A0A087XSA3_POEFO Loading...

Cellular retinoic acid-binding protein 1

Cytosolic CRABPs may regulate the access of retinoic acid to the nuclear retinoic acid receptors.

AlphaFold DB , UniProt , Accession A0A087XSA3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 142 aa.

						>A0A087XSA3_POEFO|A0A087XSA3
MENKVTDFSGKWKMKSSENFEELLKALGVNVFLRKIAVAAASSPAVEITQEGETFSIKTSTSVRTTNVSFTVGQSFNEATVDGRPCTSFPKWETDRKISCEQTLPKGDGLKTMWTRELTNDGELILTMTAGDVVCTRVYERE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	80.6	Confident	237 Å²	237	98.7 Å²	98.7	100%	1.167	50%	0.497	S	S	*	.				0	110.7	0	-77.7	158	167.3	0	0	105.5	N3	M1-N3 PolarHBondContact O-N 3.3Å
2	E	49.7	Very low	82	Confident	194 Å²	194	90.7 Å²	90.7	91%	0.907	46%	0.456	S	S	*	.			trans	-63	121.9	173	-74.2	170	142.1	0	0	107.4	K4	E2-K4 VanDerWaalsContact C-N 3.33Å; E2-K4 PolarHBondContact O-N 3.06Å
3	N	55.4	Low	83	Confident	156 Å²	156	90.3 Å²	90.3	83%	0.834	45%	0.45	S	S	*	.			trans	-64.6	100.5	169.8	-78.8	-20.7	0	0	0	106.6	M1 V5	M1-N3 PolarHBondContact O-N 3.3Å; N3-V5 PolarHBondContact O-N 2.91Å
4	K	75.9	Confident	83.9	Confident	187 Å²	187	85.4 Å²	85.4	81%	0.813	43%	0.425	S	S	*	.			trans	-75.1	99.7	-178.3	-170.5	176.5	-177.8	-179.7	0	108.3	E2	E2-K4 VanDerWaalsContact C-N 3.33Å; E2-K4 PolarHBondContact O-N 3.06Å
5	V	87	Confident	84.7	Confident	34 Å²	34	87.5 Å²	87.5	21%	0.206	43%	0.431	C	S	.	.			trans	-65.1	148.5	168.5	-66.6	0	0	0	0	110	N3 W92	N3-V5 PolarHBondContact O-N 2.91Å; V5-W92 HydrophobicContact CB-CH2 4.15Å; V5-W92 HydrophobicContact CB-CZ2 3.83Å; V5-W92 HydrophobicContact CG1-CD2 4.18Å; V5-W92 HydrophobicContact CG1-CZ2 3.95Å; V5-W92 HydrophobicContact CG2-CZ2 4.16Å
6	T	92.9	Very high	85.3	Confident	24 Å²	24	84.6 Å²	84.6	15%	0.147	42%	0.422	C	S	.	.			trans	-72.4	147.1	-178.4	-60.1	0	0	0	0	110.6	F8 Q50 D95 R96 L118	T6-F8 VanDerWaalsContact O-CD2 3.31Å; T6-F8 WeakPolarHBondContact O-CD2 3.36Å; T6-Q50 PolarHBondContact O-NE2 3.36Å; T6-Q50 VanDerWaalsContact O-NE2 3.13Å; T6-Q50 PolarHBondContact O-OE1 2.82Å; T6-D95 VanDerWaalsContact CB-O 3.23Å; T6-D95 WeakPolarHBondContact CB-O 3.06Å; T6-D95 PolarHBondContact N-O 2.82Å; T6-D95 PolarHBondContact OG1-O 2.88Å; T6-R96 HydrophobicContact CG2-CG 4.23Å; T6-R96 WeakPolarHBondContact OG1-CG 3.42Å; T6-L118 HydrophobicContact CG2-CD2 3.49Å; T6-L118 VanDerWaalsContact CG2-CD2 3.49Å
7	D	95.2	Very high	86	Confident	93 Å²	93	82.5 Å²	82.5	50%	0.497	42%	0.418	S	S	.	.			trans	-88.3	113.1	178.1	-177.7	16.6	0	0	0	111	S9	D7-S9 VanDerWaalsContact C-N 3.32Å; D7-S9 WeakPolarHBondContact OD1-CB 3.34Å; D7-S9 PolarHBondContact OD1-N 3.49Å; D7-S9 PolarHBondContact OD1-OG 2.65Å
8	F	97.7	Very high	86.6	Confident	1 Å²	1	85 Å²	85	0%	0.004	43%	0.427	C	S	.	.			trans	-87	-5.3	177.1	-70.7	-114.3	0	0	0	112.3	T6 G10 W12 I48 F55 W92 R96 R116 L118 L124	T6-F8 VanDerWaalsContact O-CD2 3.31Å; T6-F8 WeakPolarHBondContact O-CD2 3.36Å; F8-G10 PolarHBondContact O-N 2.74Å; F8-W12 PolarHBondContact O-NE1 3.24Å; F8-W12 VanDerWaalsContact O-NE1 3.07Å; F8-I48 HydrophobicContact CB-CD1 4.46Å; F8-I48 HydrophobicContact CB-CG2 4.08Å; F8-F55 HydrophobicContact CB-CE1 3.94Å; F8-F55 HydrophobicContact CD2-CE1 4.02Å; F8-F55 HydrophobicContact CD2-CZ 4.3Å; F8-F55 HydrophobicContact CG-CE1 4.03Å; F8-W92 HydrophobicContact CD2-CH2 4.21Å; F8-W92 AromaticContact CE2-CH2 3.59Å; F8-W92 HydrophobicContact CE2-CH2 3.59Å; F8-W92 AromaticContact CE2-CZ3 3.68Å; F8-W92 HydrophobicContact CE2-CZ3 3.68Å; F8-W92 HydrophobicContact CZ-CH2 4.32Å; F8-W92 HydrophobicContact CZ-CZ3 4.02Å; F8-R96 VanDerWaalsContact CZ-O 3.26Å; F8-R96 WeakPolarHBondContact CZ-O 3.44Å; F8-R116 HydrophobicContact CE1-CB 4.39Å; F8-L118 HydrophobicContact CD1-CB 4.2Å; F8-L118 HydrophobicContact CE1-CB 3.82Å; F8-L118 HydrophobicContact CE2-CB 4.45Å; F8-L118 HydrophobicContact CZ-CB 3.97Å; F8-L124 HydrophobicContact CD1-CD1 3.78Å; F8-L124 HydrophobicContact CE1-CD1 3.96Å
9	S	98	Very high	87.1	Confident	29 Å²	29	85.5 Å²	85.5	20%	0.203	43%	0.432	C	S	.	.			trans	-57.1	135.5	-175.6	-57.6	0	0	0	0	111.1	D7 I48 Q50 R141	D7-S9 VanDerWaalsContact C-N 3.32Å; D7-S9 WeakPolarHBondContact OD1-CB 3.34Å; D7-S9 PolarHBondContact OD1-N 3.49Å; D7-S9 PolarHBondContact OD1-OG 2.65Å; S9-I48 CarbonylContact C-O 3.52Å; S9-I48 VanDerWaalsContact CA-O 3.26Å; S9-I48 WeakPolarHBondContact CA-O 3.42Å; S9-Q50 WeakPolarHBondContact OG-CB 3.33Å; S9-Q50 PolarHBondContact OG-N 2.89Å; S9-R141 VanDerWaalsContact O-CZ 3.29Å; S9-R141 PolarHBondContact O-NH1 3.12Å; S9-R141 PolarHBondContact O-NH2 3.11Å
10	G	97.6	Very high	87.5	Confident	20 Å²	20	82.2 Å²	82.2	21%	0.206	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.3	174.9	-178.8	0	0	0	0	0	113.4	F8 I48	F8-G10 PolarHBondContact O-N 2.74Å; G10-I48 PolarHBondContact N-O 3.08Å; G10-I48 PolarHBondContact O-N 3.14Å
11	K	97.9	Very high	87.9	Confident	111 Å²	111	81.3 Å²	81.3	48%	0.483	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	137	168.7	-60.8	-171.7	177.5	179.9	0	108.6	V46 E47 R141 E142	K11-V46 CarbonylContact C-O 3.6Å; K11-V46 WeakPolarHBondContact CA-O 3.48Å; K11-E47 HydrophobicContact CG-CG 4.21Å; K11-R141 WeakPolarHBondContact O-CA 3.28Å; K11-E142 HydrophobicContact CB-CB 3.89Å; K11-E142 WeakPolarHBondContact CB-OE2 3.38Å; K11-E142 PolarHBondContact O-N 3.31Å
12	W	97.8	Very high	90.6	Very high	2 Å²	2	73.7 Å²	73.7	1%	0.008	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	125.2	-169.1	-63.6	97.8	0	0	0	108.5	F8 V46 L118 G122 L124 Y139 E140 R141	F8-W12 PolarHBondContact O-NE1 3.24Å; F8-W12 VanDerWaalsContact O-NE1 3.07Å; W12-V46 HydrophobicContact CB-CB 4.05Å; W12-V46 HydrophobicContact CB-CG1 4.46Å; W12-V46 WeakPolarHBondContact CB-O 3.31Å; W12-V46 PolarHBondContact N-O 2.81Å; W12-V46 PolarHBondContact O-N 2.79Å; W12-L118 HydrophobicContact CH2-CD1 3.31Å; W12-L118 HydrophobicContact CZ2-CD1 3.84Å; W12-L118 HydrophobicContact CZ3-CD1 4.19Å; W12-G122 VanDerWaalsContact CZ3-O 3.32Å; W12-G122 WeakPolarHBondContact CZ3-O 3.26Å; W12-L124 HydrophobicContact CB-CD2 4.43Å; W12-L124 HydrophobicContact CD2-CB 3.87Å; W12-L124 HydrophobicContact CD2-CD2 3.81Å; W12-L124 HydrophobicContact CE3-CB 3.55Å; W12-L124 HydrophobicContact CE3-CD2 4.33Å; W12-L124 HydrophobicContact CG-CD2 3.84Å; W12-L124 HydrophobicContact CH2-CB 3.98Å; W12-L124 HydrophobicContact CZ2-CB 4.23Å; W12-L124 HydrophobicContact CZ3-CB 3.61Å; W12-Y139 HydrophobicContact CB-CD1 4.35Å; W12-Y139 HydrophobicContact CB-CG 4.49Å; W12-E140 WeakPolarHBondContact CA-O 3.5Å; W12-R141 HydrophobicContact CE3-CB 4.22Å; W12-R141 HydrophobicContact CH2-CB 4.3Å; W12-R141 VanDerWaalsContact CZ2-NH2 3.29Å; W12-R141 HydrophobicContact CZ3-CB 3.93Å
13	K	95.2	Very high	92.8	Very high	86 Å²	86	64.6 Å²	64.6	37%	0.374	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	143.1	174	53.7	168.8	158.7	149.5	0	110	K15 Y139 E140	K13-K15 PolarHBondContact O-N 2.75Å; K13-Y139 CarbonylContact O-C 3.59Å; K13-Y139 WeakPolarHBondContact O-CA 3.41Å; K13-Y139 WeakPolarHBondContact O-CB 3.4Å; K13-E140 HydrophobicContact CD-CG 4.03Å; K13-E140 WeakPolarHBondContact CD-OE1 3.25Å; K13-E140 WeakPolarHBondContact CE-OE1 3.45Å; K13-E140 HydrophobicContact CG-CG 3.63Å; K13-E140 WeakPolarHBondContact CG-O 3.48Å; K13-E140 PolarHBondContact N-O 3.45Å; K13-E140 IonicContact NZ-OE1 3.95Å; K13-E140 PolarHBondContact NZ-OE1 3.22Å; K13-E140 PolarHBondContact O-N 3.41Å
14	M	95.3	Very high	94.7	Very high	21 Å²	21	57.4 Å²	57.4	10%	0.103	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	126.8	-180	-176.5	173.9	-76.6	0	0	110.6	S42 P44 R137 Y139	M14-S42 VanDerWaalsContact SD-O 3.35Å; M14-P44 HydrophobicContact CB-CG 4.4Å; M14-P44 HydrophobicContact CE-CG 3.31Å; M14-P44 VanDerWaalsContact SD-CD 3.57Å; M14-P44 HydrophobicContact SD-CG 4.24Å; M14-R137 HydrophobicContact CE-CB 4.3Å; M14-R137 HydrophobicContact CE-CG 4.01Å; M14-Y139 HydrophobicContact CB-CD1 4.1Å; M14-Y139 HydrophobicContact CB-CE1 3.97Å; M14-Y139 HydrophobicContact CE-CE1 3.99Å; M14-Y139 WeakPolarHBondContact CE-OH 3.42Å
