²	64.9	24%	0.237	36%	0.356	C	S	.	.			trans	94.2	158.7	-178.1	0	0	0	0	0	113.4	H40 P41 V46	H40-G43 PolarHBondContact ND1-O 3.27Å; H40-G43 PolarHBondContact O-N 2.9Å; P41-G43 PolarHBondContact O-N 2.66Å; G43-V46 VanDerWaalsContact O-CG2 3.28Å; G43-V46 WeakPolarHBondContact O-CG2 3.13Å
44	I	97.2	Very high	97.4	Very high	40 Å²	40	68.2 Å²	68.2	21%	0.205	37%	0.373	C	S	.	.	H	α-helix	trans	-73.1	-35.8	-177.8	-65.5	161.9	0	0	0	110.4	L37 E38 V46 L47 L48	L37-I44 HydrophobicContact CB-CG1 4.41Å; L37-I44 HydrophobicContact CB-CG2 4.33Å; L37-I44 WeakPolarHBondContact O-CG1 3.44Å; E38-I44 HydrophobicContact CB-CD1 4.49Å; E38-I44 HydrophobicContact CG-CD1 3.97Å; I44-V46 VanDerWaalsContact C-N 3.32Å; I44-V46 PolarHBondContact O-N 3.07Å; I44-L47 PolarHBondContact O-N 2.9Å; I44-L48 HydrophobicContact CG2-CD1 3.56Å; I44-L48 HydrophobicContact CG2-CG 3.98Å; I44-L48 PolarHBondContact O-N 2.93Å; I44-L48 VanDerWaalsContact O-N 3.11Å
45	E	97.1	Very high	97.4	Very high	137 Å²	137	66.8 Å²	66.8	64%	0.64	37%	0.365	S	S	*	.	H	α-helix	trans	-59.7	-41.8	-171.3	-67.7	72.8	-160.5	0	0	112	L47 L48 E49	E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 2.77Å; E45-L48 PolarHBondContact O-N 2.84Å; E45-E49 PolarHBondContact O-N 3.38Å
46	V	96.6	Very high	97.4	Very high	65 Å²	65	65.4 Å²	65.4	39%	0.394	34%	0.344	S	S	.	.	H	α-helix	trans	-67.4	-32.1	-179	-62.5	0	0	0	0	112.8	H40 G42 G43 I44 H50	H40-V46 VanDerWaalsContact CE1-CG2 3.49Å; H40-V46 WeakPolarHBondContact CE1-CG2 3.48Å; G42-V46 WeakPolarHBondContact O-CG2 3.43Å; G43-V46 VanDerWaalsContact O-CG2 3.28Å; G43-V46 WeakPolarHBondContact O-CG2 3.13Å; I44-V46 VanDerWaalsContact C-N 3.32Å; I44-V46 PolarHBondContact O-N 3.07Å; V46-H50 PolarHBondContact O-ND1 2.94Å
47	L	97.9	Very high	97.4	Very high	21 Å²	21	70.9 Å²	70.9	11%	0.11	37%	0.37	C	S	.	.	H	α-helix	trans	-71.2	-41.5	173.8	-63.7	-178.5	0	0	0	110.7	L24 F36 L37 H40 I44 E45 E49 H50 A51	L24-L47 HydrophobicContact CD1-CD2 3.92Å; F36-L47 HydrophobicContact CD1-CD1 4.39Å; L37-L47 HydrophobicContact CD2-CB 4.01Å; L37-L47 HydrophobicContact CD2-CD1 3.86Å; H40-L47 HydrophobicContact CB-CD1 3.59Å; H40-L47 HydrophobicContact CB-CG 4.37Å; I44-L47 PolarHBondContact O-N 2.9Å; E45-L47 VanDerWaalsContact C-N 3.33Å; E45-L47 PolarHBondContact O-N 2.77Å; L47-E49 VanDerWaalsContact C-N 3.34Å; L47-E49 PolarHBondContact O-N 3.45Å; L47-H50 CarbonylContact O-C 2.94Å; L47-H50 PolarHBondContact O-N 2.83Å; L47-A51 PolarHBondContact O-N 2.76Å; L47-A51 VanDerWaalsContact O-N 3.13Å
48	L	97.7	Very high	97.3	Very high	46 Å²	46	72 Å²	72	24%	0.241	38%	0.384	C	S	.	.	H	α-helix	trans	-70.4	-29	-179.1	-66.4	176.1	0	0	0	113.6	K19 T22 L37 I44 E45 H50 A51	K19-L48 HydrophobicContact CD-CD1 4.05Å; K19-L48 HydrophobicContact CG-CD1 3.53Å; K19-L48 HydrophobicContact CG-CD2 3.84Å; K19-L48 HydrophobicContact CG-CG 4.35Å; T22-L48 HydrophobicContact CG2-CD2 4.36Å; L37-L48 HydrophobicContact CD1-CD2 4.36Å; L37-L48 HydrophobicContact CD2-CD2 4.4Å; I44-L48 HydrophobicContact CG2-CD1 3.56Å; I44-L48 HydrophobicContact CG2-CG 3.98Å; I44-L48 PolarHBondContact O-N 2.93Å; I44-L48 VanDerWaalsContact O-N 3.11Å; E45-L48 PolarHBondContact O-N 2.84Å; L48-H50 PolarHBondContact O-N 2.6Å; L48-A51 WeakPolarHBondContact O-CB 3.29Å; L48-A51 PolarHBondContact O-N 3.31Å
49	E	97.2	Very high	97.4	Very high	132 Å²	132	64.7 Å²	64.7	62%	0.617	35%	0.35	S	S	*	.	H	α-helix	trans	-60.2	-30.5	172.7	-175.9	170.8	-167.4	0	0	112.4	E45 L47 R53	E45-E49 PolarHBondContact O-N 3.38Å; L47-E49 VanDerWaalsContact C-N 3.34Å; L47-E49 PolarHBondContact O-N 3.45Å; E49-R53 PolarHBondContact O-NH1 2.83Å
