A0A077ZDB2_TRITR Loading...

Zf-H2C2 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZDB2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 96 aa.

						>A0A077ZDB2_TRITR|A0A077ZDB2
MCQWPNCQWRFARSDELTRHYRKHTGAKPFRCKLCDRCFARSDHLALHMRRHQPKSRVSRHLSLDPTSMVAAAAAATAVNQHMPLQHSRSDPTVYH
					

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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	85.8	Confident	93	Very high	119 Å²	119	118.4 Å²	118.4	59%	0.586	55%	0.546	S	S	*	.				0	150.2	0	-53.8	173.9	67.4	0	0	107.7	R10	M1-R10 HydrophobicContact CB-CG 4.4Å; M1-R10 HydrophobicContact CE-CG 3.93Å; M1-R10 HydrophobicContact CG-CG 3.99Å; M1-R10 PolarHBondContact SD-NH2 3.47Å; M1-R10 VanDerWaalsContact SD-NH2 3.39Å
2	C	92.4	Very high	93.2	Very high	14 Å²	14	117.3 Å²	117.3	10%	0.095	57%	0.574	C	S	.	*			trans	-69.9	137	172.1	-168.7	0	0	0	0	110.2	C7 W9 L17 H20 H24	C2-C7 HydrophobicContact CB-CB 4.18Å; C2-W9 PolarHBondContact N-O 3.13Å; C2-L17 HydrophobicContact CB-CD1 4.08Å; C2-H20 VanDerWaalsContact SG-CD2 3.57Å; C2-H20 PolarHBondContact SG-NE2 3.06Å; C2-H20 VanDerWaalsContact SG-NE2 3.43Å; C2-H24 PolarHBondContact SG-NE2 3.39Å; C2-H24 VanDerWaalsContact SG-NE2 3.38Å
3	Q	92.4	Very high	93.4	Very high	171 Å²	171	119.2 Å²	119.2	80%	0.799	57%	0.571	S	S	*	*			trans	-100	1.9	-179.7	-62	175.4	30.1	0	0	112.7	Y21	Q3-Y21 WeakPolarHBondContact CB-OH 3.43Å; Q3-Y21 WeakPolarHBondContact CG-OH 3.3Å; Q3-Y21 PolarHBondContact N-OH 3.35Å
4	W	94.2	Very high	93.4	Very high	134 Å²	134	117.4 Å²	117.4	51%	0.508	58%	0.577	S	S	.	*	S	Bend	trans	-73.4	141.5	-178	-148.9	73.4	0	0	0	111	N6 C7 H24	W4-N6 PolarHBondContact O-N 2.9Å; W4-C7 HydrophobicContact CB-CB 4.01Å; W4-C7 VanDerWaalsContact O-CB 3.25Å; W4-C7 WeakPolarHBondContact O-CB 3.45Å; W4-C7 PolarHBondContact O-N 2.82Å; W4-H24 AromaticContact CD1-CG 3.89Å; W4-H24 HydrophobicContact CD2-CB 3.9Å; W4-H24 AromaticContact CD2-CE1 3.74Å; W4-H24 AromaticContact CD2-CG 3.53Å; W4-H24 AromaticContact CD2-ND1 3.2Å; W4-H24 AromaticContact CE2-CG 3.96Å; W4-H24 AromaticContact CE2-ND1 3.84Å; W4-H24 AromaticContact CE3-CE1 3.47Å; W4-H24 VanDerWaalsContact CE3-CE1 3.47Å; W4-H24 AromaticContact CE3-CG 3.98Å; W4-H24 AromaticContact CE3-ND1 3.15Å; W4-H24 HydrophobicContact CG-CB 3.87Å; W4-H24 AromaticContact CG-CD2 3.75Å; W4-H24 AromaticContact CG-CE1 3.91Å; W4-H24 AromaticContact CG-CG 3.47Å; W4-H24 VanDerWaalsContact CG-CG 3.47Å; W4-H24 AromaticContact CG-ND1 3.59Å; W4-H24 HydrophobicContact CZ2-CB 4.4Å; W4-H24 AromaticContact CZ3-ND1 3.73Å
5	P	94.9	Very high	93.3	Very high	89 Å²	89	115.3 Å²	115.3	58%	0.578	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	135.7	-179.6	-26.6	34.6	0	0	0	112.1	C7	P5-C7 PolarHBondContact O-N 3.37Å; P5-C7 VanDerWaalsContact O-N 3.09Å
6	N	93.5	Very high	93.4	Very high	164 Å²	164	110.4 Å²	110.4	88%	0.877	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	13.1	-177.8	-54	-51.4	0	0	0	115.5	W4	W4-N6 PolarHBondContact O-N 2.9Å
7	C	93.9	Very high	93.5	Very high	20 Å²	20	105.9 Å²	105.9	14%	0.135	52%	0.522	C	S	.	.			trans	-96	109.8	174.7	-170.2	0	0	0	0	111.2	C2 W4 P5 H20 H24	C2-C7 HydrophobicContact CB-CB 4.18Å; W4-C7 HydrophobicContact CB-CB 4.01Å; W4-C7 VanDerWaalsContact O-CB 3.25Å; W4-C7 WeakPolarHBondContact O-CB 3.45Å; W4-C7 PolarHBondContact O-N 2.82Å; P5-C7 PolarHBondContact O-N 3.37Å; P5-C7 VanDerWaalsContact O-N 3.09Å; C7-H20 PolarHBondContact SG-NE2 2.9Å; C7-H24 PolarHBondContact SG-NE2 2.82Å; C7-H24 VanDerWaalsContact SG-NE2 3.41Å
8	Q	92.9	Very high	93.4	Very high	183 Å²	183	104.4 Å²	104.4	86%	0.855	52%	0.52	S	S	*	.			trans	-96.5	12.3	-176.1	-63.3	173.7	3.2	0	0	113.2
9	W	94.8	Very high	93.4	Very high	177 Å²	177	103.7 Å²	103.7	67%	0.67	51%	0.511	S	S	*	.			trans	-81.6	127.5	-175.5	-65.1	98.1	0	0	0	112.2	C2 F11 H20	C2-W9 PolarHBondContact N-O 3.13Å; W9-F11 HydrophobicContact CB-CE2 3.72Å; W9-F11 HydrophobicContact CB-CZ 3.77Å; W9-H20 AromaticContact CD1-CE1 3.86Å
10	R	93.9	Very high	93.5	Very high	179 Å²	179	99.4 Å²	99.4	68%	0.675	49%	0.49	S	S	*	.			trans	-109.2	137.3	171.3	-55.4	-179.3	71.7	135.4	0.4	108.5	M1	M1-R10 HydrophobicContact CB-CG 4.4Å; M1-R10 HydrophobicContact CE-CG 3.93Å; M1-R10 HydrophobicContact CG-CG 3.99Å; M1-R10 PolarHBondContact SD-NH2 3.47Å; M1-R10 VanDerWaalsContact SD-NH2 3.39Å
11	F	94.7	Very high	93.5	Very high	52 Å²	52	97.9 Å²	97.9	23%	0.228	48%	0.479	C	S	.	.			trans	-119	140.6	177.9	-60.4	-82.7	0	0	0	108.4	W9 R13 E16 L17 H20	W9-F11 HydrophobicContact CB-CE2 3.72Å; W9-F11 HydrophobicContact CB-CZ 3.77Å; F11-R13 VanDerWaalsContact C-N 3.29Å; F11-E16 HydrophobicContact CB-CB 3.91Å; F11-E16 HydrophobicContact CD1-CB 3.72Å; F11-E16 HydrophobicContact CG-CB 4.02Å; F11-L17 HydrophobicContact CB-CB 4.11Å; F11-L17 HydrophobicContact CD2-CB 3.97Å; F11-L17 HydrophobicContact CD2-CD1 3.74Å; F11-L17 HydrophobicContact CD2-CG 4.46Å; F11-L17 HydrophobicContact CE2-CD1 4.21Å; F11-L17 HydrophobicContact CG-CB 4.27Å; F11-H20 HydrophobicContact CD2-CB 4.27Å; F11-H20 HydrophobicContact CE1-CB 4.12Å; F11-H20 HydrophobicContact CE2-CB 3.48Å; F11-H20 VanDerWaalsContact CE2-CB 3.48Å; F11-H20 AromaticContact CE2-CD2 3.47Å; F11-H20 VanDerWaalsContact CE2-CD2 3.47Å; F11-H20 WeakPolarHBondContact CE2-CD2 3.44Å; F11-H20 AromaticContact CE2-CG 3.28Å; F11-H20 AromaticContact CE2-ND1 3.75Å; F11-H20 AromaticContact CE2-NE2 3.98Å; F11-H20 HydrophobicContact CZ-CB 3.4Å; F11-H20 AromaticContact CZ-CD2 3.91Å; F11-H20 AromaticContact CZ-CE1 3.97Å; F11-H20 AromaticContact CZ-CG 3.26Å; F11-H20 AromaticContact CZ-ND1 3.34Å; F11-H20 VanDerWaalsContact CZ-ND1 3.34Å; F11-H20 WeakPolarHBondContact CZ-ND1 3.43Å
