A0A075B724_HUMAN Loading...

Tubulin beta 8 class VIII

AlphaFold DB , UniProt , Accession A0A075B724, Species HUMAN (Homo sapiens, Human), Gene TUBB8, Length 119 aa.

						>A0A075B724_HUMAN|A0A075B724|TUBB8
MREIVLTQIGQCGNQIGAKFWEVISDEHAIDSAGTYHGDSHLQLERINVYYNEASGGRYVPRAVLVDLEPGTMDSVRSGPFGQVFRPDNFIFVTGCAVLQVSVGPETTGPRDTTPKARS
					

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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	55	Low	81.2	Confident	195 Å²	195	97.1 Å²	97.1	96%	0.961	48%	0.484	S	S	*	.				0	135.3	0	-159	169.5	-83	0	0	107	N48	M1-N48 HydrophobicContact SD-CB 4.35Å
2	R	73.3	Confident	81.7	Confident	222 Å²	222	96.3 Å²	96.3	84%	0.838	49%	0.492	S	S	*	.			trans	-105.1	131.4	-179.2	-68.6	-176.2	-179.4	-161.5	0.1	108.1
3	E	80.9	Confident	82	Confident	111 Å²	111	90.8 Å²	90.8	52%	0.519	47%	0.474	S	S	.	.			trans	-118.5	141.7	179.9	-56.5	-174	159.6	0	0	108.6	R62	E3-R62 VanDerWaalsContact CD-NH1 3.31Å; E3-R62 IonicContact OE1-CZ 3.62Å; E3-R62 IonicContact OE1-NH1 3.7Å; E3-R62 IonicContact OE1-NH2 2.85Å; E3-R62 PolarHBondContact OE1-NH2 3.47Å; E3-R62 IonicContact OE2-CZ 3.42Å; E3-R62 IonicContact OE2-NH1 2.76Å; E3-R62 PolarHBondContact OE2-NH1 3.01Å; E3-R62 IonicContact OE2-NH2 3.43Å; E3-R62 PolarHBondContact OE2-NH2 3.4Å
4	I	86.6	Confident	82.4	Confident	79 Å²	79	84.6 Å²	84.6	41%	0.405	44%	0.442	S	S	.	.			trans	-119.8	131.4	177.4	-60.8	175.5	0	0	0	107.7	V49 Y50	I4-V49 HydrophobicContact CB-CG1 4.25Å; I4-V49 HydrophobicContact CD1-CG1 3.76Å; I4-V49 HydrophobicContact CG1-CG1 3.88Å; I4-V49 PolarHBondContact N-O 3.4Å; I4-Y50 HydrophobicContact CD1-CE1 4.46Å
5	V	85.5	Confident	82.6	Confident	89 Å²	89	86.5 Å²	86.5	54%	0.539	45%	0.448	S	S	.	.			trans	-105.8	123.4	171	-178.9	0	0	0	0	107.7	V64	V5-V64 HydrophobicContact CG1-CG2 4.21Å
6	L	87.4	Confident	83	Confident	49 Å²	49	88.1 Å²	88.1	26%	0.257	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	114.6	-179.9	-157.9	77.4	0	0	0	109.9	Q8 F20 W21 R62 A63 V64	L6-Q8 HydrophobicContact CD2-CG 4.39Å; L6-F20 HydrophobicContact CD2-CD1 3.61Å; L6-F20 HydrophobicContact CD2-CE1 3.7Å; L6-W21 HydrophobicContact CB-CZ2 3.98Å; L6-W21 HydrophobicContact CD2-CZ2 3.98Å; L6-R62 PolarHBondContact N-O 3.48Å; L6-A63 CarbonylContact O-C 3.59Å; L6-A63 VanDerWaalsContact O-CA 3.23Å; L6-A63 WeakPolarHBondContact O-CA 3.27Å; L6-V64 PolarHBondContact O-N 3.16Å
7	T	86.3	Confident	83.4	Confident	83 Å²	83	83.2 Å²	83.2	51%	0.509	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	117.4	176.3	-52.2	0	0	0	0	109.5	I9 V64 V66	T7-I9 HydrophobicContact CG2-CD1 4.03Å; T7-I9 HydrophobicContact CG2-CG1 3.89Å; T7-V64 WeakPolarHBondContact CA-O 3.32Å; T7-V66 HydrophobicContact CG2-CG2 4.35Å
8	Q	85.4	Confident	83.7	Confident	8 Å²	8	79.9 Å²	79.9	4%	0.037	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	129	178.7	-61.9	170	1.8	0	0	108	L6 N14 G17 W21 V64 V66	L6-Q8 HydrophobicContact CD2-CG 4.39Å; Q8-N14 WeakPolarHBondContact CB-OD1 3.38Å; Q8-G17 PolarHBondContact NE2-O 2.85Å; Q8-W21 VanDerWaalsContact NE2-CD1 3.27Å; Q8-V64 PolarHBondContact N-O 2.85Å; Q8-V66 PolarHBondContact O-N 2.85Å
9	I	84.6	Confident	84	Confident	96 Å²	96	82.1 Å²	82.1	49%	0.492	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	127	-173.1	-50.5	-179.1	0	0	0	109.8	T7 V66	T7-I9 HydrophobicContact CG2-CD1 4.03Å; T7-I9 HydrophobicContact CG2-CG1 3.89Å; I9-V66 CarbonylContact C-O 3.55Å; I9-V66 WeakPolarHBondContact CA-O 3.42Å; I9-V66 HydrophobicContact CG1-CB 4.2Å; I9-V66 HydrophobicContact CG1-CG2 4.4Å; I9-V66 HydrophobicContact CG2-CB 4.33Å
10	G	84.6	Confident	84.3	Confident	23 Å²	23	81.4 Å²	81.4	24%	0.237	42%	0.418	C	S	.	.	H	α-helix	trans	74.3	173.4	176.5	0	0	0	0	0	114.5	C12 G13 N14 V66	G10-C12 VanDerWaalsContact C-N 3.34Å; G10-C12 PolarHBondContact O-N 3.44Å; G10-G13 PolarHBondContact O-N 3.34Å; G10-G13 VanDerWaalsContact O-N 3.17Å; G10-N14 WeakPolarHBondContact O-CB 3.35Å; G10-N14 VanDerWaalsContact O-CG 3.32Å; G10-N14 PolarHBondContact O-N 3.31Å; G10-N14 PolarHBondContact O-ND2 3.46Å; G10-V66 PolarHBondContact N-O 3.35Å
11	Q	83.8	Confident	84.6	Confident	113 Å²	113	77.5 Å²	77.5	53%	0.528	40%	0.399	S	S	.	.	H	α-helix	trans	-55.5	-43.5	-172.6	-163	-157.6	-12.7	0	0	113.7	Q15 D67	Q11-Q15 WeakPolarHBondContact O-CG 3.27Å; Q11-Q15 PolarHBondContact O-N 2.84Å; Q11-Q15 PolarHBondContact O-NE2 3.12Å; Q11-Q15 VanDerWaalsContact O-NE2 3.16Å; Q11-D67 PolarHBondContact N-OD2 3.5Å
12	C	86.7	Confident	86.3	Confident	87 Å²	87	70.2 Å²	70.2	59%	0.588	36%	0.362	S	S	*	.	H	α-helix	trans	-70.8	-44.4	179.2	-176.9	0	0	0	0	111.7	G10 N14 Q15 I16	G10-C12 VanDerWaalsContact C-N 3.34Å; G10-C12 PolarHBondContact O-N 3.44Å; C12-N14 VanDerWaalsContact C-N 3.34Å; C12-N14 PolarHBondContact O-N 3.2Å; C12-Q15 PolarHBondContact O-N 3.29Å; C12-I16 WeakPolarHBondContact O-CG1 3.49Å; C12-I16 PolarHBondContact O-N 2.76Å
13	G	86.7	Confident	87.1	Confident	25 Å²	25	64.2 Å²	64.2	26%	0.258	35%	0.35	S	S	.	.	H	α-helix	trans	-63.1	-40.5	179.5	0	0	0	0	0	112.5	G10 G17	G10-G13 PolarHBondContact O-N 3.34Å; G10-G13 VanDerWaalsContact O-N 3.17Å; G13-G17 WeakPolarHBondContact O-CA 3.5Å; G13-G17 PolarHBondContact O-N 2.83Å
14	N	86.4	Confident	87.6	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-67.4	-36.9	177.1	-71.5	-31.2	0	0	0	112.3	Q8 G10 C12 A18 V66 D67 T72 V76	Q8-N14 WeakPolarHBondContact CB-OD1 3.38Å; G10-N14 WeakPolarHBondContact O-CB 3.35Å; G10-N14 VanDerWaalsContact O-CG 3.32Å; G10-N14 PolarHBondContact O-N 3.31Å; G10-N14 PolarHBondContact O-ND2 3.46Å; C12-N14 VanDerWaalsContact C-N 3.34Å; C12-N14 PolarHBondContact O-N 3.2Å; N14-A18 WeakPolarHBondContact O-CB 3.36Å; N14-A18 PolarHBondContact O-N 3.15Å; N14-V66 PolarHBondContact ND2-O 3.16Å; N14-D67 PolarHBondContact ND2-OD2 3.47Å; N14-T72 HydrophobicContact CB-CG2 3.79Å; N14-V76 HydrophobicContact CB-CG2 4.12Å
15	Q	86	Confident	87.7	Confident	113 Å²	113	56 Å²	56	53%	0.528	31%	0.31	S	S	.	.	H	α-helix	trans	-68.5	-48.1	176.3	-78.3	177	74.2	0	0	112.9	Q11 C12 G17 A18 K19	Q11-Q15 WeakPolarHBondContact O-CG 3.27Å; Q11-Q15 PolarHBondContact O-N 2.84Å; Q11-Q15 PolarHBondContact O-NE2 3.12Å; Q11-Q15 VanDerWaalsContact O-NE2 3.16Å; C12-Q15 PolarHBondContact O-N 3.29Å; Q15-G17 VanDerWaalsContact C-N 3.26Å; Q15-G17 PolarHBondContact O-N 2.73Å; Q15-A18 PolarHBondContact O-N 2.75Å; Q15-K19 PolarHBondContact O-N 2.75Å
16	I	89.8	Confident	87.9	Confident	112 Å²	112	58.1 Å²	58.1	57%	0.574	32%	0.318	S	S	*	.	H	α-helix	trans	-63.2	-41.4	176.2	-65.2	170.9	0	0	0	109.5	C12 A18 K19 F20	C12-I16 WeakPolarHBondContact O-CG1 3.49Å; C12-I16 PolarHBondContact O-N 2.76Å; I16-A18 PolarHBondContact O-N 3.35Å; I16-K19 PolarHBondContact O-N 2.92Å; I16-F20 PolarHBondContact O-N 3.41Å
17	G	89.1	Confident	88.1	Confident	5 Å²	5	61.7 Å²	61.7	5%	0.052	33%	0.334	C	S	.	.	H	α-helix	trans	-56.8	-45.8	175.9	0	0	0	0	0	114	Q8 G13 Q15 K19 F20 W21	Q8-G17 PolarHBondContact NE2-O 2.85Å; G13-G17 WeakPolarHBondContact O-CA 3.5Å; G13-G17 PolarHBondContact O-N 2.83Å; Q15-G17 VanDerWaalsContact C-N 3.26Å; Q15-G17 PolarHBondContact O-N 2.73Å; G17-K19 VanDerWaalsContact C-N 3.33Å; G17-K19 PolarHBondContact O-N 3.43Å; G17-F20 WeakPolarHBondContact O-CB 3.34Å; G17-F20 PolarHBondContact O-N 3.16Å; G17-W21 PolarHBondContact O-N 3.48Å