50	H	97.9	Very high	97.4	Very high	57 Å²	57	62.3 Å²	62.3	26%	0.264	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	4.2	179	-62.3	85.3	0	0	0	113.5	L24 V46 L47 L48 G52 R53 A55	L24-H50 HydrophobicContact CD2-CB 3.73Å; L24-H50 WeakPolarHBondContact CD2-O 3.39Å; V46-H50 PolarHBondContact O-ND1 2.94Å; L47-H50 CarbonylContact O-C 2.94Å; L47-H50 PolarHBondContact O-N 2.83Å; L48-H50 PolarHBondContact O-N 2.6Å; H50-G52 PolarHBondContact O-N 2.89Å; H50-R53 WeakPolarHBondContact O-CA 3.28Å; H50-R53 WeakPolarHBondContact O-CB 3.48Å; H50-R53 PolarHBondContact O-N 3.11Å; H50-A55 HydrophobicContact CB-CB 3.81Å
51	A	98.3	Very high	97.4	Very high	5 Å²	5	67 Å²	67	4%	0.041	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	129.5	-176.5	0	0	0	0	0	111.8	N17 T22 L47 L48 R53	N17-A51 HydrophobicContact CB-CB 4.36Å; N17-A51 WeakPolarHBondContact CB-O 3.25Å; T22-A51 HydrophobicContact CG2-CB 3.76Å; L47-A51 PolarHBondContact O-N 2.76Å; L47-A51 VanDerWaalsContact O-N 3.13Å; L48-A51 WeakPolarHBondContact O-CB 3.29Å; L48-A51 PolarHBondContact O-N 3.31Å; A51-R53 VanDerWaalsContact C-N 3.29Å
52	G	98.3	Very high	97.3	Very high	4 Å²	4	64.1 Å²	64.1	4%	0.041	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	19.4	-175	0	0	0	0	0	114.2	V13 E14 H16 W23 H50	V13-G52 VanDerWaalsContact O-CA 3.22Å; V13-G52 WeakPolarHBondContact O-CA 3.39Å; E14-G52 WeakPolarHBondContact CA-O 3Å; E14-G52 WeakPolarHBondContact CG-O 3.49Å; H16-G52 PolarHBondContact O-N 2.87Å; W23-G52 WeakPolarHBondContact O-CA 3.31Å; W23-G52 PolarHBondContact O-N 2.79Å; H50-G52 PolarHBondContact O-N 2.89Å
53	R	98.1	Very high	97.3	Very high	162 Å²	162	64.7 Å²	64.7	61%	0.611	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.9	173.4	-173.6	-55.6	176.9	-177.1	171	0.7	112.6	V25 E49 H50 A51	V25-R53 PolarHBondContact N-O 2.92Å; E49-R53 PolarHBondContact O-NH1 2.83Å; H50-R53 WeakPolarHBondContact O-CA 3.28Å; H50-R53 WeakPolarHBondContact O-CB 3.48Å; H50-R53 PolarHBondContact O-N 3.11Å; A51-R53 VanDerWaalsContact C-N 3.29Å
54	D	98	Very high	97.3	Very high	83 Å²	83	66.2 Å²	66.2	44%	0.444	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	121.7	168.7	-161.4	-43.5	0	0	0	110.5	V25 T56	V25-D54 HydrophobicContact CB-CB 4.43Å; V25-D54 CarbonylContact O-C 3.55Å; V25-D54 WeakPolarHBondContact O-CA 3.21Å; D54-T56 WeakPolarHBondContact OD1-CB 3.43Å; D54-T56 PolarHBondContact OD1-N 2.94Å; D54-T56 PolarHBondContact OD1-OG1 2.87Å
55	A	98.2	Very high	97.3	Very high	8 Å²	8	67.5 Å²	67.5	7%	0.066	37%	0.371	C	S	.	.			trans	-114.1	13.4	180	0	0	0	0	0	111.9	L24 V25 I26 H50 E57 G58 F59	L24-A55 HydrophobicContact CB-CB 4.47Å; L24-A55 HydrophobicContact CD2-CB 4.34Å; V25-A55 PolarHBondContact O-N 2.93Å; I26-A55 HydrophobicContact CG1-CB 4.14Å; H50-A55 HydrophobicContact CB-CB 3.81Å; A55-E57 PolarHBondContact O-N 2.89Å; A55-G58 PolarHBondContact O-N 3.11Å; A55-F59 VanDerWaalsContact O-CB 3.29Å; A55-F59 WeakPolarHBondContact O-CB 3.26Å; A55-F59 PolarHBondContact O-N 2.99Å
56	T	98.2	Very high	97.3	Very high	34 Å²	34	66.9 Å²	66.9	21%	0.209	37%	0.372	C	S	.	.	H	α-helix	trans	-58.4	-49.7	-173.9	-54.5	0	0	0	0	112	I26 E27 D54 F59 E60	I26-T56 WeakPolarHBondContact CA-OG1 3.5Å; E27-T56 HydrophobicContact CG-CG2 3.85Å; E27-T56 PolarHBondContact N-OG1 3.49Å; D54-T56 WeakPolarHBondContact OD1-CB 3.43Å; D54-T56 PolarHBondContact OD1-N 2.94Å; D54-T56 PolarHBondContact OD1-OG1 2.87Å; T56-F59 PolarHBondContact O-N 2.93Å; T56-E60 PolarHBondContact O-N 3.49Å
57	E	97.5	Very high	97.3	Very high	150 Å²	150	69.1 Å²	69.1	70%	0.701	38%	0.382	S	S	*	.	H	α-helix	trans	-61.8	-50.1	179.3	-174.9	175.7	-174.3	0	0	110.8	A55 F59 E60 D61	A55-E57 PolarHBondContact O-N 2.89Å; E57-F59 VanDerWaalsContact C-N 3.28Å; E57-F59 PolarHBondContact O-N 3.38Å; E57-E60 PolarHBondContact O-N 3.33Å; E57-D61 VanDerWaalsContact O-CB 3.31Å; E57-D61 WeakPolarHBondContact O-CB 3.14Å; E57-D61 PolarHBondContact O-N 2.88Å