12	A	95.4	Very high	93.9	Very high	106 Å²	106	95.9 Å²	95.9	88%	0.876	47%	0.465	S	S	*	.	S	Bend	trans	-72	-30	177.2	0	0	0	0	0	111.1
13	R	95.5	Very high	93.8	Very high	142 Å²	142	103.4 Å²	103.4	54%	0.536	50%	0.496	S	S	.	.	S	Bend	trans	-116	149.1	-176.8	-52.4	-175.4	-73.3	169.8	-1.8	112.5	F11 D15 E16 L17	F11-R13 VanDerWaalsContact C-N 3.29Å; R13-D15 WeakPolarHBondContact CB-OD1 3.21Å; R13-D15 IonicContact NE-OD1 3.39Å; R13-E16 HydrophobicContact CB-CG 4.26Å; R13-E16 IonicContact CZ-OE1 3.88Å; R13-E16 IonicContact NE-OE1 2.69Å; R13-E16 PolarHBondContact NE-OE1 3.43Å; R13-E16 IonicContact NH2-OE1 3.2Å; R13-E16 PolarHBondContact NH2-OE1 3.39Å; R13-E16 PolarHBondContact O-N 3.38Å; R13-L17 PolarHBondContact O-N 3.09Å
14	S	92.8	Very high	93.9	Very high	94 Å²	94	97.4 Å²	97.4	66%	0.657	47%	0.468	S	S	*	.	H	α-helix	trans	-69.9	-33.3	-179	56.3	0	0	0	0	112.9	L17 T18	S14-L17 PolarHBondContact O-N 3.02Å; S14-T18 WeakPolarHBondContact O-CB 3.25Å; S14-T18 PolarHBondContact O-N 3.06Å; S14-T18 PolarHBondContact O-OG1 3.26Å
15	D	92.9	Very high	93.8	Very high	85 Å²	85	95.9 Å²	95.9	46%	0.455	47%	0.473	S	S	.	.	H	α-helix	trans	-66.5	-39.5	176.8	66.4	-60.7	0	0	0	111.5	R13 T18 R19	R13-D15 WeakPolarHBondContact CB-OD1 3.21Å; R13-D15 IonicContact NE-OD1 3.39Å; D15-T18 PolarHBondContact O-N 3.08Å; D15-R19 VanDerWaalsContact O-CB 3.3Å; D15-R19 WeakPolarHBondContact O-CB 3.48Å; D15-R19 PolarHBondContact O-N 3.26Å
16	E	94.7	Very high	93.8	Very high	38 Å²	38	93.8 Å²	93.8	18%	0.178	47%	0.468	C	S	.	.	H	α-helix	trans	-64.5	-43.6	175.1	-70.6	174	176.5	0	0	111.9	F11 R13 R19 H20	F11-E16 HydrophobicContact CB-CB 3.91Å; F11-E16 HydrophobicContact CD1-CB 3.72Å; F11-E16 HydrophobicContact CG-CB 4.02Å; R13-E16 HydrophobicContact CB-CG 4.26Å; R13-E16 IonicContact CZ-OE1 3.88Å; R13-E16 IonicContact NE-OE1 2.69Å; R13-E16 PolarHBondContact NE-OE1 3.43Å; R13-E16 IonicContact NH2-OE1 3.2Å; R13-E16 PolarHBondContact NH2-OE1 3.39Å; R13-E16 PolarHBondContact O-N 3.38Å; E16-R19 PolarHBondContact O-N 3.29Å; E16-H20 VanDerWaalsContact O-CB 3.28Å; E16-H20 WeakPolarHBondContact O-CB 3.47Å; E16-H20 PolarHBondContact O-N 3.11Å
17	L	94.5	Very high	93.8	Very high	33 Å²	33	88 Å²	88	17%	0.173	44%	0.443	C	S	.	.	H	α-helix	trans	-62.1	-45.2	174.9	176	60.8	0	0	0	111.1	C2 F11 R13 S14 R19 H20 Y21	C2-L17 HydrophobicContact CB-CD1 4.08Å; F11-L17 HydrophobicContact CB-CB 4.11Å; F11-L17 HydrophobicContact CD2-CB 3.97Å; F11-L17 HydrophobicContact CD2-CD1 3.74Å; F11-L17 HydrophobicContact CD2-CG 4.46Å; F11-L17 HydrophobicContact CE2-CD1 4.21Å; F11-L17 HydrophobicContact CG-CB 4.27Å; R13-L17 PolarHBondContact O-N 3.09Å; S14-L17 PolarHBondContact O-N 3.02Å; L17-R19 PolarHBondContact O-N 3.4Å; L17-H20 WeakPolarHBondContact O-CB 3.39Å; L17-H20 PolarHBondContact O-N 3.26Å; L17-H20 VanDerWaalsContact O-N 3.13Å; L17-Y21 HydrophobicContact CD1-CD2 4.03Å; L17-Y21 HydrophobicContact CD1-CE2 3.57Å; L17-Y21 HydrophobicContact CD2-CE2 4.08Å; L17-Y21 HydrophobicContact CG-CD2 3.96Å; L17-Y21 HydrophobicContact CG-CE2 3.57Å; L17-Y21 WeakPolarHBondContact O-CD2 3.36Å; L17-Y21 PolarHBondContact O-N 3.49Å
18	T	92.3	Very high	93.8	Very high	79 Å²	79	93.4 Å²	93.4	49%	0.485	47%	0.465	S	S	.	.	H	α-helix	trans	-61.8	-43.6	177.3	-57.7	0	0	0	0	111.4	S14 D15 H20 Y21	S14-T18 WeakPolarHBondContact O-CB 3.25Å; S14-T18 PolarHBondContact O-N 3.06Å; S14-T18 PolarHBondContact O-OG1 3.26Å; D15-T18 PolarHBondContact O-N 3.08Å; T18-H20 VanDerWaalsContact C-N 3.3Å; T18-H20 PolarHBondContact O-N 3.07Å; T18-Y21 PolarHBondContact O-N 2.85Å
19	R	93.1	Very high	93.8	Very high	92 Å²	92	88.6 Å²	88.6	35%	0.347	45%	0.449	S	S	.	.	H	α-helix	trans	-62.9	-39.1	174	-178.3	-176.6	68.3	-175.8	-4.5	111.3	D15 E16 L17 R22 R41	D15-R19 VanDerWaalsContact O-CB 3.3Å; D15-R19 WeakPolarHBondContact O-CB 3.48Å; D15-R19 PolarHBondContact O-N 3.26Å; E16-R19 PolarHBondContact O-N 3.29Å; L17-R19 PolarHBondContact O-N 3.4Å; R19-R22 WeakPolarHBondContact O-CB 3.24Å; R19-R22 PolarHBondContact O-N 2.84Å; R19-R41 HydrophobicContact CG-CG 4.11Å; R19-R41 VanDerWaalsContact NH1-CZ 3.31Å; R19-R41 VanDerWaalsContact NH1-NH2 3.17Å
