A0A077ZLW0_TRITR Loading...

Histone H2A

Core component of nucleosome. Nucleosomes wrap and compact DNA into chromatin, limiting DNA accessibility to the cellular machineries which require DNA as a template. Histones thereby play a central role in transcription regulation, DNA repair, DNA replication and chromosomal stability. DNA accessibility is regulated via a complex set of post-translational modifications of histones, also called histone code, and nucleosome remodeling.

AlphaFold DB , UniProt , Accession A0A077ZLW0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 96 aa.

						>A0A077ZLW0_TRITR|A0A077ZLW0
MLRRVNYAERIGAGAPVYLAAVIEYLTAKVLELAGDAARNSKKRRIIPRHLQLAIRNDEELSKFLKGVTIAHGGVLPNIHPSLLPNRAKVKTTRKN
					

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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	82.5	Confident	86.8	Confident	178 Å²	178	137.7 Å²	137.7	88%	0.877	63%	0.625	S	S	*	*				0	-65.9	0	-163.1	174	176.3	0	0	111.5	R3 R4 V5	M1-R3 PolarHBondContact O-N 2.9Å; M1-R4 PolarHBondContact O-N 3.31Å; M1-V5 HydrophobicContact CG-CG2 4.5Å; M1-V5 WeakPolarHBondContact O-CG2 3.47Å; M1-V5 PolarHBondContact O-N 3.26Å
2	L	85.3	Confident	87.3	Confident	39 Å²	39	130.5 Å²	130.5	20%	0.204	62%	0.617	C	S	.	*	G	3₁₀ helix	trans	-50.8	-47.1	-174.6	-67.7	179.1	0	0	0	115.7	R4 V5 Y7 I11 P16 L19	L2-R4 VanDerWaalsContact C-N 3.29Å; L2-R4 PolarHBondContact O-N 3.41Å; L2-V5 PolarHBondContact O-N 3.49Å; L2-Y7 HydrophobicContact CD2-CD2 3.91Å; L2-Y7 HydrophobicContact CD2-CE2 3.9Å; L2-I11 HydrophobicContact CB-CG1 4.42Å; L2-I11 HydrophobicContact CB-CG2 4.37Å; L2-I11 HydrophobicContact CD1-CG2 4.12Å; L2-P16 HydrophobicContact CD1-CB 4.13Å; L2-L19 HydrophobicContact CD1-CD2 4.05Å; L2-L19 HydrophobicContact CD2-CD2 3.68Å; L2-L19 HydrophobicContact CG-CD2 4.15Å
3	R	80.2	Confident	87.8	Confident	203 Å²	203	127.4 Å²	127.4	77%	0.766	63%	0.627	S	S	*	*	G	3₁₀ helix	trans	-70.3	-20.3	179.3	-64	-174.2	-176	-163.1	1.3	114.5	M1 I11	M1-R3 PolarHBondContact O-N 2.9Å; R3-I11 HydrophobicContact CG-CB 4.41Å; R3-I11 HydrophobicContact CG-CG1 4.25Å
4	R	86.2	Confident	88.3	Confident	223 Å²	223	121.7 Å²	121.7	84%	0.842	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-86.3	-16.8	-178.6	-66.2	-173.1	-178.1	178.2	-0.8	112.8	M1 L2	M1-R4 PolarHBondContact O-N 3.31Å; L2-R4 VanDerWaalsContact C-N 3.29Å; L2-R4 PolarHBondContact O-N 3.41Å
5	V	81.5	Confident	88.8	Confident	70 Å²	70	116.6 Å²	116.6	42%	0.424	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104	17	-169.4	-176.8	0	0	0	0	111.8	M1 L2 Y7	M1-V5 HydrophobicContact CG-CG2 4.5Å; M1-V5 WeakPolarHBondContact O-CG2 3.47Å; M1-V5 PolarHBondContact O-N 3.26Å; L2-V5 PolarHBondContact O-N 3.49Å; V5-Y7 HydrophobicContact CB-CD2 3.8Å; V5-Y7 HydrophobicContact CB-CE2 3.41Å; V5-Y7 VanDerWaalsContact CB-CE2 3.41Å; V5-Y7 HydrophobicContact CG1-CD1 4.47Å; V5-Y7 HydrophobicContact CG1-CD2 4.05Å; V5-Y7 HydrophobicContact CG1-CE1 3.9Å; V5-Y7 HydrophobicContact CG1-CE2 3.43Å; V5-Y7 VanDerWaalsContact CG1-CE2 3.43Å; V5-Y7 WeakPolarHBondContact CG1-OH 3.47Å; V5-Y7 HydrophobicContact CG2-CE2 4.22Å; V5-Y7 PolarHBondContact O-N 3.03Å
6	N	85.4	Confident	89.2	Confident	148 Å²	148	113.1 Å²	113.1	79%	0.791	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.4	34.9	175.1	-64.1	-13.3	0	0	0	114.8	A8	N6-A8 VanDerWaalsContact C-N 3.3Å; N6-A8 PolarHBondContact O-N 3.27Å
7	Y	88.9	Confident	89.6	Confident	147 Å²	147	112.6 Å²	112.6	58%	0.576	59%	0.591	S	S	*	*	S	Bend	trans	-66.6	-32.8	177.9	-69.3	-65.7	0	0	0	112.7	L2 V5	L2-Y7 HydrophobicContact CD2-CD2 3.91Å; L2-Y7 HydrophobicContact CD2-CE2 3.9Å; V5-Y7 HydrophobicContact CB-CD2 3.8Å; V5-Y7 HydrophobicContact CB-CE2 3.41Å; V5-Y7 VanDerWaalsContact CB-CE2 3.41Å; V5-Y7 HydrophobicContact CG1-CD1 4.47Å; V5-Y7 HydrophobicContact CG1-CD2 4.05Å; V5-Y7 HydrophobicContact CG1-CE1 3.9Å; V5-Y7 HydrophobicContact CG1-CE2 3.43Å; V5-Y7 VanDerWaalsContact CG1-CE2 3.43Å; V5-Y7 WeakPolarHBondContact CG1-OH 3.47Å; V5-Y7 HydrophobicContact CG2-CE2 4.22Å; V5-Y7 PolarHBondContact O-N 3.03Å
8	A	91.4	Very high	90.1	Very high	58 Å²	58	116.2 Å²	116.2	48%	0.479	60%	0.596	S	S	.	*			trans	-161.3	160.3	176.2	0	0	0	0	0	109.4	N6 R10 I11	N6-A8 VanDerWaalsContact C-N 3.3Å; N6-A8 PolarHBondContact O-N 3.27Å; A8-R10 VanDerWaalsContact C-N 3.29Å; A8-R10 PolarHBondContact O-N 2.91Å; A8-I11 HydrophobicContact CB-CD1 4.13Å
9	E	90	Very high	90.4	Very high	196 Å²	196	113.9 Å²	113.9	92%	0.916	59%	0.585	S	S	*	*	S	Bend	trans	-60.3	-39.2	176	-170.4	-171.9	168.1	0	0	112
10	R	91.8	Very high	90.8	Very high	217 Å²	217	111 Å²	111	82%	0.819	58%	0.579	S	S	*	*			trans	-129.5	140.7	177.7	-60.7	177.7	72.3	178.4	2.6	110.1	A8	A8-R10 VanDerWaalsContact C-N 3.29Å; A8-R10 PolarHBondContact O-N 2.91Å
11	I	91.7	Very high	91.2	Very high	36 Å²	36	108.2 Å²	108.2	19%	0.185	57%	0.572	C	S	.	*			trans	-116	120	174.4	-58.5	-65.9	0	0	0	107.7	L2 R3 A8 A15	L2-I11 HydrophobicContact CB-CG1 4.42Å; L2-I11 HydrophobicContact CB-CG2 4.37Å; L2-I11 HydrophobicContact CD1-CG2 4.12Å; R3-I11 HydrophobicContact CG-CB 4.41Å; R3-I11 HydrophobicContact CG-CG1 4.25Å; A8-I11 HydrophobicContact CB-CD1 4.13Å; I11-A15 HydrophobicContact CG2-CB 3.85Å