58	G	96.5	Very high	97.3	Very high	34 Å²	34	69.2 Å²	69.2	35%	0.351	39%	0.386	S	S	.	.	H	α-helix	trans	-60.6	-35.5	178.1	0	0	0	0	0	113.6	A55 A62	A55-G58 PolarHBondContact O-N 3.11Å; G58-A62 WeakPolarHBondContact O-CB 3.5Å; G58-A62 PolarHBondContact O-N 3.03Å
59	F	97.8	Very high	97.2	Very high	23 Å²	23	70.1 Å²	70.1	10%	0.101	39%	0.388	C	S	.	.	H	α-helix	trans	-69.7	-42.9	177.6	-176.2	-92.9	0	0	0	112.5	I26 A55 T56 E57 H64 K69	I26-F59 HydrophobicContact CD1-CB 4.12Å; I26-F59 HydrophobicContact CD1-CD2 3.88Å; I26-F59 HydrophobicContact CD1-CG 3.99Å; I26-F59 HydrophobicContact CG2-CB 4.49Å; I26-F59 HydrophobicContact CG2-CD1 4.33Å; I26-F59 HydrophobicContact CG2-CG 4.45Å; A55-F59 VanDerWaalsContact O-CB 3.29Å; A55-F59 WeakPolarHBondContact O-CB 3.26Å; A55-F59 PolarHBondContact O-N 2.99Å; T56-F59 PolarHBondContact O-N 2.93Å; E57-F59 VanDerWaalsContact C-N 3.28Å; E57-F59 PolarHBondContact O-N 3.38Å; F59-H64 AromaticContact CD2-CE1 3.69Å; F59-H64 AromaticContact CD2-ND1 3.46Å; F59-H64 WeakPolarHBondContact CD2-ND1 3.2Å; F59-H64 HydrophobicContact CE1-CB 4.19Å; F59-H64 HydrophobicContact CE2-CB 4.16Å; F59-H64 AromaticContact CE2-CE1 3.89Å; F59-H64 AromaticContact CE2-CG 3.68Å; F59-H64 AromaticContact CE2-ND1 3.52Å; F59-H64 AromaticContact CG-ND1 3.86Å; F59-H64 HydrophobicContact CZ-CB 3.81Å; F59-H64 AromaticContact CZ-CG 3.87Å; F59-H64 AromaticContact CZ-ND1 3.97Å; F59-H64 PolarHBondContact O-ND1 3.19Å; F59-K69 HydrophobicContact CE1-CD 4.45Å; F59-K69 HydrophobicContact CE1-CG 3.89Å; F59-K69 HydrophobicContact CZ-CG 3.92Å
60	E	96.2	Very high	97.2	Very high	78 Å²	78	70.2 Å²	70.2	36%	0.364	39%	0.388	S	S	.	.	H	α-helix	trans	-74.8	-40.4	179.2	-69.8	-59.6	133.3	0	0	112.1	T56 E57 A62 G63 K69	T56-E60 PolarHBondContact O-N 3.49Å; E57-E60 PolarHBondContact O-N 3.33Å; E60-A62 VanDerWaalsContact C-N 3.26Å; E60-A62 PolarHBondContact O-N 3.05Å; E60-G63 PolarHBondContact O-N 3.29Å; E60-K69 IonicContact OE1-NZ 3.18Å; E60-K69 PolarHBondContact OE1-NZ 3.27Å; E60-K69 IonicContact OE2-NZ 2.96Å; E60-K69 PolarHBondContact OE2-NZ 2.9Å
61	D	97	Very high	97.2	Very high	126 Å²	126	70.8 Å²	70.8	67%	0.674	39%	0.393	S	S	*	.	H	α-helix	trans	-64.7	-30.2	178.7	-78.9	-6.4	0	0	0	112.8	E57 G63	E57-D61 VanDerWaalsContact O-CB 3.31Å; E57-D61 WeakPolarHBondContact O-CB 3.14Å; E57-D61 PolarHBondContact O-N 2.88Å; D61-G63 PolarHBondContact O-N 3.19Å
62	A	96.2	Very high	97.1	Very high	70 Å²	70	71.9 Å²	71.9	58%	0.579	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.3	174.1	0	0	0	0	0	113.4	G58 E60	G58-A62 WeakPolarHBondContact O-CB 3.5Å; G58-A62 PolarHBondContact O-N 3.03Å; E60-A62 VanDerWaalsContact C-N 3.26Å; E60-A62 PolarHBondContact O-N 3.05Å
63	G	95.4	Very high	97	Very high	61 Å²	61	74.9 Å²	74.9	63%	0.629	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	41.8	177.3	0	0	0	0	0	114	E60 D61	E60-G63 PolarHBondContact O-N 3.29Å; D61-G63 PolarHBondContact O-N 3.19Å
64	H	96.7	Very high	96.9	Very high	55 Å²	55	74.2 Å²	74.2	26%	0.255	41%	0.412	S	S	.	.			trans	-55.3	139.7	179.2	-76.6	98.6	0	0	0	113.2	F59 A68	F59-H64 AromaticContact CD2-CE1 3.69Å; F59-H64 AromaticContact CD2-ND1 3.46Å; F59-H64 WeakPolarHBondContact CD2-ND1 3.2Å; F59-H64 HydrophobicContact CE1-CB 4.19Å; F59-H64 HydrophobicContact CE2-CB 4.16Å; F59-H64 AromaticContact CE2-CE1 3.89Å; F59-H64 AromaticContact CE2-CG 3.68Å; F59-H64 AromaticContact CE2-ND1 3.52Å; F59-H64 AromaticContact CG-ND1 3.86Å; F59-H64 HydrophobicContact CZ-CB 3.81Å; F59-H64 AromaticContact CZ-CG 3.87Å; F59-H64 AromaticContact CZ-ND1 3.97Å; F59-H64 PolarHBondContact O-ND1 3.19Å; H64-A68 HydrophobicContact CB-CB 3.94Å