20	H	95	Very high	93.9	Very high	17 Å²	17	83.1 Å²	83.1	8%	0.079	43%	0.43	C	S	.	.	H	α-helix	trans	-65.3	-39.8	177.4	171.2	83.4	0	0	0	112.1	C2 C7 W9 F11 E16 L17 T18 R22 K23 H24	C2-H20 VanDerWaalsContact SG-CD2 3.57Å; C2-H20 PolarHBondContact SG-NE2 3.06Å; C2-H20 VanDerWaalsContact SG-NE2 3.43Å; C7-H20 PolarHBondContact SG-NE2 2.9Å; W9-H20 AromaticContact CD1-CE1 3.86Å; F11-H20 HydrophobicContact CD2-CB 4.27Å; F11-H20 HydrophobicContact CE1-CB 4.12Å; F11-H20 HydrophobicContact CE2-CB 3.48Å; F11-H20 VanDerWaalsContact CE2-CB 3.48Å; F11-H20 AromaticContact CE2-CD2 3.47Å; F11-H20 VanDerWaalsContact CE2-CD2 3.47Å; F11-H20 WeakPolarHBondContact CE2-CD2 3.44Å; F11-H20 AromaticContact CE2-CG 3.28Å; F11-H20 AromaticContact CE2-ND1 3.75Å; F11-H20 AromaticContact CE2-NE2 3.98Å; F11-H20 HydrophobicContact CZ-CB 3.4Å; F11-H20 AromaticContact CZ-CD2 3.91Å; F11-H20 AromaticContact CZ-CE1 3.97Å; F11-H20 AromaticContact CZ-CG 3.26Å; F11-H20 AromaticContact CZ-ND1 3.34Å; F11-H20 VanDerWaalsContact CZ-ND1 3.34Å; F11-H20 WeakPolarHBondContact CZ-ND1 3.43Å; E16-H20 VanDerWaalsContact O-CB 3.28Å; E16-H20 WeakPolarHBondContact O-CB 3.47Å; E16-H20 PolarHBondContact O-N 3.11Å; L17-H20 WeakPolarHBondContact O-CB 3.39Å; L17-H20 PolarHBondContact O-N 3.26Å; L17-H20 VanDerWaalsContact O-N 3.13Å; T18-H20 VanDerWaalsContact C-N 3.3Å; T18-H20 PolarHBondContact O-N 3.07Å; H20-R22 PolarHBondContact O-N 3.46Å; H20-R22 VanDerWaalsContact O-N 3.08Å; H20-K23 VanDerWaalsContact O-CB 3.24Å; H20-K23 WeakPolarHBondContact O-CB 3.47Å; H20-K23 PolarHBondContact O-N 3Å; H20-H24 AromaticContact CD2-NE2 3.8Å; H20-H24 AromaticContact CE1-NE2 3.78Å; H20-H24 AromaticContact NE2-CD2 3.85Å; H20-H24 AromaticContact NE2-NE2 3.09Å; H20-H24 PolarHBondContact NE2-NE2 3.09Å
21	Y	93.5	Very high	94.1	Very high	67 Å²	67	81.8 Å²	81.8	26%	0.263	43%	0.425	S	S	.	.	H	α-helix	trans	-55.9	-27.8	174.9	-84.7	-64.9	0	0	0	113.6	Q3 L17 T18 K23 H24 T25	Q3-Y21 WeakPolarHBondContact CB-OH 3.43Å; Q3-Y21 WeakPolarHBondContact CG-OH 3.3Å; Q3-Y21 PolarHBondContact N-OH 3.35Å; L17-Y21 HydrophobicContact CD1-CD2 4.03Å; L17-Y21 HydrophobicContact CD1-CE2 3.57Å; L17-Y21 HydrophobicContact CD2-CE2 4.08Å; L17-Y21 HydrophobicContact CG-CD2 3.96Å; L17-Y21 HydrophobicContact CG-CE2 3.57Å; L17-Y21 WeakPolarHBondContact O-CD2 3.36Å; L17-Y21 PolarHBondContact O-N 3.49Å; T18-Y21 PolarHBondContact O-N 2.85Å; Y21-K23 PolarHBondContact O-N 3.39Å; Y21-H24 PolarHBondContact O-N 3.08Å; Y21-T25 PolarHBondContact O-N 3.29Å; Y21-T25 VanDerWaalsContact O-N 3.11Å; Y21-T25 PolarHBondContact O-OG1 2.69Å
22	R	93.9	Very high	94.2	Very high	78 Å²	78	79.3 Å²	79.3	29%	0.294	41%	0.414	S	S	.	.	H	α-helix	trans	-64.5	-23.7	174.2	-57	-179.1	-175.5	-174	-1.9	113.2	R19 H20 H24 T25 G26 A27 F30 A40	R19-R22 WeakPolarHBondContact O-CB 3.24Å; R19-R22 PolarHBondContact O-N 2.84Å; H20-R22 PolarHBondContact O-N 3.46Å; H20-R22 VanDerWaalsContact O-N 3.08Å; R22-H24 VanDerWaalsContact C-N 3.31Å; R22-T25 WeakPolarHBondContact CA-OG1 3.34Å; R22-G26 WeakPolarHBondContact O-CA 2.99Å; R22-G26 PolarHBondContact O-N 2.87Å; R22-A27 PolarHBondContact O-N 3.47Å; R22-F30 VanDerWaalsContact NH1-CE2 3.3Å; R22-A40 WeakPolarHBondContact CD-O 3.28Å; R22-A40 PolarHBondContact NH1-O 3.41Å
23	K	91.3	Very high	94.2	Very high	172 Å²	172	83.9 Å²	83.9	75%	0.748	41%	0.414	S	S	*	.	H	α-helix	trans	-67.5	-33	172.3	-68.5	-171.7	172.2	-170.1	0	112	H20 Y21	H20-K23 VanDerWaalsContact O-CB 3.24Å; H20-K23 WeakPolarHBondContact O-CB 3.47Å; H20-K23 PolarHBondContact O-N 3Å; Y21-K23 PolarHBondContact O-N 3.39Å
24	H	94.4	Very high	94.2	Very high	45 Å²	45	82.6 Å²	82.6	21%	0.208	42%	0.417	C	S	.	.	H	α-helix	trans	-80.5	-43	179.3	-64	-57.1	0	0	0	112.2	C2 W4 C7 H20 Y21 R22 G26	C2-H24 PolarHBondContact SG-NE2 3.39Å; C2-H24 VanDerWaalsContact SG-NE2 3.38Å; W4-H24 AromaticContact CD1-CG 3.89Å; W4-H24 HydrophobicContact CD2-CB 3.9Å; W4-H24 AromaticContact CD2-CE1 3.74Å; W4-H24 AromaticContact CD2-CG 3.53Å; W4-H24 AromaticContact CD2-ND1 3.2Å; W4-H24 AromaticContact CE2-CG 3.96Å; W4-H24 AromaticContact CE2-ND1 3.84Å; W4-H24 AromaticContact CE3-CE1 3.47Å; W4-H24 VanDerWaalsContact CE3-CE1 3.47Å; W4-H24 AromaticContact CE3-CG 3.98Å; W4-H24 AromaticContact CE3-ND1 3.15Å; W4-H24 HydrophobicContact CG-CB 3.87Å; W4-H24 AromaticContact CG-CD2 3.75Å; W4-H24 AromaticContact CG-CE1 3.91Å; W4-H24 AromaticContact CG-CG 3.47Å; W4-H24 VanDerWaalsContact CG-CG 3.47Å; W4-H24 AromaticContact CG-ND1 3.59Å; W4-H24 HydrophobicContact CZ2-CB 4.4Å; W4-H24 AromaticContact CZ3-ND1 3.73Å; C7-H24 PolarHBondContact SG-NE2 2.82Å; C7-H24 VanDerWaalsContact SG-NE2 3.41Å; H20-H24 AromaticContact CD2-NE2 3.8Å; H20-H24 AromaticContact CE1-NE2 3.78Å; H20-H24 AromaticContact NE2-CD2 3.85Å; H20-H24 AromaticContact NE2-NE2 3.09Å; H20-H24 PolarHBondContact NE2-NE2 3.09Å; Y21-H24 PolarHBondContact O-N 3.08Å; R22-H24 VanDerWaalsContact C-N 3.31Å; H24-G26 VanDerWaalsContact C-N 3.33Å
25	T	93	Very high	94.4	Very high	101 Å²	101	79.8 Å²	79.8	62%	0.62	40%	0.398	S	S	*	.	H	α-helix	trans	-79.8	-16.4	-179	55.9	0	0	0	0	113.5	Y21 R22 A27	Y21-T25 PolarHBondContact O-N 3.29Å; Y21-T25 VanDerWaalsContact O-N 3.11Å; Y21-T25 PolarHBondContact O-OG1 2.69Å; R22-T25 WeakPolarHBondContact CA-OG1 3.34Å; T25-A27 PolarHBondContact O-N 3.41Å; T25-A27 WeakPolarHBondContact OG1-CB 3.49Å; T25-A27 PolarHBondContact OG1-N 3.29Å