15	K	95	Very high	95.6	Very high	117 Å²	117	53.4 Å²	53.4	51%	0.509	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	-43.3	173.7	-175.4	-178	-179.4	-177.3	0	111.3	K13 E123 V138 E140	K13-K15 PolarHBondContact O-N 2.75Å; K15-E123 WeakPolarHBondContact CD-OE1 3.37Å; K15-E123 IonicContact NZ-OE1 2.78Å; K15-E123 PolarHBondContact NZ-OE1 3.44Å; K15-V138 HydrophobicContact CB-CG1 4.48Å; K15-V138 HydrophobicContact CD-CG1 4.34Å; K15-V138 PolarHBondContact N-O 2.97Å; K15-E140 HydrophobicContact CB-CG 4.46Å
16	S	95.6	Very high	95.9	Very high	42 Å²	42	53.3 Å²	53.3	29%	0.294	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	157.3	177.7	66.9	0	0	0	0	112.2	R137 V138	S16-R137 WeakPolarHBondContact O-CA 3.37Å; S16-V138 PolarHBondContact N-O 2.89Å; S16-V138 PolarHBondContact O-N 2.69Å; S16-V138 WeakPolarHBondContact OG-CB 3.46Å; S16-V138 WeakPolarHBondContact OG-CG2 3.29Å
17	S	95.8	Very high	95.9	Very high	49 Å²	49	53 Å²	53	34%	0.343	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	120.4	174.1	177.7	0	0	0	0	109.4	T136 R137	S17-T136 WeakPolarHBondContact CA-O 3.37Å; S17-R137 WeakPolarHBondContact OG-CG 3.45Å; S17-R137 PolarHBondContact OG-NE 2.55Å
18	E	97.2	Very high	95.7	Very high	127 Å²	127	51.7 Å²	51.7	59%	0.593	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.4	-178.9	-63.8	-179.4	-177.8	0	0	110.1	F20 C135 T136	E18-F20 PolarHBondContact O-N 2.85Å; E18-C135 WeakPolarHBondContact O-CA 3.28Å; E18-C135 PolarHBondContact O-SG 2.91Å; E18-T136 PolarHBondContact N-O 2.86Å; E18-T136 PolarHBondContact O-N 2.83Å
19	N	96.6	Very high	95.4	Very high	95 Å²	95	52.9 Å²	52.9	51%	0.508	29%	0.288	S	S	.	.	S	Bend	trans	57.7	16.8	175.7	-82.6	3.7	0	0	0	117.5	E21 E22 L23 V134	N19-E21 VanDerWaalsContact C-N 3.34Å; N19-E21 PolarHBondContact O-N 2.98Å; N19-E22 PolarHBondContact O-N 2.8Å; N19-L23 PolarHBondContact O-N 2.84Å; N19-V134 WeakPolarHBondContact CB-O 3.2Å; N19-V134 PolarHBondContact ND2-O 3.44Å
20	F	95.4	Very high	95.3	Very high	18 Å²	18	55.6 Å²	55.6	8%	0.079	30%	0.3	C	S	.	.	H	α-helix	trans	-61.9	-39.7	179.5	-174.1	-118.6	0	0	0	113	E18 L23 L24 A37 V38 A41 V81 M128 C135 R137	E18-F20 PolarHBondContact O-N 2.85Å; F20-L23 PolarHBondContact O-N 3.16Å; F20-L24 HydrophobicContact CD1-CD1 4.23Å; F20-L24 HydrophobicContact CE1-CD1 3.8Å; F20-L24 HydrophobicContact CE1-CG 4.45Å; F20-L24 HydrophobicContact CE2-CD2 4.49Å; F20-L24 HydrophobicContact CZ-CD1 4.05Å; F20-L24 HydrophobicContact CZ-CD2 4.3Å; F20-L24 HydrophobicContact CZ-CG 4.31Å; F20-L24 WeakPolarHBondContact O-CG 3.26Å; F20-L24 PolarHBondContact O-N 2.9Å; F20-L24 VanDerWaalsContact O-N 3.17Å; F20-A37 HydrophobicContact CE1-CB 4.5Å; F20-V38 HydrophobicContact CD1-CG2 4Å; F20-A41 HydrophobicContact CE1-CB 4.02Å; F20-A41 HydrophobicContact CZ-CB 4.39Å; F20-V81 HydrophobicContact CE2-CG2 3.83Å; F20-V81 HydrophobicContact CZ-CG2 4.18Å; F20-M128 HydrophobicContact CD2-CE 3.98Å; F20-M128 HydrophobicContact CE2-CE 4.12Å; F20-C135 VanDerWaalsContact CA-SG 3.56Å; F20-R137 VanDerWaalsContact CE1-NH2 3.27Å
21	E	95.4	Very high	95.1	Very high	64 Å²	64	58.4 Å²	58.4	30%	0.299	31%	0.313	S	S	.	.	H	α-helix	trans	-65.3	-42.4	176.2	-170.2	171.8	173.6	0	0	112.1	N19 L23 L24 K25 R34 V38	N19-E21 VanDerWaalsContact C-N 3.34Å; N19-E21 PolarHBondContact O-N 2.98Å; E21-L23 VanDerWaalsContact C-N 3.33Å; E21-L23 PolarHBondContact O-N 3.13Å; E21-L24 PolarHBondContact O-N 3.03Å; E21-K25 WeakPolarHBondContact O-CB 3.23Å; E21-K25 PolarHBondContact O-N 3.08Å; E21-R34 HydrophobicContact CG-CB 4.14Å; E21-R34 WeakPolarHBondContact O-CD 3.36Å; E21-R34 IonicContact OE1-NE 2.64Å; E21-R34 IonicContact OE1-NH2 3.57Å; E21-V38 HydrophobicContact CB-CG2 3.8Å; E21-V38 HydrophobicContact CG-CG2 4.23Å
22	E	96.7	Very high	94.9	Very high	78 Å²	78	59.8 Å²	59.8	36%	0.364	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-35.4	179.1	-68.1	-57.3	123.5	0	0	111.6	N19 K25 A26 V133	N19-E22 PolarHBondContact O-N 2.8Å; E22-K25 WeakPolarHBondContact O-CB 3.06Å; E22-K25 PolarHBondContact O-N 3.07Å; E22-K25 IonicContact OE1-NZ 2.82Å; E22-K25 WeakPolarHBondContact OE2-CD 3.48Å; E22-K25 IonicContact OE2-NZ 3.73Å; E22-K25 PolarHBondContact OE2-NZ 2.48Å; E22-A26 PolarHBondContact O-N 2.83Å; E22-V133 HydrophobicContact CB-CG1 4.24Å
23	L	96.1	Very high	94.6	Very high	2 Å²	2	64 Å²	64	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-59.5	-49.4	171.4	-175.6	80.5	0	0	0	111.2	N19 F20 E21 K25 A26 L27 V81 M128 A130 V133 C135	N19-L23 PolarHBondContact O-N 2.84Å; F20-L23 PolarHBondContact O-N 3.16Å; E21-L23 VanDerWaalsContact C-N 3.33Å; E21-L23 PolarHBondContact O-N 3.13Å; L23-K25 VanDerWaalsContact C-N 3.26Å; L23-K25 PolarHBondContact O-N 3.06Å; L23-A26 PolarHBondContact O-N 3.41Å; L23-L27 HydrophobicContact CG-CD1 4.29Å; L23-L27 WeakPolarHBondContact O-CG 3.27Å; L23-L27 PolarHBondContact O-N 2.92Å; L23-L27 VanDerWaalsContact O-N 3.07Å; L23-V81 HydrophobicContact CD2-CG1 4.03Å; L23-M128 HydrophobicContact CD1-CB 4.48Å; L23-M128 HydrophobicContact CD2-CB 3.73Å; L23-M128 HydrophobicContact CD2-CE 4.03Å; L23-M128 HydrophobicContact CD2-SD 4.22Å; L23-A130 HydrophobicContact CD1-CB 3.73Å; L23-V133 HydrophobicContact CB-CG1 4.34Å; L23-V133 HydrophobicContact CD1-CG1 4.45Å; L23-C135 HydrophobicContact CB-CB 3.92Å; L23-C135 HydrophobicContact CD1-CB 4.38Å; L23-C135 HydrophobicContact CD2-CB 3.9Å; L23-C135 HydrophobicContact CG-CB 4.29Å
24	L	94.5	Very high	94.6	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-62.9	-35.3	178.1	-64.4	176.3	0	0	0	111.8	F20 E21 L27 G28 V29 R34 A37 V81	F20-L24 HydrophobicContact CD1-CD1 4.23Å; F20-L24 HydrophobicContact CE1-CD1 3.8Å; F20-L24 HydrophobicContact CE1-CG 4.45Å; F20-L24 HydrophobicContact CE2-CD2 4.49Å; F20-L24 HydrophobicContact CZ-CD1 4.05Å; F20-L24 HydrophobicContact CZ-CD2 4.3Å; F20-L24 HydrophobicContact CZ-CG 4.31Å; F20-L24 WeakPolarHBondContact O-CG 3.26Å; F20-L24 PolarHBondContact O-N 2.9Å; F20-L24 VanDerWaalsContact O-N 3.17Å; E21-L24 PolarHBondContact O-N 3.03Å; L24-L27 PolarHBondContact O-N 3.14Å; L24-G28 PolarHBondContact O-N 2.96Å; L24-V29 HydrophobicContact CB-CB 4.13Å; L24-V29 HydrophobicContact CB-CG2 4.18Å; L24-V29 HydrophobicContact CD2-CG2 4.36Å; L24-V29 VanDerWaalsContact O-CB 3.23Å; L24-V29 WeakPolarHBondContact O-CB 3.26Å; L24-V29 VanDerWaalsContact O-CG2 3.32Å; L24-V29 WeakPolarHBondContact O-CG2 3.26Å; L24-V29 PolarHBondContact O-N 3.01Å; L24-R34 HydrophobicContact CB-CG 3.75Å; L24-R34 HydrophobicContact CD1-CB 4.45Å; L24-R34 HydrophobicContact CD1-CG 4.41Å; L24-A37 HydrophobicContact CD1-CB 3.62Å; L24-V81 HydrophobicContact CD2-CG1 4.18Å; L24-V81 HydrophobicContact CD2-CG2 4.43Å
25	K	95	Very high	94.4	Very high	103 Å²	103	66.9 Å²	66.9	45%	0.448	35%	0.353	S	S	.	.	H	α-helix	trans	-66	-43.4	175.5	178.5	-174.9	165.9	-164.3	0	111.6	E21 E22 L23 L27 G28 R34	E21-K25 WeakPolarHBondContact O-CB 3.23Å; E21-K25 PolarHBondContact O-N 3.08Å; E22-K25 WeakPolarHBondContact O-CB 3.06Å; E22-K25 PolarHBondContact O-N 3.07Å; E22-K25 IonicContact OE1-NZ 2.82Å; E22-K25 WeakPolarHBondContact OE2-CD 3.48Å; E22-K25 IonicContact OE2-NZ 3.73Å; E22-K25 PolarHBondContact OE2-NZ 2.48Å; L23-K25 VanDerWaalsContact C-N 3.26Å; L23-K25 PolarHBondContact O-N 3.06Å; K25-L27 PolarHBondContact O-N 3.39Å; K25-G28 PolarHBondContact O-N 2.94Å; K25-R34 VanDerWaalsContact N-CD 3.31Å
26	A	93.7	Very high	94.3	Very high	33 Å²	33	65.2 Å²	65.2	27%	0.273	35%	0.348	S	S	.	.	H	α-helix	trans	-60.3	-35.4	174.8	0	0	0	0	0	111.8	E22 L23 G28 L110 A130 V133	E22-A26 PolarHBondContact O-N 2.83Å; L23-A26 PolarHBondContact O-N 3.41Å; A26-G28 PolarHBondContact O-N 3.06Å; A26-L110 HydrophobicContact CB-CD1 4.41Å; A26-L110 VanDerWaalsContact O-CD1 3.24Å; A26-L110 WeakPolarHBondContact O-CD1 3.45Å; A26-A130 HydrophobicContact CB-CB 4.38Å; A26-V133 HydrophobicContact CB-CB 4.14Å; A26-V133 HydrophobicContact CB-CG2 3.84Å
27	L	91.8	Very high	94	Very high	17 Å²	17	64.7 Å²	64.7	9%	0.089	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	2.2	174.7	-63.1	168	0	0	0	113.9	L23 L24 K25 V81 D82 T112 A130	L23-L27 HydrophobicContact CG-CD1 4.29Å; L23-L27 WeakPolarHBondContact O-CG 3.27Å; L23-L27 PolarHBondContact O-N 2.92Å; L23-L27 VanDerWaalsContact O-N 3.07Å; L24-L27 PolarHBondContact O-N 3.14Å; K25-L27 PolarHBondContact O-N 3.39Å; L27-V81 HydrophobicContact CD1-CG1 3.31Å; L27-D82 HydrophobicContact CB-CB 4.19Å; L27-D82 HydrophobicContact CD1-CB 4.18Å; L27-T112 HydrophobicContact CD2-CG2 3.65Å; L27-A130 HydrophobicContact CD2-CB 3.67Å; L27-A130 HydrophobicContact CG-CB 3.96Å