65	S	96.9	Very high	96.9	Very high	67 Å²	67	72.5 Å²	72.5	47%	0.469	40%	0.4	S	S	.	.			trans	-67.6	165.6	175.7	65.8	0	0	0	0	112.2	D67 A68 K69	S65-D67 VanDerWaalsContact C-N 3.27Å; S65-D67 PolarHBondContact O-N 2.58Å; S65-A68 WeakPolarHBondContact O-CB 3.31Å; S65-A68 PolarHBondContact O-N 3.3Å; S65-A68 VanDerWaalsContact O-N 3.12Å; S65-A68 PolarHBondContact OG-N 3.05Å; S65-K69 PolarHBondContact O-N 2.86Å
66	N	97	Very high	96.9	Very high	124 Å²	124	74 Å²	74	66%	0.663	41%	0.407	S	S	*	.	H	α-helix	trans	-57.9	-41.2	173	-69.1	-22.9	0	0	0	111.7	A68 K69 E70	N66-A68 VanDerWaalsContact C-N 3.29Å; N66-A68 PolarHBondContact O-N 3.29Å; N66-K69 CarbonylContact O-C 3.55Å; N66-K69 WeakPolarHBondContact O-CA 3.46Å; N66-K69 WeakPolarHBondContact O-CB 3.18Å; N66-K69 PolarHBondContact O-N 3.37Å; N66-E70 WeakPolarHBondContact O-CG 3.37Å; N66-E70 PolarHBondContact O-N 3.25Å
67	D	96.7	Very high	96.8	Very high	111 Å²	111	74.8 Å²	74.8	59%	0.594	41%	0.409	S	S	*	.	H	α-helix	trans	-58.9	-40.6	175.9	-58.3	-4.8	0	0	0	111.7	S65 E70 I71	S65-D67 VanDerWaalsContact C-N 3.27Å; S65-D67 PolarHBondContact O-N 2.58Å; D67-E70 PolarHBondContact O-N 2.84Å; D67-I71 VanDerWaalsContact O-CG1 3.31Å; D67-I71 WeakPolarHBondContact O-CG1 3.35Å; D67-I71 PolarHBondContact O-N 3.43Å
68	A	97	Very high	96.8	Very high	24 Å²	24	67.7 Å²	67.7	20%	0.198	38%	0.376	C	S	.	.	H	α-helix	trans	-66.5	-37.6	175.5	0	0	0	0	0	111.9	H64 S65 N66 E70 I71 R72	H64-A68 HydrophobicContact CB-CB 3.94Å; S65-A68 WeakPolarHBondContact O-CB 3.31Å; S65-A68 PolarHBondContact O-N 3.3Å; S65-A68 VanDerWaalsContact O-N 3.12Å; S65-A68 PolarHBondContact OG-N 3.05Å; N66-A68 VanDerWaalsContact C-N 3.29Å; N66-A68 PolarHBondContact O-N 3.29Å; A68-E70 VanDerWaalsContact C-N 3.32Å; A68-I71 PolarHBondContact O-N 3.35Å; A68-R72 WeakPolarHBondContact O-CB 3.23Å; A68-R72 PolarHBondContact O-N 3.23Å
69	K	97.4	Very high	96.7	Very high	65 Å²	65	70.2 Å²	70.2	28%	0.283	38%	0.379	S	S	.	.	H	α-helix	trans	-64.7	-35.5	172.5	-65.5	-174.6	-179.2	-148.8	0	111.7	F59 E60 S65 N66 R72 E73	F59-K69 HydrophobicContact CE1-CD 4.45Å; F59-K69 HydrophobicContact CE1-CG 3.89Å; F59-K69 HydrophobicContact CZ-CG 3.92Å; E60-K69 IonicContact OE1-NZ 3.18Å; E60-K69 PolarHBondContact OE1-NZ 3.27Å; E60-K69 IonicContact OE2-NZ 2.96Å; E60-K69 PolarHBondContact OE2-NZ 2.9Å; S65-K69 PolarHBondContact O-N 2.86Å; N66-K69 CarbonylContact O-C 3.55Å; N66-K69 WeakPolarHBondContact O-CA 3.46Å; N66-K69 WeakPolarHBondContact O-CB 3.18Å; N66-K69 PolarHBondContact O-N 3.37Å; K69-R72 WeakPolarHBondContact O-CB 3.29Å; K69-E73 PolarHBondContact O-N 3.35Å
70	E	96.9	Very high	96.6	Very high	133 Å²	133	70 Å²	70	62%	0.621	38%	0.378	S	S	*	.	H	α-helix	trans	-70.2	-42.4	174.5	-71.7	-179.4	-172.2	0	0	112.5	N66 D67 A68 R72 E73	N66-E70 WeakPolarHBondContact O-CG 3.37Å; N66-E70 PolarHBondContact O-N 3.25Å; D67-E70 PolarHBondContact O-N 2.84Å; A68-E70 VanDerWaalsContact C-N 3.32Å; E70-R72 VanDerWaalsContact C-N 3.31Å; E70-R72 PolarHBondContact O-N 3.17Å; E70-E73 PolarHBondContact O-N 3.32Å
71	I	96.6	Very high	96.2	Very high	69 Å²	69	67.7 Å²	67.7	35%	0.354	37%	0.37	S	S	.	.	H	α-helix	trans	-60.7	-42.7	173.9	-69.5	165.8	0	0	0	110.3	F36 D67 A68 E73 Q74 Y75	F36-I71 HydrophobicContact CE2-CG2 4.3Å; F36-I71 HydrophobicContact CZ-CG2 4.44Å; D67-I71 VanDerWaalsContact O-CG1 3.31Å; D67-I71 WeakPolarHBondContact O-CG1 3.35Å; D67-I71 PolarHBondContact O-N 3.43Å; A68-I71 PolarHBondContact O-N 3.35Å; I71-E73 VanDerWaalsContact C-N 3.27Å; I71-E73 PolarHBondContact O-N 3.36Å; I71-Q74 VanDerWaalsContact O-CB 3.26Å; I71-Q74 WeakPolarHBondContact O-CB 3.49Å; I71-Q74 WeakPolarHBondContact O-CG 3.18Å; I71-Q74 PolarHBondContact O-N 3.38Å; I71-Y75 HydrophobicContact CG2-CE2 3.88Å; I71-Y75 WeakPolarHBondContact O-CD2 3.38Å