26	G	93.1	Very high	94.4	Very high	46 Å²	46	81.8 Å²	81.8	47%	0.474	41%	0.408	S	S	.	.			trans	68.5	12.3	-172.7	0	0	0	0	0	113.8	R22 H24 K28	R22-G26 WeakPolarHBondContact O-CA 2.99Å; R22-G26 PolarHBondContact O-N 2.87Å; H24-G26 VanDerWaalsContact C-N 3.33Å; G26-K28 WeakPolarHBondContact O-CG 3.47Å; G26-K28 PolarHBondContact O-N 3.34Å
27	A	94.4	Very high	94.5	Very high	43 Å²	43	86.1 Å²	86.1	36%	0.355	42%	0.423	S	S	.	.			trans	-61.7	125.9	-177.2	0	0	0	0	0	112.1	R22 T25 P29	R22-A27 PolarHBondContact O-N 3.47Å; T25-A27 PolarHBondContact O-N 3.41Å; T25-A27 WeakPolarHBondContact OG1-CB 3.49Å; T25-A27 PolarHBondContact OG1-N 3.29Å; A27-P29 WeakPolarHBondContact O-CD 3.49Å
28	K	94.6	Very high	94.6	Very high	133 Å²	133	87 Å²	87	58%	0.578	43%	0.432	S	S	*	.			trans	-126.4	71	-179.5	-65.9	166.4	-174.6	178.7	0	111	G26 F30 C38 F39	G26-K28 WeakPolarHBondContact O-CG 3.47Å; G26-K28 PolarHBondContact O-N 3.34Å; K28-F30 VanDerWaalsContact C-N 3.26Å; K28-F30 PolarHBondContact O-N 3.44Å; K28-C38 HydrophobicContact CB-CB 3.75Å; K28-C38 HydrophobicContact CD-CB 4.42Å; K28-F39 CarbonylContact C-O 3.15Å; K28-F39 WeakPolarHBondContact CA-O 3.39Å
29	P	93.2	Very high	94.9	Very high	81 Å²	81	85.2 Å²	85.2	53%	0.526	42%	0.417	S	S	.	.			trans	-71.3	-16.8	-173.2	28.4	-34.8	0	0	0	114	A27 R31	A27-P29 WeakPolarHBondContact O-CD 3.49Å; P29-R31 PolarHBondContact O-N 3.48Å
30	F	96.6	Very high	95	Very high	62 Å²	62	82.4 Å²	82.4	27%	0.272	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	96.6	-174.4	-56.9	-75	0	0	0	111.2	R22 K28 C38 F39 S42 L45	R22-F30 VanDerWaalsContact NH1-CE2 3.3Å; K28-F30 VanDerWaalsContact C-N 3.26Å; K28-F30 PolarHBondContact O-N 3.44Å; F30-C38 CarbonylContact O-C 3.35Å; F30-C38 WeakPolarHBondContact O-CA 3.47Å; F30-F39 HydrophobicContact CB-CB 4.32Å; F30-F39 WeakPolarHBondContact CB-O 3.42Å; F30-F39 WeakPolarHBondContact CD2-O 3.38Å; F30-F39 PolarHBondContact N-O 2.92Å; F30-F39 VanDerWaalsContact N-O 3.09Å; F30-F39 PolarHBondContact O-N 2.77Å; F30-S42 VanDerWaalsContact CE2-N 3.32Å; F30-L45 HydrophobicContact CB-CB 4.2Å; F30-L45 HydrophobicContact CB-CD2 3.9Å
31	R	97.4	Very high	95	Very high	151 Å²	151	84.9 Å²	84.9	57%	0.57	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	136.9	176.7	-175.9	169.9	178.9	-118.8	2	111.6	P29 D36	P29-R31 PolarHBondContact O-N 3.48Å; R31-D36 IonicContact CZ-OD1 2.84Å; R31-D36 IonicContact NE-OD1 3.41Å; R31-D36 IonicContact NH2-OD1 3.5Å; R31-D36 PolarHBondContact NH2-OD1 3.09Å
32	C	97.4	Very high	95.1	Very high	1 Å²	1	85.1 Å²	85.1	1%	0.007	43%	0.433	C	S	.	.			trans	-68.5	138.1	168.7	-178	0	0	0	0	110.4	L34 C35 R37 F39 L45 H48 H52	C32-L34 VanDerWaalsContact C-N 3.32Å; C32-L34 PolarHBondContact SG-N 3.28Å; C32-L34 VanDerWaalsContact SG-N 3.37Å; C32-C35 CarbonylContact C-O 3.53Å; C32-C35 WeakPolarHBondContact CB-O 3.45Å; C32-R37 WeakPolarHBondContact CB-O 3.01Å; C32-R37 PolarHBondContact N-O 2.84Å; C32-F39 HydrophobicContact CB-CE2 4.45Å; C32-L45 HydrophobicContact CB-CD1 3.94Å; C32-H48 PolarHBondContact SG-NE2 3.45Å; C32-H52 PolarHBondContact SG-NE2 3.46Å
33	K	95	Very high	95.2	Very high	201 Å²	201	84.7 Å²	84.7	87%	0.874	44%	0.437	S	S	*	.	S	Bend	trans	-81.4	-13.2	178.6	-61.9	-176	-180	-177.3	0	113.6
34	L	95.4	Very high	95.4	Very high	115 Å²	115	80.6 Å²	80.6	60%	0.602	42%	0.42	S	S	*	.	S	Bend	trans	-108.8	-11.2	-174.6	-58.6	177.5	0	0	0	112.9	C32 M49 H52	C32-L34 VanDerWaalsContact C-N 3.32Å; C32-L34 PolarHBondContact SG-N 3.28Å; C32-L34 VanDerWaalsContact SG-N 3.37Å; L34-M49 HydrophobicContact CD1-CE 3.7Å; L34-M49 HydrophobicContact CG-CE 4.13Å; L34-H52 HydrophobicContact CD1-CB 3.5Å; L34-H52 VanDerWaalsContact CD1-CB 3.5Å
35	C	96.1	Very high	95.6	Very high	36 Å²	36	80 Å²	80	24%	0.243	42%	0.418	C	S	.	.	S	Bend	trans	-158.1	169.5	175.2	70.2	0	0	0	0	110.7	C32 R37 H48	C32-C35 CarbonylContact C-O 3.53Å; C32-C35 WeakPolarHBondContact CB-O 3.45Å; C35-R37 PolarHBondContact O-N 3.45Å; C35-H48 PolarHBondContact SG-NE2 3.31Å
36	D	93.9	Very high	95.7	Very high	127 Å²	127	77.9 Å²	77.9	68%	0.679	41%	0.411	S	S	*	.	S	Bend	trans	-80.8	22.4	-174.4	-62.2	-51.9	0	0	0	115.4	R31	R31-D36 IonicContact CZ-OD1 2.84Å; R31-D36 IonicContact NE-OD1 3.41Å; R31-D36 IonicContact NH2-OD1 3.5Å; R31-D36 PolarHBondContact NH2-OD1 3.09Å
37	R	96.7	Very high	95.9	Very high	129 Å²	129	80.1 Å²	80.1	49%	0.487	41%	0.412	S	S	.	.			trans	-84.7	128	178	-67.3	-172.5	-178.8	-177.8	1.3	111.3	C32 C35 F39	C32-R37 WeakPolarHBondContact CB-O 3.01Å; C32-R37 PolarHBondContact N-O 2.84Å; C35-R37 PolarHBondContact O-N 3.45Å; R37-F39 HydrophobicContact CB-CE2 3.83Å; R37-F39 HydrophobicContact CB-CZ 3.88Å
38	C	97	Very high	96	Very high	52 Å²	52	78.6 Å²	78.6	35%	0.351	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	141.8	174	-58.5	0	0	0	0	111.3	K28 F30	K28-C38 HydrophobicContact CB-CB 3.75Å; K28-C38 HydrophobicContact CD-CB 4.42Å; F30-C38 CarbonylContact O-C 3.35Å; F30-C38 WeakPolarHBondContact O-CA 3.47Å