12	G	93.2	Very high	91.9	Very high	51 Å²	51	102.4 Å²	102.4	53%	0.526	55%	0.546	S	S	.	.			trans	-59.7	149.5	177.6	0	0	0	0	0	112.3	G14 A15 P16	G12-G14 VanDerWaalsContact C-N 3.28Å; G12-G14 PolarHBondContact O-N 3.24Å; G12-A15 WeakPolarHBondContact O-CB 3.44Å; G12-A15 PolarHBondContact O-N 2.87Å; G12-A15 VanDerWaalsContact O-N 3.15Å; G12-P16 WeakPolarHBondContact O-CD 3.41Å
13	A	93.4	Very high	92.5	Very high	90 Å²	90	104.9 Å²	104.9	74%	0.744	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-34.1	-174.3	0	0	0	0	0	113.5	P16	A13-P16 WeakPolarHBondContact O-CD 3.26Å; A13-P16 WeakPolarHBondContact O-CG 3.42Å
14	G	95.2	Very high	93.4	Very high	48 Å²	48	102 Å²	102	50%	0.495	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.9	-18.2	178.2	0	0	0	0	0	115.1	G12 V17 Y18	G12-G14 VanDerWaalsContact C-N 3.28Å; G12-G14 PolarHBondContact O-N 3.24Å; G14-V17 PolarHBondContact O-N 3.1Å; G14-Y18 PolarHBondContact O-N 2.87Å
15	A	95	Very high	94	Very high	45 Å²	45	98.2 Å²	98.2	37%	0.372	54%	0.541	S	S	.	.	H	α-helix	trans	-59	-48.5	-177.9	0	0	0	0	0	114.1	I11 G12 V17 Y18 L19	I11-A15 HydrophobicContact CG2-CB 3.85Å; G12-A15 WeakPolarHBondContact O-CB 3.44Å; G12-A15 PolarHBondContact O-N 2.87Å; G12-A15 VanDerWaalsContact O-N 3.15Å; A15-V17 VanDerWaalsContact C-N 3.28Å; A15-V17 PolarHBondContact O-N 3.49Å; A15-Y18 PolarHBondContact O-N 3.13Å; A15-L19 WeakPolarHBondContact O-CB 3.41Å; A15-L19 PolarHBondContact O-N 2.86Å
16	P	95.3	Very high	94.7	Very high	61 Å²	61	97.8 Å²	97.8	40%	0.396	54%	0.536	S	S	.	.	H	α-helix	trans	-63.9	-32	175.9	24.2	-34.6	0	0	0	113.2	L2 G12 A13 A20	L2-P16 HydrophobicContact CD1-CB 4.13Å; G12-P16 WeakPolarHBondContact O-CD 3.41Å; A13-P16 WeakPolarHBondContact O-CD 3.26Å; A13-P16 WeakPolarHBondContact O-CG 3.42Å; P16-A20 VanDerWaalsContact O-CB 3.26Å; P16-A20 WeakPolarHBondContact O-CB 3.14Å; P16-A20 PolarHBondContact O-N 3.23Å
17	V	97.2	Very high	95.4	Very high	104 Å²	104	94.1 Å²	94.1	63%	0.63	52%	0.519	S	S	*	.	H	α-helix	trans	-68.3	-49.7	178.7	-178.4	0	0	0	0	110.2	G14 A15 L19 A20 A21	G14-V17 PolarHBondContact O-N 3.1Å; A15-V17 VanDerWaalsContact C-N 3.28Å; A15-V17 PolarHBondContact O-N 3.49Å; V17-L19 PolarHBondContact O-N 3.39Å; V17-A20 PolarHBondContact O-N 3.22Å; V17-A21 PolarHBondContact O-N 2.93Å
18	Y	97.7	Very high	95.8	Very high	177 Å²	177	89.7 Å²	89.7	69%	0.694	51%	0.513	S	S	*	.	H	α-helix	trans	-61.3	-45	177.9	-170.7	-90.6	0	0	0	111.7	G14 A15 A20 A21 V22	G14-Y18 PolarHBondContact O-N 2.87Å; A15-Y18 PolarHBondContact O-N 3.13Å; Y18-A20 PolarHBondContact O-N 3.3Å; Y18-A21 PolarHBondContact O-N 3.32Å; Y18-V22 HydrophobicContact CD1-CG2 4.05Å; Y18-V22 HydrophobicContact CE1-CG2 3.7Å; Y18-V22 WeakPolarHBondContact O-CG2 3.44Å; Y18-V22 PolarHBondContact O-N 2.99Å
19	L	96.8	Very high	96.1	Very high	73 Å²	73	90.2 Å²	90.2	38%	0.382	50%	0.504	S	S	.	.	H	α-helix	trans	-62.7	-41.8	177.6	-179.3	59	0	0	0	112.1	L2 A15 V17 V22 I23	L2-L19 HydrophobicContact CD1-CD2 4.05Å; L2-L19 HydrophobicContact CD2-CD2 3.68Å; L2-L19 HydrophobicContact CG-CD2 4.15Å; A15-L19 WeakPolarHBondContact O-CB 3.41Å; A15-L19 PolarHBondContact O-N 2.86Å; V17-L19 PolarHBondContact O-N 3.39Å; L19-V22 PolarHBondContact O-N 3.42Å; L19-I23 HydrophobicContact CD1-CD1 4.04Å; L19-I23 HydrophobicContact CD1-CG1 4.27Å; L19-I23 HydrophobicContact CG-CD1 3.93Å; L19-I23 WeakPolarHBondContact O-CG1 3.44Å; L19-I23 PolarHBondContact O-N 2.86Å
20	A	97.8	Very high	96.5	Very high	56 Å²	56	82.2 Å²	82.2	46%	0.463	47%	0.469	S	S	.	.	H	α-helix	trans	-60.8	-44.7	176.2	0	0	0	0	0	111.5	P16 V17 Y18 V22 I23 E24	P16-A20 VanDerWaalsContact O-CB 3.26Å; P16-A20 WeakPolarHBondContact O-CB 3.14Å; P16-A20 PolarHBondContact O-N 3.23Å; V17-A20 PolarHBondContact O-N 3.22Å; Y18-A20 PolarHBondContact O-N 3.3Å; A20-V22 PolarHBondContact O-N 3.38Å; A20-I23 PolarHBondContact O-N 3.07Å; A20-E24 WeakPolarHBondContact O-CB 3.31Å; A20-E24 PolarHBondContact O-N 2.83Å
21	A	98.4	Very high	96.8	Very high	53 Å²	53	76.1 Å²	76.1	44%	0.438	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-41.4	177.6	0	0	0	0	0	112.6	V17 Y18 E24 Y25	V17-A21 PolarHBondContact O-N 2.93Å; Y18-A21 PolarHBondContact O-N 3.32Å; A21-E24 PolarHBondContact O-N 3.31Å; A21-Y25 WeakPolarHBondContact O-CB 3.05Å; A21-Y25 PolarHBondContact O-N 3.42Å
22	V	98	Very high	97.2	Very high	55 Å²	55	80.4 Å²	80.4	33%	0.333	47%	0.471	S	S	.	.	H	α-helix	trans	-65.7	-42.4	176.2	173.4	0	0	0	0	111.5	Y18 L19 A20 E24 Y25 L26	Y18-V22 HydrophobicContact CD1-CG2 4.05Å; Y18-V22 HydrophobicContact CE1-CG2 3.7Å; Y18-V22 WeakPolarHBondContact O-CG2 3.44Å; Y18-V22 PolarHBondContact O-N 2.99Å; L19-V22 PolarHBondContact O-N 3.42Å; A20-V22 PolarHBondContact O-N 3.38Å; V22-E24 VanDerWaalsContact C-N 3.34Å; V22-Y25 PolarHBondContact O-N 3.41Å; V22-L26 HydrophobicContact CG1-CD1 4.07Å; V22-L26 WeakPolarHBondContact O-CG 3.38Å; V22-L26 PolarHBondContact O-N 3.31Å
23	I	98.1	Very high	97.4	Very high	92 Å²	92	79.9 Å²	79.9	47%	0.472	46%	0.457	S	S	.	.	H	α-helix	trans	-64	-41.5	176.8	-69.5	169.6	0	0	0	110.7	L19 A20 L26 T27	L19-I23 HydrophobicContact CD1-CD1 4.04Å; L19-I23 HydrophobicContact CD1-CG1 4.27Å; L19-I23 HydrophobicContact CG-CD1 3.93Å; L19-I23 WeakPolarHBondContact O-CG1 3.44Å; L19-I23 PolarHBondContact O-N 2.86Å; A20-I23 PolarHBondContact O-N 3.07Å; I23-L26 PolarHBondContact O-N 2.95Å; I23-T27 VanDerWaalsContact O-CB 3.3Å; I23-T27 WeakPolarHBondContact O-CB 3.46Å; I23-T27 PolarHBondContact O-N 3.36Å; I23-T27 PolarHBondContact O-OG1 2.82Å