72	R	96.9	Very high	95.2	Very high	29 Å²	29	68.3 Å²	68.3	11%	0.109	37%	0.369	C	S	.	.	H	α-helix	trans	-51.5	-45.2	176	-177.7	-168	71.3	172.2	11	111.8	I26 E27 Y31 A68 K69 E70 Q74 Y75	I26-R72 VanDerWaalsContact CG2-NH1 3.28Å; E27-R72 IonicContact OE2-CZ 3.35Å; E27-R72 IonicContact OE2-NH1 2.89Å; E27-R72 PolarHBondContact OE2-NH1 2.85Å; E27-R72 IonicContact OE2-NH2 3.03Å; E27-R72 PolarHBondContact OE2-NH2 3.47Å; Y31-R72 HydrophobicContact CD1-CG 3.9Å; Y31-R72 WeakPolarHBondContact CD1-O 3.05Å; Y31-R72 HydrophobicContact CE1-CG 3.58Å; Y31-R72 VanDerWaalsContact CE1-O 3.29Å; Y31-R72 WeakPolarHBondContact CE1-O 3.48Å; Y31-R72 HydrophobicContact CE2-CG 4.4Å; Y31-R72 HydrophobicContact CG-CG 4.43Å; Y31-R72 PolarHBondContact OH-NE 2.74Å; Y31-R72 PolarHBondContact OH-NH2 2.85Å; A68-R72 WeakPolarHBondContact O-CB 3.23Å; A68-R72 PolarHBondContact O-N 3.23Å; K69-R72 WeakPolarHBondContact O-CB 3.29Å; E70-R72 VanDerWaalsContact C-N 3.31Å; E70-R72 PolarHBondContact O-N 3.17Å; R72-Q74 PolarHBondContact O-N 3.03Å; R72-Q74 VanDerWaalsContact O-N 3.13Å; R72-Y75 PolarHBondContact O-N 2.81Å
73	E	96.4	Very high	93.9	Very high	67 Å²	67	67.4 Å²	67.4	31%	0.313	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-18.1	-178.2	-62.3	-58.8	123.4	0	0	113.6	K29 Y31 K69 E70 I71 Y75 L76	K29-E73 IonicContact NZ-OE1 3.56Å; K29-E73 IonicContact NZ-OE2 2.86Å; K29-E73 PolarHBondContact NZ-OE2 3.32Å; Y31-E73 PolarHBondContact OH-OE1 2.88Å; K69-E73 PolarHBondContact O-N 3.35Å; E70-E73 PolarHBondContact O-N 3.32Å; I71-E73 VanDerWaalsContact C-N 3.27Å; I71-E73 PolarHBondContact O-N 3.36Å; E73-Y75 PolarHBondContact O-N 2.97Å; E73-L76 WeakPolarHBondContact O-CB 3.43Å; E73-L76 PolarHBondContact O-N 3.13Å
74	Q	96.2	Very high	92.4	Very high	147 Å²	147	66 Å²	66	69%	0.687	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-23.7	174.1	-56.3	-179.2	23.9	0	0	112.7	I71 R72	I71-Q74 VanDerWaalsContact O-CB 3.26Å; I71-Q74 WeakPolarHBondContact O-CB 3.49Å; I71-Q74 WeakPolarHBondContact O-CG 3.18Å; I71-Q74 PolarHBondContact O-N 3.38Å; R72-Q74 PolarHBondContact O-N 3.03Å; R72-Q74 VanDerWaalsContact O-N 3.13Å
75	Y	97.6	Very high	91.1	Very high	48 Å²	48	67.4 Å²	67.4	19%	0.188	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	2.7	-179.3	-59.8	-77.8	0	0	0	112.8	Y31 D32 V33 F36 I71 R72 E73 I77	Y31-Y75 CarbonylContact C-O 3.53Å; Y31-Y75 WeakPolarHBondContact CA-O 3.4Å; D32-Y75 PolarHBondContact N-O 2.88Å; D32-Y75 VanDerWaalsContact O-CD1 3.23Å; D32-Y75 WeakPolarHBondContact O-CD1 3.49Å; V33-Y75 HydrophobicContact CG1-CG 4.45Å; F36-Y75 HydrophobicContact CB-CD1 4.43Å; F36-Y75 HydrophobicContact CB-CE1 3.74Å; F36-Y75 HydrophobicContact CB-CE2 4.07Å; F36-Y75 HydrophobicContact CD2-CE2 4.01Å; F36-Y75 AromaticContact CD2-CZ 3.78Å; F36-Y75 WeakPolarHBondContact CD2-OH 3.41Å; F36-Y75 HydrophobicContact CG-CE1 4.47Å; F36-Y75 AromaticContact CG-CE2 3.94Å; F36-Y75 HydrophobicContact CG-CE2 3.94Å; F36-Y75 AromaticContact CG-CZ 3.79Å; I71-Y75 HydrophobicContact CG2-CE2 3.88Å; I71-Y75 WeakPolarHBondContact O-CD2 3.38Å; R72-Y75 PolarHBondContact O-N 2.81Å; E73-Y75 PolarHBondContact O-N 2.97Å; Y75-I77 PolarHBondContact O-N 3.43Å
76	L	97.6	Very high	89.7	Confident	40 Å²	40	69 Å²	69	21%	0.209	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	121.5	-179.6	179	63.3	0	0	0	110.9	L5 K29 Y31 E73 G78	L5-L76 HydrophobicContact CD1-CD2 4.2Å; L5-L76 HydrophobicContact CD2-CD2 4.12Å; L5-L76 HydrophobicContact CD2-CG 4.26Å; K29-L76 HydrophobicContact CB-CD1 3.66Å; K29-L76 HydrophobicContact CD-CD1 3.96Å; K29-L76 HydrophobicContact CD-CD2 4.44Å; K29-L76 HydrophobicContact CG-CD1 3.98Å; Y31-L76 HydrophobicContact CD1-CB 4.07Å; Y31-L76 HydrophobicContact CD1-CD1 4.41Å; Y31-L76 HydrophobicContact CE1-CB 3.84Å; Y31-L76 HydrophobicContact CE1-CD1 3.98Å; Y31-L76 HydrophobicContact CE1-CG 4.49Å; E73-L76 WeakPolarHBondContact O-CB 3.43Å; E73-L76 PolarHBondContact O-N 3.13Å; L76-G78 VanDerWaalsContact CD1-O 3.31Å; L76-G78 WeakPolarHBondContact CD1-O 3.43Å