28	G	91.3	Very high	93.8	Very high	66 Å²	66	64.8 Å²	64.8	68%	0.68	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	10.3	176.8	0	0	0	0	0	114.9	L24 K25 A26 N30	L24-G28 PolarHBondContact O-N 2.96Å; K25-G28 PolarHBondContact O-N 2.94Å; A26-G28 PolarHBondContact O-N 3.06Å; G28-N30 PolarHBondContact O-N 3.01Å
29	V	92.3	Very high	93.4	Very high	26 Å²	26	61.7 Å²	61.7	16%	0.158	34%	0.341	C	S	.	.			trans	-67.7	129.7	177.1	-176.2	0	0	0	0	109.4	L24 L33 R34 D82	L24-V29 HydrophobicContact CB-CB 4.13Å; L24-V29 HydrophobicContact CB-CG2 4.18Å; L24-V29 HydrophobicContact CD2-CG2 4.36Å; L24-V29 VanDerWaalsContact O-CB 3.23Å; L24-V29 WeakPolarHBondContact O-CB 3.26Å; L24-V29 VanDerWaalsContact O-CG2 3.32Å; L24-V29 WeakPolarHBondContact O-CG2 3.26Å; L24-V29 PolarHBondContact O-N 3.01Å; V29-L33 HydrophobicContact CG1-CB 3.7Å; V29-R34 HydrophobicContact CB-CG 3.77Å; V29-R34 HydrophobicContact CG1-CG 3.63Å; V29-R34 WeakPolarHBondContact O-CD 3.44Å; V29-R34 WeakPolarHBondContact O-CG 3.21Å; V29-R34 PolarHBondContact O-NH1 2.8Å; V29-D82 HydrophobicContact CG2-CB 3.7Å
30	N	95.1	Very high	93	Very high	86 Å²	86	57.7 Å²	57.7	46%	0.46	32%	0.322	S	S	.	.			trans	-67.6	154.4	-179.4	73	70.3	0	0	0	112.6	G28 F32 L33 R34	G28-N30 PolarHBondContact O-N 3.01Å; N30-F32 VanDerWaalsContact C-N 3.27Å; N30-F32 PolarHBondContact O-N 2.82Å; N30-F32 VanDerWaalsContact O-N 3.15Å; N30-F32 PolarHBondContact OD1-N 3.06Å; N30-L33 WeakPolarHBondContact ND2-CD1 3.4Å; N30-L33 WeakPolarHBondContact ND2-CG 3.31Å; N30-L33 PolarHBondContact O-N 2.81Å; N30-L33 VanDerWaalsContact O-N 3.15Å; N30-L33 PolarHBondContact OD1-N 2.78Å; N30-L33 VanDerWaalsContact OD1-N 3.11Å; N30-R34 WeakPolarHBondContact O-CG 3.39Å; N30-R34 PolarHBondContact O-N 2.87Å
31	V	93.7	Very high	92.6	Very high	78 Å²	78	57.3 Å²	57.3	47%	0.473	32%	0.322	S	S	.	.	H	α-helix	trans	-55.3	-37.4	-171.6	64.9	0	0	0	0	114.3	R34 K35	V31-R34 PolarHBondContact O-N 3.04Å; V31-K35 WeakPolarHBondContact O-CG 3.38Å; V31-K35 PolarHBondContact O-N 2.99Å; V31-K35 VanDerWaalsContact O-N 3.17Å
32	F	93.7	Very high	92.1	Very high	141 Å²	141	58.1 Å²	58.1	62%	0.618	33%	0.334	S	S	*	.	H	α-helix	trans	-66.8	-48.4	-179.1	179.9	-101.7	0	0	0	111	N30 R34 K35 I36	N30-F32 VanDerWaalsContact C-N 3.27Å; N30-F32 PolarHBondContact O-N 2.82Å; N30-F32 VanDerWaalsContact O-N 3.15Å; N30-F32 PolarHBondContact OD1-N 3.06Å; F32-R34 VanDerWaalsContact C-N 3.33Å; F32-R34 PolarHBondContact O-N 2.84Å; F32-K35 PolarHBondContact O-N 2.87Å; F32-I36 HydrophobicContact CD1-CD1 3.9Å; F32-I36 HydrophobicContact CE1-CD1 3.4Å; F32-I36 HydrophobicContact CE2-CD1 4.35Å; F32-I36 HydrophobicContact CZ-CD1 3.66Å; F32-I36 PolarHBondContact O-N 2.85Å
33	L	91.7	Very high	91.7	Very high	90 Å²	90	58.3 Å²	58.3	47%	0.471	34%	0.344	S	S	.	.	H	α-helix	trans	-64.6	-36.2	176.9	-67.6	-177.8	0	0	0	112.4	V29 N30 I36 A37	V29-L33 HydrophobicContact CG1-CB 3.7Å; N30-L33 WeakPolarHBondContact ND2-CD1 3.4Å; N30-L33 WeakPolarHBondContact ND2-CG 3.31Å; N30-L33 PolarHBondContact O-N 2.81Å; N30-L33 VanDerWaalsContact O-N 3.15Å; N30-L33 PolarHBondContact OD1-N 2.78Å; N30-L33 VanDerWaalsContact OD1-N 3.11Å; L33-I36 PolarHBondContact O-N 2.87Å; L33-A37 WeakPolarHBondContact O-CB 3.27Å; L33-A37 PolarHBondContact O-N 3.3Å
34	R	94	Very high	91.3	Very high	33 Å²	33	58.3 Å²	58.3	13%	0.125	34%	0.344	C	S	.	.	H	α-helix	trans	-61.4	-46.6	177	-66.6	-164.8	-49.7	-99.7	5.7	112.3	E21 L24 K25 V29 N30 V31 F32 I36 A37 V38	E21-R34 HydrophobicContact CG-CB 4.14Å; E21-R34 WeakPolarHBondContact O-CD 3.36Å; E21-R34 IonicContact OE1-NE 2.64Å; E21-R34 IonicContact OE1-NH2 3.57Å; L24-R34 HydrophobicContact CB-CG 3.75Å; L24-R34 HydrophobicContact CD1-CB 4.45Å; L24-R34 HydrophobicContact CD1-CG 4.41Å; K25-R34 VanDerWaalsContact N-CD 3.31Å; V29-R34 HydrophobicContact CB-CG 3.77Å; V29-R34 HydrophobicContact CG1-CG 3.63Å; V29-R34 WeakPolarHBondContact O-CD 3.44Å; V29-R34 WeakPolarHBondContact O-CG 3.21Å; V29-R34 PolarHBondContact O-NH1 2.8Å; N30-R34 WeakPolarHBondContact O-CG 3.39Å; N30-R34 PolarHBondContact O-N 2.87Å; V31-R34 PolarHBondContact O-N 3.04Å; F32-R34 VanDerWaalsContact C-N 3.33Å; F32-R34 PolarHBondContact O-N 2.84Å; R34-I36 VanDerWaalsContact C-N 3.31Å; R34-I36 PolarHBondContact O-N 3.07Å; R34-A37 PolarHBondContact O-N 3Å; R34-A37 VanDerWaalsContact O-N 3.16Å; R34-V38 VanDerWaalsContact O-CG2 3.29Å; R34-V38 WeakPolarHBondContact O-CG2 3.4Å; R34-V38 PolarHBondContact O-N 2.83Å
35	K	92.7	Very high	91.2	Very high	135 Å²	135	60.1 Å²	60.1	59%	0.587	36%	0.36	S	S	*	.	H	α-helix	trans	-61.5	-40.3	179.1	-71.4	-166.4	176.7	-166.5	0	112.2	V31 F32 A39	V31-K35 WeakPolarHBondContact O-CG 3.38Å; V31-K35 PolarHBondContact O-N 2.99Å; V31-K35 VanDerWaalsContact O-N 3.17Å; F32-K35 PolarHBondContact O-N 2.87Å; K35-A39 WeakPolarHBondContact O-CB 3.48Å; K35-A39 PolarHBondContact O-N 3.39Å
36	I	91.2	Very high	91.3	Very high	81 Å²	81	55.2 Å²	55.2	42%	0.415	34%	0.339	S	S	.	.	H	α-helix	trans	-63.2	-46.1	174.5	-66	171.1	0	0	0	110.6	F32 L33 R34 V38 A39 A40	F32-I36 HydrophobicContact CD1-CD1 3.9Å; F32-I36 HydrophobicContact CE1-CD1 3.4Å; F32-I36 HydrophobicContact CE2-CD1 4.35Å; F32-I36 HydrophobicContact CZ-CD1 3.66Å; F32-I36 PolarHBondContact O-N 2.85Å; L33-I36 PolarHBondContact O-N 2.87Å; R34-I36 VanDerWaalsContact C-N 3.31Å; R34-I36 PolarHBondContact O-N 3.07Å; I36-V38 PolarHBondContact O-N 3.23Å; I36-A39 PolarHBondContact O-N 2.57Å; I36-A40 VanDerWaalsContact O-CB 3.28Å; I36-A40 WeakPolarHBondContact O-CB 3.03Å; I36-A40 PolarHBondContact O-N 3.33Å
37	A	89.9	Confident	91.5	Very high	32 Å²	32	56.7 Å²	56.7	26%	0.264	34%	0.34	S	S	.	.	H	α-helix	trans	-63.2	-42	180	0	0	0	0	0	112.5	F20 L24 L33 R34 A40 A41	F20-A37 HydrophobicContact CE1-CB 4.5Å; L24-A37 HydrophobicContact CD1-CB 3.62Å; L33-A37 WeakPolarHBondContact O-CB 3.27Å; L33-A37 PolarHBondContact O-N 3.3Å; R34-A37 PolarHBondContact O-N 3Å; R34-A37 VanDerWaalsContact O-N 3.16Å; A37-A40 PolarHBondContact O-N 2.96Å; A37-A41 VanDerWaalsContact O-CB 3.24Å; A37-A41 WeakPolarHBondContact O-CB 3.08Å; A37-A41 PolarHBondContact O-N 2.65Å
38	V	91.3	Very high	91.8	Very high	51 Å²	51	56.1 Å²	56.1	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-61.2	-47.5	175.3	171.2	0	0	0	0	110.6	F20 E21 R34 I36 A41 S42	F20-V38 HydrophobicContact CD1-CG2 4Å; E21-V38 HydrophobicContact CB-CG2 3.8Å; E21-V38 HydrophobicContact CG-CG2 4.23Å; R34-V38 VanDerWaalsContact O-CG2 3.29Å; R34-V38 WeakPolarHBondContact O-CG2 3.4Å; R34-V38 PolarHBondContact O-N 2.83Å; I36-V38 PolarHBondContact O-N 3.23Å; V38-A41 CarbonylContact O-C 3.51Å; V38-A41 PolarHBondContact O-N 3.4Å; V38-S42 PolarHBondContact O-N 2.83Å; V38-S42 VanDerWaalsContact O-N 3.08Å
39	A	90.4	Very high	92.1	Very high	62 Å²	62	56.8 Å²	56.8	51%	0.512	33%	0.328	S	S	.	.	H	α-helix	trans	-63.4	-44.1	178.3	0	0	0	0	0	112	K35 I36 S42	K35-A39 WeakPolarHBondContact O-CB 3.48Å; K35-A39 PolarHBondContact O-N 3.39Å; I36-A39 PolarHBondContact O-N 2.57Å; A39-S42 WeakPolarHBondContact O-CB 3.36Å; A39-S42 PolarHBondContact O-N 2.82Å; A39-S42 PolarHBondContact O-OG 2.84Å
40	A	87.6	Confident	92.4	Very high	11 Å²	11	56.9 Å²	56.9	9%	0.091	33%	0.327	C	S	.	.	H	α-helix	trans	-66.1	-39.4	-179.9	0	0	0	0	0	112.5	I36 A37 T61 S62 V63	I36-A40 VanDerWaalsContact O-CB 3.28Å; I36-A40 WeakPolarHBondContact O-CB 3.03Å; I36-A40 PolarHBondContact O-N 3.33Å; A37-A40 PolarHBondContact O-N 2.96Å; A40-T61 WeakPolarHBondContact O-CB 3.47Å; A40-S62 WeakPolarHBondContact CA-OG 3.43Å; A40-S62 PolarHBondContact O-N 3.03Å; A40-S62 PolarHBondContact O-OG 3.16Å; A40-V63 HydrophobicContact CB-CB 4.05Å; A40-V63 HydrophobicContact CB-CG2 3.53Å
41	A	85.9	Confident	92.5	Very high	10 Å²	10	60.4 Å²	60.4	8%	0.083	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	25.9	-178.1	0	0	0	0	0	113	F20 A37 V38 P44 T61 R137	F20-A41 HydrophobicContact CE1-CB 4.02Å; F20-A41 HydrophobicContact CZ-CB 4.39Å; A37-A41 VanDerWaalsContact O-CB 3.24Å; A37-A41 WeakPolarHBondContact O-CB 3.08Å; A37-A41 PolarHBondContact O-N 2.65Å; V38-A41 CarbonylContact O-C 3.51Å; V38-A41 PolarHBondContact O-N 3.4Å; A41-P44 WeakPolarHBondContact O-CD 3.26Å; A41-T61 HydrophobicContact CB-CG2 4.21Å; A41-R137 PolarHBondContact O-NH2 3.16Å