39	F	97.2	Very high	96.1	Very high	40 Å²	40	75.2 Å²	75.2	18%	0.175	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	146.8	-175.9	-57.6	-89	0	0	0	110.8	K28 F30 C32 R37 R41 H44 L45 H48	K28-F39 CarbonylContact C-O 3.15Å; K28-F39 WeakPolarHBondContact CA-O 3.39Å; F30-F39 HydrophobicContact CB-CB 4.32Å; F30-F39 WeakPolarHBondContact CB-O 3.42Å; F30-F39 WeakPolarHBondContact CD2-O 3.38Å; F30-F39 PolarHBondContact N-O 2.92Å; F30-F39 VanDerWaalsContact N-O 3.09Å; F30-F39 PolarHBondContact O-N 2.77Å; C32-F39 HydrophobicContact CB-CE2 4.45Å; R37-F39 HydrophobicContact CB-CE2 3.83Å; R37-F39 HydrophobicContact CB-CZ 3.88Å; F39-R41 VanDerWaalsContact C-N 3.29Å; F39-H44 HydrophobicContact CB-CB 4.28Å; F39-H44 HydrophobicContact CD1-CB 4Å; F39-H44 HydrophobicContact CG-CB 4.4Å; F39-L45 HydrophobicContact CB-CB 4.35Å; F39-L45 HydrophobicContact CD2-CB 3.91Å; F39-L45 HydrophobicContact CD2-CD1 3.79Å; F39-L45 HydrophobicContact CD2-CG 4.44Å; F39-L45 HydrophobicContact CE2-CD1 3.91Å; F39-L45 HydrophobicContact CG-CB 4.27Å; F39-H48 HydrophobicContact CE1-CB 3.96Å; F39-H48 HydrophobicContact CE2-CB 3.86Å; F39-H48 AromaticContact CE2-CD2 3.46Å; F39-H48 VanDerWaalsContact CE2-CD2 3.46Å; F39-H48 WeakPolarHBondContact CE2-CD2 3.44Å; F39-H48 AromaticContact CE2-CG 3.62Å; F39-H48 HydrophobicContact CZ-CB 3.41Å; F39-H48 VanDerWaalsContact CZ-CB 3.41Å; F39-H48 AromaticContact CZ-CD2 3.57Å; F39-H48 AromaticContact CZ-CG 3.24Å; F39-H48 AromaticContact CZ-ND1 3.7Å
40	A	95.7	Very high	96.1	Very high	34 Å²	34	78.6 Å²	78.6	28%	0.281	39%	0.387	S	S	.	.	S	Bend	trans	-75.6	-19	176	0	0	0	0	0	113.1	R22	R22-A40 WeakPolarHBondContact CD-O 3.28Å; R22-A40 PolarHBondContact NH1-O 3.41Å
41	R	95.6	Very high	95.8	Very high	69 Å²	69	84.5 Å²	84.5	26%	0.26	41%	0.407	S	S	.	.	S	Bend	trans	-134.8	148.6	-176.4	-55.2	168.1	52.5	161.3	-0.4	112.1	R19 F39 D43 H44 L45	R19-R41 HydrophobicContact CG-CG 4.11Å; R19-R41 VanDerWaalsContact NH1-CZ 3.31Å; R19-R41 VanDerWaalsContact NH1-NH2 3.17Å; F39-R41 VanDerWaalsContact C-N 3.29Å; R41-D43 WeakPolarHBondContact CB-OD1 3.35Å; R41-D43 IonicContact CZ-OD1 2.66Å; R41-D43 IonicContact CZ-OD2 2.7Å; R41-D43 VanDerWaalsContact CZ-OD2 3.23Å; R41-D43 IonicContact NE-OD1 3.23Å; R41-D43 PolarHBondContact NE-OD1 2.7Å; R41-D43 IonicContact NE-OD2 2.87Å; R41-D43 PolarHBondContact NE-OD2 2.66Å; R41-D43 IonicContact NH2-OD1 3.7Å; R41-D43 PolarHBondContact NH2-OD1 2.86Å; R41-D43 IonicContact NH2-OD2 3.92Å; R41-D43 PolarHBondContact NH2-OD2 2.84Å; R41-H44 HydrophobicContact CB-CB 4.45Å; R41-L45 PolarHBondContact O-N 3.39Å
42	S	94.8	Very high	95.6	Very high	71 Å²	71	80.3 Å²	80.3	50%	0.497	39%	0.394	S	S	.	.	H	α-helix	trans	-69.8	-38.1	-178.9	51.2	0	0	0	0	112.8	F30 H44 L45 A46	F30-S42 VanDerWaalsContact CE2-N 3.32Å; S42-H44 VanDerWaalsContact C-N 3.32Å; S42-H44 PolarHBondContact O-N 3.01Å; S42-L45 WeakPolarHBondContact O-CB 3.46Å; S42-L45 PolarHBondContact O-N 2.88Å; S42-L45 VanDerWaalsContact O-N 3.17Å; S42-A46 PolarHBondContact O-N 2.93Å
43	D	95.8	Very high	95.1	Very high	69 Å²	69	86.5 Å²	86.5	37%	0.369	42%	0.423	S	S	.	.	H	α-helix	trans	-64.7	-36.2	177.3	61.7	-46	0	0	0	112.1	R41 A46 L47	R41-D43 WeakPolarHBondContact CB-OD1 3.35Å; R41-D43 IonicContact CZ-OD1 2.66Å; R41-D43 IonicContact CZ-OD2 2.7Å; R41-D43 VanDerWaalsContact CZ-OD2 3.23Å; R41-D43 IonicContact NE-OD1 3.23Å; R41-D43 PolarHBondContact NE-OD1 2.7Å; R41-D43 IonicContact NE-OD2 2.87Å; R41-D43 PolarHBondContact NE-OD2 2.66Å; R41-D43 IonicContact NH2-OD1 3.7Å; R41-D43 PolarHBondContact NH2-OD1 2.86Å; R41-D43 IonicContact NH2-OD2 3.92Å; R41-D43 PolarHBondContact NH2-OD2 2.84Å; D43-A46 PolarHBondContact O-N 2.94Å; D43-L47 WeakPolarHBondContact O-CB 3.46Å; D43-L47 PolarHBondContact O-N 2.98Å
44	H	96.6	Very high	94.3	Very high	86 Å²	86	82.5 Å²	82.5	40%	0.398	42%	0.418	S	S	.	.	H	α-helix	trans	-66	-40.6	172.5	-70.2	-162.5	0	0	0	111.7	F39 R41 S42 H48	F39-H44 HydrophobicContact CB-CB 4.28Å; F39-H44 HydrophobicContact CD1-CB 4Å; F39-H44 HydrophobicContact CG-CB 4.4Å; R41-H44 HydrophobicContact CB-CB 4.45Å; S42-H44 VanDerWaalsContact C-N 3.32Å; S42-H44 PolarHBondContact O-N 3.01Å; H44-H48 WeakPolarHBondContact O-CB 3.49Å; H44-H48 PolarHBondContact O-N 3.32Å
45	L	97.3	Very high	93.2	Very high	32 Å²	32	86.4 Å²	86.4	17%	0.168	43%	0.43	C	S	.	.	H	α-helix	trans	-62.1	-45.2	172.2	172.5	61.6	0	0	0	110.7	F30 C32 F39 R41 S42 L47 H48 M49	F30-L45 HydrophobicContact CB-CB 4.2Å; F30-L45 HydrophobicContact CB-CD2 3.9Å; C32-L45 HydrophobicContact CB-CD1 3.94Å; F39-L45 HydrophobicContact CB-CB 4.35Å; F39-L45 HydrophobicContact CD2-CB 3.91Å; F39-L45 HydrophobicContact CD2-CD1 3.79Å; F39-L45 HydrophobicContact CD2-CG 4.44Å; F39-L45 HydrophobicContact CE2-CD1 3.91Å; F39-L45 HydrophobicContact CG-CB 4.27Å; R41-L45 PolarHBondContact O-N 3.39Å; S42-L45 WeakPolarHBondContact O-CB 3.46Å; S42-L45 PolarHBondContact O-N 2.88Å; S42-L45 VanDerWaalsContact O-N 3.17Å; L45-L47 PolarHBondContact O-N 3.46Å; L45-H48 CarbonylContact O-C 3.59Å; L45-H48 WeakPolarHBondContact O-CA 3.33Å; L45-H48 WeakPolarHBondContact O-CB 3.33Å; L45-H48 PolarHBondContact O-N 3.08Å; L45-H48 VanDerWaalsContact O-N 3.08Å; L45-M49 HydrophobicContact CD1-CG 4.25Å; L45-M49 HydrophobicContact CD1-SD 4.14Å; L45-M49 HydrophobicContact CG-CG 4.5Å; L45-M49 WeakPolarHBondContact O-CG 3.43Å; L45-M49 PolarHBondContact O-N 3.17Å