77	I	97.1	Very high	88.4	Confident	50 Å²	50	68.1 Å²	68.1	26%	0.256	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	-17.9	177.6	59.4	160.4	0	0	0	113.4	F8 W23 V30 D32 Y75	F8-I77 HydrophobicContact CE2-CD1 4.02Å; F8-I77 HydrophobicContact CE2-CG1 4.09Å; F8-I77 HydrophobicContact CZ-CD1 3.96Å; F8-I77 HydrophobicContact CZ-CG1 4.45Å; W23-I77 HydrophobicContact CD2-CD1 3.73Å; W23-I77 VanDerWaalsContact CE2-CD1 3.5Å; W23-I77 HydrophobicContact CE3-CD1 3.9Å; W23-I77 HydrophobicContact CG-CD1 4.45Å; W23-I77 HydrophobicContact CH2-CD1 3.69Å; W23-I77 HydrophobicContact CZ2-CD1 3.48Å; W23-I77 VanDerWaalsContact CZ2-CD1 3.48Å; W23-I77 HydrophobicContact CZ3-CD1 3.89Å; V30-I77 HydrophobicContact CB-CG1 4.12Å; V30-I77 HydrophobicContact CG1-CD1 3.88Å; V30-I77 HydrophobicContact CG1-CG1 3.9Å; V30-I77 VanDerWaalsContact O-CG1 3.26Å; V30-I77 WeakPolarHBondContact O-CG1 3.48Å; V30-I77 PolarHBondContact O-N 2.99Å; D32-I77 HydrophobicContact CB-CD1 4.18Å; D32-I77 HydrophobicContact CB-CG2 3.89Å; Y75-I77 PolarHBondContact O-N 3.43Å
78	G	96.2	Very high	87.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.7	-161.6	-179.6	0	0	0	0	0	115.2	R6 V30 L76	R6-G78 CarbonylContact O-C 3.46Å; R6-G78 WeakPolarHBondContact O-CA 3.46Å; V30-G78 PolarHBondContact N-O 3.23Å; V30-G78 PolarHBondContact O-N 3.3Å; L76-G78 VanDerWaalsContact CD1-O 3.31Å; L76-G78 WeakPolarHBondContact CD1-O 3.43Å
79	E	95.3	Very high	85.8	Confident	87 Å²	87	66.6 Å²	66.6	41%	0.407	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	150.4	-179	62.8	-172.3	176.6	0	0	111.6	R6 T7 F8 N28	R6-E79 PolarHBondContact O-N 3.44Å; T7-E79 WeakPolarHBondContact CA-O 3.44Å; T7-E79 HydrophobicContact CG2-CG 4.02Å; F8-E79 PolarHBondContact N-O 3.08Å; N28-E79 CarbonylContact O-C 3.58Å; N28-E79 WeakPolarHBondContact O-CA 3.41Å
80	I	94.4	Very high	84.5	Confident	18 Å²	18	67 Å²	67	9%	0.092	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	130.6	175.7	-67.1	-65.1	0	0	0	109.6	F8 R10 V13 V25 N28 V30	F8-I80 CarbonylContact O-C 3.55Å; F8-I80 VanDerWaalsContact O-CA 3.27Å; F8-I80 WeakPolarHBondContact O-CA 3.26Å; R10-I80 HydrophobicContact CG-CD1 4.33Å; R10-I80 HydrophobicContact CG-CG2 3.99Å; V13-I80 HydrophobicContact CG2-CD1 3.69Å; V25-I80 HydrophobicContact CB-CG1 4.49Å; V25-I80 HydrophobicContact CG1-CG1 3.72Å; V25-I80 HydrophobicContact CG2-CD1 3.82Å; V25-I80 HydrophobicContact CG2-CG1 3.91Å; N28-I80 HydrophobicContact CB-CB 4.32Å; N28-I80 PolarHBondContact O-N 3.21Å; V30-I80 HydrophobicContact CG2-CD1 3.62Å; V30-I80 HydrophobicContact CG2-CG1 3.84Å
81	V	88.9	Confident	83.3	Confident	30 Å²	30	65.7 Å²	65.7	18%	0.182	35%	0.348	C	S	.	.			trans	-119.3	134.8	167.2	-64.5	0	0	0	0	109.4	T7 F8 V83	T7-V81 HydrophobicContact CG2-CG1 3.63Å; F8-V81 PolarHBondContact O-N 3.4Å; V81-V83 WeakPolarHBondContact CG2-O 3.34Å; V81-V83 PolarHBondContact O-N 3.32Å
82	E	77	Confident	82.4	Confident	140 Å²	140	67.2 Å²	67.2	65%	0.654	36%	0.36	S	S	*	.	S	Bend	trans	-66.5	-23.7	178.3	-66.8	-65.9	160.6	0	0	112.4	R10	R10-E82 IonicContact CZ-OE1 2.74Å; R10-E82 IonicContact NH1-OE1 3.37Å; R10-E82 PolarHBondContact NH1-OE1 2.93Å; R10-E82 IonicContact NH1-OE2 2.8Å; R10-E82 PolarHBondContact NH1-OE2 3Å; R10-E82 IonicContact NH2-OE1 3.83Å; R10-E82 PolarHBondContact NH2-OE1 3.21Å
83	V	68.8	Low	81.7	Confident	51 Å²	51	73.3 Å²	73.3	31%	0.309	39%	0.387	S	S	.	.	S	Bend	trans	-140.2	131.1	-179.2	-121.6	0	0	0	0	108	V81 I85 L88	V81-V83 WeakPolarHBondContact CG2-O 3.34Å; V81-V83 PolarHBondContact O-N 3.32Å; V83-I85 PolarHBondContact O-N 2.89Å; V83-L88 HydrophobicContact CB-CD2 4.44Å; V83-L88 HydrophobicContact CG2-CD2 4.37Å