24	E	98.5	Very high	97.7	Very high	142 Å²	142	75.6 Å²	75.6	66%	0.664	42%	0.421	S	S	*	.	H	α-helix	trans	-60.4	-49.4	175.8	-176.5	178.7	165.1	0	0	111.2	A20 A21 V22 L26 T27 A28	A20-E24 WeakPolarHBondContact O-CB 3.31Å; A20-E24 PolarHBondContact O-N 2.83Å; A21-E24 PolarHBondContact O-N 3.31Å; V22-E24 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 2.74Å; E24-T27 PolarHBondContact O-N 2.89Å; E24-A28 WeakPolarHBondContact O-CB 3.19Å; E24-A28 PolarHBondContact O-N 2.73Å
25	Y	98.1	Very high	97.8	Very high	144 Å²	144	74.6 Å²	74.6	57%	0.565	41%	0.411	S	S	*	.	H	α-helix	trans	-56.1	-49.9	176.9	168.5	-103.6	0	0	0	112.4	A21 V22 T27 A28 K29	A21-Y25 WeakPolarHBondContact O-CB 3.05Å; A21-Y25 PolarHBondContact O-N 3.42Å; V22-Y25 PolarHBondContact O-N 3.41Å; Y25-T27 VanDerWaalsContact C-N 3.34Å; Y25-T27 PolarHBondContact O-N 3.15Å; Y25-A28 PolarHBondContact O-N 2.84Å; Y25-K29 WeakPolarHBondContact O-CB 3.43Å; Y25-K29 PolarHBondContact O-N 3.07Å
26	L	97.8	Very high	98	Very high	60 Å²	60	74.7 Å²	74.7	31%	0.314	41%	0.405	S	S	.	.	H	α-helix	trans	-64.5	-40.3	179.7	-68.1	171.4	0	0	0	111.7	V22 I23 E24 K29 V30	V22-L26 HydrophobicContact CG1-CD1 4.07Å; V22-L26 WeakPolarHBondContact O-CG 3.38Å; V22-L26 PolarHBondContact O-N 3.31Å; I23-L26 PolarHBondContact O-N 2.95Å; E24-L26 PolarHBondContact O-N 2.74Å; L26-K29 PolarHBondContact O-N 2.79Å; L26-V30 WeakPolarHBondContact O-CG2 3.33Å; L26-V30 PolarHBondContact O-N 2.98Å; L26-V30 VanDerWaalsContact O-N 3.07Å
27	T	98.4	Very high	98.1	Very high	71 Å²	71	72.4 Å²	72.4	44%	0.436	39%	0.391	S	S	.	.	H	α-helix	trans	-63.8	-46.4	177.6	-56.8	0	0	0	0	110.7	I23 E24 Y25 K29 V30 L31	I23-T27 VanDerWaalsContact O-CB 3.3Å; I23-T27 WeakPolarHBondContact O-CB 3.46Å; I23-T27 PolarHBondContact O-N 3.36Å; I23-T27 PolarHBondContact O-OG1 2.82Å; E24-T27 PolarHBondContact O-N 2.89Å; Y25-T27 VanDerWaalsContact C-N 3.34Å; Y25-T27 PolarHBondContact O-N 3.15Å; T27-K29 PolarHBondContact O-N 3.35Å; T27-V30 PolarHBondContact O-N 3.1Å; T27-L31 HydrophobicContact CG2-CD1 3.88Å; T27-L31 HydrophobicContact CG2-CG 4.31Å; T27-L31 WeakPolarHBondContact O-CB 3.23Å; T27-L31 VanDerWaalsContact O-CG 3.29Å; T27-L31 WeakPolarHBondContact O-CG 3.44Å; T27-L31 PolarHBondContact O-N 3.26Å
28	A	98.5	Very high	98.2	Very high	55 Å²	55	67.6 Å²	67.6	46%	0.455	36%	0.362	S	S	.	.	H	α-helix	trans	-60.1	-46.5	177.5	0	0	0	0	0	111.5	E24 Y25 V30 L31 E32	E24-A28 WeakPolarHBondContact O-CB 3.19Å; E24-A28 PolarHBondContact O-N 2.73Å; Y25-A28 PolarHBondContact O-N 2.84Å; A28-V30 PolarHBondContact O-N 3.49Å; A28-L31 PolarHBondContact O-N 3.14Å; A28-E32 WeakPolarHBondContact O-CB 3.38Å; A28-E32 PolarHBondContact O-N 2.92Å
29	K	97.9	Very high	98.2	Very high	68 Å²	68	66.7 Å²	66.7	30%	0.296	36%	0.358	S	S	.	.	H	α-helix	trans	-59.3	-45.4	177.9	177.3	63.7	176.3	179.1	0	112.5	Y25 L26 T27 L33 D58 L61	Y25-K29 WeakPolarHBondContact O-CB 3.43Å; Y25-K29 PolarHBondContact O-N 3.07Å; L26-K29 PolarHBondContact O-N 2.79Å; T27-K29 PolarHBondContact O-N 3.35Å; K29-L33 HydrophobicContact CD-CD1 4.29Å; K29-L33 WeakPolarHBondContact O-CG 3.3Å; K29-L33 PolarHBondContact O-N 2.95Å; K29-D58 WeakPolarHBondContact CE-OD1 3.47Å; K29-D58 IonicContact NZ-OD1 3.32Å; K29-D58 PolarHBondContact NZ-OD1 3.46Å; K29-L61 HydrophobicContact CG-CD1 4.48Å
30	V	98.2	Very high	98.2	Very high	28 Å²	28	69.1 Å²	69.1	17%	0.17	37%	0.371	C	S	.	.	H	α-helix	trans	-66.3	-42.3	177.7	172.8	0	0	0	0	111.2	L26 T27 A28 A34 L51 I55 L61	L26-V30 WeakPolarHBondContact O-CG2 3.33Å; L26-V30 PolarHBondContact O-N 2.98Å; L26-V30 VanDerWaalsContact O-N 3.07Å; T27-V30 PolarHBondContact O-N 3.1Å; A28-V30 PolarHBondContact O-N 3.49Å; V30-A34 WeakPolarHBondContact O-CB 3.35Å; V30-A34 PolarHBondContact O-N 3.4Å; V30-L51 HydrophobicContact CG1-CD2 3.84Å; V30-I55 HydrophobicContact CG1-CD1 4.4Å; V30-L61 HydrophobicContact CG2-CD1 3.91Å; V30-L61 HydrophobicContact CG2-CD2 3.86Å
31	L	98.6	Very high	98.1	Very high	89 Å²	89	69 Å²	69	47%	0.466	37%	0.367	S	S	.	.	H	α-helix	trans	-67.9	-38.2	-179.5	-75	180	0	0	0	112.9	T27 A28 A34 G35 I46	T27-L31 HydrophobicContact CG2-CD1 3.88Å; T27-L31 HydrophobicContact CG2-CG 4.31Å; T27-L31 WeakPolarHBondContact O-CB 3.23Å; T27-L31 VanDerWaalsContact O-CG 3.29Å; T27-L31 WeakPolarHBondContact O-CG 3.44Å; T27-L31 PolarHBondContact O-N 3.26Å; A28-L31 PolarHBondContact O-N 3.14Å; L31-A34 PolarHBondContact O-N 3.48Å; L31-G35 PolarHBondContact O-N 3.35Å; L31-I46 HydrophobicContact CD2-CD1 4.09Å
32	E	98.4	Very high	98.1	Very high	126 Å²	126	75.9 Å²	75.9	59%	0.589	39%	0.387	S	S	*	.	H	α-helix	trans	-59.1	-55.5	176.1	-177.5	62.4	-163.3	0	0	110.5	A28 A34 G35 D36	A28-E32 WeakPolarHBondContact O-CB 3.38Å; A28-E32 PolarHBondContact O-N 2.92Å; E32-A34 VanDerWaalsContact C-N 3.33Å; E32-A34 PolarHBondContact O-N 2.91Å; E32-G35 PolarHBondContact O-N 3.4Å; E32-G35 VanDerWaalsContact O-N 3.14Å; E32-D36 PolarHBondContact O-N 3.47Å
33	L	98.5	Very high	98.1	Very high	41 Å²	41	79.6 Å²	79.6	22%	0.215	40%	0.398	C	S	.	.	H	α-helix	trans	-63.9	-36.8	-179.8	-65.4	176.3	0	0	0	112.5	K29 D36 A37 A54 D58 L61	K29-L33 HydrophobicContact CD-CD1 4.29Å; K29-L33 WeakPolarHBondContact O-CG 3.3Å; K29-L33 PolarHBondContact O-N 2.95Å; L33-D36 PolarHBondContact O-N 2.79Å; L33-A37 WeakPolarHBondContact O-CB 3.36Å; L33-A37 PolarHBondContact O-N 2.98Å; L33-A54 HydrophobicContact CB-CB 3.65Å; L33-D58 HydrophobicContact CD1-CB 3.79Å; L33-L61 HydrophobicContact CD1-CD1 3.77Å