46	A	96.5	Very high	91.7	Very high	57 Å²	57	89.3 Å²	89.3	47%	0.471	45%	0.45	S	S	.	.	H	α-helix	trans	-60.6	-44.9	179.1	0	0	0	0	0	112.3	S42 D43 H48 M49	S42-A46 PolarHBondContact O-N 2.93Å; D43-A46 PolarHBondContact O-N 2.94Å; A46-H48 VanDerWaalsContact C-N 3.31Å; A46-H48 PolarHBondContact O-N 3.37Å; A46-M49 PolarHBondContact O-N 3.34Å
47	L	96.4	Very high	90.2	Very high	94 Å²	94	94.4 Å²	94.4	49%	0.492	46%	0.46	S	S	.	.	H	α-helix	trans	-59.3	-43.2	171.9	167.2	64	0	0	0	111.2	D43 L45 M49 R50	D43-L47 WeakPolarHBondContact O-CB 3.46Å; D43-L47 PolarHBondContact O-N 2.98Å; L45-L47 PolarHBondContact O-N 3.46Å; L47-M49 VanDerWaalsContact C-N 3.33Å; L47-M49 PolarHBondContact O-N 3.25Å; L47-R50 WeakPolarHBondContact O-CB 3.39Å; L47-R50 PolarHBondContact O-N 3.23Å
48	H	97	Very high	88.3	Confident	11 Å²	11	93.6 Å²	93.6	5%	0.051	47%	0.469	C	S	.	.	H	α-helix	trans	-61.3	-40.6	177.5	168.3	67.9	0	0	0	112.4	C32 C35 F39 H44 L45 A46 R50 R51 H52	C32-H48 PolarHBondContact SG-NE2 3.45Å; C35-H48 PolarHBondContact SG-NE2 3.31Å; F39-H48 HydrophobicContact CE1-CB 3.96Å; F39-H48 HydrophobicContact CE2-CB 3.86Å; F39-H48 AromaticContact CE2-CD2 3.46Å; F39-H48 VanDerWaalsContact CE2-CD2 3.46Å; F39-H48 WeakPolarHBondContact CE2-CD2 3.44Å; F39-H48 AromaticContact CE2-CG 3.62Å; F39-H48 HydrophobicContact CZ-CB 3.41Å; F39-H48 VanDerWaalsContact CZ-CB 3.41Å; F39-H48 AromaticContact CZ-CD2 3.57Å; F39-H48 AromaticContact CZ-CG 3.24Å; F39-H48 AromaticContact CZ-ND1 3.7Å; H44-H48 WeakPolarHBondContact O-CB 3.49Å; H44-H48 PolarHBondContact O-N 3.32Å; L45-H48 CarbonylContact O-C 3.59Å; L45-H48 WeakPolarHBondContact O-CA 3.33Å; L45-H48 WeakPolarHBondContact O-CB 3.33Å; L45-H48 PolarHBondContact O-N 3.08Å; L45-H48 VanDerWaalsContact O-N 3.08Å; A46-H48 VanDerWaalsContact C-N 3.31Å; A46-H48 PolarHBondContact O-N 3.37Å; H48-R50 PolarHBondContact O-N 3.28Å; H48-R50 VanDerWaalsContact O-N 3.13Å; H48-R51 VanDerWaalsContact O-CB 3.32Å; H48-R51 WeakPolarHBondContact O-CB 3.32Å; H48-R51 PolarHBondContact O-N 3.25Å; H48-H52 AromaticContact CD2-NE2 3.86Å; H48-H52 AromaticContact CE1-NE2 3.45Å; H48-H52 PolarHBondContact CE1-NE2 2.93Å; H48-H52 AromaticContact NE2-CD2 3.7Å; H48-H52 AromaticContact NE2-CE1 3.97Å; H48-H52 AromaticContact NE2-NE2 2.98Å; H48-H52 PolarHBondContact NE2-NE2 3.46Å
49	M	96.4	Very high	86.6	Confident	62 Å²	62	95.3 Å²	95.3	31%	0.305	48%	0.482	S	S	.	.	H	α-helix	trans	-59	-26.7	178.9	-67.4	-55	-66.8	0	0	112.9	L34 L45 A46 L47 R51 H52 Q53	L34-M49 HydrophobicContact CD1-CE 3.7Å; L34-M49 HydrophobicContact CG-CE 4.13Å; L45-M49 HydrophobicContact CD1-CG 4.25Å; L45-M49 HydrophobicContact CD1-SD 4.14Å; L45-M49 HydrophobicContact CG-CG 4.5Å; L45-M49 WeakPolarHBondContact O-CG 3.43Å; L45-M49 PolarHBondContact O-N 3.17Å; A46-M49 PolarHBondContact O-N 3.34Å; L47-M49 VanDerWaalsContact C-N 3.33Å; L47-M49 PolarHBondContact O-N 3.25Å; M49-R51 PolarHBondContact O-N 3.13Å; M49-H52 WeakPolarHBondContact O-CB 3.46Å; M49-H52 PolarHBondContact O-N 3.36Å; M49-Q53 PolarHBondContact O-N 3.03Å
50	R	93.7	Very high	85	Confident	151 Å²	151	105.3 Å²	105.3	57%	0.57	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-24.5	174.2	-60.6	-161.9	-72.9	-109.8	18.1	113.4	L47 H48 H52 Q53	L47-R50 WeakPolarHBondContact O-CB 3.39Å; L47-R50 PolarHBondContact O-N 3.23Å; H48-R50 PolarHBondContact O-N 3.28Å; H48-R50 VanDerWaalsContact O-N 3.13Å; R50-H52 VanDerWaalsContact C-N 3.27Å; R50-Q53 PolarHBondContact O-N 3.42Å
51	R	90.3	Very high	83.7	Confident	186 Å²	186	110.7 Å²	110.7	70%	0.702	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-21.2	175.2	-63.5	178.5	60.6	160.6	3.1	112.9	H48 M49	H48-R51 VanDerWaalsContact O-CB 3.32Å; H48-R51 WeakPolarHBondContact O-CB 3.32Å; H48-R51 PolarHBondContact O-N 3.25Å; M49-R51 PolarHBondContact O-N 3.13Å
52	H	92.8	Very high	81.9	Confident	64 Å²	64	113.6 Å²	113.6	30%	0.296	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.5	-16.5	175.7	-65	-57.7	0	0	0	112.7	C32 L34 H48 M49 R50 P54	C32-H52 PolarHBondContact SG-NE2 3.46Å; L34-H52 HydrophobicContact CD1-CB 3.5Å; L34-H52 VanDerWaalsContact CD1-CB 3.5Å; H48-H52 AromaticContact CD2-NE2 3.86Å; H48-H52 AromaticContact CE1-NE2 3.45Å; H48-H52 PolarHBondContact CE1-NE2 2.93Å; H48-H52 AromaticContact NE2-CD2 3.7Å; H48-H52 AromaticContact NE2-CE1 3.97Å; H48-H52 AromaticContact NE2-NE2 2.98Å; H48-H52 PolarHBondContact NE2-NE2 3.46Å; M49-H52 WeakPolarHBondContact O-CB 3.46Å; M49-H52 PolarHBondContact O-N 3.36Å; R50-H52 VanDerWaalsContact C-N 3.27Å; H52-P54 WeakPolarHBondContact O-CD 3.5Å
53	Q	87.1	Confident	80.3	Confident	130 Å²	130	113.2 Å²	113.2	61%	0.607	55%	0.554	S	S	*	*	S	Bend	trans	-61.7	126.1	175.7	-67.9	-179.5	14.1	0	0	108.3	M49 R50 K55	M49-Q53 PolarHBondContact O-N 3.03Å; R50-Q53 PolarHBondContact O-N 3.42Å; Q53-K55 PolarHBondContact O-N 2.84Å; Q53-K55 VanDerWaalsContact O-N 3.13Å
54	P	78.2	Confident	78.6	Confident	118 Å²	118	117.1 Å²	117.1	77%	0.766	58%	0.575	S	S	*	*			trans	-58.3	125.7	170.3	24.3	-30.1	0	0	0	106.3	H52 S56	H52-P54 WeakPolarHBondContact O-CD 3.5Å; P54-S56 PolarHBondContact O-N 3.13Å