42	S	86.8	Confident	92.5	Very high	80 Å²	80	59.1 Å²	59.1	56%	0.559	34%	0.343	S	S	*	.	S	Bend	trans	-72.8	-32.6	178.5	55.4	0	0	0	0	113.2	M14 V38 A39	M14-S42 VanDerWaalsContact SD-O 3.35Å; V38-S42 PolarHBondContact O-N 2.83Å; V38-S42 VanDerWaalsContact O-N 3.08Å; A39-S42 WeakPolarHBondContact O-CB 3.36Å; A39-S42 PolarHBondContact O-N 2.82Å; A39-S42 PolarHBondContact O-OG 2.84Å
43	S	87	Confident	92.6	Very high	83 Å²	83	56.1 Å²	56.1	58%	0.58	33%	0.331	S	S	*	.	S	Bend	trans	-145.6	70.1	175.5	-169.5	0	0	0	0	110.9
44	P	88.8	Confident	92.9	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	33%	0.326	C	S	.	.			trans	-73.1	138.8	176.1	30.2	-32.4	0	0	0	110.6	M14 A41 T59 S60 T61 Y139	M14-P44 HydrophobicContact CB-CG 4.4Å; M14-P44 HydrophobicContact CE-CG 3.31Å; M14-P44 VanDerWaalsContact SD-CD 3.57Å; M14-P44 HydrophobicContact SD-CG 4.24Å; A41-P44 WeakPolarHBondContact O-CD 3.26Å; P44-T59 HydrophobicContact CB-CG2 4.1Å; P44-S60 CarbonylContact C-O 3.54Å; P44-S60 WeakPolarHBondContact CA-O 3.38Å; P44-T61 HydrophobicContact CB-CG2 4Å; P44-Y139 HydrophobicContact CG-CE1 4.2Å
45	A	91.4	Very high	93.1	Very high	43 Å²	43	53.2 Å²	53.2	36%	0.355	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	127.8	165.2	0	0	0	0	0	109.1	S60	A45-S60 PolarHBondContact N-O 3.07Å; A45-S60 PolarHBondContact O-N 2.97Å
46	V	97	Very high	93.3	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.006	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.2	179.3	174.1	0	0	0	0	108.9	K11 W12 I48 I57 K58 T59 Y139	K11-V46 CarbonylContact C-O 3.6Å; K11-V46 WeakPolarHBondContact CA-O 3.48Å; W12-V46 HydrophobicContact CB-CB 4.05Å; W12-V46 HydrophobicContact CB-CG1 4.46Å; W12-V46 WeakPolarHBondContact CB-O 3.31Å; W12-V46 PolarHBondContact N-O 2.81Å; W12-V46 PolarHBondContact O-N 2.79Å; V46-I48 HydrophobicContact CG1-CD1 4.32Å; V46-I48 HydrophobicContact CG1-CG1 3.96Å; V46-I57 HydrophobicContact CG1-CG2 4.07Å; V46-K58 CarbonylContact C-O 3.53Å; V46-K58 WeakPolarHBondContact CA-O 3.09Å; V46-T59 HydrophobicContact CG2-CG2 4.1Å; V46-Y139 HydrophobicContact CB-CE1 4.42Å; V46-Y139 HydrophobicContact CG2-CD1 4.26Å; V46-Y139 HydrophobicContact CG2-CE1 3.64Å
47	E	98.1	Very high	93.6	Very high	64 Å²	64	45.3 Å²	45.3	30%	0.299	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	126	174	-52.3	178.6	-122.5	0	0	108	K11 I57 K58	K11-E47 HydrophobicContact CG-CG 4.21Å; E47-I57 WeakPolarHBondContact O-CA 3.46Å; E47-K58 HydrophobicContact CB-CB 4.28Å; E47-K58 PolarHBondContact N-O 2.91Å; E47-K58 PolarHBondContact O-N 3.25Å; E47-K58 IonicContact OE1-NZ 3.72Å; E47-K58 PolarHBondContact OE1-NZ 2.83Å
48	I	98.3	Very high	93.9	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.026	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	132.9	178	-56.6	177.8	0	0	0	108.2	F8 S9 G10 V46 F55 S56 I57 L124	F8-I48 HydrophobicContact CB-CD1 4.46Å; F8-I48 HydrophobicContact CB-CG2 4.08Å; S9-I48 CarbonylContact C-O 3.52Å; S9-I48 VanDerWaalsContact CA-O 3.26Å; S9-I48 WeakPolarHBondContact CA-O 3.42Å; G10-I48 PolarHBondContact N-O 3.08Å; G10-I48 PolarHBondContact O-N 3.14Å; V46-I48 HydrophobicContact CG1-CD1 4.32Å; V46-I48 HydrophobicContact CG1-CG1 3.96Å; I48-F55 HydrophobicContact CG2-CD1 4.06Å; I48-S56 WeakPolarHBondContact CA-O 3.35Å; I48-I57 HydrophobicContact CG1-CG1 4.33Å; I48-I57 HydrophobicContact CG1-CG2 4.32Å; I48-I57 HydrophobicContact CG2-CG1 4.48Å; I48-L124 HydrophobicContact CD1-CD2 3.62Å
49	T	98.1	Very high	94	Very high	80 Å²	80	46.3 Å²	46.3	49%	0.491	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	132.1	163.8	62.6	0	0	0	0	108.8	F55 S56	T49-F55 WeakPolarHBondContact O-CA 3.35Å; T49-S56 PolarHBondContact N-O 2.53Å; T49-S56 PolarHBondContact O-N 2.84Å; T49-S56 WeakPolarHBondContact OG1-CB 3.4Å
50	Q	97.6	Very high	94.1	Very high	27 Å²	27	44.6 Å²	44.6	13%	0.126	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.3	-179.9	-177.3	-178.4	-18.2	0	0	110.5	T6 S9 G52 T54 F55	T6-Q50 PolarHBondContact O-NE2 3.36Å; T6-Q50 VanDerWaalsContact O-NE2 3.13Å; T6-Q50 PolarHBondContact O-OE1 2.82Å; S9-Q50 WeakPolarHBondContact OG-CB 3.33Å; S9-Q50 PolarHBondContact OG-N 2.89Å; Q50-G52 WeakPolarHBondContact CG-O 3.31Å; Q50-G52 PolarHBondContact NE2-O 3.39Å; Q50-G52 VanDerWaalsContact NE2-O 3.07Å; Q50-T54 CarbonylContact C-O 3.44Å; Q50-T54 WeakPolarHBondContact CA-O 3.26Å; Q50-F55 HydrophobicContact CB-CD1 4.25Å; Q50-F55 HydrophobicContact CB-CE1 4.09Å; Q50-F55 HydrophobicContact CB-CZ 4.47Å; Q50-F55 HydrophobicContact CG-CD1 4.22Å; Q50-F55 HydrophobicContact CG-CD2 4.49Å; Q50-F55 HydrophobicContact CG-CE1 3.76Å; Q50-F55 HydrophobicContact CG-CE2 4.04Å; Q50-F55 HydrophobicContact CG-CZ 3.64Å; Q50-F55 VanDerWaalsContact OE1-CE1 3.3Å
51	E	96.8	Very high	94.1	Very high	161 Å²	161	45.8 Å²	45.8	75%	0.752	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	90.9	174.5	-68.6	-179.2	-168.6	0	0	108.4	E53 T54	E51-E53 PolarHBondContact O-N 3.03Å; E51-E53 VanDerWaalsContact O-N 3.08Å; E51-T54 PolarHBondContact N-O 3.31Å; E51-T54 PolarHBondContact O-N 2.83Å
52	G	94.3	Very high	94.1	Very high	51 Å²	51	50.1 Å²	50.1	53%	0.526	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	-110	-171.2	0	0	0	0	0	111.3	Q50	Q50-G52 WeakPolarHBondContact CG-O 3.31Å; Q50-G52 PolarHBondContact NE2-O 3.39Å; Q50-G52 VanDerWaalsContact NE2-O 3.07Å
53	E	96	Very high	93.8	Very high	78 Å²	78	51.5 Å²	51.5	36%	0.364	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-8.2	179.9	-61.6	-59.9	158.1	0	0	113.7	E51 F55 T71 V72 W92	E51-E53 PolarHBondContact O-N 3.03Å; E51-E53 VanDerWaalsContact O-N 3.08Å; E53-F55 WeakPolarHBondContact O-CD2 3.42Å; E53-T71 HydrophobicContact CB-CG2 4Å; E53-T71 WeakPolarHBondContact O-CA 3.49Å; E53-V72 PolarHBondContact O-N 3.12Å; E53-W92 PolarHBondContact OE2-NE1 2.85Å
54	T	97.2	Very high	93.5	Very high	59 Å²	59	55.9 Å²	55.9	36%	0.362	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.8	-176.3	-60.5	0	0	0	0	110.4	Q50 E51 F70 T71	Q50-T54 CarbonylContact C-O 3.44Å; Q50-T54 WeakPolarHBondContact CA-O 3.26Å; E51-T54 PolarHBondContact N-O 3.31Å; E51-T54 PolarHBondContact O-N 2.83Å; T54-F70 CarbonylContact C-O 3.56Å; T54-F70 WeakPolarHBondContact CA-O 3.33Å; T54-T71 PolarHBondContact OG1-OG1 3.23Å
55	F	98.2	Very high	93.5	Very high	3 Å²	3	59.3 Å²	59.3	1%	0.013	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.8	179.6	-70.5	-103.3	0	0	0	109.6	F8 I48 T49 Q50 E53 I57 S69 F70 V72 W92 I98	F8-F55 HydrophobicContact CB-CE1 3.94Å; F8-F55 HydrophobicContact CD2-CE1 4.02Å; F8-F55 HydrophobicContact CD2-CZ 4.3Å; F8-F55 HydrophobicContact CG-CE1 4.03Å; I48-F55 HydrophobicContact CG2-CD1 4.06Å; T49-F55 WeakPolarHBondContact O-CA 3.35Å; Q50-F55 HydrophobicContact CB-CD1 4.25Å; Q50-F55 HydrophobicContact CB-CE1 4.09Å; Q50-F55 HydrophobicContact CB-CZ 4.47Å; Q50-F55 HydrophobicContact CG-CD1 4.22Å; Q50-F55 HydrophobicContact CG-CD2 4.49Å; Q50-F55 HydrophobicContact CG-CE1 3.76Å; Q50-F55 HydrophobicContact CG-CE2 4.04Å; Q50-F55 HydrophobicContact CG-CZ 3.64Å; Q50-F55 VanDerWaalsContact OE1-CE1 3.3Å; E53-F55 WeakPolarHBondContact O-CD2 3.42Å; F55-I57 HydrophobicContact CB-CG1 4.47Å; F55-S69 CarbonylContact O-C 3.49Å; F55-S69 WeakPolarHBondContact O-CA 3.35Å; F55-F70 HydrophobicContact CB-CD1 4.29Å; F55-F70 HydrophobicContact CB-CD2 4.28Å; F55-F70 HydrophobicContact CB-CE1 3.84Å; F55-F70 HydrophobicContact CB-CE2 3.83Å; F55-F70 HydrophobicContact CB-CG 4.5Å; F55-F70 HydrophobicContact CB-CZ 3.58Å; F55-F70 HydrophobicContact CD1-CZ 4.4Å; F55-F70 HydrophobicContact CD2-CD2 4.36Å; F55-F70 AromaticContact CD2-CE2 3.67Å; F55-F70 HydrophobicContact CD2-CE2 3.67Å; F55-F70 HydrophobicContact CD2-CZ 4.07Å; F55-F70 HydrophobicContact CE2-CE2 4.5Å; F55-F70 HydrophobicContact CG-CE1 4.5Å; F55-F70 AromaticContact CG-CE2 3.85Å; F55-F70 HydrophobicContact CG-CE2 3.85Å; F55-F70 AromaticContact CG-CZ 3.76Å; F55-F70 HydrophobicContact CG-CZ 3.76Å; F55-F70 PolarHBondContact N-O 3.05Å; F55-F70 PolarHBondContact O-N 3.32Å; F55-V72 HydrophobicContact CD2-CG2 4.01Å; F55-V72 HydrophobicContact CE2-CG2 3.69Å; F55-W92 HydrophobicContact CE2-CH2 4.35Å; F55-W92 AromaticContact CE2-CZ2 3.92Å; F55-W92 HydrophobicContact CE2-CZ2 3.92Å; F55-W92 AromaticContact CZ-CH2 3.75Å; F55-W92 HydrophobicContact CZ-CH2 3.75Å; F55-W92 AromaticContact CZ-CZ2 3.75Å; F55-W92 HydrophobicContact CZ-CZ2 3.75Å; F55-I98 HydrophobicContact CD2-CD1 4.4Å; F55-I98 HydrophobicContact CE1-CD1 3.99Å; F55-I98 HydrophobicContact CE2-CD1 3.79Å; F55-I98 HydrophobicContact CZ-CD1 3.55Å