34	A	98.6	Very high	98	Very high	0 Å²	0	87.6 Å²	87.6	0%	0	42%	0.423	C	S	.	.	H	α-helix	trans	-71.7	-33.2	176.2	0	0	0	0	0	112.3	V30 L31 E32 A37 A38 I46 L51 A54	V30-A34 WeakPolarHBondContact O-CB 3.35Å; V30-A34 PolarHBondContact O-N 3.4Å; L31-A34 PolarHBondContact O-N 3.48Å; E32-A34 VanDerWaalsContact C-N 3.33Å; E32-A34 PolarHBondContact O-N 2.91Å; A34-A37 PolarHBondContact O-N 2.91Å; A34-A38 WeakPolarHBondContact O-CB 3.5Å; A34-A38 PolarHBondContact O-N 2.87Å; A34-I46 HydrophobicContact CB-CD1 4.14Å; A34-I46 HydrophobicContact CB-CG2 4.01Å; A34-L51 HydrophobicContact CB-CD2 3.78Å; A34-L51 HydrophobicContact CB-CG 4.49Å; A34-A54 HydrophobicContact CB-CB 4.07Å
35	G	98.6	Very high	98	Very high	27 Å²	27	90.4 Å²	90.4	28%	0.278	43%	0.427	S	S	.	.	H	α-helix	trans	-63	-46	171.1	0	0	0	0	0	111.4	L31 E32 A38 R39	L31-G35 PolarHBondContact O-N 3.35Å; E32-G35 PolarHBondContact O-N 3.4Å; E32-G35 VanDerWaalsContact O-N 3.14Å; G35-A38 WeakPolarHBondContact O-CB 3.29Å; G35-A38 PolarHBondContact O-N 3.05Å; G35-R39 WeakPolarHBondContact O-CB 3.36Å; G35-R39 PolarHBondContact O-N 2.84Å
36	D	98.4	Very high	98.1	Very high	46 Å²	46	86.6 Å²	86.6	25%	0.246	42%	0.416	C	S	.	.	H	α-helix	trans	-60.8	-45	173.5	-82.7	-11.7	0	0	0	112.1	E32 L33 A38 R39 N40	E32-D36 PolarHBondContact O-N 3.47Å; L33-D36 PolarHBondContact O-N 2.79Å; D36-A38 VanDerWaalsContact C-N 3.3Å; D36-A38 PolarHBondContact O-N 3.36Å; D36-R39 PolarHBondContact O-N 3.34Å; D36-R39 IonicContact OD1-CZ 3.04Å; D36-R39 IonicContact OD1-NH1 2.84Å; D36-R39 PolarHBondContact OD1-NH1 3.44Å; D36-R39 IonicContact OD1-NH2 2.73Å; D36-R39 PolarHBondContact OD1-NH2 2.71Å; D36-R39 IonicContact OD2-NH2 3.96Å; D36-N40 WeakPolarHBondContact O-CB 3.3Å; D36-N40 PolarHBondContact O-N 2.93Å; D36-N40 PolarHBondContact O-ND2 3.49Å; D36-N40 PolarHBondContact O-OD1 3.38Å
37	A	98.1	Very high	98.1	Very high	13 Å²	13	87.6 Å²	87.6	11%	0.107	42%	0.421	C	S	.	.	H	α-helix	trans	-61.9	-37.1	175.3	0	0	0	0	0	112.6	L33 A34 S41 H50 L53	L33-A37 WeakPolarHBondContact O-CB 3.36Å; L33-A37 PolarHBondContact O-N 2.98Å; A34-A37 PolarHBondContact O-N 2.91Å; A37-S41 WeakPolarHBondContact O-CB 3.37Å; A37-S41 PolarHBondContact O-N 2.91Å; A37-S41 VanDerWaalsContact O-N 3.13Å; A37-S41 PolarHBondContact O-OG 3.12Å; A37-H50 HydrophobicContact CB-CB 4.15Å; A37-L53 HydrophobicContact CB-CB 4.33Å
38	A	98.5	Very high	98.1	Very high	3 Å²	3	86.8 Å²	86.8	3%	0.025	42%	0.417	C	S	.	.	H	α-helix	trans	-65.9	-45.8	174.1	0	0	0	0	0	111.6	A34 G35 D36 N40 S41 K42 K43 I46 H50	A34-A38 WeakPolarHBondContact O-CB 3.5Å; A34-A38 PolarHBondContact O-N 2.87Å; G35-A38 WeakPolarHBondContact O-CB 3.29Å; G35-A38 PolarHBondContact O-N 3.05Å; D36-A38 VanDerWaalsContact C-N 3.3Å; D36-A38 PolarHBondContact O-N 3.36Å; A38-N40 PolarHBondContact O-N 3.18Å; A38-S41 CarbonylContact O-C 3.45Å; A38-S41 WeakPolarHBondContact O-CA 3.37Å; A38-S41 PolarHBondContact O-N 3.38Å; A38-S41 VanDerWaalsContact O-N 3.1Å; A38-K42 PolarHBondContact O-N 3.07Å; A38-K43 CarbonylContact C-O 3.34Å; A38-K43 PolarHBondContact O-N 3.24Å; A38-K43 VanDerWaalsContact O-O 3.11Å; A38-I46 HydrophobicContact CB-CG1 4.36Å; A38-H50 VanDerWaalsContact CB-ND1 3.26Å; A38-H50 WeakPolarHBondContact CB-ND1 3.36Å
39	R	98.2	Very high	98.1	Very high	159 Å²	159	87.4 Å²	87.4	60%	0.6	41%	0.407	S	S	*	.	H	α-helix	trans	-59.4	-46.5	176.9	-172.9	177.5	70.2	-135.3	-5.1	111.1	G35 D36 S41 K42	G35-R39 WeakPolarHBondContact O-CB 3.36Å; G35-R39 PolarHBondContact O-N 2.84Å; D36-R39 PolarHBondContact O-N 3.34Å; D36-R39 IonicContact OD1-CZ 3.04Å; D36-R39 IonicContact OD1-NH1 2.84Å; D36-R39 PolarHBondContact OD1-NH1 3.44Å; D36-R39 IonicContact OD1-NH2 2.73Å; D36-R39 PolarHBondContact OD1-NH2 2.71Å; D36-R39 IonicContact OD2-NH2 3.96Å; R39-S41 PolarHBondContact O-N 2.86Å; R39-K42 WeakPolarHBondContact O-CA 3.45Å; R39-K42 PolarHBondContact O-N 3.27Å
40	N	96.9	Very high	98.1	Very high	124 Å²	124	84.4 Å²	84.4	66%	0.663	39%	0.394	S	S	*	.	H	α-helix	trans	-61.6	-30.5	176.7	-68.2	-13.7	0	0	0	112.2	D36 A38 K42	D36-N40 WeakPolarHBondContact O-CB 3.3Å; D36-N40 PolarHBondContact O-N 2.93Å; D36-N40 PolarHBondContact O-ND2 3.49Å; D36-N40 PolarHBondContact O-OD1 3.38Å; A38-N40 PolarHBondContact O-N 3.18Å; N40-K42 PolarHBondContact O-N 3.49Å
41	S	96.3	Very high	98.1	Very high	53 Å²	53	85.5 Å²	85.5	37%	0.371	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	7.9	174.6	-55.6	0	0	0	0	113.6	A37 A38 R39 K43	A37-S41 WeakPolarHBondContact O-CB 3.37Å; A37-S41 PolarHBondContact O-N 2.91Å; A37-S41 VanDerWaalsContact O-N 3.13Å; A37-S41 PolarHBondContact O-OG 3.12Å; A38-S41 CarbonylContact O-C 3.45Å; A38-S41 WeakPolarHBondContact O-CA 3.37Å; A38-S41 PolarHBondContact O-N 3.38Å; A38-S41 VanDerWaalsContact O-N 3.1Å; R39-S41 PolarHBondContact O-N 2.86Å; S41-K43 PolarHBondContact O-N 3.13Å
42	K	97.7	Very high	98.1	Very high	198 Å²	198	82.2 Å²	82.2	86%	0.861	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	34.9	-175.5	-53.4	179.1	-178.9	-179.7	0	112.8	A38 R39 N40	A38-K42 PolarHBondContact O-N 3.07Å; R39-K42 WeakPolarHBondContact O-CA 3.45Å; R39-K42 PolarHBondContact O-N 3.27Å; N40-K42 PolarHBondContact O-N 3.49Å
43	K	97.6	Very high	98.1	Very high	132 Å²	132	77.6 Å²	77.6	57%	0.574	36%	0.36	S	S	*	.			trans	-115.4	145.9	177.8	-58.3	-60.6	-177.1	172.5	0	110.1	A38 S41	A38-K43 CarbonylContact C-O 3.34Å; A38-K43 PolarHBondContact O-N 3.24Å; A38-K43 VanDerWaalsContact O-O 3.11Å; S41-K43 PolarHBondContact O-N 3.13Å