18	A	87.9	Confident	88.2	Confident	24 Å²	24	58.8 Å²	58.8	20%	0.198	32%	0.315	C	S	.	.	H	α-helix	trans	-59.5	-44	175.3	0	0	0	0	0	111.7	N14 Q15 I16 W21 E22	N14-A18 WeakPolarHBondContact O-CB 3.36Å; N14-A18 PolarHBondContact O-N 3.15Å; Q15-A18 PolarHBondContact O-N 2.75Å; I16-A18 PolarHBondContact O-N 3.35Å; A18-W21 PolarHBondContact O-N 3.01Å; A18-E22 WeakPolarHBondContact O-CG 3.42Å; A18-E22 PolarHBondContact O-N 3.11Å
19	K	89.6	Confident	88.5	Confident	122 Å²	122	59.6 Å²	59.6	53%	0.53	32%	0.322	S	S	.	.	H	α-helix	trans	-67.1	-36.4	175.9	-68.9	-52.6	-176	-165.5	0	113.6	Q15 I16 G17 E22 V23	Q15-K19 PolarHBondContact O-N 2.75Å; I16-K19 PolarHBondContact O-N 2.92Å; G17-K19 VanDerWaalsContact C-N 3.33Å; G17-K19 PolarHBondContact O-N 3.43Å; K19-E22 WeakPolarHBondContact CD-OE2 3.38Å; K19-E22 WeakPolarHBondContact CE-OE2 3.38Å; K19-E22 IonicContact NZ-OE1 2.91Å; K19-E22 PolarHBondContact NZ-OE1 3.31Å; K19-E22 IonicContact NZ-OE2 2.64Å; K19-E22 PolarHBondContact NZ-OE2 3.12Å; K19-E22 WeakPolarHBondContact O-CB 3.28Å; K19-E22 PolarHBondContact O-N 3.13Å; K19-V23 WeakPolarHBondContact O-CG2 3.47Å; K19-V23 PolarHBondContact O-N 3.13Å; K19-V23 VanDerWaalsContact O-N 3.16Å
20	F	90.9	Very high	88.8	Confident	67 Å²	67	55.2 Å²	55.2	29%	0.294	30%	0.3	S	S	.	.	H	α-helix	trans	-60.3	-47.5	173.4	171	-95.8	0	0	0	111.4	L6 I16 G17 E22 V23 I24 Y50	L6-F20 HydrophobicContact CD2-CD1 3.61Å; L6-F20 HydrophobicContact CD2-CE1 3.7Å; I16-F20 PolarHBondContact O-N 3.41Å; G17-F20 WeakPolarHBondContact O-CB 3.34Å; G17-F20 PolarHBondContact O-N 3.16Å; F20-E22 VanDerWaalsContact C-N 3.34Å; F20-E22 PolarHBondContact O-N 3.32Å; F20-V23 PolarHBondContact O-N 2.71Å; F20-I24 HydrophobicContact CD1-CG1 4.39Å; F20-I24 HydrophobicContact CD2-CG1 4.16Å; F20-I24 HydrophobicContact CE1-CG1 3.95Å; F20-I24 HydrophobicContact CE2-CD1 4.07Å; F20-I24 HydrophobicContact CE2-CG1 3.71Å; F20-I24 HydrophobicContact CG-CG1 4.5Å; F20-I24 HydrophobicContact CZ-CD1 4.09Å; F20-I24 HydrophobicContact CZ-CG1 3.6Å; F20-I24 WeakPolarHBondContact O-CG1 3.32Å; F20-I24 PolarHBondContact O-N 3.05Å; F20-Y50 HydrophobicContact CZ-CE1 4.17Å
21	W	90	Very high	89	Confident	1 Å²	1	56.3 Å²	56.3	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-67.3	-33.4	179.2	-72.6	114.3	0	0	0	112.8	L6 Q8 G17 A18 S25 Y50 Y51 P61 A63 F85	L6-W21 HydrophobicContact CB-CZ2 3.98Å; L6-W21 HydrophobicContact CD2-CZ2 3.98Å; Q8-W21 VanDerWaalsContact NE2-CD1 3.27Å; G17-W21 PolarHBondContact O-N 3.48Å; A18-W21 PolarHBondContact O-N 3.01Å; W21-S25 WeakPolarHBondContact O-CB 3.34Å; W21-S25 PolarHBondContact O-N 3.02Å; W21-S25 PolarHBondContact O-OG 2.98Å; W21-Y50 HydrophobicContact CH2-CD1 4.49Å; W21-Y50 WeakPolarHBondContact CH2-O 3.29Å; W21-Y51 HydrophobicContact CE3-CE1 4.37Å; W21-Y51 AromaticContact CE3-CZ 3.98Å; W21-Y51 HydrophobicContact CZ3-CE1 4.17Å; W21-Y51 HydrophobicContact CZ3-CE2 4.13Å; W21-Y51 AromaticContact CZ3-CZ 3.83Å; W21-P61 HydrophobicContact CD2-CB 4.05Å; W21-P61 HydrophobicContact CD2-CG 4.5Å; W21-P61 HydrophobicContact CE3-CB 3.84Å; W21-P61 HydrophobicContact CE3-CG 4.18Å; W21-P61 HydrophobicContact CH2-CB 3.74Å; W21-P61 HydrophobicContact CZ2-CB 3.94Å; W21-P61 HydrophobicContact CZ3-CB 3.68Å; W21-P61 HydrophobicContact CZ3-CG 4.35Å; W21-A63 HydrophobicContact CZ2-CB 3.66Å; W21-F85 HydrophobicContact CB-CZ 3.96Å; W21-F85 AromaticContact CD1-CE1 3.65Å; W21-F85 AromaticContact CD1-CZ 3.41Å; W21-F85 VanDerWaalsContact CD1-CZ 3.41Å; W21-F85 HydrophobicContact CD2-CE1 4.38Å; W21-F85 HydrophobicContact CD2-CZ 4.43Å; W21-F85 HydrophobicContact CG-CE1 4.05Å; W21-F85 AromaticContact CG-CZ 3.68Å; W21-F85 HydrophobicContact CG-CZ 3.68Å; W21-F85 AromaticContact NE1-CE1 3.78Å
22	E	90.2	Very high	89.1	Confident	42 Å²	42	53.8 Å²	53.8	20%	0.196	30%	0.295	C	S	.	.	H	α-helix	trans	-56.5	-52.1	170.3	-80.3	172.5	-156.6	0	0	111.5	A18 K19 F20 S25 D26 P80 F81	A18-E22 WeakPolarHBondContact O-CG 3.42Å; A18-E22 PolarHBondContact O-N 3.11Å; K19-E22 WeakPolarHBondContact CD-OE2 3.38Å; K19-E22 WeakPolarHBondContact CE-OE2 3.38Å; K19-E22 IonicContact NZ-OE1 2.91Å; K19-E22 PolarHBondContact NZ-OE1 3.31Å; K19-E22 IonicContact NZ-OE2 2.64Å; K19-E22 PolarHBondContact NZ-OE2 3.12Å; K19-E22 WeakPolarHBondContact O-CB 3.28Å; K19-E22 PolarHBondContact O-N 3.13Å; F20-E22 VanDerWaalsContact C-N 3.34Å; F20-E22 PolarHBondContact O-N 3.32Å; E22-S25 PolarHBondContact O-N 3.42Å; E22-D26 PolarHBondContact O-N 2.75Å; E22-P80 HydrophobicContact CG-CG 3.97Å; E22-P80 VanDerWaalsContact OE1-CG 3.23Å; E22-P80 WeakPolarHBondContact OE1-CG 3.22Å; E22-F81 HydrophobicContact CB-CD2 4.14Å; E22-F81 HydrophobicContact CB-CE2 4.14Å; E22-F81 HydrophobicContact CG-CD2 3.45Å; E22-F81 VanDerWaalsContact CG-CD2 3.45Å; E22-F81 HydrophobicContact CG-CE2 3.8Å
23	V	91.1	Very high	89	Confident	96 Å²	96	51.5 Å²	51.5	58%	0.582	28%	0.282	S	S	*	.	H	α-helix	trans	-66.4	-44.9	-175.8	174.1	0	0	0	0	111.8	K19 F20 S25 D26 E27	K19-V23 WeakPolarHBondContact O-CG2 3.47Å; K19-V23 PolarHBondContact O-N 3.13Å; K19-V23 VanDerWaalsContact O-N 3.16Å; F20-V23 PolarHBondContact O-N 2.71Å; V23-S25 VanDerWaalsContact C-N 3.35Å; V23-D26 PolarHBondContact O-N 3.36Å; V23-E27 PolarHBondContact O-N 3.45Å
24	I	90.3	Very high	89	Confident	17 Å²	17	50.3 Å²	50.3	9%	0.087	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-38.3	179	-67.1	-71.5	0	0	0	110.7	F20 D26 E27 H28 Y51	F20-I24 HydrophobicContact CD1-CG1 4.39Å; F20-I24 HydrophobicContact CD2-CG1 4.16Å; F20-I24 HydrophobicContact CE1-CG1 3.95Å; F20-I24 HydrophobicContact CE2-CD1 4.07Å; F20-I24 HydrophobicContact CE2-CG1 3.71Å; F20-I24 HydrophobicContact CG-CG1 4.5Å; F20-I24 HydrophobicContact CZ-CD1 4.09Å; F20-I24 HydrophobicContact CZ-CG1 3.6Å; F20-I24 WeakPolarHBondContact O-CG1 3.32Å; F20-I24 PolarHBondContact O-N 3.05Å; I24-D26 VanDerWaalsContact C-N 3.32Å; I24-D26 PolarHBondContact O-N 3.42Å; I24-E27 PolarHBondContact O-N 3.15Å; I24-H28 WeakPolarHBondContact O-CB 3.33Å; I24-H28 PolarHBondContact O-CD2 2.73Å; I24-H28 PolarHBondContact O-N 2.72Å; I24-Y51 HydrophobicContact CG2-CE2 3.91Å
25	S	90.1	Very high	89.1	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.007	29%	0.286	C	S	.	.	H	α-helix	trans	-63.1	-41.4	176.4	-58.1	0	0	0	0	111.5	W21 E22 V23 H28 A29 I30 Y51 F81	W21-S25 WeakPolarHBondContact O-CB 3.34Å; W21-S25 PolarHBondContact O-N 3.02Å; W21-S25 PolarHBondContact O-OG 2.98Å; E22-S25 PolarHBondContact O-N 3.42Å; V23-S25 VanDerWaalsContact C-N 3.35Å; S25-H28 CarbonylContact O-C 3.52Å; S25-H28 PolarHBondContact O-N 2.97Å; S25-A29 PolarHBondContact O-N 2.88Å; S25-I30 PolarHBondContact O-N 3.02Å; S25-Y51 PolarHBondContact OG-OH 3.01Å; S25-F81 WeakPolarHBondContact OG-CE1 3.35Å