56	S	97.8	Very high	93.4	Very high	41 Å²	41	60.2 Å²	60.2	29%	0.287	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	125.5	161.7	-162.9	0	0	0	0	108.7	I48 T49 S69	I48-S56 WeakPolarHBondContact CA-O 3.35Å; T49-S56 PolarHBondContact N-O 2.53Å; T49-S56 PolarHBondContact O-N 2.84Å; T49-S56 WeakPolarHBondContact OG1-CB 3.4Å; S56-S69 PolarHBondContact OG-OG 3.27Å; S56-S69 VanDerWaalsContact OG-OG 3.09Å
57	I	96.9	Very high	93.2	Very high	8 Å²	8	65.4 Å²	65.4	4%	0.041	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	116	-174.4	-52.5	-172.3	0	0	0	108.3	V46 E47 I48 F55 N67 V68 F70	V46-I57 HydrophobicContact CG1-CG2 4.07Å; E47-I57 WeakPolarHBondContact O-CA 3.46Å; I48-I57 HydrophobicContact CG1-CG1 4.33Å; I48-I57 HydrophobicContact CG1-CG2 4.32Å; I48-I57 HydrophobicContact CG2-CG1 4.48Å; F55-I57 HydrophobicContact CB-CG1 4.47Å; I57-N67 WeakPolarHBondContact O-CA 3.44Å; I57-V68 PolarHBondContact N-O 3.09Å; I57-V68 PolarHBondContact O-N 2.92Å; I57-F70 HydrophobicContact CD1-CE1 3.69Å; I57-F70 HydrophobicContact CD1-CZ 4.21Å; I57-F70 HydrophobicContact CG1-CE1 4.31Å
58	K	96.3	Very high	93	Very high	73 Å²	73	64.4 Å²	64.4	32%	0.317	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.9	172.1	175.6	177.3	169.7	-143.2	0	108.9	V46 E47 T65 T66 N67	V46-K58 CarbonylContact C-O 3.53Å; V46-K58 WeakPolarHBondContact CA-O 3.09Å; E47-K58 HydrophobicContact CB-CB 4.28Å; E47-K58 PolarHBondContact N-O 2.91Å; E47-K58 PolarHBondContact O-N 3.25Å; E47-K58 IonicContact OE1-NZ 3.72Å; E47-K58 PolarHBondContact OE1-NZ 2.83Å; K58-T65 HydrophobicContact CD-CG2 4.44Å; K58-T65 HydrophobicContact CG-CG2 3.95Å; K58-T66 CarbonylContact C-O 3.6Å; K58-T66 WeakPolarHBondContact CA-O 3.05Å; K58-N67 WeakPolarHBondContact CB-OD1 3.17Å; K58-N67 VanDerWaalsContact CG-OD1 3.26Å; K58-N67 WeakPolarHBondContact CG-OD1 3.45Å
59	T	93.2	Very high	92.9	Very high	31 Å²	31	67.7 Å²	67.7	19%	0.19	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.1	175.5	-55.8	0	0	0	0	109	P44 V46 T65 T66	P44-T59 HydrophobicContact CB-CG2 4.1Å; V46-T59 HydrophobicContact CG2-CG2 4.1Å; T59-T65 CarbonylContact O-C 3.57Å; T59-T65 WeakPolarHBondContact O-CA 3.45Å; T59-T66 PolarHBondContact N-O 2.93Å; T59-T66 PolarHBondContact O-N 2.91Å; T59-T66 PolarHBondContact O-OG1 2.78Å
60	S	92.3	Very high	92.8	Very high	26 Å²	26	64.2 Å²	64.2	18%	0.182	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.9	179.9	-51.5	0	0	0	0	109.8	P44 A45	P44-S60 CarbonylContact C-O 3.54Å; P44-S60 WeakPolarHBondContact CA-O 3.38Å; A45-S60 PolarHBondContact N-O 3.07Å; A45-S60 PolarHBondContact O-N 2.97Å
61	T	88.4	Confident	92.9	Very high	37 Å²	37	64.5 Å²	64.5	23%	0.227	37%	0.367	C	S	.	.			trans	-111.5	174.7	173.6	63.6	0	0	0	0	109.3	A40 A41 P44 V63 R64	A40-T61 WeakPolarHBondContact O-CB 3.47Å; A41-T61 HydrophobicContact CB-CG2 4.21Å; P44-T61 HydrophobicContact CB-CG2 4Å; T61-V63 PolarHBondContact O-N 2.74Å; T61-V63 VanDerWaalsContact O-N 3.16Å; T61-V63 PolarHBondContact OG1-N 3.39Å; T61-R64 PolarHBondContact N-O 2.9Å; T61-R64 PolarHBondContact OG1-N 3.41Å; T61-R64 PolarHBondContact OG1-O 2.96Å
62	S	84.9	Confident	92.9	Very high	101 Å²	101	57.6 Å²	57.6	71%	0.706	34%	0.336	S	S	*	.	S	Bend	trans	-64.9	-16.9	176.2	58.5	0	0	0	0	114.1	A40	A40-S62 WeakPolarHBondContact CA-OG 3.43Å; A40-S62 PolarHBondContact O-N 3.03Å; A40-S62 PolarHBondContact O-OG 3.16Å
63	V	80.8	Confident	93	Very high	108 Å²	108	57.3 Å²	57.3	66%	0.655	33%	0.333	S	S	*	.	S	Bend	trans	-113.5	-31.4	-174.6	179.9	0	0	0	0	112.7	A40 T61	A40-V63 HydrophobicContact CB-CB 4.05Å; A40-V63 HydrophobicContact CB-CG2 3.53Å; T61-V63 PolarHBondContact O-N 2.74Å; T61-V63 VanDerWaalsContact O-N 3.16Å; T61-V63 PolarHBondContact OG1-N 3.39Å
64	R	81.3	Confident	93.1	Very high	176 Å²	176	59.2 Å²	59.2	66%	0.664	34%	0.342	S	S	*	.			trans	-149.6	142.4	-172.2	-175.6	-179.8	-69.5	-169.7	-1.6	111.8	T61 T66	T61-R64 PolarHBondContact N-O 2.9Å; T61-R64 PolarHBondContact OG1-N 3.41Å; T61-R64 PolarHBondContact OG1-O 2.96Å; R64-T66 HydrophobicContact CG-CG2 4Å
65	T	89.2	Confident	93.1	Very high	73 Å²	73	60.3 Å²	60.3	45%	0.448	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	135.5	163.1	-58.8	0	0	0	0	109.7	K58 T59	K58-T65 HydrophobicContact CD-CG2 4.44Å; K58-T65 HydrophobicContact CG-CG2 3.95Å; T59-T65 CarbonylContact O-C 3.57Å; T59-T65 WeakPolarHBondContact O-CA 3.45Å
66	T	89.3	Confident	92.9	Very high	62 Å²	62	61.5 Å²	61.5	38%	0.38	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.5	176.3	56.6	0	0	0	0	109.5	K58 T59 R64	K58-T66 CarbonylContact C-O 3.6Å; K58-T66 WeakPolarHBondContact CA-O 3.05Å; T59-T66 PolarHBondContact N-O 2.93Å; T59-T66 PolarHBondContact O-N 2.91Å; T59-T66 PolarHBondContact O-OG1 2.78Å; R64-T66 HydrophobicContact CG-CG2 4Å
67	N	92.4	Very high	92.7	Very high	109 Å²	109	66 Å²	66	58%	0.583	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.7	174.3	-58.2	-72	0	0	0	107.8	I57 K58	I57-N67 WeakPolarHBondContact O-CA 3.44Å; K58-N67 WeakPolarHBondContact CB-OD1 3.17Å; K58-N67 VanDerWaalsContact CG-OD1 3.26Å; K58-N67 WeakPolarHBondContact CG-OD1 3.45Å
68	V	93.8	Very high	92.4	Very high	44 Å²	44	67.2 Å²	67.2	27%	0.267	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.7	174.7	176.7	0	0	0	0	107.7	I57 F70 F76	I57-V68 PolarHBondContact N-O 3.09Å; I57-V68 PolarHBondContact O-N 2.92Å; V68-F70 HydrophobicContact CG1-CD1 4.29Å; V68-F76 HydrophobicContact CG1-CD2 4.46Å; V68-F76 HydrophobicContact CG1-CE2 3.63Å; V68-F76 HydrophobicContact CG1-CZ 4.37Å
69	S	96.1	Very high	92	Very high	73 Å²	73	66.1 Å²	66.1	51%	0.51	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.1	173.4	-52.7	0	0	0	0	109.3	F55 S56	F55-S69 CarbonylContact O-C 3.49Å; F55-S69 WeakPolarHBondContact O-CA 3.35Å; S56-S69 PolarHBondContact OG-OG 3.27Å; S56-S69 VanDerWaalsContact OG-OG 3.09Å
70	F	97.3	Very high	91.5	Very high	7 Å²	7	65 Å²	65	3%	0.031	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	159.3	179.9	64.6	-95.9	0	0	0	110.7	T54 F55 I57 V68 V72 F76 P90 I98 W114	T54-F70 CarbonylContact C-O 3.56Å; T54-F70 WeakPolarHBondContact CA-O 3.33Å; F55-F70 HydrophobicContact CB-CD1 4.29Å; F55-F70 HydrophobicContact CB-CD2 4.28Å; F55-F70 HydrophobicContact CB-CE1 3.84Å; F55-F70 HydrophobicContact CB-CE2 3.83Å; F55-F70 HydrophobicContact CB-CG 4.5Å; F55-F70 HydrophobicContact CB-CZ 3.58Å; F55-F70 HydrophobicContact CD1-CZ 4.4Å; F55-F70 HydrophobicContact CD2-CD2 4.36Å; F55-F70 AromaticContact CD2-CE2 3.67Å; F55-F70 HydrophobicContact CD2-CE2 3.67Å; F55-F70 HydrophobicContact CD2-CZ 4.07Å; F55-F70 HydrophobicContact CE2-CE2 4.5Å; F55-F70 HydrophobicContact CG-CE1 4.5Å; F55-F70 AromaticContact CG-CE2 3.85Å; F55-F70 HydrophobicContact CG-CE2 3.85Å; F55-F70 AromaticContact CG-CZ 3.76Å; F55-F70 HydrophobicContact CG-CZ 3.76Å; F55-F70 PolarHBondContact N-O 3.05Å; F55-F70 PolarHBondContact O-N 3.32Å; I57-F70 HydrophobicContact CD1-CE1 3.69Å; I57-F70 HydrophobicContact CD1-CZ 4.21Å; I57-F70 HydrophobicContact CG1-CE1 4.31Å; V68-F70 HydrophobicContact CG1-CD1 4.29Å; F70-V72 HydrophobicContact CD2-CG2 4.44Å; F70-V72 HydrophobicContact CE2-CG2 4.01Å; F70-F76 HydrophobicContact CB-CD1 3.6Å; F70-F76 HydrophobicContact CB-CD2 3.99Å; F70-F76 HydrophobicContact CB-CE1 3.58Å; F70-F76 HydrophobicContact CB-CE2 3.96Å; F70-F76 HydrophobicContact CB-CG 3.82Å; F70-F76 HydrophobicContact CB-CZ 3.78Å; F70-F76 HydrophobicContact CD1-CZ 4.15Å; F70-F76 HydrophobicContact CG-CE1 4.1Å; F70-F76 HydrophobicContact CG-CZ 4.15Å; F70-P90 HydrophobicContact CB-CG 4.33Å; F70-P90 HydrophobicContact CD2-CB 3.92Å; F70-P90 HydrophobicContact CD2-CG 3.51Å; F70-P90 HydrophobicContact CE2-CB 4.01Å; F70-P90 HydrophobicContact CE2-CG 4.13Å; F70-P90 HydrophobicContact CG-CG 4.15Å; F70-I98 HydrophobicContact CE2-CD1 4.48Å; F70-W114 AromaticContact CE1-CH2 3.98Å; F70-W114 HydrophobicContact CE1-CH2 3.98Å; F70-W114 HydrophobicContact CE1-CZ2 4.32Å; F70-W114 HydrophobicContact CE2-CH2 4.33Å; F70-W114 AromaticContact CZ-CH2 3.76Å; F70-W114 HydrophobicContact CZ-CH2 3.76Å