44	R	97.1	Very high	98.1	Very high	260 Å²	260	76 Å²	76	98%	0.981	35%	0.353	S	S	*	.	S	Bend	trans	-94.4	-9.3	175.2	-63.3	-177.5	71.4	171.2	2.8	113.8
45	R	98.5	Very high	98.1	Very high	202 Å²	202	76.4 Å²	76.4	76%	0.762	36%	0.355	S	S	*	.	S	Bend	trans	-118.3	132.6	-177.1	-172.5	-178.1	-65.4	146.6	-0.1	109.9	H50	R45-H50 PolarHBondContact O-CE1 2.77Å; R45-H50 VanDerWaalsContact O-CE1 3.3Å; R45-H50 PolarHBondContact O-ND1 3.16Å
46	I	98.5	Very high	98.1	Very high	64 Å²	64	77.6 Å²	77.6	33%	0.328	35%	0.351	S	S	.	.			trans	-70	130.4	171.3	-61.9	173.9	0	0	0	108.7	L31 A34 A38 H50 L51	L31-I46 HydrophobicContact CD2-CD1 4.09Å; A34-I46 HydrophobicContact CB-CD1 4.14Å; A34-I46 HydrophobicContact CB-CG2 4.01Å; A38-I46 HydrophobicContact CB-CG1 4.36Å; I46-H50 HydrophobicContact CG2-CB 4.26Å; I46-L51 HydrophobicContact CG2-CD2 4.22Å; I46-L51 HydrophobicContact CG2-CG 4.07Å
47	I	98.4	Very high	98	Very high	80 Å²	80	80.9 Å²	80.9	41%	0.41	37%	0.369	S	S	.	.			trans	-122.7	165.9	173.2	63.6	166.8	0	0	0	108.7	R49 H50 L51	I47-R49 HydrophobicContact CD1-CB 3.94Å; I47-R49 HydrophobicContact CG1-CB 4.07Å; I47-R49 PolarHBondContact O-N 3.14Å; I47-H50 PolarHBondContact N-ND1 2.94Å; I47-H50 WeakPolarHBondContact O-CB 3.4Å; I47-H50 PolarHBondContact O-N 3.14Å; I47-L51 PolarHBondContact O-N 3.46Å
48	P	98.6	Very high	98	Very high	54 Å²	54	81.6 Å²	81.6	35%	0.351	37%	0.37	S	S	.	.	H	α-helix	trans	-55.1	-31.2	-177.7	-28	35.7	0	0	0	114.8	H50 L51 Q52 I70 A71 H72	P48-H50 VanDerWaalsContact C-N 3.34Å; P48-H50 PolarHBondContact O-N 2.97Å; P48-L51 PolarHBondContact O-N 3.41Å; P48-Q52 PolarHBondContact O-N 2.95Å; P48-I70 HydrophobicContact CB-CG2 4.32Å; P48-A71 WeakPolarHBondContact CB-O 3.48Å; P48-H72 HydrophobicContact CB-CB 4.09Å; P48-H72 HydrophobicContact CG-CB 4.29Å
49	R	98.4	Very high	98	Very high	68 Å²	68	89.7 Å²	89.7	26%	0.257	41%	0.408	S	S	.	.	H	α-helix	trans	-58	-42.4	171.7	178.8	56.6	176.5	176.4	-1.4	112.8	I47 Q52 L53 G73 V75	I47-R49 HydrophobicContact CD1-CB 3.94Å; I47-R49 HydrophobicContact CG1-CB 4.07Å; I47-R49 PolarHBondContact O-N 3.14Å; R49-Q52 PolarHBondContact O-N 3.24Å; R49-L53 HydrophobicContact CG-CD1 4.25Å; R49-L53 HydrophobicContact CG-CG 4.47Å; R49-L53 VanDerWaalsContact O-CG 3.31Å; R49-L53 WeakPolarHBondContact O-CG 3.43Å; R49-L53 PolarHBondContact O-N 3.44Å; R49-G73 WeakPolarHBondContact CD-O 3.27Å; R49-G73 PolarHBondContact NH1-O 3.46Å; R49-V75 VanDerWaalsContact CZ-O 3.24Å; R49-V75 VanDerWaalsContact NH1-N 3.18Å; R49-V75 PolarHBondContact NH1-O 3.49Å; R49-V75 PolarHBondContact NH2-O 3.32Å
50	H	98.5	Very high	98	Very high	5 Å²	5	88.7 Å²	88.7	2%	0.023	41%	0.41	C	S	.	.	H	α-helix	trans	-67.7	-38.6	-179.7	-54.9	152.7	0	0	0	111.2	A37 A38 R45 I46 I47 P48 L53 A54	A37-H50 HydrophobicContact CB-CB 4.15Å; A38-H50 VanDerWaalsContact CB-ND1 3.26Å; A38-H50 WeakPolarHBondContact CB-ND1 3.36Å; R45-H50 PolarHBondContact O-CE1 2.77Å; R45-H50 VanDerWaalsContact O-CE1 3.3Å; R45-H50 PolarHBondContact O-ND1 3.16Å; I46-H50 HydrophobicContact CG2-CB 4.26Å; I47-H50 PolarHBondContact N-ND1 2.94Å; I47-H50 WeakPolarHBondContact O-CB 3.4Å; I47-H50 PolarHBondContact O-N 3.14Å; P48-H50 VanDerWaalsContact C-N 3.34Å; P48-H50 PolarHBondContact O-N 2.97Å; H50-L53 PolarHBondContact O-N 2.87Å; H50-A54 VanDerWaalsContact O-CB 3.3Å; H50-A54 WeakPolarHBondContact O-CB 3.41Å; H50-A54 PolarHBondContact O-N 2.86Å
51	L	98.5	Very high	98	Very high	52 Å²	52	83.2 Å²	83.2	27%	0.272	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-46.1	173	-67.3	170.5	0	0	0	111.4	V30 A34 I46 I47 P48 L53 A54 I55 I70	V30-L51 HydrophobicContact CG1-CD2 3.84Å; A34-L51 HydrophobicContact CB-CD2 3.78Å; A34-L51 HydrophobicContact CB-CG 4.49Å; I46-L51 HydrophobicContact CG2-CD2 4.22Å; I46-L51 HydrophobicContact CG2-CG 4.07Å; I47-L51 PolarHBondContact O-N 3.46Å; P48-L51 PolarHBondContact O-N 3.41Å; L51-L53 PolarHBondContact O-N 3.03Å; L51-A54 PolarHBondContact O-N 3.49Å; L51-I55 WeakPolarHBondContact O-CB 3.42Å; L51-I55 WeakPolarHBondContact O-CG1 3.36Å; L51-I55 PolarHBondContact O-N 2.92Å; L51-I70 HydrophobicContact CB-CD1 4.39Å
52	Q	98.5	Very high	98.1	Very high	19 Å²	19	82.6 Å²	82.6	9%	0.089	38%	0.376	C	S	.	.	H	α-helix	trans	-61.3	-45.3	177.1	-178.3	77.2	-2.6	0	0	112	P48 R49 R56 I70 G73 G74	P48-Q52 PolarHBondContact O-N 2.95Å; R49-Q52 PolarHBondContact O-N 3.24Å; Q52-R56 HydrophobicContact CG-CG 4.25Å; Q52-R56 WeakPolarHBondContact O-CB 3.41Å; Q52-R56 VanDerWaalsContact O-CG 3.23Å; Q52-R56 WeakPolarHBondContact O-CG 3.33Å; Q52-R56 PolarHBondContact O-N 3.48Å; Q52-I70 HydrophobicContact CB-CD1 4.4Å; Q52-G73 WeakPolarHBondContact CB-O 3.45Å; Q52-G73 WeakPolarHBondContact CG-O 3.47Å; Q52-G74 WeakPolarHBondContact CG-O 3.39Å; Q52-G74 PolarHBondContact NE2-O 3.36Å
53	L	98.1	Very high	98.1	Very high	30 Å²	30	81.5 Å²	81.5	16%	0.157	37%	0.372	C	S	.	.	H	α-helix	trans	-62.9	-44	177.6	-70.1	179.5	0	0	0	111.4	A37 R49 H50 L51 N57 L76	A37-L53 HydrophobicContact CB-CB 4.33Å; R49-L53 HydrophobicContact CG-CD1 4.25Å; R49-L53 HydrophobicContact CG-CG 4.47Å; R49-L53 VanDerWaalsContact O-CG 3.31Å; R49-L53 WeakPolarHBondContact O-CG 3.43Å; R49-L53 PolarHBondContact O-N 3.44Å; H50-L53 PolarHBondContact O-N 2.87Å; L51-L53 PolarHBondContact O-N 3.03Å; L53-N57 VanDerWaalsContact O-CB 3.27Å; L53-N57 WeakPolarHBondContact O-CB 3.31Å; L53-N57 PolarHBondContact O-N 3.24Å; L53-N57 VanDerWaalsContact O-N 3.13Å; L53-N57 PolarHBondContact O-ND2 3.39Å; L53-L76 HydrophobicContact CD2-CD2 3.66Å