26	D	89.9	Confident	89.3	Confident	132 Å²	132	50 Å²	50	71%	0.706	27%	0.271	S	S	*	.	H	α-helix	trans	-63.5	-44.8	176.3	-166.6	50.4	0	0	0	111.7	E22 V23 I24 H28 A29	E22-D26 PolarHBondContact O-N 2.75Å; V23-D26 PolarHBondContact O-N 3.36Å; I24-D26 VanDerWaalsContact C-N 3.32Å; I24-D26 PolarHBondContact O-N 3.42Å; D26-H28 VanDerWaalsContact C-N 3.3Å; D26-H28 PolarHBondContact O-N 2.82Å; D26-A29 PolarHBondContact O-N 2.93Å; D26-A29 VanDerWaalsContact O-N 3.07Å
27	E	90.1	Very high	89.2	Confident	125 Å²	125	51.2 Å²	51.2	58%	0.584	27%	0.274	S	S	*	.	H	α-helix	trans	-59.9	-40	176.9	-173.8	175.1	-176.7	0	0	112.4	V23 I24 A29 Q43	V23-E27 PolarHBondContact O-N 3.45Å; I24-E27 PolarHBondContact O-N 3.15Å; E27-A29 VanDerWaalsContact C-N 3.33Å; E27-Q43 PolarHBondContact O-NE2 2.87Å
28	H	89.4	Confident	89	Confident	22 Å²	22	52 Å²	52	10%	0.102	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	3.8	178.2	-72.7	-77.9	0	0	0	114	I24 S25 D26 I30 Y36 Q43 I47	I24-H28 WeakPolarHBondContact O-CB 3.33Å; I24-H28 PolarHBondContact O-CD2 2.73Å; I24-H28 PolarHBondContact O-N 2.72Å; S25-H28 CarbonylContact O-C 3.52Å; S25-H28 PolarHBondContact O-N 2.97Å; D26-H28 VanDerWaalsContact C-N 3.3Å; D26-H28 PolarHBondContact O-N 2.82Å; H28-I30 HydrophobicContact CB-CG1 3.96Å; H28-I30 PolarHBondContact O-N 2.87Å; H28-Y36 VanDerWaalsContact O-CD2 3.32Å; H28-Y36 WeakPolarHBondContact O-CD2 3.48Å; H28-Y36 WeakPolarHBondContact O-CE2 3.47Å; H28-Q43 PolarHBondContact ND1-O 2.85Å; H28-I47 HydrophobicContact CB-CD1 4.14Å
29	A	91.2	Very high	88.8	Confident	24 Å²	24	58.3 Å²	58.3	20%	0.198	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	39.6	-176.5	0	0	0	0	0	113.6	S25 D26 E27 Y36 H37 G38	S25-A29 PolarHBondContact O-N 2.88Å; D26-A29 PolarHBondContact O-N 2.93Å; D26-A29 VanDerWaalsContact O-N 3.07Å; E27-A29 VanDerWaalsContact C-N 3.33Å; A29-Y36 HydrophobicContact CB-CE2 4.29Å; A29-H37 PolarHBondContact O-N 3.28Å; A29-G38 VanDerWaalsContact CB-CA 3.4Å
30	I	90.3	Very high	88.5	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.026	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-93.2	126.8	172.9	-57.2	-59	0	0	0	108.5	S25 H28 T35 Y36 I47 Y59	S25-I30 PolarHBondContact O-N 3.02Å; H28-I30 HydrophobicContact CB-CG1 3.96Å; H28-I30 PolarHBondContact O-N 2.87Å; I30-T35 WeakPolarHBondContact CA-O 3.22Å; I30-Y36 HydrophobicContact CD1-CD2 3.91Å; I30-Y36 HydrophobicContact CD1-CG 4.35Å; I30-I47 HydrophobicContact CD1-CD1 3.76Å; I30-I47 HydrophobicContact CG1-CD1 3.98Å; I30-Y59 HydrophobicContact CD1-CD2 3.52Å; I30-Y59 HydrophobicContact CD1-CE2 4.11Å; I30-Y59 HydrophobicContact CD1-CG 3.89Å
31	D	89.6	Confident	88	Confident	46 Å²	46	58.4 Å²	58.4	25%	0.246	32%	0.32	C	S	.	.			trans	-76.2	174.1	176.1	76.1	6.4	0	0	0	112.3	A33 G34 T35 H37	D31-A33 PolarHBondContact O-N 3.26Å; D31-A33 VanDerWaalsContact OD1-C 3.23Å; D31-A33 WeakPolarHBondContact OD1-CA 3.23Å; D31-A33 VanDerWaalsContact OD1-CB 3.31Å; D31-A33 WeakPolarHBondContact OD1-CB 3.43Å; D31-A33 PolarHBondContact OD1-N 3.06Å; D31-G34 PolarHBondContact O-N 3.26Å; D31-G34 PolarHBondContact OD1-N 2.81Å; D31-T35 PolarHBondContact N-O 3.07Å; D31-T35 PolarHBondContact OD1-N 2.9Å; D31-T35 WeakPolarHBondContact OD2-CB 3.31Å; D31-T35 PolarHBondContact OD2-OG1 2.98Å; D31-H37 IonicContact OD2-CD2 3.66Å; D31-H37 IonicContact OD2-NE2 3.42Å; D31-H37 PolarHBondContact OD2-NE2 2.85Å
32	S	85.9	Confident	87.8	Confident	60 Å²	60	64.1 Å²	64.1	42%	0.42	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.9	175.3	52.5	0	0	0	0	114.5	P80	S32-P80 WeakPolarHBondContact CB-O 3.4Å
33	A	85.6	Confident	87.5	Confident	38 Å²	38	64.4 Å²	64.4	31%	0.314	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-12.9	173.5	0	0	0	0	0	112.4	D31 R58	D31-A33 PolarHBondContact O-N 3.26Å; D31-A33 VanDerWaalsContact OD1-C 3.23Å; D31-A33 WeakPolarHBondContact OD1-CA 3.23Å; D31-A33 VanDerWaalsContact OD1-CB 3.31Å; D31-A33 WeakPolarHBondContact OD1-CB 3.43Å; D31-A33 PolarHBondContact OD1-N 3.06Å; A33-R58 VanDerWaalsContact O-CZ 3.29Å; A33-R58 PolarHBondContact O-NE 2.82Å; A33-R58 PolarHBondContact O-NH2 3.35Å
34	G	86.6	Confident	87.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	90.3	14.9	-176.3	0	0	0	0	0	113.3	D31 R58 Y59 V84	D31-G34 PolarHBondContact O-N 3.26Å; D31-G34 PolarHBondContact OD1-N 2.81Å; G34-R58 CarbonylContact O-C 3.55Å; G34-R58 WeakPolarHBondContact O-CA 3.49Å; G34-Y59 PolarHBondContact O-N 2.92Å; G34-V84 VanDerWaalsContact CA-CG2 3.4Å; G34-V84 VanDerWaalsContact N-CG2 3.29Å
35	T	88.7	Confident	86.7	Confident	59 Å²	59	66 Å²	66	36%	0.362	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-90.7	136.8	178.3	-38.5	0	0	0	0	109.9	I30 D31	I30-T35 WeakPolarHBondContact CA-O 3.22Å; D31-T35 PolarHBondContact N-O 3.07Å; D31-T35 PolarHBondContact OD1-N 2.9Å; D31-T35 WeakPolarHBondContact OD2-CB 3.31Å; D31-T35 PolarHBondContact OD2-OG1 2.98Å
36	Y	89.6	Confident	86.4	Confident	52 Å²	52	74.8 Å²	74.8	20%	0.204	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-80.8	127	174	174.9	-104.2	0	0	0	111.3	H28 A29 I30 G38 S40 Q43 L44	H28-Y36 VanDerWaalsContact O-CD2 3.32Å; H28-Y36 WeakPolarHBondContact O-CD2 3.48Å; H28-Y36 WeakPolarHBondContact O-CE2 3.47Å; A29-Y36 HydrophobicContact CB-CE2 4.29Å; I30-Y36 HydrophobicContact CD1-CD2 3.91Å; I30-Y36 HydrophobicContact CD1-CG 4.35Å; Y36-G38 VanDerWaalsContact CE1-O 3.28Å; Y36-G38 WeakPolarHBondContact CE1-O 3.49Å; Y36-G38 VanDerWaalsContact CZ-C 3.5Å; Y36-G38 WeakPolarHBondContact OH-CA 3.29Å; Y36-G38 PolarHBondContact OH-O 2.91Å; Y36-S40 PolarHBondContact OH-O 3.2Å; Y36-Q43 HydrophobicContact CE2-CB 4.09Å; Y36-Q43 PolarHBondContact OH-OE1 3.04Å; Y36-L44 HydrophobicContact CD1-CD1 4.2Å; Y36-L44 HydrophobicContact CD1-CD2 4.12Å; Y36-L44 HydrophobicContact CD1-CG 4.44Å; Y36-L44 HydrophobicContact CD2-CD2 3.63Å; Y36-L44 HydrophobicContact CD2-CG 4.31Å; Y36-L44 HydrophobicContact CE1-CD1 3.77Å; Y36-L44 HydrophobicContact CE1-CD2 4.18Å; Y36-L44 HydrophobicContact CE1-CG 4.03Å; Y36-L44 HydrophobicContact CE2-CD2 3.71Å; Y36-L44 HydrophobicContact CE2-CG 3.88Å; Y36-L44 HydrophobicContact CG-CD2 3.84Å
37	H	86.9	Confident	86.2	Confident	137 Å²	137	68.7 Å²	68.7	63%	0.634	35%	0.353	S	S	*	.			trans	-122.6	13.5	178	-74.9	-77	0	0	0	113	A29 D31	A29-H37 PolarHBondContact O-N 3.28Å; D31-H37 IonicContact OD2-CD2 3.66Å; D31-H37 IonicContact OD2-NE2 3.42Å; D31-H37 PolarHBondContact OD2-NE2 2.85Å
38	G	84.8	Confident	86	Confident	21 Å²	21	65.1 Å²	65.1	22%	0.216	34%	0.338	C	S	.	.			trans	-75.5	163	-179.9	0	0	0	0	0	113.8	A29 Y36	A29-G38 VanDerWaalsContact CB-CA 3.4Å; Y36-G38 VanDerWaalsContact CE1-O 3.28Å; Y36-G38 WeakPolarHBondContact CE1-O 3.49Å; Y36-G38 VanDerWaalsContact CZ-C 3.5Å; Y36-G38 WeakPolarHBondContact OH-CA 3.29Å; Y36-G38 PolarHBondContact OH-O 2.91Å
39	D	83.8	Confident	85.9	Confident	157 Å²	157	65.5 Å²	65.5	84%	0.84	34%	0.342	S	S	*	.	S	Bend	trans	-109.9	-10.6	178.9	59.9	-8.4	0	0	0	112.7
40	S	84.6	Confident	85.8	Confident	40 Å²	40	67.4 Å²	67.4	28%	0.28	35%	0.345	S	S	.	.			trans	-110.1	124.3	-175	-179.6	0	0	0	0	112.7	Y36 L42 Q43	Y36-S40 PolarHBondContact OH-O 3.2Å; S40-L42 PolarHBondContact O-N 3.05Å; S40-L42 VanDerWaalsContact O-N 3.15Å; S40-L42 PolarHBondContact OG-N 3.01Å; S40-Q43 WeakPolarHBondContact O-CB 3.42Å; S40-Q43 PolarHBondContact O-N 3.14Å