71	T	97.8	Very high	91.1	Very high	34 Å²	34	66.9 Å²	66.9	21%	0.209	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.9	171.5	-57.9	0	0	0	0	108.4	E53 T54 G73 Q74	E53-T71 HydrophobicContact CB-CG2 4Å; E53-T71 WeakPolarHBondContact O-CA 3.49Å; T54-T71 PolarHBondContact OG1-OG1 3.23Å; T71-G73 PolarHBondContact O-N 2.83Å; T71-Q74 HydrophobicContact CG2-CG 4.3Å; T71-Q74 PolarHBondContact O-N 3.36Å
72	V	97.5	Very high	90.9	Very high	16 Å²	16	67.2 Å²	67.2	10%	0.097	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	134.2	179.2	-175.2	0	0	0	0	109.8	E53 F55 F70 W92 I98	E53-V72 PolarHBondContact O-N 3.12Å; F55-V72 HydrophobicContact CD2-CG2 4.01Å; F55-V72 HydrophobicContact CE2-CG2 3.69Å; F70-V72 HydrophobicContact CD2-CG2 4.44Å; F70-V72 HydrophobicContact CE2-CG2 4.01Å; V72-W92 VanDerWaalsContact CG1-CD1 3.43Å; V72-W92 HydrophobicContact CG1-CD2 4.47Å; V72-W92 HydrophobicContact CG1-CG 3.97Å; V72-W92 HydrophobicContact CG2-CZ2 4.33Å; V72-I98 HydrophobicContact CG2-CD1 3.98Å
73	G	97.3	Very high	90.9	Very high	44 Å²	44	64.8 Å²	64.8	45%	0.454	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	2.2	-173.5	0	0	0	0	0	115.2	T71 F89 P90	T71-G73 PolarHBondContact O-N 2.83Å; G73-F89 WeakPolarHBondContact O-CE2 3.13Å; G73-F89 WeakPolarHBondContact O-CZ 3.49Å; G73-P90 PolarHBondContact N-O 3.13Å
74	Q	97.7	Very high	91.2	Very high	118 Å²	118	63.4 Å²	63.4	55%	0.551	37%	0.366	S	S	*	.	S	Bend	trans	-123.1	138.4	177.2	-59.2	-173.6	8.8	0	0	112.1	T71 P90	T71-Q74 HydrophobicContact CG2-CG 4.3Å; T71-Q74 PolarHBondContact O-N 3.36Å; Q74-P90 WeakPolarHBondContact O-CD 3.46Å
75	S	96.5	Very high	91.7	Very high	83 Å²	83	59.4 Å²	59.4	58%	0.58	36%	0.363	S	S	*	.			trans	-66.9	142.2	172	-68.2	0	0	0	0	111.3	S88 F89	S75-S88 VanDerWaalsContact CA-O 3.27Å; S75-S88 WeakPolarHBondContact CA-O 3.28Å; S75-F89 WeakPolarHBondContact OG-CD2 3.48Å
76	F	95.2	Very high	91.8	Very high	28 Å²	28	56.1 Å²	56.1	12%	0.123	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	162.3	172	71.9	-72.2	0	0	0	110.7	V68 F70 E78 T87 S88 P90	V68-F76 HydrophobicContact CG1-CD2 4.46Å; V68-F76 HydrophobicContact CG1-CE2 3.63Å; V68-F76 HydrophobicContact CG1-CZ 4.37Å; F70-F76 HydrophobicContact CB-CD1 3.6Å; F70-F76 HydrophobicContact CB-CD2 3.99Å; F70-F76 HydrophobicContact CB-CE1 3.58Å; F70-F76 HydrophobicContact CB-CE2 3.96Å; F70-F76 HydrophobicContact CB-CG 3.82Å; F70-F76 HydrophobicContact CB-CZ 3.78Å; F70-F76 HydrophobicContact CD1-CZ 4.15Å; F70-F76 HydrophobicContact CG-CE1 4.1Å; F70-F76 HydrophobicContact CG-CZ 4.15Å; F76-E78 HydrophobicContact CD2-CB 4.17Å; F76-E78 HydrophobicContact CE2-CB 3.66Å; F76-E78 HydrophobicContact CE2-CG 3.86Å; F76-E78 HydrophobicContact CZ-CB 4.48Å; F76-E78 HydrophobicContact CZ-CG 4.2Å; F76-T87 CarbonylContact O-C 3.58Å; F76-T87 WeakPolarHBondContact O-CA 3.32Å; F76-S88 WeakPolarHBondContact CD1-O 3.4Å; F76-S88 PolarHBondContact N-O 3.14Å; F76-S88 PolarHBondContact O-N 3.3Å; F76-P90 HydrophobicContact CD1-CG 4.27Å; F76-P90 HydrophobicContact CE1-CG 3.93Å
77	N	92.9	Very high	91.9	Very high	134 Å²	134	55.6 Å²	55.6	72%	0.717	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.6	175.2	-67.1	-36.2	0	0	0	109.8	C86 T87	N77-C86 WeakPolarHBondContact CA-O 3.43Å; N77-T87 PolarHBondContact OD1-OG1 2.53Å; N77-T87 VanDerWaalsContact OD1-OG1 3.07Å
78	E	90.5	Very high	92.1	Very high	34 Å²	34	50.4 Å²	50.4	16%	0.159	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	-164.5	173.9	68	174.5	160.7	0	0	110.5	F76 P85 C86 S88 Q102 W114	F76-E78 HydrophobicContact CD2-CB 4.17Å; F76-E78 HydrophobicContact CE2-CB 3.66Å; F76-E78 HydrophobicContact CE2-CG 3.86Å; F76-E78 HydrophobicContact CZ-CB 4.48Å; F76-E78 HydrophobicContact CZ-CG 4.2Å; E78-P85 WeakPolarHBondContact O-CA 3.41Å; E78-C86 VanDerWaalsContact CG-SG 3.53Å; E78-C86 PolarHBondContact N-O 2.68Å; E78-C86 PolarHBondContact O-N 2.9Å; E78-S88 VanDerWaalsContact CD-OG 3.31Å; E78-S88 WeakPolarHBondContact CG-OG 3.24Å; E78-S88 WeakPolarHBondContact OE1-CB 3.36Å; E78-S88 PolarHBondContact OE1-OG 3.35Å; E78-Q102 PolarHBondContact OE1-NE2 3.24Å; E78-W114 PolarHBondContact OE1-NE1 3.07Å
79	A	87.8	Confident	92.2	Very high	51 Å²	51	51.5 Å²	51.5	42%	0.421	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	144.2	167.6	0	0	0	0	0	109.7	R84	A79-R84 CarbonylContact C-O 3.56Å; A79-R84 VanDerWaalsContact CA-O 3.23Å; A79-R84 WeakPolarHBondContact CA-O 3.46Å
80	T	83.6	Confident	92.3	Very high	6 Å²	6	48 Å²	48	4%	0.037	29%	0.289	C	S	.	.			trans	-60.7	166.8	167.2	59.2	0	0	0	0	110.4	D82 G83 R84 C86 L104	T80-D82 WeakPolarHBondContact CB-OD1 3.49Å; T80-D82 PolarHBondContact O-N 3.23Å; T80-D82 VanDerWaalsContact O-N 3.13Å; T80-D82 PolarHBondContact OG1-OD1 2.97Å; T80-G83 WeakPolarHBondContact O-CA 3.49Å; T80-G83 PolarHBondContact O-N 3.35Å; T80-R84 PolarHBondContact N-O 3.25Å; T80-R84 WeakPolarHBondContact OG1-CB 3.34Å; T80-R84 PolarHBondContact OG1-N 3.23Å; T80-R84 VanDerWaalsContact OG1-N 3.14Å; T80-R84 PolarHBondContact OG1-O 2.8Å; T80-C86 HydrophobicContact CG2-CB 4.02Å; T80-L104 HydrophobicContact CG2-CD2 4.04Å
81	V	82.6	Confident	92.3	Very high	66 Å²	66	52.5 Å²	52.5	40%	0.4	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-26	-177.4	70.5	0	0	0	0	113.7	F20 L23 L24 L27 G83 M128	F20-V81 HydrophobicContact CE2-CG2 3.83Å; F20-V81 HydrophobicContact CZ-CG2 4.18Å; L23-V81 HydrophobicContact CD2-CG1 4.03Å; L24-V81 HydrophobicContact CD2-CG1 4.18Å; L24-V81 HydrophobicContact CD2-CG2 4.43Å; L27-V81 HydrophobicContact CD1-CG1 3.31Å; V81-G83 VanDerWaalsContact C-N 3.33Å; V81-M128 HydrophobicContact CG2-SD 4.39Å
82	D	84.6	Confident	92.3	Very high	45 Å²	45	53.6 Å²	53.6	24%	0.241	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1.9	173.1	64.1	-50.1	0	0	0	113.8	L27 V29 T80 R84	L27-D82 HydrophobicContact CB-CB 4.19Å; L27-D82 HydrophobicContact CD1-CB 4.18Å; V29-D82 HydrophobicContact CG2-CB 3.7Å; T80-D82 WeakPolarHBondContact CB-OD1 3.49Å; T80-D82 PolarHBondContact O-N 3.23Å; T80-D82 VanDerWaalsContact O-N 3.13Å; T80-D82 PolarHBondContact OG1-OD1 2.97Å; D82-R84 IonicContact OD1-NE 2.68Å; D82-R84 IonicContact OD1-NH2 3.03Å; D82-R84 PolarHBondContact OD1-NH2 3.03Å; D82-R84 IonicContact OD2-CZ 3.49Å; D82-R84 VanDerWaalsContact OD2-CZ 3.24Å; D82-R84 IonicContact OD2-NE 3.24Å; D82-R84 PolarHBondContact OD2-NE 2.94Å; D82-R84 IonicContact OD2-NH2 2.57Å; D82-R84 PolarHBondContact OD2-NH2 3.49Å
83	G	84.9	Confident	92.2	Very high	50 Å²	50	58.2 Å²	58.2	52%	0.515	33%	0.329	S	S	.	.	S	Bend	trans	91.7	11.4	170.3	0	0	0	0	0	115.8	T80 V81	T80-G83 WeakPolarHBondContact O-CA 3.49Å; T80-G83 PolarHBondContact O-N 3.35Å; V81-G83 VanDerWaalsContact C-N 3.33Å
84	R	87.6	Confident	92.2	Very high	78 Å²	78	59.3 Å²	59.3	29%	0.294	33%	0.327	S	S	.	.			trans	-80.6	132.6	175.8	-70.7	179.2	-74.3	164.1	1	110.2	A79 T80 D82 C86 L104	A79-R84 CarbonylContact C-O 3.56Å; A79-R84 VanDerWaalsContact CA-O 3.23Å; A79-R84 WeakPolarHBondContact CA-O 3.46Å; T80-R84 PolarHBondContact N-O 3.25Å; T80-R84 WeakPolarHBondContact OG1-CB 3.34Å; T80-R84 PolarHBondContact OG1-N 3.23Å; T80-R84 VanDerWaalsContact OG1-N 3.14Å; T80-R84 PolarHBondContact OG1-O 2.8Å; D82-R84 IonicContact OD1-NE 2.68Å; D82-R84 IonicContact OD1-NH2 3.03Å; D82-R84 PolarHBondContact OD1-NH2 3.03Å; D82-R84 IonicContact OD2-CZ 3.49Å; D82-R84 VanDerWaalsContact OD2-CZ 3.24Å; D82-R84 IonicContact OD2-NE 3.24Å; D82-R84 PolarHBondContact OD2-NE 2.94Å; D82-R84 IonicContact OD2-NH2 2.57Å; D82-R84 PolarHBondContact OD2-NH2 3.49Å; R84-C86 PolarHBondContact O-N 2.89Å; R84-L104 HydrophobicContact CB-CD2 3.92Å
85	P	90.3	Very high	92	Very high	93 Å²	93	57.7 Å²	57.7	60%	0.604	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.3	133.4	174.2	-23.6	33.5	0	0	0	111.4	E78 L104 P105	E78-P85 WeakPolarHBondContact O-CA 3.41Å; P85-L104 WeakPolarHBondContact O-CD2 3.18Å; P85-P105 WeakPolarHBondContact O-CD 3.35Å
86	C	91.3	Very high	92	Very high	3 Å²	3	57.5 Å²	57.5	2%	0.02	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	160.7	175.7	64.6	0	0	0	0	111.6	N77 E78 T80 R84 Q102 T103 L104	N77-C86 WeakPolarHBondContact CA-O 3.43Å; E78-C86 VanDerWaalsContact CG-SG 3.53Å; E78-C86 PolarHBondContact N-O 2.68Å; E78-C86 PolarHBondContact O-N 2.9Å; T80-C86 HydrophobicContact CG2-CB 4.02Å; R84-C86 PolarHBondContact O-N 2.89Å; C86-Q102 HydrophobicContact CB-CB 4.44Å; C86-T103 CarbonylContact C-O 3.6Å; C86-T103 WeakPolarHBondContact CA-O 3.39Å; C86-T103 WeakPolarHBondContact CB-O 3.44Å; C86-L104 HydrophobicContact CB-CD2 4.09Å