54	A	98.1	Very high	98.1	Very high	6 Å²	6	82 Å²	82	5%	0.05	37%	0.374	C	S	.	.	H	α-helix	trans	-60.1	-51.6	177.3	0	0	0	0	0	111.9	L33 A34 H50 L51 R56 D58	L33-A54 HydrophobicContact CB-CB 3.65Å; A34-A54 HydrophobicContact CB-CB 4.07Å; H50-A54 VanDerWaalsContact O-CB 3.3Å; H50-A54 WeakPolarHBondContact O-CB 3.41Å; H50-A54 PolarHBondContact O-N 2.86Å; L51-A54 PolarHBondContact O-N 3.49Å; A54-R56 PolarHBondContact O-N 3.39Å; A54-D58 WeakPolarHBondContact O-CB 3.43Å; A54-D58 PolarHBondContact O-N 2.99Å
55	I	98.2	Very high	98.2	Very high	9 Å²	9	71.3 Å²	71.3	5%	0.046	34%	0.336	C	S	.	.	H	α-helix	trans	-67.7	-38.6	-176	-72.4	162.5	0	0	0	112.1	V30 L51 L61 S62 L65 I70	V30-I55 HydrophobicContact CG1-CD1 4.4Å; L51-I55 WeakPolarHBondContact O-CB 3.42Å; L51-I55 WeakPolarHBondContact O-CG1 3.36Å; L51-I55 PolarHBondContact O-N 2.92Å; I55-L61 HydrophobicContact CG1-CD1 4.4Å; I55-L61 HydrophobicContact CG2-CB 4.34Å; I55-S62 WeakPolarHBondContact O-CA 3.32Å; I55-S62 WeakPolarHBondContact O-CB 3.1Å; I55-S62 PolarHBondContact O-N 3.48Å; I55-S62 VanDerWaalsContact O-N 3.16Å; I55-L65 HydrophobicContact CD1-CD1 3.65Å; I55-L65 HydrophobicContact CG1-CD1 3.96Å; I55-L65 HydrophobicContact CG2-CB 4.05Å; I55-L65 HydrophobicContact CG2-CD1 3.82Å; I55-L65 HydrophobicContact CG2-CG 4.5Å; I55-I70 HydrophobicContact CD1-CD1 3.46Å; I55-I70 VanDerWaalsContact CD1-CD1 3.46Å
56	R	98.1	Very high	98.1	Very high	52 Å²	52	70.2 Å²	70.2	20%	0.196	34%	0.337	C	S	.	.	H	α-helix	trans	-81.9	-22.7	-176.4	-60.7	-57.8	179	-136.6	-1	113.6	Q52 A54 L65 V68 L76	Q52-R56 HydrophobicContact CG-CG 4.25Å; Q52-R56 WeakPolarHBondContact O-CB 3.41Å; Q52-R56 VanDerWaalsContact O-CG 3.23Å; Q52-R56 WeakPolarHBondContact O-CG 3.33Å; Q52-R56 PolarHBondContact O-N 3.48Å; A54-R56 PolarHBondContact O-N 3.39Å; R56-L65 PolarHBondContact NH1-O 2.88Å; R56-V68 PolarHBondContact NH2-O 3.44Å; R56-L76 HydrophobicContact CB-CD1 3.66Å; R56-L76 HydrophobicContact CB-CD2 4.12Å; R56-L76 HydrophobicContact CB-CG 3.69Å
57	N	97.5	Very high	98.1	Very high	116 Å²	116	71 Å²	71	62%	0.62	36%	0.36	S	S	*	.	H	α-helix	trans	-86.1	-18.2	175	-73.4	-50.9	0	0	0	113.3	L53 L76	L53-N57 VanDerWaalsContact O-CB 3.27Å; L53-N57 WeakPolarHBondContact O-CB 3.31Å; L53-N57 PolarHBondContact O-N 3.24Å; L53-N57 VanDerWaalsContact O-N 3.13Å; L53-N57 PolarHBondContact O-ND2 3.39Å; N57-L76 WeakPolarHBondContact ND2-CD2 3.46Å; N57-L76 WeakPolarHBondContact OD1-CD2 3.26Å
58	D	98	Very high	98	Very high	27 Å²	27	70.7 Å²	70.7	14%	0.144	36%	0.362	C	S	.	.	S	Bend	trans	-94	124.1	174.9	-179	102.4	0	0	0	110.1	K29 L33 A54 E60 L61 S62	K29-D58 WeakPolarHBondContact CE-OD1 3.47Å; K29-D58 IonicContact NZ-OD1 3.32Å; K29-D58 PolarHBondContact NZ-OD1 3.46Å; L33-D58 HydrophobicContact CD1-CB 3.79Å; A54-D58 WeakPolarHBondContact O-CB 3.43Å; A54-D58 PolarHBondContact O-N 2.99Å; D58-E60 PolarHBondContact O-N 2.85Å; D58-E60 PolarHBondContact OD2-N 3.49Å; D58-L61 HydrophobicContact CB-CB 4.14Å; D58-L61 HydrophobicContact CB-CD1 4.11Å; D58-L61 HydrophobicContact CB-CG 4.3Å; D58-L61 WeakPolarHBondContact OD2-CB 3.39Å; D58-L61 WeakPolarHBondContact OD2-CG 3.41Å; D58-L61 PolarHBondContact OD2-N 3.41Å; D58-S62 WeakPolarHBondContact O-CB 3.36Å; D58-S62 PolarHBondContact O-N 3.19Å
59	E	97.7	Very high	98	Very high	174 Å²	174	74.4 Å²	74.4	81%	0.813	38%	0.384	S	S	*	.	H	α-helix	trans	-63.8	-43.3	-173.2	-173.8	179.5	174	0	0	112.4	S62 K63	E59-S62 PolarHBondContact O-N 3.47Å; E59-K63 WeakPolarHBondContact O-CB 3.27Å; E59-K63 PolarHBondContact O-N 3.3Å
60	E	97.8	Very high	98	Very high	137 Å²	137	72.9 Å²	72.9	64%	0.64	38%	0.381	S	S	*	.	H	α-helix	trans	-67	-47.6	-178.1	-62.3	-174.9	162.5	0	0	110.9	D58 K63 F64	D58-E60 PolarHBondContact O-N 2.85Å; D58-E60 PolarHBondContact OD2-N 3.49Å; E60-K63 PolarHBondContact O-N 3.01Å; E60-F64 VanDerWaalsContact O-CB 3.27Å; E60-F64 WeakPolarHBondContact O-CB 3.37Å; E60-F64 PolarHBondContact O-N 3.08Å
61	L	98.1	Very high	98	Very high	9 Å²	9	76 Å²	76	5%	0.047	41%	0.407	C	S	.	.	H	α-helix	trans	-66.8	-38	177.3	-67.7	178.5	0	0	0	112.1	K29 V30 L33 I55 D58 K63 F64 L65	K29-L61 HydrophobicContact CG-CD1 4.48Å; V30-L61 HydrophobicContact CG2-CD1 3.91Å; V30-L61 HydrophobicContact CG2-CD2 3.86Å; L33-L61 HydrophobicContact CD1-CD1 3.77Å; I55-L61 HydrophobicContact CG1-CD1 4.4Å; I55-L61 HydrophobicContact CG2-CB 4.34Å; D58-L61 HydrophobicContact CB-CB 4.14Å; D58-L61 HydrophobicContact CB-CD1 4.11Å; D58-L61 HydrophobicContact CB-CG 4.3Å; D58-L61 WeakPolarHBondContact OD2-CB 3.39Å; D58-L61 WeakPolarHBondContact OD2-CG 3.41Å; D58-L61 PolarHBondContact OD2-N 3.41Å; L61-K63 VanDerWaalsContact C-N 3.33Å; L61-K63 PolarHBondContact O-N 3.41Å; L61-F64 PolarHBondContact O-N 3.48Å; L61-L65 VanDerWaalsContact O-CB 3.32Å; L61-L65 WeakPolarHBondContact O-CB 3.32Å; L61-L65 PolarHBondContact O-N 3.29Å
62	S	97.8	Very high	98	Very high	40 Å²	40	81.9 Å²	81.9	28%	0.28	43%	0.433	S	S	.	.	H	α-helix	trans	-63.5	-41.2	177.1	-172.6	0	0	0	0	111.2	I55 D58 E59 L65 K66	I55-S62 WeakPolarHBondContact O-CA 3.32Å; I55-S62 WeakPolarHBondContact O-CB 3.1Å; I55-S62 PolarHBondContact O-N 3.48Å; I55-S62 VanDerWaalsContact O-N 3.16Å; D58-S62 WeakPolarHBondContact O-CB 3.36Å; D58-S62 PolarHBondContact O-N 3.19Å; E59-S62 PolarHBondContact O-N 3.47Å; S62-L65 CarbonylContact O-C 3.57Å; S62-K66 VanDerWaalsContact O-CA 3.31Å; S62-K66 WeakPolarHBondContact O-CA 3.44Å; S62-K66 PolarHBondContact O-N 3.25Å; S62-K66 VanDerWaalsContact O-N 3.08Å