41	H	79.9	Confident	85.8	Confident	152 Å²	152	67.2 Å²	67.2	70%	0.704	34%	0.343	S	S	*	.	H	α-helix	trans	-59.3	-27.2	175.3	-176.2	60.4	0	0	0	113.2	Q43 L44 E45	H41-Q43 PolarHBondContact O-N 3.24Å; H41-L44 PolarHBondContact O-N 3.18Å; H41-L44 VanDerWaalsContact O-N 3.12Å; H41-E45 PolarHBondContact O-N 3.2Å
42	L	85.9	Confident	85.7	Confident	121 Å²	121	67.7 Å²	67.7	63%	0.634	35%	0.346	S	S	*	.	H	α-helix	trans	-63.9	-28.3	177.4	-65.9	174.2	0	0	0	112.4	S40 L44 E45	S40-L42 PolarHBondContact O-N 3.05Å; S40-L42 VanDerWaalsContact O-N 3.15Å; S40-L42 PolarHBondContact OG-N 3.01Å; L42-L44 VanDerWaalsContact C-N 3.27Å; L42-L44 PolarHBondContact O-N 2.88Å; L42-E45 WeakPolarHBondContact CD2-OE2 3.49Å; L42-E45 VanDerWaalsContact O-CB 3.27Å; L42-E45 WeakPolarHBondContact O-CB 3.49Å; L42-E45 PolarHBondContact O-N 2.62Å; L42-E45 VanDerWaalsContact O-N 3.13Å
43	Q	83	Confident	85.8	Confident	47 Å²	47	70.6 Å²	70.6	22%	0.22	35%	0.353	C	S	.	.	H	α-helix	trans	-70	-27.4	176.7	-66.5	171.2	-39.3	0	0	111.9	E27 H28 Y36 S40 H41 E45	E27-Q43 PolarHBondContact O-NE2 2.87Å; H28-Q43 PolarHBondContact ND1-O 2.85Å; Y36-Q43 HydrophobicContact CE2-CB 4.09Å; Y36-Q43 PolarHBondContact OH-OE1 3.04Å; S40-Q43 WeakPolarHBondContact O-CB 3.42Å; S40-Q43 PolarHBondContact O-N 3.14Å; H41-Q43 PolarHBondContact O-N 3.24Å; Q43-E45 VanDerWaalsContact C-N 3.33Å
44	L	83.3	Confident	85.7	Confident	50 Å²	50	69.8 Å²	69.8	26%	0.262	35%	0.346	S	S	.	.	H	α-helix	trans	-84.6	-15.8	173.1	-64.7	176	0	0	0	111.7	Y36 H41 L42 R46 I47 Y59	Y36-L44 HydrophobicContact CD1-CD1 4.2Å; Y36-L44 HydrophobicContact CD1-CD2 4.12Å; Y36-L44 HydrophobicContact CD1-CG 4.44Å; Y36-L44 HydrophobicContact CD2-CD2 3.63Å; Y36-L44 HydrophobicContact CD2-CG 4.31Å; Y36-L44 HydrophobicContact CE1-CD1 3.77Å; Y36-L44 HydrophobicContact CE1-CD2 4.18Å; Y36-L44 HydrophobicContact CE1-CG 4.03Å; Y36-L44 HydrophobicContact CE2-CD2 3.71Å; Y36-L44 HydrophobicContact CE2-CG 3.88Å; Y36-L44 HydrophobicContact CG-CD2 3.84Å; H41-L44 PolarHBondContact O-N 3.18Å; H41-L44 VanDerWaalsContact O-N 3.12Å; L42-L44 VanDerWaalsContact C-N 3.27Å; L42-L44 PolarHBondContact O-N 2.88Å; L44-R46 PolarHBondContact O-N 2.92Å; L44-R46 VanDerWaalsContact O-N 3.12Å; L44-I47 HydrophobicContact CD2-CD1 4.23Å; L44-I47 WeakPolarHBondContact O-CG2 3.3Å; L44-I47 PolarHBondContact O-N 3.05Å; L44-Y59 WeakPolarHBondContact CD2-OH 3.23Å
45	E	82.3	Confident	85.3	Confident	98 Å²	98	75.7 Å²	75.7	46%	0.458	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	115.9	177.6	-155	-171.1	156	0	0	109.4	H41 L42 Q43 I47	H41-E45 PolarHBondContact O-N 3.2Å; L42-E45 WeakPolarHBondContact CD2-OE2 3.49Å; L42-E45 VanDerWaalsContact O-CB 3.27Å; L42-E45 WeakPolarHBondContact O-CB 3.49Å; L42-E45 PolarHBondContact O-N 2.62Å; L42-E45 VanDerWaalsContact O-N 3.13Å; Q43-E45 VanDerWaalsContact C-N 3.33Å; E45-I47 VanDerWaalsContact C-N 3.26Å; E45-I47 PolarHBondContact O-N 3.49Å
46	R	82.6	Confident	84.8	Confident	185 Å²	185	76.9 Å²	76.9	70%	0.698	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	17.3	-179.3	-52.4	171.4	-175	172	3.6	115.5	L44 N48 V49	L44-R46 PolarHBondContact O-N 2.92Å; L44-R46 VanDerWaalsContact O-N 3.12Å; R46-N48 PolarHBondContact O-N 3.39Å; R46-N48 VanDerWaalsContact O-N 3.11Å; R46-V49 HydrophobicContact CB-CG2 3.97Å; R46-V49 WeakPolarHBondContact O-CB 3.43Å; R46-V49 VanDerWaalsContact O-CG2 3.23Å; R46-V49 WeakPolarHBondContact O-CG2 2.97Å; R46-V49 PolarHBondContact O-N 3.39Å
47	I	86.3	Confident	84.5	Confident	3 Å²	3	76.1 Å²	76.1	2%	0.015	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-55.9	-31	171.4	-163.1	167.2	0	0	0	112.2	H28 I30 L44 E45 V49 Y50 Y51 Y59	H28-I47 HydrophobicContact CB-CD1 4.14Å; I30-I47 HydrophobicContact CD1-CD1 3.76Å; I30-I47 HydrophobicContact CG1-CD1 3.98Å; L44-I47 HydrophobicContact CD2-CD1 4.23Å; L44-I47 WeakPolarHBondContact O-CG2 3.3Å; L44-I47 PolarHBondContact O-N 3.05Å; E45-I47 VanDerWaalsContact C-N 3.26Å; E45-I47 PolarHBondContact O-N 3.49Å; I47-V49 PolarHBondContact O-N 3.34Å; I47-Y50 PolarHBondContact O-N 3.35Å; I47-Y50 VanDerWaalsContact O-N 3.13Å; I47-Y51 HydrophobicContact CD1-CD2 4.3Å; I47-Y51 HydrophobicContact CG1-CD2 3.62Å; I47-Y51 HydrophobicContact CG1-CE2 4.42Å; I47-Y51 HydrophobicContact CG1-CG 4.2Å; I47-Y51 PolarHBondContact O-N 3.02Å; I47-Y59 HydrophobicContact CD1-CD1 3.81Å; I47-Y59 HydrophobicContact CD1-CE1 3.91Å; I47-Y59 HydrophobicContact CD1-CG 4.17Å; I47-Y59 HydrophobicContact CG1-CD1 4.24Å; I47-Y59 HydrophobicContact CG1-CE1 4.42Å; I47-Y59 HydrophobicContact CG2-CD1 4.33Å; I47-Y59 HydrophobicContact CG2-CE1 3.78Å
48	N	85.5	Confident	84.5	Confident	50 Å²	50	75.2 Å²	75.2	27%	0.267	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-59.5	-13.7	175.8	-65.9	-27.5	0	0	0	114.8	M1 R46 Y51	M1-N48 HydrophobicContact SD-CB 4.35Å; R46-N48 PolarHBondContact O-N 3.39Å; R46-N48 VanDerWaalsContact O-N 3.11Å; N48-Y51 CarbonylContact C-O 3.49Å; N48-Y51 WeakPolarHBondContact CA-O 3.42Å
49	V	88	Confident	84.8	Confident	30 Å²	30	75.2 Å²	75.2	18%	0.182	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-67.3	-42.2	175.2	176.1	0	0	0	0	110.7	I4 R46 I47	I4-V49 HydrophobicContact CB-CG1 4.25Å; I4-V49 HydrophobicContact CD1-CG1 3.76Å; I4-V49 HydrophobicContact CG1-CG1 3.88Å; I4-V49 PolarHBondContact N-O 3.4Å; R46-V49 HydrophobicContact CB-CG2 3.97Å; R46-V49 WeakPolarHBondContact O-CB 3.43Å; R46-V49 VanDerWaalsContact O-CG2 3.23Å; R46-V49 WeakPolarHBondContact O-CG2 2.97Å; R46-V49 PolarHBondContact O-N 3.39Å; I47-V49 PolarHBondContact O-N 3.34Å
50	Y	88.4	Confident	85	Confident	65 Å²	65	68.1 Å²	68.1	26%	0.255	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-28.9	-175.5	-65.2	-67.2	0	0	0	113.3	I4 F20 W21 I47 R62	I4-Y50 HydrophobicContact CD1-CE1 4.46Å; F20-Y50 HydrophobicContact CZ-CE1 4.17Å; W21-Y50 HydrophobicContact CH2-CD1 4.49Å; W21-Y50 WeakPolarHBondContact CH2-O 3.29Å; I47-Y50 PolarHBondContact O-N 3.35Å; I47-Y50 VanDerWaalsContact O-N 3.13Å; Y50-R62 VanDerWaalsContact O-CB 3.29Å; Y50-R62 WeakPolarHBondContact O-CB 3.34Å; Y50-R62 WeakPolarHBondContact O-CG 3.4Å; Y50-R62 PolarHBondContact O-N 3.47Å
51	Y	89.7	Confident	85.3	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	154.7	-178.4	-65.2	-91.2	0	0	0	111.7	W21 I24 S25 I47 N48 V60 P61 R62	W21-Y51 HydrophobicContact CE3-CE1 4.37Å; W21-Y51 AromaticContact CE3-CZ 3.98Å; W21-Y51 HydrophobicContact CZ3-CE1 4.17Å; W21-Y51 HydrophobicContact CZ3-CE2 4.13Å; W21-Y51 AromaticContact CZ3-CZ 3.83Å; I24-Y51 HydrophobicContact CG2-CE2 3.91Å; S25-Y51 PolarHBondContact OG-OH 3.01Å; I47-Y51 HydrophobicContact CD1-CD2 4.3Å; I47-Y51 HydrophobicContact CG1-CD2 3.62Å; I47-Y51 HydrophobicContact CG1-CE2 4.42Å; I47-Y51 HydrophobicContact CG1-CG 4.2Å; I47-Y51 PolarHBondContact O-N 3.02Å; N48-Y51 CarbonylContact C-O 3.49Å; N48-Y51 WeakPolarHBondContact CA-O 3.42Å; Y51-V60 CarbonylContact C-O 3.52Å; Y51-V60 WeakPolarHBondContact CA-O 3.19Å; Y51-P61 HydrophobicContact CD1-CG 4.18Å; Y51-P61 HydrophobicContact CE1-CB 4.33Å; Y51-P61 HydrophobicContact CE1-CG 3.76Å; Y51-R62 PolarHBondContact O-NE 3.46Å; Y51-R62 VanDerWaalsContact O-NE 3.15Å