84	C	63.8	Low	81	Confident	32 Å²	32	76.8 Å²	76.8	22%	0.216	41%	0.408	C	S	.	.			trans	-57.2	131.3	168.3	-65.5	0	0	0	0	108.3	T9 S86 D87 L88	T9-C84 WeakPolarHBondContact CG2-SG 3.42Å; C84-S86 WeakPolarHBondContact CB-OG 3.18Å; C84-S86 PolarHBondContact O-N 3.03Å; C84-S86 VanDerWaalsContact O-N 3.09Å; C84-D87 HydrophobicContact CB-CB 4.41Å; C84-D87 WeakPolarHBondContact CB-OD2 3.49Å; C84-D87 WeakPolarHBondContact O-CA 3.2Å; C84-D87 WeakPolarHBondContact O-CB 3.48Å; C84-D87 PolarHBondContact O-N 3.41Å; C84-L88 PolarHBondContact O-N 2.93Å
85	I	68	Low	80.2	Confident	84 Å²	84	77.6 Å²	77.6	43%	0.431	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-57.1	-28.9	177.8	-63.9	175.6	0	0	0	110.6	V83 D87 L88 F99	V83-I85 PolarHBondContact O-N 2.89Å; I85-D87 PolarHBondContact O-N 2.86Å; I85-L88 PolarHBondContact O-N 3.47Å; I85-F99 HydrophobicContact CG2-CD1 4.13Å; I85-F99 HydrophobicContact CG2-CE1 3.88Å; I85-F99 HydrophobicContact CG2-CZ 4.23Å
86	S	68.1	Low	79.4	Confident	101 Å²	101	83.8 Å²	83.8	71%	0.706	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-64	-24.4	173.4	55.1	0	0	0	0	114.4	C84	C84-S86 WeakPolarHBondContact CB-OG 3.18Å; C84-S86 PolarHBondContact O-N 3.03Å; C84-S86 VanDerWaalsContact O-N 3.09Å
87	D	69.9	Low	78.3	Confident	104 Å²	104	86.7 Å²	86.7	56%	0.556	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-93.5	-7	-179.6	-59.6	-25.4	0	0	0	112.3	C84 I85	C84-D87 HydrophobicContact CB-CB 4.41Å; C84-D87 WeakPolarHBondContact CB-OD2 3.49Å; C84-D87 WeakPolarHBondContact O-CA 3.2Å; C84-D87 WeakPolarHBondContact O-CB 3.48Å; C84-D87 PolarHBondContact O-N 3.41Å; I85-D87 PolarHBondContact O-N 2.86Å
88	L	68.9	Low	77.2	Confident	34 Å²	34	89.5 Å²	89.5	18%	0.178	47%	0.47	C	S	.	.	S	Bend	trans	-67.4	130.8	171.3	-67.4	177.3	0	0	0	108.9	V83 C84 I85 V90 F99	V83-L88 HydrophobicContact CB-CD2 4.44Å; V83-L88 HydrophobicContact CG2-CD2 4.37Å; C84-L88 PolarHBondContact O-N 2.93Å; I85-L88 PolarHBondContact O-N 3.47Å; L88-V90 PolarHBondContact O-N 3.42Å; L88-F99 HydrophobicContact CB-CD1 4.25Å; L88-F99 HydrophobicContact CD1-CB 4.25Å
89	P	69	Low	76	Confident	70 Å²	70	95 Å²	95	46%	0.455	50%	0.495	S	S	.	.			trans	-58.5	118.9	176.4	13.2	-17.7	0	0	0	109.5	L91 A100	P89-L91 PolarHBondContact O-N 3.13Å; P89-A100 HydrophobicContact CG-CB 4.27Å; P89-A100 PolarHBondContact O-N 3.06Å
90	V	69.9	Low	74.6	Confident	74 Å²	74	92.2 Å²	92.2	45%	0.448	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	114.5	175.6	-178.9	0	0	0	0	107.7	L88 V92 T97 F99	L88-V90 PolarHBondContact O-N 3.42Å; V90-V92 HydrophobicContact CG1-CG2 4.39Å; V90-T97 HydrophobicContact CG1-CG2 3.78Å; V90-F99 HydrophobicContact CG2-CD1 4.21Å; V90-F99 HydrophobicContact CG2-CE1 4.01Å
91	L	73.6	Confident	73.1	Confident	105 Å²	105	99.9 Å²	99.9	55%	0.55	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.2	171	-66.3	175.7	0	0	0	108.7	P89 F98 A100	P89-L91 PolarHBondContact O-N 3.13Å; L91-F98 PolarHBondContact N-O 3Å; L91-F98 PolarHBondContact O-N 3.26Å; L91-A100 HydrophobicContact CD1-CB 4.04Å; L91-A100 HydrophobicContact CG-CB 4.45Å
92	V	75.9	Confident	71.5	Confident	100 Å²	100	106.8 Å²	106.8	61%	0.606	54%	0.544	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	114.5	172.9	-177.8	0	0	0	0	108.3	V90 R96 T97	V90-V92 HydrophobicContact CG1-CG2 4.39Å; V92-R96 WeakPolarHBondContact CA-O 3.31Å; V92-T97 HydrophobicContact CG2-CG2 4.15Å
93	F	82.3	Confident	70.3	Confident	157 Å²	157	108.6 Å²	108.6	69%	0.689	55%	0.553	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-128.5	126.6	175	-174.6	-101.4	0	0	0	109.9	N95 R96	F93-N95 VanDerWaalsContact C-N 3.31Å; F93-N95 PolarHBondContact O-N 3.03Å; F93-R96 PolarHBondContact N-O 3.27Å; F93-R96 PolarHBondContact O-N 3.12Å
94	N	82.6	Confident	69.3	Low	140 Å²	140	115.7 Å²	115.7	75%	0.749	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.8	48.2	-179	-160	32.9	0	0	0	113.5	R96	N94-R96 PolarHBondContact O-N 3.37Å