63	K	98.2	Very high	97.9	Very high	175 Å²	175	81 Å²	81	76%	0.761	43%	0.429	S	S	*	.	H	α-helix	trans	-67.4	-47.6	174	-175.1	177.8	179.6	179.6	0	111.8	E59 E60 L61 L65 K66	E59-K63 WeakPolarHBondContact O-CB 3.27Å; E59-K63 PolarHBondContact O-N 3.3Å; E60-K63 PolarHBondContact O-N 3.01Å; L61-K63 VanDerWaalsContact C-N 3.33Å; L61-K63 PolarHBondContact O-N 3.41Å; K63-L65 VanDerWaalsContact C-N 3.31Å; K63-L65 PolarHBondContact O-N 3.29Å; K63-K66 PolarHBondContact O-N 3Å
64	F	97.9	Very high	97.9	Very high	144 Å²	144	82 Å²	82	63%	0.632	45%	0.446	S	S	*	.	H	α-helix	trans	-61.3	-38.8	179.9	-177.9	-116.4	0	0	0	112.1	E60 L61	E60-F64 VanDerWaalsContact O-CB 3.27Å; E60-F64 WeakPolarHBondContact O-CB 3.37Å; E60-F64 PolarHBondContact O-N 3.08Å; L61-F64 PolarHBondContact O-N 3.48Å
65	L	97.9	Very high	97.9	Very high	35 Å²	35	86.8 Å²	86.8	18%	0.183	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	29.6	-176.4	-57.6	176.8	0	0	0	113	I55 R56 L61 S62 K63 G67 V68	I55-L65 HydrophobicContact CD1-CD1 3.65Å; I55-L65 HydrophobicContact CG1-CD1 3.96Å; I55-L65 HydrophobicContact CG2-CB 4.05Å; I55-L65 HydrophobicContact CG2-CD1 3.82Å; I55-L65 HydrophobicContact CG2-CG 4.5Å; R56-L65 PolarHBondContact NH1-O 2.88Å; L61-L65 VanDerWaalsContact O-CB 3.32Å; L61-L65 WeakPolarHBondContact O-CB 3.32Å; L61-L65 PolarHBondContact O-N 3.29Å; S62-L65 CarbonylContact O-C 3.57Å; K63-L65 VanDerWaalsContact C-N 3.31Å; K63-L65 PolarHBondContact O-N 3.29Å; L65-G67 VanDerWaalsContact C-N 3.29Å; L65-G67 PolarHBondContact O-N 2.97Å; L65-V68 HydrophobicContact CB-CB 4.26Å; L65-V68 HydrophobicContact CB-CG2 4.37Å; L65-V68 HydrophobicContact CD2-CG2 4.02Å; L65-V68 PolarHBondContact O-N 3.46Å
66	K	97.2	Very high	97.8	Very high	179 Å²	179	89.2 Å²	89.2	78%	0.778	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-38.2	-176.3	-175.9	177.7	178.9	-179.4	0	113.2	S62 K63	S62-K66 VanDerWaalsContact O-CA 3.31Å; S62-K66 WeakPolarHBondContact O-CA 3.44Å; S62-K66 PolarHBondContact O-N 3.25Å; S62-K66 VanDerWaalsContact O-N 3.08Å; K63-K66 PolarHBondContact O-N 3Å
67	G	97.5	Very high	97.7	Very high	79 Å²	79	92.1 Å²	92.1	81%	0.814	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	2.6	-178.9	0	0	0	0	0	115.2	L65	L65-G67 VanDerWaalsContact C-N 3.29Å; L65-G67 PolarHBondContact O-N 2.97Å
68	V	98.2	Very high	97.7	Very high	74 Å²	74	93.5 Å²	93.5	45%	0.448	52%	0.52	S	S	.	.			trans	-96.4	128.4	-174.4	179.1	0	0	0	0	110.1	R56 L65	R56-V68 PolarHBondContact NH2-O 3.44Å; L65-V68 HydrophobicContact CB-CB 4.26Å; L65-V68 HydrophobicContact CB-CG2 4.37Å; L65-V68 HydrophobicContact CD2-CG2 4.02Å; L65-V68 PolarHBondContact O-N 3.46Å
69	T	98.3	Very high	97.6	Very high	132 Å²	132	97.6 Å²	97.6	81%	0.81	54%	0.541	S	S	*	.			trans	-95.5	124.7	173	-62.9	0	0	0	0	110.3
70	I	97.8	Very high	97.5	Very high	37 Å²	37	94.9 Å²	94.9	19%	0.19	53%	0.528	C	S	.	.			trans	-93	111.7	174.4	-54	-176.9	0	0	0	108.6	P48 L51 Q52 I55 H72 G73	P48-I70 HydrophobicContact CB-CG2 4.32Å; L51-I70 HydrophobicContact CB-CD1 4.39Å; Q52-I70 HydrophobicContact CB-CD1 4.4Å; I55-I70 HydrophobicContact CD1-CD1 3.46Å; I55-I70 VanDerWaalsContact CD1-CD1 3.46Å; I70-H72 PolarHBondContact O-N 3.04Å; I70-G73 PolarHBondContact O-N 2.86Å; I70-G73 VanDerWaalsContact O-N 3.07Å
71	A	98.4	Very high	97.3	Very high	69 Å²	69	92.9 Å²	92.9	57%	0.57	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	135	175.4	0	0	0	0	0	110.5	P48 G73	P48-A71 WeakPolarHBondContact CB-O 3.48Å; A71-G73 PolarHBondContact O-N 3.36Å; A71-G73 VanDerWaalsContact O-N 3.15Å
72	H	98	Very high	97.2	Very high	176 Å²	176	97.2 Å²	97.2	82%	0.815	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.3	18.7	-176.2	-54.5	-75.9	0	0	0	115.8	P48 I70	P48-H72 HydrophobicContact CB-CB 4.09Å; P48-H72 HydrophobicContact CG-CB 4.29Å; I70-H72 PolarHBondContact O-N 3.04Å
73	G	97.8	Very high	97	Very high	1 Å²	1	101.7 Å²	101.7	1%	0.01	58%	0.578	C	S	.	*			trans	-79.8	-31.4	179.8	0	0	0	0	0	115.1	R49 Q52 I70 A71	R49-G73 WeakPolarHBondContact CD-O 3.27Å; R49-G73 PolarHBondContact NH1-O 3.46Å; Q52-G73 WeakPolarHBondContact CB-O 3.45Å; Q52-G73 WeakPolarHBondContact CG-O 3.47Å; I70-G73 PolarHBondContact O-N 2.86Å; I70-G73 VanDerWaalsContact O-N 3.07Å; A71-G73 PolarHBondContact O-N 3.36Å; A71-G73 VanDerWaalsContact O-N 3.15Å
74	G	97.7	Very high	96.7	Very high	50 Å²	50	98.1 Å²	98.1	52%	0.515	57%	0.567	S	S	.	*			trans	65.3	-155.1	-169.1	0	0	0	0	0	112.6	Q52	Q52-G74 WeakPolarHBondContact CG-O 3.39Å; Q52-G74 PolarHBondContact NE2-O 3.36Å
75	V	97.6	Very high	96.4	Very high	108 Å²	108	95.8 Å²	95.8	66%	0.655	57%	0.566	S	S	*	*			trans	-129.2	161.2	-178	-62.5	0	0	0	0	112.1	R49	R49-V75 VanDerWaalsContact CZ-O 3.24Å; R49-V75 VanDerWaalsContact NH1-N 3.18Å; R49-V75 PolarHBondContact NH1-O 3.49Å; R49-V75 PolarHBondContact NH2-O 3.32Å
76	L	96.5	Very high	95.7	Very high	59 Å²	59	100 Å²	100	31%	0.309	59%	0.589	S	S	.	*			trans	-60.8	133.9	169.8	-71.9	179.7	0	0	0	109.5	L53 R56 N57 N78	L53-L76 HydrophobicContact CD2-CD2 3.66Å; R56-L76 HydrophobicContact CB-CD1 3.66Å; R56-L76 HydrophobicContact CB-CD2 4.12Å; R56-L76 HydrophobicContact CB-CG 3.69Å; N57-L76 WeakPolarHBondContact ND2-CD2 3.46Å; N57-L76 WeakPolarHBondContact OD1-CD2 3.26Å; L76-N78 PolarHBondContact O-N 2.95Å; L76-N78 VanDerWaalsContact O-N 3.12Å