52	N	88.8	Confident	85.7	Confident	56 Å²	56	60.8 Å²	60.8	30%	0.299	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.3	163.4	-91.4	-48.8	0	0	0	108.3	A54 Y59 V60 R62	N52-A54 PolarHBondContact O-N 3.18Å; N52-Y59 WeakPolarHBondContact O-CA 3.34Å; N52-V60 PolarHBondContact N-O 3.39Å; N52-V60 PolarHBondContact O-N 3.1Å; N52-R62 VanDerWaalsContact CG-CZ 3.46Å; N52-R62 WeakPolarHBondContact ND2-CG 3.48Å; N52-R62 PolarHBondContact ND2-NE 3.28Å; N52-R62 PolarHBondContact OD1-NE 3.02Å; N52-R62 VanDerWaalsContact OD1-NE 3.16Å; N52-R62 PolarHBondContact OD1-NH2 3.37Å
53	E	87.7	Confident	85.7	Confident	122 Å²	122	55.1 Å²	55.1	57%	0.57	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	113	168.3	-167.7	-177.1	171.4	0	0	108.9	Y59	E53-Y59 HydrophobicContact CB-CD1 4.43Å; E53-Y59 HydrophobicContact CB-CE1 4.17Å; E53-Y59 HydrophobicContact CG-CE1 4.11Å
54	A	83.2	Confident	85.9	Confident	21 Å²	21	54.7 Å²	54.7	17%	0.174	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	163.5	173.7	0	0	0	0	0	110.5	N52 G56 G57 R58 V60	N52-A54 PolarHBondContact O-N 3.18Å; A54-G56 PolarHBondContact O-N 2.85Å; A54-G57 PolarHBondContact O-N 2.98Å; A54-R58 WeakPolarHBondContact CA-O 3.49Å; A54-R58 HydrophobicContact CB-CB 4.43Å; A54-R58 WeakPolarHBondContact CB-O 3.49Å; A54-R58 PolarHBondContact N-O 3.17Å; A54-V60 HydrophobicContact CB-CG2 4.25Å
55	S	78.6	Confident	86	Confident	123 Å²	123	52.5 Å²	52.5	86%	0.86	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	130.9	175.1	54.5	0	0	0	0	111.4
56	G	78.1	Confident	86.1	Confident	85 Å²	85	49.4 Å²	49.4	88%	0.876	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	18.1	179.5	0	0	0	0	0	115	A54 R58	A54-G56 PolarHBondContact O-N 2.85Å; G56-R58 VanDerWaalsContact C-N 3.29Å; G56-R58 PolarHBondContact O-N 3.07Å
57	G	82.5	Confident	86.2	Confident	35 Å²	35	41.1 Å²	41.1	36%	0.361	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	24.5	177.3	0	0	0	0	0	113.3	A54	A54-G57 PolarHBondContact O-N 2.98Å
58	R	88	Confident	85.9	Confident	118 Å²	118	44.2 Å²	44.2	45%	0.445	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.2	-177.7	-167	178.5	-160.8	-174.4	2.1	110.4	A33 G34 A54 G56	A33-R58 VanDerWaalsContact O-CZ 3.29Å; A33-R58 PolarHBondContact O-NE 2.82Å; A33-R58 PolarHBondContact O-NH2 3.35Å; G34-R58 CarbonylContact O-C 3.55Å; G34-R58 WeakPolarHBondContact O-CA 3.49Å; A54-R58 WeakPolarHBondContact CA-O 3.49Å; A54-R58 HydrophobicContact CB-CB 4.43Å; A54-R58 WeakPolarHBondContact CB-O 3.49Å; A54-R58 PolarHBondContact N-O 3.17Å; G56-R58 VanDerWaalsContact C-N 3.29Å; G56-R58 PolarHBondContact O-N 3.07Å
59	Y	89.6	Confident	85.6	Confident	22 Å²	22	47.3 Å²	47.3	9%	0.086	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	123.5	178	-65.3	-85.8	0	0	0	110.3	I30 G34 L44 I47 N52 E53	I30-Y59 HydrophobicContact CD1-CD2 3.52Å; I30-Y59 HydrophobicContact CD1-CE2 4.11Å; I30-Y59 HydrophobicContact CD1-CG 3.89Å; G34-Y59 PolarHBondContact O-N 2.92Å; L44-Y59 WeakPolarHBondContact CD2-OH 3.23Å; I47-Y59 HydrophobicContact CD1-CD1 3.81Å; I47-Y59 HydrophobicContact CD1-CE1 3.91Å; I47-Y59 HydrophobicContact CD1-CG 4.17Å; I47-Y59 HydrophobicContact CG1-CD1 4.24Å; I47-Y59 HydrophobicContact CG1-CE1 4.42Å; I47-Y59 HydrophobicContact CG2-CD1 4.33Å; I47-Y59 HydrophobicContact CG2-CE1 3.78Å; N52-Y59 WeakPolarHBondContact O-CA 3.34Å; E53-Y59 HydrophobicContact CB-CD1 4.43Å; E53-Y59 HydrophobicContact CB-CE1 4.17Å; E53-Y59 HydrophobicContact CG-CE1 4.11Å
60	V	89.5	Confident	84.9	Confident	8 Å²	8	50.2 Å²	50.2	5%	0.048	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	123.6	-179.5	-178.8	0	0	0	0	109.9	Y51 N52 A54 R86	Y51-V60 CarbonylContact C-O 3.52Å; Y51-V60 WeakPolarHBondContact CA-O 3.19Å; N52-V60 PolarHBondContact N-O 3.39Å; N52-V60 PolarHBondContact O-N 3.1Å; A54-V60 HydrophobicContact CB-CG2 4.25Å; V60-R86 HydrophobicContact CG1-CG 3.87Å
61	P	89.5	Confident	84.5	Confident	1 Å²	1	49.1 Å²	49.1	1%	0.006	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	137.2	177.2	-24.6	31.1	0	0	0	112.7	W21 Y51 A63 V84 F85	W21-P61 HydrophobicContact CD2-CB 4.05Å; W21-P61 HydrophobicContact CD2-CG 4.5Å; W21-P61 HydrophobicContact CE3-CB 3.84Å; W21-P61 HydrophobicContact CE3-CG 4.18Å; W21-P61 HydrophobicContact CH2-CB 3.74Å; W21-P61 HydrophobicContact CZ2-CB 3.94Å; W21-P61 HydrophobicContact CZ3-CB 3.68Å; W21-P61 HydrophobicContact CZ3-CG 4.35Å; Y51-P61 HydrophobicContact CD1-CG 4.18Å; Y51-P61 HydrophobicContact CE1-CB 4.33Å; Y51-P61 HydrophobicContact CE1-CG 3.76Å; P61-A63 HydrophobicContact CB-CB 4.39Å; P61-A63 PolarHBondContact O-N 3.28Å; P61-V84 VanDerWaalsContact CD-CG1 3.47Å; P61-V84 WeakPolarHBondContact CD-O 3.4Å; P61-V84 HydrophobicContact CG-CG1 3.32Å; P61-F85 HydrophobicContact CB-CD1 4.15Å; P61-F85 HydrophobicContact CB-CE1 3.89Å; P61-F85 HydrophobicContact CG-CD1 4.22Å; P61-F85 HydrophobicContact CG-CE1 4.04Å
62	R	88.2	Confident	83.9	Confident	37 Å²	37	49.6 Å²	49.6	14%	0.14	30%	0.303	C	S	.	.			trans	-83.7	65.2	168.6	-66	171.9	178.5	-110.4	17.8	109.6	E3 L6 Y50 Y51 N52	E3-R62 VanDerWaalsContact CD-NH1 3.31Å; E3-R62 IonicContact OE1-CZ 3.62Å; E3-R62 IonicContact OE1-NH1 3.7Å; E3-R62 IonicContact OE1-NH2 2.85Å; E3-R62 PolarHBondContact OE1-NH2 3.47Å; E3-R62 IonicContact OE2-CZ 3.42Å; E3-R62 IonicContact OE2-NH1 2.76Å; E3-R62 PolarHBondContact OE2-NH1 3.01Å; E3-R62 IonicContact OE2-NH2 3.43Å; E3-R62 PolarHBondContact OE2-NH2 3.4Å; L6-R62 PolarHBondContact N-O 3.48Å; Y50-R62 VanDerWaalsContact O-CB 3.29Å; Y50-R62 WeakPolarHBondContact O-CB 3.34Å; Y50-R62 WeakPolarHBondContact O-CG 3.4Å; Y50-R62 PolarHBondContact O-N 3.47Å; Y51-R62 PolarHBondContact O-NE 3.46Å; Y51-R62 VanDerWaalsContact O-NE 3.15Å; N52-R62 VanDerWaalsContact CG-CZ 3.46Å; N52-R62 WeakPolarHBondContact ND2-CG 3.48Å; N52-R62 PolarHBondContact ND2-NE 3.28Å; N52-R62 PolarHBondContact OD1-NE 3.02Å; N52-R62 VanDerWaalsContact OD1-NE 3.16Å; N52-R62 PolarHBondContact OD1-NH2 3.37Å
63	A	87	Confident	83.2	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.008	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	142.7	177.3	0	0	0	0	0	111.1	L6 W21 P61 L65 F85 N89	L6-A63 CarbonylContact O-C 3.59Å; L6-A63 VanDerWaalsContact O-CA 3.23Å; L6-A63 WeakPolarHBondContact O-CA 3.27Å; W21-A63 HydrophobicContact CZ2-CB 3.66Å; P61-A63 HydrophobicContact CB-CB 4.39Å; P61-A63 PolarHBondContact O-N 3.28Å; A63-L65 HydrophobicContact CB-CD1 4.14Å; A63-F85 HydrophobicContact CB-CD1 4.06Å; A63-F85 HydrophobicContact CB-CE1 3.72Å; A63-N89 VanDerWaalsContact O-CB 3.29Å; A63-N89 WeakPolarHBondContact O-CB 3.44Å; A63-N89 PolarHBondContact O-ND2 3.2Å
64	V	86.3	Confident	83	Confident	38 Å²	38	48 Å²	48	23%	0.23	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.8	167	-179.7	0	0	0	0	107.4	V5 L6 T7 Q8 V66 I91	V5-V64 HydrophobicContact CG1-CG2 4.21Å; L6-V64 PolarHBondContact O-N 3.16Å; T7-V64 WeakPolarHBondContact CA-O 3.32Å; Q8-V64 PolarHBondContact N-O 2.85Å; V64-V66 HydrophobicContact CG1-CG2 4.05Å; V64-I91 HydrophobicContact CG1-CD1 3.7Å; V64-I91 HydrophobicContact CG1-CG1 4.24Å