87	T	93.1	Very high	92.1	Very high	51 Å²	51	58.9 Å²	58.9	31%	0.313	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	133.1	165.6	-58.1	0	0	0	0	108.3	F76 N77 T103	F76-T87 CarbonylContact O-C 3.58Å; F76-T87 WeakPolarHBondContact O-CA 3.32Å; N77-T87 PolarHBondContact OD1-OG1 2.53Å; N77-T87 VanDerWaalsContact OD1-OG1 3.07Å; T87-T103 PolarHBondContact N-O 3.18Å; T87-T103 PolarHBondContact O-N 3.37Å
88	S	95.1	Very high	92.4	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	147.4	-173	-72.6	0	0	0	0	111.1	S75 F76 E78 E101 Q102	S75-S88 VanDerWaalsContact CA-O 3.27Å; S75-S88 WeakPolarHBondContact CA-O 3.28Å; F76-S88 WeakPolarHBondContact CD1-O 3.4Å; F76-S88 PolarHBondContact N-O 3.14Å; F76-S88 PolarHBondContact O-N 3.3Å; E78-S88 VanDerWaalsContact CD-OG 3.31Å; E78-S88 WeakPolarHBondContact CG-OG 3.24Å; E78-S88 WeakPolarHBondContact OE1-CB 3.36Å; E78-S88 PolarHBondContact OE1-OG 3.35Å; S88-E101 VanDerWaalsContact CA-O 3.31Å; S88-E101 WeakPolarHBondContact CA-O 3.24Å; S88-Q102 WeakPolarHBondContact OG-CG 3.49Å
89	F	96.6	Very high	92.7	Very high	67 Å²	67	51.4 Å²	51.4	29%	0.294	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	100.9	179.1	-168	-85.7	0	0	0	110.7	G73 S75 K91 C100 E101	G73-F89 WeakPolarHBondContact O-CE2 3.13Å; G73-F89 WeakPolarHBondContact O-CZ 3.49Å; S75-F89 WeakPolarHBondContact OG-CD2 3.48Å; F89-K91 HydrophobicContact CD1-CD 4.03Å; F89-K91 HydrophobicContact CD1-CG 3.65Å; F89-K91 HydrophobicContact CE1-CD 3.9Å; F89-K91 HydrophobicContact CE1-CG 3.46Å; F89-K91 VanDerWaalsContact CE1-CG 3.46Å; F89-C100 WeakPolarHBondContact O-CA 3.38Å; F89-E101 PolarHBondContact N-O 2.94Å; F89-E101 PolarHBondContact O-N 2.8Å
90	P	97.6	Very high	93.2	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	140.2	179.5	24.7	-17.9	0	0	0	111.6	F70 G73 Q74 F76 I98 S99 C100 W114	F70-P90 HydrophobicContact CB-CG 4.33Å; F70-P90 HydrophobicContact CD2-CB 3.92Å; F70-P90 HydrophobicContact CD2-CG 3.51Å; F70-P90 HydrophobicContact CE2-CB 4.01Å; F70-P90 HydrophobicContact CE2-CG 4.13Å; F70-P90 HydrophobicContact CG-CG 4.15Å; G73-P90 PolarHBondContact N-O 3.13Å; Q74-P90 WeakPolarHBondContact O-CD 3.46Å; F76-P90 HydrophobicContact CD1-CG 4.27Å; F76-P90 HydrophobicContact CE1-CG 3.93Å; P90-I98 HydrophobicContact CB-CG2 3.97Å; P90-S99 CarbonylContact C-O 3.52Å; P90-S99 VanDerWaalsContact CA-O 3.26Å; P90-S99 WeakPolarHBondContact CA-O 3.45Å; P90-C100 HydrophobicContact CB-CB 4.3Å; P90-W114 HydrophobicContact CB-CH2 4.49Å
91	K	97.6	Very high	93.6	Very high	101 Å²	101	52 Å²	52	44%	0.439	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	143.4	178	-68.4	175.6	-175.7	169.6	0	110.4	F89 E93 I98 S99	F89-K91 HydrophobicContact CD1-CD 4.03Å; F89-K91 HydrophobicContact CD1-CG 3.65Å; F89-K91 HydrophobicContact CE1-CD 3.9Å; F89-K91 HydrophobicContact CE1-CG 3.46Å; F89-K91 VanDerWaalsContact CE1-CG 3.46Å; K91-E93 PolarHBondContact O-N 2.85Å; K91-I98 CarbonylContact O-C 3.59Å; K91-I98 VanDerWaalsContact O-CA 3.26Å; K91-I98 WeakPolarHBondContact O-CA 3.36Å; K91-S99 PolarHBondContact N-O 3.17Å; K91-S99 PolarHBondContact O-N 3.25Å
92	W	97.3	Very high	94.1	Very high	57 Å²	57	49.9 Å²	49.9	22%	0.216	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	125.5	163.5	-69.1	113.7	0	0	0	109.9	V5 F8 E53 F55 V72 I98	V5-W92 HydrophobicContact CB-CH2 4.15Å; V5-W92 HydrophobicContact CB-CZ2 3.83Å; V5-W92 HydrophobicContact CG1-CD2 4.18Å; V5-W92 HydrophobicContact CG1-CZ2 3.95Å; V5-W92 HydrophobicContact CG2-CZ2 4.16Å; F8-W92 HydrophobicContact CD2-CH2 4.21Å; F8-W92 AromaticContact CE2-CH2 3.59Å; F8-W92 HydrophobicContact CE2-CH2 3.59Å; F8-W92 AromaticContact CE2-CZ3 3.68Å; F8-W92 HydrophobicContact CE2-CZ3 3.68Å; F8-W92 HydrophobicContact CZ-CH2 4.32Å; F8-W92 HydrophobicContact CZ-CZ3 4.02Å; E53-W92 PolarHBondContact OE2-NE1 2.85Å; F55-W92 HydrophobicContact CE2-CH2 4.35Å; F55-W92 AromaticContact CE2-CZ2 3.92Å; F55-W92 HydrophobicContact CE2-CZ2 3.92Å; F55-W92 AromaticContact CZ-CH2 3.75Å; F55-W92 HydrophobicContact CZ-CH2 3.75Å; F55-W92 AromaticContact CZ-CZ2 3.75Å; F55-W92 HydrophobicContact CZ-CZ2 3.75Å; V72-W92 VanDerWaalsContact CG1-CD1 3.43Å; V72-W92 HydrophobicContact CG1-CD2 4.47Å; V72-W92 HydrophobicContact CG1-CG 3.97Å; V72-W92 HydrophobicContact CG2-CZ2 4.33Å; W92-I98 HydrophobicContact CD2-CG1 3.93Å; W92-I98 HydrophobicContact CE3-CD1 4.26Å; W92-I98 HydrophobicContact CE3-CG1 3.39Å; W92-I98 HydrophobicContact CH2-CD1 3.64Å; W92-I98 HydrophobicContact CH2-CG1 3.69Å; W92-I98 HydrophobicContact CZ2-CD1 4Å; W92-I98 HydrophobicContact CZ2-CG1 4.16Å; W92-I98 HydrophobicContact CZ3-CD1 3.79Å; W92-I98 HydrophobicContact CZ3-CG1 3.28Å
93	E	96.6	Very high	94.3	Very high	113 Å²	113	52.1 Å²	52.1	53%	0.528	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-34.3	165.9	-61.8	-62.1	153.9	0	0	110.4	K91 K97 S99	K91-E93 PolarHBondContact O-N 2.85Å; E93-K97 HydrophobicContact CB-CB 4.29Å; E93-K97 HydrophobicContact CB-CD 4.32Å; E93-K97 HydrophobicContact CB-CG 4.21Å; E93-K97 PolarHBondContact N-O 2.89Å; E93-S99 VanDerWaalsContact OE1-CB 3.28Å; E93-S99 WeakPolarHBondContact OE1-CB 3.49Å; E93-S99 PolarHBondContact OE1-OG 3.48Å
94	T	96.1	Very high	94.4	Very high	67 Å²	67	51.5 Å²	51.5	41%	0.411	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	-179	173.3	70.4	0	0	0	0	109.3	R96 K97	T94-R96 PolarHBondContact O-N 2.89Å; T94-R96 VanDerWaalsContact O-N 3.12Å; T94-R96 PolarHBondContact OG1-N 2.87Å; T94-R96 VanDerWaalsContact OG1-N 3.14Å; T94-K97 PolarHBondContact N-O 2.76Å; T94-K97 VanDerWaalsContact OG1-CB 3.31Å; T94-K97 WeakPolarHBondContact OG1-CB 3.21Å; T94-K97 PolarHBondContact OG1-N 2.86Å; T94-K97 VanDerWaalsContact OG1-N 3.08Å
95	D	94.9	Very high	93.9	Very high	84 Å²	84	52.1 Å²	52.1	45%	0.449	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-5.8	171.2	67.2	-28	0	0	0	114.1	T6	T6-D95 VanDerWaalsContact CB-O 3.23Å; T6-D95 WeakPolarHBondContact CB-O 3.06Å; T6-D95 PolarHBondContact N-O 2.82Å; T6-D95 PolarHBondContact OG1-O 2.88Å
96	R	96.3	Very high	93	Very high	78 Å²	78	57.1 Å²	57.1	29%	0.294	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.3	0.9	-173.5	-74	170	-177.1	-102.1	0.7	113.7	T6 F8 T94 E117 L118 N120	T6-R96 HydrophobicContact CG2-CG 4.23Å; T6-R96 WeakPolarHBondContact OG1-CG 3.42Å; F8-R96 VanDerWaalsContact CZ-O 3.26Å; F8-R96 WeakPolarHBondContact CZ-O 3.44Å; T94-R96 PolarHBondContact O-N 2.89Å; T94-R96 VanDerWaalsContact O-N 3.12Å; T94-R96 PolarHBondContact OG1-N 2.87Å; T94-R96 VanDerWaalsContact OG1-N 3.14Å; R96-E117 CarbonylContact O-C 3.56Å; R96-E117 VanDerWaalsContact O-CA 3.27Å; R96-E117 WeakPolarHBondContact O-CA 3.46Å; R96-L118 PolarHBondContact O-N 2.97Å; R96-N120 PolarHBondContact NH1-OD1 3.15Å
97	K	97.7	Very high	91.7	Very high	57 Å²	57	60.2 Å²	60.2	25%	0.248	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	123.6	-174.7	-173.6	173.2	-168	146	0	111.4	E93 T94 R116 E117	E93-K97 HydrophobicContact CB-CB 4.29Å; E93-K97 HydrophobicContact CB-CD 4.32Å; E93-K97 HydrophobicContact CB-CG 4.21Å; E93-K97 PolarHBondContact N-O 2.89Å; T94-K97 PolarHBondContact N-O 2.76Å; T94-K97 VanDerWaalsContact OG1-CB 3.31Å; T94-K97 WeakPolarHBondContact OG1-CB 3.21Å; T94-K97 PolarHBondContact OG1-N 2.86Å; T94-K97 VanDerWaalsContact OG1-N 3.08Å; K97-R116 CarbonylContact C-O 3.6Å; K97-R116 WeakPolarHBondContact CA-O 3.41Å; K97-E117 HydrophobicContact CB-CB 4.33Å; K97-E117 HydrophobicContact CB-CG 4.13Å; K97-E117 HydrophobicContact CD-CB 4.44Å; K97-E117 HydrophobicContact CD-CG 4.36Å; K97-E117 WeakPolarHBondContact CD-OE2 3.32Å; K97-E117 WeakPolarHBondContact CE-OE2 3.12Å; K97-E117 HydrophobicContact CG-CB 4.08Å; K97-E117 HydrophobicContact CG-CG 4.27Å; K97-E117 IonicContact NZ-OE2 2.74Å; K97-E117 PolarHBondContact NZ-OE2 3.28Å