95	N	78.6	Confident	68.4	Low	165 Å²	165	122 Å²	122	88%	0.882	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.9	21	-177.9	-100.8	17.3	0	0	0	115.9	F93	F93-N95 VanDerWaalsContact C-N 3.31Å; F93-N95 PolarHBondContact O-N 3.03Å
96	R	80.6	Confident	67.2	Low	178 Å²	178	129.2 Å²	129.2	67%	0.672	65%	0.648	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.7	138.6	168.2	-72	-177.6	-165.3	-110.1	0.8	110.6	V92 F93 N94 F98	V92-R96 WeakPolarHBondContact CA-O 3.31Å; F93-R96 PolarHBondContact N-O 3.27Å; F93-R96 PolarHBondContact O-N 3.12Å; N94-R96 PolarHBondContact O-N 3.37Å; R96-F98 HydrophobicContact CB-CD2 4.22Å; R96-F98 HydrophobicContact CB-CE2 3.51Å; R96-F98 HydrophobicContact CB-CZ 4.02Å
97	T	74.5	Confident	67.1	Low	100 Å²	100	130.7 Å²	130.7	61%	0.613	65%	0.645	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.8	128.9	171.4	32.5	0	0	0	0	110	V90 V92	V90-T97 HydrophobicContact CG1-CG2 3.78Å; V92-T97 HydrophobicContact CG2-CG2 4.15Å
98	F	75.1	Confident	67	Low	109 Å²	109	132.1 Å²	132.1	48%	0.478	65%	0.649	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.3	139.3	171.8	-63.6	-93	0	0	0	108.5	L91 R96	L91-F98 PolarHBondContact N-O 3Å; L91-F98 PolarHBondContact O-N 3.26Å; R96-F98 HydrophobicContact CB-CD2 4.22Å; R96-F98 HydrophobicContact CB-CE2 3.51Å; R96-F98 HydrophobicContact CB-CZ 4.02Å
99	F	71.2	Confident	66.9	Low	117 Å²	117	137.5 Å²	137.5	51%	0.513	68%	0.676	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.5	121.8	170	-61.9	-82.4	0	0	0	107.6	I85 L88 V90 E101	I85-F99 HydrophobicContact CG2-CD1 4.13Å; I85-F99 HydrophobicContact CG2-CE1 3.88Å; I85-F99 HydrophobicContact CG2-CZ 4.23Å; L88-F99 HydrophobicContact CB-CD1 4.25Å; L88-F99 HydrophobicContact CD1-CB 4.25Å; V90-F99 HydrophobicContact CG2-CD1 4.21Å; V90-F99 HydrophobicContact CG2-CE1 4.01Å; F99-E101 PolarHBondContact O-N 2.86Å
100	A	66	Low	66.7	Low	28 Å²	28	141.5 Å²	141.5	23%	0.231	69%	0.689	C	S	.	*	P	Polyproline II helix	trans	-75.5	120.6	176.4	0	0	0	0	0	109.6	P89 L91	P89-A100 HydrophobicContact CG-CB 4.27Å; P89-A100 PolarHBondContact O-N 3.06Å; L91-A100 HydrophobicContact CD1-CB 4.04Å; L91-A100 HydrophobicContact CG-CB 4.45Å
101	E	61.7	Low	66.5	Low	179 Å²	179	145.7 Å²	145.7	84%	0.836	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-67.3	134.6	166.5	-68.2	-177.1	165.8	0	0	108.2	F99 E103	F99-E101 PolarHBondContact O-N 2.86Å; E101-E103 PolarHBondContact O-N 3.35Å
102	R	56.8	Low	66.1	Low	175 Å²	175	148.4 Å²	148.4	66%	0.66	71%	0.714	S	S	*	*			trans	-64.7	107.7	175.7	-71	-166.9	-171.7	-102.4	2.1	108	K104	R102-K104 PolarHBondContact O-N 3.25Å; R102-K104 VanDerWaalsContact O-N 3.16Å
103	E	51	Low	65.4	Low	177 Å²	177	151.9 Å²	151.9	83%	0.827	72%	0.722	S	S	*	*			trans	-58.7	119.8	165.1	-66.8	-165.4	158.9	0	0	107.7	E101 I105	E101-E103 PolarHBondContact O-N 3.35Å; E103-I105 VanDerWaalsContact C-N 3.34Å; E103-I105 PolarHBondContact O-N 2.88Å
104	K	48.5	Very low	64.1	Low	200 Å²	200	151.5 Å²	151.5	87%	0.87	72%	0.724	S	S	*	*			trans	-61.6	100.6	167.8	-85	-177.7	175.3	180	0	107.2	R102 L106	R102-K104 PolarHBondContact O-N 3.25Å; R102-K104 VanDerWaalsContact O-N 3.16Å; K104-L106 PolarHBondContact O-N 3.24Å
105	I	43.2	Very low	62.5	Low	165 Å²	165	152.4 Å²	152.4	85%	0.846	72%	0.722	S	S	*	*			trans	-69	110.9	163.7	-58.6	172.1	0	0	0	105.2	E103	E103-I105 VanDerWaalsContact C-N 3.34Å; E103-I105 PolarHBondContact O-N 2.88Å
106	L	43	Very low	61.1	Low	236 Å²	236	151.3 Å²	151.3	100%	1.236	71%	0.708	S	S	*	*			trans	-57	0	178.5	-70.4	163.1	0	0	0	112.4	K104	K104-L106 PolarHBondContact O-N 3.24Å

Retrieved 106 of 106 residues in 166.5 ms (Link to these results)

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