65	L	87	Confident	83	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.5	180	-66.3	89.8	0	0	0	108.2	A63 V76 F85 N89 F90 I91	A63-L65 HydrophobicContact CB-CD1 4.14Å; L65-V76 HydrophobicContact CD2-CB 4.44Å; L65-V76 HydrophobicContact CD2-CG1 3.78Å; L65-V76 HydrophobicContact CD2-CG2 4.27Å; L65-F85 HydrophobicContact CD1-CD1 3.86Å; L65-F85 HydrophobicContact CD1-CE1 4.2Å; L65-F85 HydrophobicContact CD1-CG 4.37Å; L65-N89 PolarHBondContact N-O 2.91Å; L65-F90 HydrophobicContact CB-CD1 3.95Å; L65-F90 HydrophobicContact CB-CE1 4.2Å; L65-F90 HydrophobicContact CD1-CE1 4.26Å; L65-F90 HydrophobicContact CD1-CZ 4.45Å; L65-F90 HydrophobicContact CD2-CD1 4.43Å; L65-F90 HydrophobicContact CD2-CE1 3.86Å; L65-F90 HydrophobicContact CG-CE1 4.34Å; L65-I91 PolarHBondContact O-N 2.64Å
66	V	84.7	Confident	83.2	Confident	33 Å²	33	45.3 Å²	45.3	20%	0.2	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.9	-179.4	-171.6	0	0	0	0	108.5	T7 Q8 I9 G10 N14 V64 I91	T7-V66 HydrophobicContact CG2-CG2 4.35Å; Q8-V66 PolarHBondContact O-N 2.85Å; I9-V66 CarbonylContact C-O 3.55Å; I9-V66 WeakPolarHBondContact CA-O 3.42Å; I9-V66 HydrophobicContact CG1-CB 4.2Å; I9-V66 HydrophobicContact CG1-CG2 4.4Å; I9-V66 HydrophobicContact CG2-CB 4.33Å; G10-V66 PolarHBondContact N-O 3.35Å; N14-V66 PolarHBondContact ND2-O 3.16Å; V64-V66 HydrophobicContact CG1-CG2 4.05Å; V66-I91 WeakPolarHBondContact CA-O 3.46Å; V66-I91 HydrophobicContact CG2-CB 4.31Å
67	D	82.9	Confident	83.5	Confident	11 Å²	11	46.8 Å²	46.8	6%	0.059	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	154.1	172	-145	-41.5	0	0	0	111.6	Q11 N14 E69 T72 I91 F92 V93	Q11-D67 PolarHBondContact N-OD2 3.5Å; N14-D67 PolarHBondContact ND2-OD2 3.47Å; D67-E69 PolarHBondContact OD1-N 3.19Å; D67-T72 WeakPolarHBondContact OD2-CB 3.48Å; D67-T72 WeakPolarHBondContact OD2-CG2 3.26Å; D67-T72 PolarHBondContact OD2-OG1 3.22Å; D67-I91 PolarHBondContact N-O 2.9Å; D67-I91 VanDerWaalsContact N-O 3.1Å; D67-F92 VanDerWaalsContact O-CA 3.27Å; D67-F92 WeakPolarHBondContact O-CA 2.89Å; D67-V93 PolarHBondContact O-N 3.06Å
68	L	79.9	Confident	83.6	Confident	69 Å²	69	50 Å²	50	36%	0.361	27%	0.273	S	S	.	.	S	Bend	trans	-92.8	-18.9	171.6	-57	171.8	0	0	0	110.7	V93 A97	L68-V93 HydrophobicContact CD2-CB 3.95Å; L68-V93 HydrophobicContact CD2-CG2 4.41Å; L68-A97 WeakPolarHBondContact CD1-O 3.39Å; L68-A97 HydrophobicContact CD2-CB 4.3Å
69	E	79.8	Confident	83.4	Confident	115 Å²	115	45.5 Å²	45.5	54%	0.537	26%	0.264	S	S	.	.			trans	-104.4	119.5	179	-66.7	-171.6	171.6	0	0	111	D67 G71 T72	D67-E69 PolarHBondContact OD1-N 3.19Å; E69-G71 PolarHBondContact O-N 2.78Å; E69-T72 PolarHBondContact O-N 2.86Å
70	P	74.2	Confident	83.1	Confident	90 Å²	90	48.1 Å²	48.1	58%	0.584	28%	0.283	S	S	*	.	H	α-helix	trans	-64.4	-24.4	178.1	25	-32.4	0	0	0	112.4	T72 M73	P70-T72 VanDerWaalsContact C-N 3.3Å; P70-T72 PolarHBondContact O-N 3.42Å; P70-M73 WeakPolarHBondContact O-CB 3.48Å; P70-M73 PolarHBondContact O-N 3.48Å; P70-M73 VanDerWaalsContact O-N 3.16Å
71	G	79.2	Confident	83	Confident	42 Å²	42	49.4 Å²	49.4	43%	0.433	29%	0.288	S	S	.	.	H	α-helix	trans	-66.1	-26.7	179.9	0	0	0	0	0	114.5	E69 M73 D74 S75	E69-G71 PolarHBondContact O-N 2.78Å; G71-M73 VanDerWaalsContact C-N 3.28Å; G71-M73 PolarHBondContact O-N 3.33Å; G71-D74 PolarHBondContact O-N 3.39Å; G71-S75 PolarHBondContact O-N 3.17Å; G71-S75 PolarHBondContact O-OG 3.43Å
72	T	76.6	Confident	82.6	Confident	10 Å²	10	49.5 Å²	49.5	6%	0.061	29%	0.289	C	S	.	.	H	α-helix	trans	-67.2	-33.6	174.8	-54.5	0	0	0	0	111.2	N14 D67 E69 P70 D74 S75 V76	N14-T72 HydrophobicContact CB-CG2 3.79Å; D67-T72 WeakPolarHBondContact OD2-CB 3.48Å; D67-T72 WeakPolarHBondContact OD2-CG2 3.26Å; D67-T72 PolarHBondContact OD2-OG1 3.22Å; E69-T72 PolarHBondContact O-N 2.86Å; P70-T72 VanDerWaalsContact C-N 3.3Å; P70-T72 PolarHBondContact O-N 3.42Å; T72-D74 PolarHBondContact O-N 3.45Å; T72-S75 WeakPolarHBondContact O-CB 3.48Å; T72-S75 PolarHBondContact O-N 3.07Å; T72-V76 HydrophobicContact CG2-CG2 4.43Å; T72-V76 PolarHBondContact O-N 3.36Å
73	M	75.3	Confident	82.3	Confident	37 Å²	37	53.6 Å²	53.6	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-43	-179.8	-63.8	177.8	52	0	0	111.5	P70 G71 S75 V76 R77 F90 F92	P70-M73 WeakPolarHBondContact O-CB 3.48Å; P70-M73 PolarHBondContact O-N 3.48Å; P70-M73 VanDerWaalsContact O-N 3.16Å; G71-M73 VanDerWaalsContact C-N 3.28Å; G71-M73 PolarHBondContact O-N 3.33Å; M73-S75 PolarHBondContact O-N 3.03Å; M73-V76 PolarHBondContact O-N 2.88Å; M73-R77 WeakPolarHBondContact O-CB 3.43Å; M73-R77 WeakPolarHBondContact O-CG 3.41Å; M73-R77 PolarHBondContact O-N 3.28Å; M73-F90 HydrophobicContact CE-CB 3.53Å; M73-F90 HydrophobicContact CE-CD1 3.96Å; M73-F90 HydrophobicContact CE-CG 3.88Å; M73-F90 HydrophobicContact CG-CD1 4.19Å; M73-F90 HydrophobicContact SD-CB 4.43Å; M73-F92 HydrophobicContact CE-CD1 3.9Å; M73-F92 HydrophobicContact CE-CE1 4.31Å; M73-F92 HydrophobicContact SD-CB 3.85Å; M73-F92 HydrophobicContact SD-CD1 3.55Å; M73-F92 VanDerWaalsContact SD-CD1 3.55Å; M73-F92 HydrophobicContact SD-CE1 4.43Å; M73-F92 HydrophobicContact SD-CG 3.95Å
74	D	83.8	Confident	82.2	Confident	109 Å²	109	53.8 Å²	53.8	58%	0.583	31%	0.311	S	S	*	.	H	α-helix	trans	-61.5	-38.5	175.8	-69.4	-30.3	0	0	0	111.1	G71 T72 R77 S78	G71-D74 PolarHBondContact O-N 3.39Å; T72-D74 PolarHBondContact O-N 3.45Å; D74-R77 PolarHBondContact O-N 2.99Å; D74-S78 WeakPolarHBondContact O-CB 3.39Å; D74-S78 PolarHBondContact O-N 2.77Å; D74-S78 PolarHBondContact O-OG 2.85Å
75	S	83.3	Confident	82.1	Confident	76 Å²	76	52.6 Å²	52.6	53%	0.531	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-48.6	175.8	-57	0	0	0	0	111.6	G71 T72 M73 S78 G79	G71-S75 PolarHBondContact O-N 3.17Å; G71-S75 PolarHBondContact O-OG 3.43Å; T72-S75 WeakPolarHBondContact O-CB 3.48Å; T72-S75 PolarHBondContact O-N 3.07Å; M73-S75 PolarHBondContact O-N 3.03Å; S75-S78 PolarHBondContact O-N 2.99Å; S75-S78 PolarHBondContact O-OG 3.4Å; S75-G79 PolarHBondContact O-N 3.25Å
76	V	82.4	Confident	81.8	Confident	11 Å²	11	56.9 Å²	56.9	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-65.6	-41.3	178	177.5	0	0	0	0	111.7	N14 L65 T72 M73 S78 G79 G82 F85 F90	N14-V76 HydrophobicContact CB-CG2 4.12Å; L65-V76 HydrophobicContact CD2-CB 4.44Å; L65-V76 HydrophobicContact CD2-CG1 3.78Å; L65-V76 HydrophobicContact CD2-CG2 4.27Å; T72-V76 HydrophobicContact CG2-CG2 4.43Å; T72-V76 PolarHBondContact O-N 3.36Å; M73-V76 PolarHBondContact O-N 2.88Å; V76-S78 VanDerWaalsContact C-N 3.33Å; V76-S78 PolarHBondContact O-N 3.43Å; V76-G79 PolarHBondContact O-N 3.34Å; V76-G82 VanDerWaalsContact O-CA 3.26Å; V76-G82 WeakPolarHBondContact O-CA 2.97Å; V76-F85 HydrophobicContact CG1-CE2 4.44Å; V76-F90 HydrophobicContact CG1-CE1 4.48Å