55	K	72.6	Confident	76.8	Confident	196 Å²	196	116.8 Å²	116.8	85%	0.852	58%	0.576	S	S	*	*			trans	-60	104.2	161.4	-68.8	174.9	-178	169.7	0	103.7	Q53 R57	Q53-K55 PolarHBondContact O-N 2.84Å; Q53-K55 VanDerWaalsContact O-N 3.13Å; K55-R57 VanDerWaalsContact C-N 3.26Å; K55-R57 PolarHBondContact O-N 2.81Å
56	S	64.2	Low	75.2	Confident	97 Å²	97	120 Å²	120	68%	0.678	60%	0.599	S	S	*	*			trans	-54.2	109.5	163.1	50.9	0	0	0	0	103.7	P54 V58	P54-S56 PolarHBondContact O-N 3.13Å; S56-V58 PolarHBondContact O-N 2.75Å
57	R	61.8	Low	73.7	Confident	235 Å²	235	122 Å²	122	89%	0.887	61%	0.605	S	S	*	*			trans	-66.7	83.7	160.4	-79	-171.7	-86.7	-164.2	-3.8	102.7	K55 S59	K55-R57 VanDerWaalsContact C-N 3.26Å; K55-R57 PolarHBondContact O-N 2.81Å; R57-S59 PolarHBondContact O-N 2.84Å
58	V	57.8	Low	71.9	Confident	111 Å²	111	122.2 Å²	122.2	67%	0.673	62%	0.615	S	S	*	*			trans	-57.9	101.7	150.6	-159.4	0	0	0	0	101.2	S56 R60	S56-V58 PolarHBondContact O-N 2.75Å; V58-R60 PolarHBondContact O-N 2.89Å
59	S	61.8	Low	70.1	Confident	88 Å²	88	129.6 Å²	129.6	62%	0.615	65%	0.651	S	S	*	*			trans	-49.4	110.5	175.1	-95.7	0	0	0	0	105.5	R57 H61 L62	R57-S59 PolarHBondContact O-N 2.84Å; S59-H61 CarbonylContact O-C 3.58Å; S59-H61 PolarHBondContact O-N 3.2Å; S59-H61 VanDerWaalsContact O-N 3.15Å; S59-L62 PolarHBondContact O-N 3.15Å
60	R	62.8	Low	68.3	Low	250 Å²	250	132.4 Å²	132.4	94%	0.943	67%	0.672	S	S	*	*	S	Bend	trans	-63.9	-14.7	176.8	-78.3	-173.9	-150.2	174.5	5.7	111.5	V58 L62	V58-R60 PolarHBondContact O-N 2.89Å; R60-L62 PolarHBondContact O-N 2.8Å
61	H	67.9	Low	66	Low	148 Å²	148	129.3 Å²	129.3	69%	0.685	68%	0.678	S	S	*	*			trans	-71.5	74.7	152.4	-144.8	-97.5	0	0	0	107.8	S59 S63	S59-H61 CarbonylContact O-C 3.58Å; S59-H61 PolarHBondContact O-N 3.2Å; S59-H61 VanDerWaalsContact O-N 3.15Å; H61-S63 PolarHBondContact CE1-OG 3.48Å; H61-S63 PolarHBondContact ND1-OG 2.52Å; H61-S63 PolarHBondContact O-N 2.86Å
62	L	58.5	Low	63.8	Low	130 Å²	130	125.5 Å²	125.5	68%	0.681	69%	0.686	S	S	*	*			trans	-62.9	92.6	150.7	-163.5	77.1	0	0	0	102.3	S59 R60 L64	S59-L62 PolarHBondContact O-N 3.15Å; R60-L62 PolarHBondContact O-N 2.8Å; L62-L64 HydrophobicContact CD2-CD2 4.45Å; L62-L64 PolarHBondContact O-N 2.74Å
63	S	60.6	Low	61.6	Low	62 Å²	62	127.3 Å²	127.3	43%	0.434	71%	0.713	S	S	.	*			trans	-62.9	94.5	175.5	-138.5	0	0	0	0	104.3	H61 D65	H61-S63 PolarHBondContact CE1-OG 3.48Å; H61-S63 PolarHBondContact ND1-OG 2.52Å; H61-S63 PolarHBondContact O-N 2.86Å; S63-D65 WeakPolarHBondContact CB-OD2 3.05Å; S63-D65 PolarHBondContact O-N 2.9Å; S63-D65 PolarHBondContact OG-OD2 2.93Å
64	L	59.7	Low	59.5	Low	151 Å²	151	126 Å²	126	79%	0.791	72%	0.724	S	S	*	*			trans	-69	67.2	163.6	-68.5	161.1	0	0	0	104.2	L62 P66	L62-L64 HydrophobicContact CD2-CD2 4.45Å; L62-L64 PolarHBondContact O-N 2.74Å; L64-P66 WeakPolarHBondContact O-CD 3.08Å
65	D	60.2	Low	58	Low	80 Å²	80	124.3 Å²	124.3	43%	0.428	72%	0.72	S	S	.	*			trans	-73.1	104.3	171	-93.6	-95.9	0	0	0	105.4	S63 T67 S68	S63-D65 WeakPolarHBondContact CB-OD2 3.05Å; S63-D65 PolarHBondContact O-N 2.9Å; S63-D65 PolarHBondContact OG-OD2 2.93Å; D65-T67 PolarHBondContact O-N 3.32Å; D65-T67 VanDerWaalsContact O-N 3.07Å; D65-S68 PolarHBondContact O-N 3.38Å; D65-S68 VanDerWaalsContact O-N 3.12Å; D65-S68 PolarHBondContact O-OG 3.01Å
66	P	62.9	Low	57.2	Low	100 Å²	100	119.8 Å²	119.8	65%	0.649	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-62.4	-18.2	-178.8	28.2	-34.7	0	0	0	111.4	L64 S68 M69	L64-P66 WeakPolarHBondContact O-CD 3.08Å; P66-S68 PolarHBondContact O-N 3.18Å; P66-M69 PolarHBondContact O-N 3.12Å
67	T	65.6	Low	56.9	Low	98 Å²	98	120.7 Å²	120.7	60%	0.601	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-62.6	-23.3	176.5	-30.5	0	0	0	0	113.2	D65 M69 V70	D65-T67 PolarHBondContact O-N 3.32Å; D65-T67 VanDerWaalsContact O-N 3.07Å; T67-M69 VanDerWaalsContact C-N 3.26Å; T67-M69 PolarHBondContact O-N 3.24Å; T67-V70 WeakPolarHBondContact O-CG2 3.13Å
68	S	58.2	Low	56.5	Low	99 Å²	99	114.3 Å²	114.3	69%	0.692	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-74.1	-14.7	177.7	66.5	0	0	0	0	114	D65 P66	D65-S68 PolarHBondContact O-N 3.38Å; D65-S68 VanDerWaalsContact O-N 3.12Å; D65-S68 PolarHBondContact O-OG 3.01Å; P66-S68 PolarHBondContact O-N 3.18Å
69	M	59.8	Low	56.8	Low	165 Å²	165	114 Å²	114	81%	0.813	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-92.9	6.4	-179.2	-62.8	-169.7	75.2	0	0	114	P66 T67 A71	P66-M69 PolarHBondContact O-N 3.12Å; T67-M69 VanDerWaalsContact C-N 3.26Å; T67-M69 PolarHBondContact O-N 3.24Å; M69-A71 PolarHBondContact O-N 3.07Å
70	V	56.9	Low	56.9	Low	122 Å²	122	117.2 Å²	117.2	74%	0.739	73%	0.727	S	S	*	*			trans	-80.3	61.7	174.4	-60.2	0	0	0	0	111.4	T67	T67-V70 WeakPolarHBondContact O-CG2 3.13Å
71	A	46.7	Very low	56.8	Low	86 Å²	86	111.8 Å²	111.8	71%	0.711	71%	0.712	S	S	*	*	S	Bend	trans	-125.3	107.1	167.4	0	0	0	0	0	109.4	M69	M69-A71 PolarHBondContact O-N 3.07Å
72	A	42.8	Very low	56.9	Low	105 Å²	105	112.6 Å²	112.6	87%	0.868	72%	0.715	S	S	*	*			trans	69.5	66.7	157.5	0	0	0	0	0	117.8
73	A	47	Very low	57.2	Low	103 Å²	103	112.9 Å²	112.9	85%	0.851	72%	0.715	S	S	*	*			trans	-107.7	84.8	143	0	0	0	0	0	107.7	A75	A73-A75 VanDerWaalsContact C-N 3.28Å; A73-A75 PolarHBondContact O-N 3.02Å