77	P	96	Very high	94.3	Very high	113 Å²	113	102.8 Å²	102.8	73%	0.734	59%	0.594	S	S	*	*			trans	-61.3	116.1	171.9	-19.8	33	0	0	0	109.4
78	N	96.6	Very high	92.7	Very high	146 Å²	146	102.8 Å²	102.8	78%	0.781	59%	0.587	S	S	*	*			trans	-148.6	122.3	177.7	-176.9	32.2	0	0	0	109	L76	L76-N78 PolarHBondContact O-N 2.95Å; L76-N78 VanDerWaalsContact O-N 3.12Å
79	I	96.5	Very high	90.8	Very high	113 Å²	113	107.3 Å²	107.3	58%	0.579	60%	0.601	S	S	*	*			trans	-115.6	121.1	175.2	-59.6	175.6	0	0	0	106.7	L83 L84	I79-L83 HydrophobicContact CG2-CB 3.91Å; I79-L84 HydrophobicContact CG2-CD2 3.95Å
80	H	95.9	Very high	89	Confident	117 Å²	117	105.8 Å²	105.8	54%	0.542	59%	0.591	S	S	.	*			trans	-59.3	134.5	177.2	-170.8	-91.2	0	0	0	110.1	S82 L83	H80-S82 PolarHBondContact CE1-OG 2.99Å; H80-S82 WeakPolarHBondContact ND1-CB 3.45Å; H80-S82 PolarHBondContact ND1-N 3.27Å; H80-S82 PolarHBondContact ND1-OG 3.22Å; H80-S82 VanDerWaalsContact ND1-OG 3.14Å; H80-S82 PolarHBondContact O-N 3.47Å; H80-L83 HydrophobicContact CB-CD1 4.17Å; H80-L83 HydrophobicContact CB-CG 4.27Å; H80-L83 WeakPolarHBondContact O-CB 3.33Å; H80-L83 PolarHBondContact O-N 3.44Å
81	P	93.8	Very high	87	Confident	95 Å²	95	113.7 Å²	113.7	62%	0.617	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-53.3	-34	-174	-30	35.8	0	0	0	114.8	L83 L84	P81-L83 PolarHBondContact O-N 3.15Å; P81-L84 WeakPolarHBondContact O-CB 3.39Å; P81-L84 PolarHBondContact O-N 3.01Å; P81-L84 VanDerWaalsContact O-N 3.1Å
82	S	94.8	Very high	84.8	Confident	100 Å²	100	116.3 Å²	116.3	70%	0.699	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-64.1	-16.7	176.9	-45	0	0	0	0	114.6	H80	H80-S82 PolarHBondContact CE1-OG 2.99Å; H80-S82 WeakPolarHBondContact ND1-CB 3.45Å; H80-S82 PolarHBondContact ND1-N 3.27Å; H80-S82 PolarHBondContact ND1-OG 3.22Å; H80-S82 VanDerWaalsContact ND1-OG 3.14Å; H80-S82 PolarHBondContact O-N 3.47Å
83	L	94.1	Very high	82.8	Confident	134 Å²	134	114 Å²	114	70%	0.702	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-91.1	-5.3	177.9	-57.3	177.3	0	0	0	112.5	I79 H80 P81	I79-L83 HydrophobicContact CG2-CB 3.91Å; H80-L83 HydrophobicContact CB-CD1 4.17Å; H80-L83 HydrophobicContact CB-CG 4.27Å; H80-L83 WeakPolarHBondContact O-CB 3.33Å; H80-L83 PolarHBondContact O-N 3.44Å; P81-L83 PolarHBondContact O-N 3.15Å
84	L	92.3	Very high	80.5	Confident	99 Å²	99	125.6 Å²	125.6	52%	0.518	68%	0.675	S	S	.	*	S	Bend	trans	-75.9	143.3	177.6	-62.1	175.6	0	0	0	110.3	I79 P81 N86	I79-L84 HydrophobicContact CG2-CD2 3.95Å; P81-L84 WeakPolarHBondContact O-CB 3.39Å; P81-L84 PolarHBondContact O-N 3.01Å; P81-L84 VanDerWaalsContact O-N 3.1Å; L84-N86 PolarHBondContact O-N 3.48Å
85	P	91.5	Very high	77.7	Confident	95 Å²	95	132.4 Å²	132.4	62%	0.617	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-60.5	131.5	177.6	25.1	-33.3	0	0	0	110	R87 V90	P85-R87 PolarHBondContact O-N 3.39Å; P85-V90 HydrophobicContact CB-CG2 4.44Å; P85-V90 HydrophobicContact CG-CG2 4.47Å
86	N	82.2	Confident	75.3	Confident	125 Å²	125	138.7 Å²	138.7	67%	0.668	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-58.1	129	172.6	-167.5	-5.3	0	0	0	108.5	L84 A88 K89	L84-N86 PolarHBondContact O-N 3.48Å; N86-A88 PolarHBondContact O-N 2.97Å; N86-K89 PolarHBondContact O-N 3.41Å
87	R	69.5	Low	74.2	Confident	236 Å²	236	142.7 Å²	142.7	89%	0.891	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-50.5	-21.9	-172.7	-73.6	-177.8	176.6	-175.1	-0.7	113.5	P85 K89	P85-R87 PolarHBondContact O-N 3.39Å; R87-K89 PolarHBondContact O-N 3.19Å
88	A	62.6	Low	73.1	Confident	79 Å²	79	144.2 Å²	144.2	65%	0.653	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-65.4	-23.6	177.6	0	0	0	0	0	115.8	N86	N86-A88 PolarHBondContact O-N 2.97Å
89	K	59.7	Low	71.8	Confident	170 Å²	170	144.1 Å²	144.1	74%	0.739	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-95.2	-11.7	-172.7	-71.2	-170.4	178.7	-176.5	0	116.2	N86 R87 K91	N86-K89 PolarHBondContact O-N 3.41Å; R87-K89 PolarHBondContact O-N 3.19Å; K89-K91 PolarHBondContact O-N 3.46Å
90	V	58.8	Low	70.3	Confident	100 Å²	100	145.9 Å²	145.9	61%	0.606	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-82.2	-14.3	-170	-179.1	0	0	0	0	113.6	P85	P85-V90 HydrophobicContact CB-CG2 4.44Å; P85-V90 HydrophobicContact CG-CG2 4.47Å
91	K	55.6	Low	68.7	Low	202 Å²	202	147.8 Å²	147.8	88%	0.878	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-82.1	-9.2	-177.1	-73.9	-169.9	176.8	-176.5	0	115.5	K89	K89-K91 PolarHBondContact O-N 3.46Å
92	T	53.2	Low	67	Low	125 Å²	125	151.3 Å²	151.3	77%	0.767	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-97.6	-1.2	-166.4	-41	0	0	0	0	115.3
93	T	55.9	Low	65	Low	126 Å²	126	154.9 Å²	154.9	77%	0.773	78%	0.776	S	S	*	*	S	Bend	trans	-113.9	19.9	-171.7	13.7	0	0	0	0	116.3
94	R	49.2	Very low	62.8	Low	245 Å²	245	156.5 Å²	156.5	93%	0.925	78%	0.781	S	S	*	*			trans	-117.2	81.8	167.6	-76.9	-174.2	176.7	171	-1.1	111
95	K	40.2	Very low	60.3	Low	193 Å²	193	161.3 Å²	161.3	84%	0.839	80%	0.803	S	S	*	*			trans	-145.8	130.3	160.2	-110	-175.2	178.2	-176.8	0	107.5
96	N	45.7	Very low	57.5	Low	240 Å²	240	167.4 Å²	167.4	100%	1.283	82%	0.82	S	S	*	*			trans	105.3	0	179.6	-54.7	-0.6	0	0	0	113.7

Retrieved 96 of 96 residues in 106.3 ms (Link to these results)

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