77	R	83.5	Confident	81.5	Confident	116 Å²	116	59.7 Å²	59.7	44%	0.438	34%	0.338	S	S	.	.	H	α-helix	trans	-69.3	-30.5	179.5	-71.9	-175.7	81	-154.8	5.9	113.2	M73 D74 Q83 F90	M73-R77 WeakPolarHBondContact O-CB 3.43Å; M73-R77 WeakPolarHBondContact O-CG 3.41Å; M73-R77 PolarHBondContact O-N 3.28Å; D74-R77 PolarHBondContact O-N 2.99Å; R77-Q83 PolarHBondContact O-NE2 3.25Å; R77-F90 HydrophobicContact CG-CE1 4.49Å; R77-F90 HydrophobicContact CG-CZ 4.12Å
78	S	85.1	Confident	81.4	Confident	102 Å²	102	65.5 Å²	65.5	71%	0.713	37%	0.369	S	S	*	.	H	α-helix	trans	-73.5	-14.4	171.6	75.2	0	0	0	0	113.1	D74 S75 V76	D74-S78 WeakPolarHBondContact O-CB 3.39Å; D74-S78 PolarHBondContact O-N 2.77Å; D74-S78 PolarHBondContact O-OG 2.85Å; S75-S78 PolarHBondContact O-N 2.99Å; S75-S78 PolarHBondContact O-OG 3.4Å; V76-S78 VanDerWaalsContact C-N 3.33Å; V76-S78 PolarHBondContact O-N 3.43Å
79	G	84.4	Confident	81.5	Confident	24 Å²	24	64.1 Å²	64.1	25%	0.247	36%	0.362	C	S	.	.	S	Bend	trans	-67	160.9	175.9	0	0	0	0	0	113.1	S75 V76 F81 G82	S75-G79 PolarHBondContact O-N 3.25Å; V76-G79 PolarHBondContact O-N 3.34Å; G79-F81 PolarHBondContact O-N 3.2Å; G79-G82 PolarHBondContact O-N 2.9Å
80	P	83.5	Confident	81.5	Confident	77 Å²	77	59.5 Å²	59.5	50%	0.5	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-34.3	-174.9	21	-31.6	0	0	0	113.4	E22 S32	E22-P80 HydrophobicContact CG-CG 3.97Å; E22-P80 VanDerWaalsContact OE1-CG 3.23Å; E22-P80 WeakPolarHBondContact OE1-CG 3.22Å; S32-P80 WeakPolarHBondContact CB-O 3.4Å
81	F	85.4	Confident	81.7	Confident	34 Å²	34	59.4 Å²	59.4	15%	0.149	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	12.1	177.6	-69.4	-92.3	0	0	0	113.6	E22 S25 G79 Q83 V84 F85	E22-F81 HydrophobicContact CB-CD2 4.14Å; E22-F81 HydrophobicContact CB-CE2 4.14Å; E22-F81 HydrophobicContact CG-CD2 3.45Å; E22-F81 VanDerWaalsContact CG-CD2 3.45Å; E22-F81 HydrophobicContact CG-CE2 3.8Å; S25-F81 WeakPolarHBondContact OG-CE1 3.35Å; G79-F81 PolarHBondContact O-N 3.2Å; F81-Q83 PolarHBondContact O-N 3.45Å; F81-V84 WeakPolarHBondContact O-CB 3.23Å; F81-V84 WeakPolarHBondContact O-CG1 2.96Å; F81-V84 PolarHBondContact O-N 3.17Å; F81-V84 VanDerWaalsContact O-N 3.14Å; F81-F85 WeakPolarHBondContact O-CD2 3.15Å; F81-F85 WeakPolarHBondContact O-CE2 3.38Å
82	G	82.4	Confident	81.4	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.031	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.9	-177.2	0	0	0	0	0	114.2	V76 G79 V84	V76-G82 VanDerWaalsContact O-CA 3.26Å; V76-G82 WeakPolarHBondContact O-CA 2.97Å; G79-G82 PolarHBondContact O-N 2.9Å; G82-V84 VanDerWaalsContact C-N 3.31Å
83	Q	82.4	Confident	80.8	Confident	123 Å²	123	65.7 Å²	65.7	58%	0.575	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-12.6	-178.8	-59	-56.3	-43.9	0	0	113.9	R77 F81	R77-Q83 PolarHBondContact O-NE2 3.25Å; F81-Q83 PolarHBondContact O-N 3.45Å
84	V	84.3	Confident	79.6	Confident	6 Å²	6	70.5 Å²	70.5	4%	0.036	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-23.2	-176.2	109.6	0	0	0	0	111.3	G34 P61 F81 G82	G34-V84 VanDerWaalsContact CA-CG2 3.4Å; G34-V84 VanDerWaalsContact N-CG2 3.29Å; P61-V84 VanDerWaalsContact CD-CG1 3.47Å; P61-V84 WeakPolarHBondContact CD-O 3.4Å; P61-V84 HydrophobicContact CG-CG1 3.32Å; F81-V84 WeakPolarHBondContact O-CB 3.23Å; F81-V84 WeakPolarHBondContact O-CG1 2.96Å; F81-V84 PolarHBondContact O-N 3.17Å; F81-V84 VanDerWaalsContact O-N 3.14Å; G82-V84 VanDerWaalsContact C-N 3.31Å
85	F	83.3	Confident	78.1	Confident	13 Å²	13	67.4 Å²	67.4	6%	0.057	38%	0.379	C	S	.	.	S	Bend	trans	-73.7	138.5	174.3	-62.1	-78	0	0	0	111.4	W21 P61 A63 L65 V76 F81 F90	W21-F85 HydrophobicContact CB-CZ 3.96Å; W21-F85 AromaticContact CD1-CE1 3.65Å; W21-F85 AromaticContact CD1-CZ 3.41Å; W21-F85 VanDerWaalsContact CD1-CZ 3.41Å; W21-F85 HydrophobicContact CD2-CE1 4.38Å; W21-F85 HydrophobicContact CD2-CZ 4.43Å; W21-F85 HydrophobicContact CG-CE1 4.05Å; W21-F85 AromaticContact CG-CZ 3.68Å; W21-F85 HydrophobicContact CG-CZ 3.68Å; W21-F85 AromaticContact NE1-CE1 3.78Å; P61-F85 HydrophobicContact CB-CD1 4.15Å; P61-F85 HydrophobicContact CB-CE1 3.89Å; P61-F85 HydrophobicContact CG-CD1 4.22Å; P61-F85 HydrophobicContact CG-CE1 4.04Å; A63-F85 HydrophobicContact CB-CD1 4.06Å; A63-F85 HydrophobicContact CB-CE1 3.72Å; L65-F85 HydrophobicContact CD1-CD1 3.86Å; L65-F85 HydrophobicContact CD1-CE1 4.2Å; L65-F85 HydrophobicContact CD1-CG 4.37Å; V76-F85 HydrophobicContact CG1-CE2 4.44Å; F81-F85 WeakPolarHBondContact O-CD2 3.15Å; F81-F85 WeakPolarHBondContact O-CE2 3.38Å; F85-F90 HydrophobicContact CB-CE2 3.74Å; F85-F90 HydrophobicContact CB-CZ 3.81Å; F85-F90 HydrophobicContact CG-CZ 4.39Å
86	R	81.1	Confident	76.2	Confident	94 Å²	94	69.7 Å²	69.7	36%	0.355	39%	0.394	S	S	.	.			trans	-70.4	135.1	171.5	-83.8	178.9	172.2	115	2.6	110.1	V60 D88 N89 F90	V60-R86 HydrophobicContact CG1-CG 3.87Å; R86-D88 PolarHBondContact O-N 3.28Å; R86-N89 WeakPolarHBondContact O-CB 3.49Å; R86-N89 PolarHBondContact O-N 3.24Å; R86-F90 VanDerWaalsContact O-CD2 3.3Å; R86-F90 WeakPolarHBondContact O-CD2 3.12Å; R86-F90 WeakPolarHBondContact O-CE2 3.4Å
87	P	78.6	Confident	74.7	Confident	91 Å²	91	71.7 Å²	71.7	59%	0.591	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-58.2	-29.6	174.8	24	-32.6	0	0	0	112	N89 F90	P87-N89 PolarHBondContact O-N 3.46Å; P87-F90 PolarHBondContact O-N 3.24Å
88	D	80.6	Confident	73.2	Confident	133 Å²	133	72 Å²	72	71%	0.711	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-67.2	-17.2	178	-51.4	-46.8	0	0	0	113.7	R86 F90	R86-D88 PolarHBondContact O-N 3.28Å; D88-F90 VanDerWaalsContact C-N 3.33Å
89	N	81.9	Confident	71.4	Confident	40 Å²	40	73.4 Å²	73.4	21%	0.214	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-88.9	-2.3	-179.5	-67.7	9.5	0	0	0	113.1	A63 L65 R86 P87	A63-N89 VanDerWaalsContact O-CB 3.29Å; A63-N89 WeakPolarHBondContact O-CB 3.44Å; A63-N89 PolarHBondContact O-ND2 3.2Å; L65-N89 PolarHBondContact N-O 2.91Å; R86-N89 WeakPolarHBondContact O-CB 3.49Å; R86-N89 PolarHBondContact O-N 3.24Å; P87-N89 PolarHBondContact O-N 3.46Å
90	F	79.5	Confident	69.6	Low	19 Å²	19	79.8 Å²	79.8	8%	0.083	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	115.8	176.5	-66.8	-93.2	0	0	0	109.7	L65 M73 V76 R77 F85 R86 P87 D88	L65-F90 HydrophobicContact CB-CD1 3.95Å; L65-F90 HydrophobicContact CB-CE1 4.2Å; L65-F90 HydrophobicContact CD1-CE1 4.26Å; L65-F90 HydrophobicContact CD1-CZ 4.45Å; L65-F90 HydrophobicContact CD2-CD1 4.43Å; L65-F90 HydrophobicContact CD2-CE1 3.86Å; L65-F90 HydrophobicContact CG-CE1 4.34Å; M73-F90 HydrophobicContact CE-CB 3.53Å; M73-F90 HydrophobicContact CE-CD1 3.96Å; M73-F90 HydrophobicContact CE-CG 3.88Å; M73-F90 HydrophobicContact CG-CD1 4.19Å; M73-F90 HydrophobicContact SD-CB 4.43Å; V76-F90 HydrophobicContact CG1-CE1 4.48Å; R77-F90 HydrophobicContact CG-CE1 4.49Å; R77-F90 HydrophobicContact CG-CZ 4.12Å; F85-F90 HydrophobicContact CB-CE2 3.74Å; F85-F90 HydrophobicContact CB-CZ 3.81Å; F85-F90 HydrophobicContact CG-CZ 4.39Å; R86-F90 VanDerWaalsContact O-CD2 3.3Å; R86-F90 WeakPolarHBondContact O-CD2 3.12Å; R86-F90 WeakPolarHBondContact O-CE2 3.4Å; P87-F90 PolarHBondContact O-N 3.24Å; D88-F90 VanDerWaalsContact C-N 3.33Å