74	A	43.3	Very low	57.6	Low	102 Å²	102	114.3 Å²	114.3	84%	0.843	72%	0.723	S	S	*	*			trans	-63.2	92.2	169.1	0	0	0	0	0	108.2	A76	A74-A76 PolarHBondContact O-N 2.89Å
75	A	47.2	Very low	58	Low	83 Å²	83	114.5 Å²	114.5	69%	0.686	72%	0.724	S	S	*	*			trans	-68.7	101.8	170.4	0	0	0	0	0	107.7	A73 T77	A73-A75 VanDerWaalsContact C-N 3.28Å; A73-A75 PolarHBondContact O-N 3.02Å; A75-T77 VanDerWaalsContact C-N 3.27Å; A75-T77 PolarHBondContact O-N 3.19Å; A75-T77 PolarHBondContact O-OG1 2.81Å
76	A	54.8	Low	58.4	Low	100 Å²	100	119.3 Å²	119.3	83%	0.826	74%	0.744	S	S	*	*			trans	-53.7	93.6	165.7	0	0	0	0	0	108.7	A74 A78	A74-A76 PolarHBondContact O-N 2.89Å; A76-A78 PolarHBondContact O-N 3.13Å; A76-A78 VanDerWaalsContact O-N 3.13Å
77	T	58.7	Low	58.6	Low	117 Å²	117	121.9 Å²	121.9	72%	0.718	75%	0.747	S	S	*	*			trans	-84.8	90.4	175.4	-46.1	0	0	0	0	106.2	A75 V79	A75-T77 VanDerWaalsContact C-N 3.27Å; A75-T77 PolarHBondContact O-N 3.19Å; A75-T77 PolarHBondContact O-OG1 2.81Å; T77-V79 VanDerWaalsContact C-N 3.34Å; T77-V79 HydrophobicContact CG2-CG2 4.29Å; T77-V79 PolarHBondContact O-N 2.97Å
78	A	53.1	Low	58.2	Low	101 Å²	101	122.5 Å²	122.5	84%	0.835	76%	0.755	S	S	*	*			trans	-65.4	93.6	170.4	0	0	0	0	0	108.7	A76 N80	A76-A78 PolarHBondContact O-N 3.13Å; A76-A78 VanDerWaalsContact O-N 3.13Å; A78-N80 PolarHBondContact O-N 3.03Å
79	V	64.8	Low	58.3	Low	103 Å²	103	128.3 Å²	128.3	62%	0.624	76%	0.762	S	S	*	*			trans	-80.7	105.8	169.4	178.7	0	0	0	0	107.6	T77 Q81	T77-V79 VanDerWaalsContact C-N 3.34Å; T77-V79 HydrophobicContact CG2-CG2 4.29Å; T77-V79 PolarHBondContact O-N 2.97Å; V79-Q81 VanDerWaalsContact C-N 3.34Å; V79-Q81 HydrophobicContact CG1-CG 3.61Å; V79-Q81 PolarHBondContact O-N 3.33Å
80	N	63.1	Low	58.1	Low	157 Å²	157	125.3 Å²	125.3	84%	0.84	76%	0.757	S	S	*	*			trans	-71.5	87.1	169.2	-176.1	16.4	0	0	0	109	A78 H82	A78-N80 PolarHBondContact O-N 3.03Å; N80-H82 PolarHBondContact O-N 3.04Å
81	Q	61.9	Low	58.6	Low	135 Å²	135	126.3 Å²	126.3	63%	0.631	76%	0.758	S	S	*	*			trans	-80.3	104.2	172	-61.1	-171.2	12	0	0	108.6	V79 M83	V79-Q81 VanDerWaalsContact C-N 3.34Å; V79-Q81 HydrophobicContact CG1-CG 3.61Å; V79-Q81 PolarHBondContact O-N 3.33Å; Q81-M83 PolarHBondContact O-N 3.3Å
82	H	69.6	Low	59.2	Low	165 Å²	165	127.6 Å²	127.6	76%	0.764	76%	0.759	S	S	*	*			trans	-62.4	103.8	165	174.7	71.1	0	0	0	108.6	N80 P84	N80-H82 PolarHBondContact O-N 3.04Å; H82-P84 WeakPolarHBondContact O-CD 3.4Å
83	M	64.3	Low	60.5	Low	137 Å²	137	128.6 Å²	128.6	68%	0.675	76%	0.755	S	S	*	*			trans	-71.5	120	174.3	-86.1	-73.4	144.7	0	0	109.9	Q81 L85	Q81-M83 PolarHBondContact O-N 3.3Å; M83-L85 PolarHBondContact O-N 3.47Å
84	P	69.3	Low	61.2	Low	91 Å²	91	130.1 Å²	130.1	59%	0.591	75%	0.753	S	S	*	*			trans	-73.2	126.8	176.8	27.4	-30.7	0	0	0	110.8	H82 Q86	H82-P84 WeakPolarHBondContact O-CD 3.4Å; P84-Q86 PolarHBondContact O-N 3.18Å; P84-Q86 VanDerWaalsContact O-N 3.17Å
85	L	68.5	Low	62.1	Low	155 Å²	155	135.9 Å²	135.9	81%	0.812	76%	0.755	S	S	*	*			trans	-68.1	107.4	174.6	-71.3	169.9	0	0	0	110	M83 H87	M83-L85 PolarHBondContact O-N 3.47Å; L85-H87 PolarHBondContact O-N 3.17Å
86	Q	69	Low	62.7	Low	182 Å²	182	143.6 Å²	143.6	85%	0.85	78%	0.776	S	S	*	*			trans	-72.2	104.6	172	26.1	-150.8	-88.4	0	0	109.2	P84 S88	P84-Q86 PolarHBondContact O-N 3.18Å; P84-Q86 VanDerWaalsContact O-N 3.17Å; Q86-S88 PolarHBondContact O-N 3.24Å
87	H	65.8	Low	63.1	Low	153 Å²	153	145.8 Å²	145.8	71%	0.708	77%	0.774	S	S	*	*			trans	-77.9	99.6	168.9	-86.6	74.5	0	0	0	108.8	L85 R89	L85-H87 PolarHBondContact O-N 3.17Å; H87-R89 PolarHBondContact O-N 3.15Å; H87-R89 VanDerWaalsContact O-N 3.15Å
88	S	57.6	Low	63.3	Low	111 Å²	111	147.3 Å²	147.3	78%	0.776	78%	0.777	S	S	*	*			trans	-71	95	165.2	54.7	0	0	0	0	109.1	Q86	Q86-S88 PolarHBondContact O-N 3.24Å
89	R	60.2	Low	63.9	Low	221 Å²	221	149.9 Å²	149.9	83%	0.834	77%	0.773	S	S	*	*			trans	-101.7	92.3	163	-75.2	-170.8	-178.7	-174.8	0.7	108.8	H87	H87-R89 PolarHBondContact O-N 3.15Å; H87-R89 VanDerWaalsContact O-N 3.15Å
90	S	56.6	Low	63.8	Low	103 Å²	103	152.6 Å²	152.6	72%	0.72	78%	0.782	S	S	*	*			trans	-69.1	115.8	158.6	45.7	0	0	0	0	109
91	D	66.7	Low	63.9	Low	143 Å²	143	152.4 Å²	152.4	77%	0.765	78%	0.779	S	S	*	*			trans	-134.3	109.1	160	-99.9	-58.9	0	0	0	109
92	P	59.9	Low	64	Low	112 Å²	112	153.5 Å²	153.5	73%	0.727	79%	0.788	S	S	*	*			trans	-86.2	105	176.2	31.8	-28.5	0	0	0	109.8
93	T	68.4	Low	63.6	Low	127 Å²	127	152.7 Å²	152.7	78%	0.779	79%	0.79	S	S	*	*			trans	-97.4	94.1	166.3	24.7	0	0	0	0	109.9	Y95	T93-Y95 PolarHBondContact O-N 3.35Å
94	V	63.5	Low	63.5	Low	134 Å²	134	153.9 Å²	153.9	81%	0.812	80%	0.799	S	S	*	*			trans	-64.2	114.5	158.6	174.5	0	0	0	0	107
95	Y	61.7	Low	63.1	Low	223 Å²	223	159.2 Å²	159.2	88%	0.875	82%	0.816	S	S	*	*			trans	-112.2	135.5	158.1	-105.8	-91.7	0	0	0	108.5	T93	T93-Y95 PolarHBondContact O-N 3.35Å
96	H	58.8	Low	62.6	Low	246 Å²	246	159.5 Å²	159.5	100%	1.139	82%	0.817	S	S	*	*			trans	-74.4	0	-155.5	-161.4	-56.5	0	0	0	114.7

Retrieved 96 of 96 residues in 40.8 ms (Link to these results)

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