91	I	79.2	Confident	67.8	Low	87 Å²	87	81.4 Å²	81.4	45%	0.446	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	115.3	176.2	-57.2	176.4	0	0	0	107.2	V64 L65 V66 D67	V64-I91 HydrophobicContact CG1-CD1 3.7Å; V64-I91 HydrophobicContact CG1-CG1 4.24Å; L65-I91 PolarHBondContact O-N 2.64Å; V66-I91 WeakPolarHBondContact CA-O 3.46Å; V66-I91 HydrophobicContact CG2-CB 4.31Å; D67-I91 PolarHBondContact N-O 2.9Å; D67-I91 VanDerWaalsContact N-O 3.1Å
92	F	72.4	Confident	66	Low	114 Å²	114	84 Å²	84	50%	0.5	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	138.3	172.1	58	-85.6	0	0	0	110.3	D67 M73	D67-F92 VanDerWaalsContact O-CA 3.27Å; D67-F92 WeakPolarHBondContact O-CA 2.89Å; M73-F92 HydrophobicContact CE-CD1 3.9Å; M73-F92 HydrophobicContact CE-CE1 4.31Å; M73-F92 HydrophobicContact SD-CB 3.85Å; M73-F92 HydrophobicContact SD-CD1 3.55Å; M73-F92 VanDerWaalsContact SD-CD1 3.55Å; M73-F92 HydrophobicContact SD-CE1 4.43Å; M73-F92 HydrophobicContact SD-CG 3.95Å
93	V	64	Low	64.5	Low	70 Å²	70	88.6 Å²	88.6	42%	0.424	51%	0.507	S	S	.	.			trans	-107	117.7	176.2	-173.9	0	0	0	0	108.2	D67 L68 G95	D67-V93 PolarHBondContact O-N 3.06Å; L68-V93 HydrophobicContact CD2-CB 3.95Å; L68-V93 HydrophobicContact CD2-CG2 4.41Å; V93-G95 PolarHBondContact O-N 2.93Å
94	T	51.6	Low	62.7	Low	139 Å²	139	84.9 Å²	84.9	85%	0.853	50%	0.501	S	S	*	.	S	Bend	trans	-77.9	90.3	171.2	17.6	0	0	0	0	108.6
95	G	52.3	Low	61.3	Low	43 Å²	43	90.7 Å²	90.7	44%	0.443	54%	0.539	S	S	.	.	S	Bend	trans	153	121.7	-179.9	0	0	0	0	0	109.2	V93 A97	V93-G95 PolarHBondContact O-N 2.93Å; G95-A97 VanDerWaalsContact C-N 3.31Å; G95-A97 PolarHBondContact O-N 3.04Å
96	C	42.8	Very low	59.9	Low	125 Å²	125	99.3 Å²	99.3	85%	0.845	58%	0.579	S	S	*	*			trans	-61.2	91.6	179.3	-170.7	0	0	0	0	109.6
97	A	50.1	Low	58.4	Low	53 Å²	53	99.9 Å²	99.9	44%	0.438	59%	0.593	S	S	.	*			trans	-100.9	93	172.3	0	0	0	0	0	107.2	L68 G95 L99	L68-A97 WeakPolarHBondContact CD1-O 3.39Å; L68-A97 HydrophobicContact CD2-CB 4.3Å; G95-A97 VanDerWaalsContact C-N 3.31Å; G95-A97 PolarHBondContact O-N 3.04Å; A97-L99 PolarHBondContact O-N 3.17Å
98	V	53	Low	57.1	Low	123 Å²	123	100 Å²	100	75%	0.745	59%	0.593	S	S	*	*			trans	-57.7	109.3	169.1	-177.8	0	0	0	0	107	Q100	V98-Q100 PolarHBondContact O-N 3.05Å
99	L	46.5	Very low	55.7	Low	131 Å²	131	96.2 Å²	96.2	69%	0.686	59%	0.585	S	S	*	*			trans	-69.7	86.5	172.9	-170.5	76.6	0	0	0	107.3	A97 V101	A97-L99 PolarHBondContact O-N 3.17Å; L99-V101 HydrophobicContact CD2-CG2 4.46Å; L99-V101 PolarHBondContact O-N 2.85Å
100	Q	46.3	Very low	54	Low	157 Å²	157	100.7 Å²	100.7	73%	0.734	62%	0.616	S	S	*	*			trans	-74.3	96.7	172.4	-169.9	175.4	-90.2	0	0	108	V98 S102	V98-Q100 PolarHBondContact O-N 3.05Å; Q100-S102 VanDerWaalsContact C-N 3.29Å; Q100-S102 PolarHBondContact O-N 2.85Å
101	V	46.6	Very low	52.8	Low	111 Å²	111	109.9 Å²	109.9	67%	0.673	65%	0.65	S	S	*	*			trans	-66.7	98.2	163.1	-179.6	0	0	0	0	106.6	L99 V103	L99-V101 HydrophobicContact CD2-CG2 4.46Å; L99-V101 PolarHBondContact O-N 2.85Å; V101-V103 PolarHBondContact O-N 3.16Å
102	S	48.2	Very low	51.3	Low	88 Å²	88	113 Å²	113	62%	0.615	67%	0.668	S	S	*	*			trans	-75.4	102.9	171.3	-52	0	0	0	0	106.1	Q100 G104	Q100-S102 VanDerWaalsContact C-N 3.29Å; Q100-S102 PolarHBondContact O-N 2.85Å; S102-G104 PolarHBondContact O-N 3.2Å
103	V	49.7	Very low	50.5	Low	101 Å²	101	113.3 Å²	113.3	61%	0.612	68%	0.679	S	S	*	*			trans	-62.4	111.7	168.5	179.6	0	0	0	0	106.3	V101 T107	V101-V103 PolarHBondContact O-N 3.16Å; V103-T107 WeakPolarHBondContact CG1-OG1 3.34Å
104	G	45.5	Very low	49.6	Very low	44 Å²	44	115.9 Å²	115.9	45%	0.454	70%	0.695	S	S	.	*			trans	-56.2	152.1	177.8	0	0	0	0	0	110.5	S102 E106	S102-G104 PolarHBondContact O-N 3.2Å; G104-E106 PolarHBondContact O-N 2.83Å
105	P	54.8	Low	49.4	Very low	129 Å²	129	115 Å²	115	84%	0.838	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-61.2	-5.3	-172.2	22.6	-32.7	0	0	0	115.3
106	E	53.5	Low	49.2	Very low	193 Å²	193	122.9 Å²	122.9	90%	0.902	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-84.8	-7.8	-175.2	-104.8	-179.2	139	0	0	115.9	G104	G104-E106 PolarHBondContact O-N 2.83Å
107	T	49.3	Very low	49.5	Very low	106 Å²	106	121.8 Å²	121.8	65%	0.65	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-102.9	7.4	-177.4	66.2	0	0	0	0	115.1	V103	V103-T107 WeakPolarHBondContact CG1-OG1 3.34Å
108	T	50.7	Low	49.2	Very low	95 Å²	95	131.3 Å²	131.3	58%	0.583	74%	0.738	S	S	*	*			trans	-98.6	92.2	165.1	52.6	0	0	0	0	109.4
109	G	51.4	Low	49.1	Very low	53 Å²	53	134.4 Å²	134.4	55%	0.546	77%	0.765	S	S	.	*			trans	-53.4	153.1	158.5	0	0	0	0	0	110.2	R111	G109-R111 PolarHBondContact O-N 3.09Å
110	P	47.4	Very low	49.2	Very low	134 Å²	134	134.6 Å²	134.6	87%	0.87	77%	0.769	S	S	*	*			trans	-57.6	116.6	-173.4	22.4	-31.1	0	0	0	109.7	D112	P110-D112 PolarHBondContact O-N 3.02Å; P110-D112 VanDerWaalsContact O-N 3.09Å
111	R	53.8	Low	49.4	Very low	211 Å²	211	133.4 Å²	133.4	80%	0.796	77%	0.771	S	S	*	*			trans	-69.7	105.8	168.9	-81	-173.7	-96	-165.9	-6.2	106.8	G109 T113	G109-R111 PolarHBondContact O-N 3.09Å; R111-T113 PolarHBondContact O-N 2.85Å
112	D	48.4	Very low	49.5	Very low	152 Å²	152	134.6 Å²	134.6	81%	0.813	78%	0.777	S	S	*	*			trans	-65.9	86	173.3	-142.6	-1	0	0	0	108.4	P110 T114	P110-D112 PolarHBondContact O-N 3.02Å; P110-D112 VanDerWaalsContact O-N 3.09Å; D112-T114 VanDerWaalsContact C-N 3.32Å; D112-T114 PolarHBondContact O-N 3.07Å; D112-T114 VanDerWaalsContact O-N 3.07Å
113	T	53.9	Low	49.6	Very low	121 Å²	121	137.4 Å²	137.4	74%	0.742	79%	0.786	S	S	*	*			trans	-77.7	88.1	171.7	53.5	0	0	0	0	107.7	R111 P115	R111-T113 PolarHBondContact O-N 2.85Å; T113-P115 WeakPolarHBondContact O-CD 3.34Å
114	T	46.3	Very low	49.6	Very low	125 Å²	125	139.6 Å²	139.6	77%	0.767	80%	0.797	S	S	*	*			trans	-60.3	119.4	163.5	20.4	0	0	0	0	108.2	D112 K116	D112-T114 VanDerWaalsContact C-N 3.32Å; D112-T114 PolarHBondContact O-N 3.07Å; D112-T114 VanDerWaalsContact O-N 3.07Å; T114-K116 PolarHBondContact O-N 3.26Å
115	P	47.1	Very low	49.9	Very low	120 Å²	120	146 Å²	146	78%	0.779	82%	0.82	S	S	*	*			trans	-74.1	117.3	173.5	11.6	-0.4	0	0	0	108	T113 A117	T113-P115 WeakPolarHBondContact O-CD 3.34Å; P115-A117 VanDerWaalsContact C-N 3.34Å; P115-A117 PolarHBondContact O-N 2.91Å
116	K	48.8	Very low	49.5	Very low	209 Å²	209	147.2 Å²	147.2	91%	0.909	82%	0.819	S	S	*	*			trans	-62.6	97.4	166.6	-132.1	178.1	-174.9	179.2	0	107.3	T114 R118	T114-K116 PolarHBondContact O-N 3.26Å; K116-R118 PolarHBondContact O-N 3.22Å
117	A	47.7	Very low	49.2	Very low	101 Å²	101	143.7 Å²	143.7	84%	0.835	81%	0.812	S	S	*	*			trans	-61.6	119.2	173.1	0	0	0	0	0	108.6	P115	P115-A117 VanDerWaalsContact C-N 3.34Å; P115-A117 PolarHBondContact O-N 2.91Å
118	R	44.1	Very low	49.2	Very low	253 Å²	253	146.8 Å²	146.8	96%	0.955	83%	0.826	S	S	*	*			trans	-95.4	104.8	170.3	-161.5	179	-167.2	-118.3	3.8	106.4	K116	K116-R118 PolarHBondContact O-N 3.22Å
119	S	50.9	Low	49.1	Very low	188 Å²	188	151.5 Å²	151.5	100%	1.315	85%	0.848	S	S	*	*			trans	-159.9	0	156.2	179	0	0	0	0	108.7

Retrieved 119 of 119 residues in 39 ms (Link to these results)

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