98	I	98.1	Very high	90.3	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.005	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	130.1	172.3	-57.7	172.6	0	0	0	108	F55 F70 V72 P90 K91 W92 W114 T115 R116	F55-I98 HydrophobicContact CD2-CD1 4.4Å; F55-I98 HydrophobicContact CE1-CD1 3.99Å; F55-I98 HydrophobicContact CE2-CD1 3.79Å; F55-I98 HydrophobicContact CZ-CD1 3.55Å; F70-I98 HydrophobicContact CE2-CD1 4.48Å; V72-I98 HydrophobicContact CG2-CD1 3.98Å; P90-I98 HydrophobicContact CB-CG2 3.97Å; K91-I98 CarbonylContact O-C 3.59Å; K91-I98 VanDerWaalsContact O-CA 3.26Å; K91-I98 WeakPolarHBondContact O-CA 3.36Å; W92-I98 HydrophobicContact CD2-CG1 3.93Å; W92-I98 HydrophobicContact CE3-CD1 4.26Å; W92-I98 HydrophobicContact CE3-CG1 3.39Å; W92-I98 HydrophobicContact CH2-CD1 3.64Å; W92-I98 HydrophobicContact CH2-CG1 3.69Å; W92-I98 HydrophobicContact CZ2-CD1 4Å; W92-I98 HydrophobicContact CZ2-CG1 4.16Å; W92-I98 HydrophobicContact CZ3-CD1 3.79Å; W92-I98 HydrophobicContact CZ3-CG1 3.28Å; I98-W114 HydrophobicContact CG2-CH2 4.2Å; I98-W114 HydrophobicContact CG2-CZ3 4Å; I98-T115 CarbonylContact O-C 3.58Å; I98-T115 WeakPolarHBondContact O-CA 3.22Å; I98-T115 WeakPolarHBondContact O-CB 3.4Å; I98-R116 PolarHBondContact N-O 2.93Å; I98-R116 PolarHBondContact O-N 2.86Å
99	S	97.9	Very high	89.2	Confident	10 Å²	10	68 Å²	68	7%	0.07	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	153.5	161.8	72.1	0	0	0	0	109.6	P90 K91 E93 W114	P90-S99 CarbonylContact C-O 3.52Å; P90-S99 VanDerWaalsContact CA-O 3.26Å; P90-S99 WeakPolarHBondContact CA-O 3.45Å; K91-S99 PolarHBondContact N-O 3.17Å; K91-S99 PolarHBondContact O-N 3.25Å; E93-S99 VanDerWaalsContact OE1-CB 3.28Å; E93-S99 WeakPolarHBondContact OE1-CB 3.49Å; E93-S99 PolarHBondContact OE1-OG 3.48Å; S99-W114 CarbonylContact C-O 3.59Å
100	C	96.8	Very high	88.5	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	115.6	175.2	-171.2	0	0	0	0	110.1	F89 P90 M113 W114	F89-C100 WeakPolarHBondContact O-CA 3.38Å; P90-C100 HydrophobicContact CB-CB 4.3Å; C100-M113 VanDerWaalsContact O-CA 3.26Å; C100-M113 WeakPolarHBondContact O-CA 3.47Å; C100-M113 WeakPolarHBondContact O-CG 3.46Å; C100-W114 HydrophobicContact CB-CD2 3.48Å; C100-W114 VanDerWaalsContact CB-CD2 3.48Å; C100-W114 HydrophobicContact CB-CE3 3.79Å; C100-W114 HydrophobicContact CB-CG 4.15Å; C100-W114 HydrophobicContact CB-CH2 3.54Å; C100-W114 HydrophobicContact CB-CZ2 3.22Å; C100-W114 HydrophobicContact CB-CZ3 3.81Å; C100-W114 PolarHBondContact N-O 2.83Å; C100-W114 PolarHBondContact O-N 3.44Å; C100-W114 VanDerWaalsContact SG-CE2 3.57Å; C100-W114 WeakPolarHBondContact SG-CZ2 3.48Å
101	E	93.5	Very high	87.8	Confident	70 Å²	70	74.6 Å²	74.6	33%	0.327	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	136.1	172.8	-60.9	-168.3	130.6	0	0	109.5	S88 F89 K111 M113	S88-E101 VanDerWaalsContact CA-O 3.31Å; S88-E101 WeakPolarHBondContact CA-O 3.24Å; F89-E101 PolarHBondContact N-O 2.94Å; F89-E101 PolarHBondContact O-N 2.8Å; E101-K111 WeakPolarHBondContact OE1-CE 3.33Å; E101-K111 IonicContact OE1-NZ 2.75Å; E101-K111 PolarHBondContact OE1-NZ 2.98Å; E101-M113 HydrophobicContact CG-CE 4.42Å; E101-M113 HydrophobicContact CG-CG 4.49Å
102	Q	91.9	Very high	87.6	Confident	21 Å²	21	70.1 Å²	70.1	10%	0.098	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.6	177.7	-50	-176.7	-68.9	0	0	109.3	E78 C86 S88 T112	E78-Q102 PolarHBondContact OE1-NE2 3.24Å; C86-Q102 HydrophobicContact CB-CB 4.44Å; S88-Q102 WeakPolarHBondContact OG-CG 3.49Å; Q102-T112 WeakPolarHBondContact CB-OG1 3.49Å; Q102-T112 PolarHBondContact N-O 3.18Å; Q102-T112 PolarHBondContact OE1-OG1 2.91Å
103	T	88.6	Confident	87.4	Confident	93 Å²	93	70.1 Å²	70.1	57%	0.571	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.4	125.6	-178.5	-55.6	0	0	0	0	109.7	C86 T87	C86-T103 CarbonylContact C-O 3.6Å; C86-T103 WeakPolarHBondContact CA-O 3.39Å; C86-T103 WeakPolarHBondContact CB-O 3.44Å; T87-T103 PolarHBondContact N-O 3.18Å; T87-T103 PolarHBondContact O-N 3.37Å
104	L	86.8	Confident	87.4	Confident	36 Å²	36	65.8 Å²	65.8	19%	0.188	36%	0.358	C	S	.	.			trans	-77.5	138.7	176.1	-65.2	170.2	0	0	0	110.2	T80 R84 P85 C86 K106	T80-L104 HydrophobicContact CG2-CD2 4.04Å; R84-L104 HydrophobicContact CB-CD2 3.92Å; P85-L104 WeakPolarHBondContact O-CD2 3.18Å; C86-L104 HydrophobicContact CB-CD2 4.09Å; L104-K106 VanDerWaalsContact C-N 3.27Å; L104-K106 PolarHBondContact O-N 3.4Å
105	P	77.8	Confident	87.5	Confident	92 Å²	92	63.5 Å²	63.5	60%	0.597	34%	0.344	S	S	*	.	S	Bend	trans	-66	-26.5	-177.8	-21.6	32.3	0	0	0	114	P85	P85-P105 WeakPolarHBondContact O-CD 3.35Å
106	K	71.5	Confident	87.7	Confident	197 Å²	197	60.7 Å²	60.7	86%	0.857	33%	0.327	S	S	*	.	S	Bend	trans	-150	131.3	179.3	-66	-173.3	179.2	179.8	0	110.9	L104	L104-K106 VanDerWaalsContact C-N 3.27Å; L104-K106 PolarHBondContact O-N 3.4Å
107	G	64.1	Low	87.8	Confident	69 Å²	69	59.9 Å²	59.9	71%	0.711	33%	0.326	S	S	*	.	S	Bend	trans	113.3	164.6	164.3	0	0	0	0	0	116.7	G109	G107-G109 PolarHBondContact O-N 2.64Å
108	D	64.2	Low	87.8	Confident	183 Å²	183	57.9 Å²	57.9	98%	0.979	32%	0.318	S	S	*	.			trans	-79.3	51.2	176.1	-65.8	-37	0	0	0	112.3
109	G	71.3	Confident	87.7	Confident	33 Å²	33	58.9 Å²	58.9	34%	0.34	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-77.1	150.1	174.3	0	0	0	0	0	111.8	G107 K111	G107-G109 PolarHBondContact O-N 2.64Å; G109-K111 PolarHBondContact O-N 3.42Å
110	L	81.3	Confident	87.4	Confident	78 Å²	78	65.1 Å²	65.1	41%	0.408	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-52.5	135.8	169.3	-74.7	169	0	0	0	110.2	A26 T112	A26-L110 HydrophobicContact CB-CD1 4.41Å; A26-L110 VanDerWaalsContact O-CD1 3.24Å; A26-L110 WeakPolarHBondContact O-CD1 3.45Å; L110-T112 PolarHBondContact O-N 3.37Å
111	K	83.9	Confident	87.2	Confident	126 Å²	126	71.1 Å²	71.1	55%	0.548	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-60.6	127.4	169.3	-171.7	175.8	-179.6	-177.4	0	108.1	E101 G109 G131	E101-K111 WeakPolarHBondContact OE1-CE 3.33Å; E101-K111 IonicContact OE1-NZ 2.75Å; E101-K111 PolarHBondContact OE1-NZ 2.98Å; G109-K111 PolarHBondContact O-N 3.42Å; K111-G131 PolarHBondContact O-N 3.47Å
112	T	92.3	Very high	87.2	Confident	8 Å²	8	69.3 Å²	69.3	5%	0.049	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.2	174.2	64.1	0	0	0	0	110.5	L27 Q102 L110 T129 A130	L27-T112 HydrophobicContact CD2-CG2 3.65Å; Q102-T112 WeakPolarHBondContact CB-OG1 3.49Å; Q102-T112 PolarHBondContact N-O 3.18Å; Q102-T112 PolarHBondContact OE1-OG1 2.91Å; L110-T112 PolarHBondContact O-N 3.37Å; T112-T129 VanDerWaalsContact CA-O 3.24Å; T112-T129 WeakPolarHBondContact CA-O 3.42Å; T112-T129 WeakPolarHBondContact CB-O 3.23Å; T112-A130 HydrophobicContact CG2-CB 4.08Å
113	M	94.8	Very high	87.5	Confident	56 Å²	56	70.1 Å²	70.1	28%	0.276	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	149.5	177.9	-173.6	-161	-52.5	0	0	108.2	C100 E101 M128 T129	C100-M113 VanDerWaalsContact O-CA 3.26Å; C100-M113 WeakPolarHBondContact O-CA 3.47Å; C100-M113 WeakPolarHBondContact O-CG 3.46Å; E101-M113 HydrophobicContact CG-CE 4.42Å; E101-M113 HydrophobicContact CG-CG 4.49Å; M113-M128 WeakPolarHBondContact O-CA 3.32Å; M113-T129 WeakPolarHBondContact CB-OG1 3.45Å; M113-T129 PolarHBondContact N-O 2.76Å; M113-T129 PolarHBondContact N-OG1 3.08Å; M113-T129 PolarHBondContact O-N 3.43Å; M113-T129 PolarHBondContact O-OG1 3.48Å
114	W	96.5	Very high	88	Confident	23 Å²	23	65.7 Å²	65.7	9%	0.087	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	154.8	166.7	58.4	-101.2	0	0	0	111.5	F70 E78 P90 I98 S99 C100 R116 L126 T127 M128	F70-W114 AromaticContact CE1-CH2 3.98Å; F70-W114 HydrophobicContact CE1-CH2 3.98Å; F70-W114 HydrophobicContact CE1-CZ2 4.32Å; F70-W114 HydrophobicContact CE2-CH2 4.33Å; F70-W114 AromaticContact CZ-CH2 3.76Å; F70-W114 HydrophobicContact CZ-CH2 3.76Å; E78-W114 PolarHBondContact OE1-NE1 3.07Å; P90-W114 HydrophobicContact CB-CH2 4.49Å; I98-W114 HydrophobicContact CG2-CH2 4.2Å; I98-W114 HydrophobicContact CG2-CZ3 4Å; S99-W114 CarbonylContact C-O 3.59Å; C100-W114 HydrophobicContact CB-CD2 3.48Å; C100-W114 VanDerWaalsContact CB-CD2 3.48Å; C100-W114 HydrophobicContact CB-CE3 3.79Å; C100-W114 HydrophobicContact CB-CG 4.15Å; C100-W114 HydrophobicContact CB-CH2 3.54Å; C100-W114 HydrophobicContact CB-CZ2 3.22Å; C100-W114 HydrophobicContact CB-CZ3 3.81Å; C100-W114 PolarHBondContact N-O 2.83Å; C100-W114 PolarHBondContact O-N 3.44Å; C100-W114 VanDerWaalsContact SG-CE2 3.57Å; C100-W114 WeakPolarHBondContact SG-CZ2 3.48Å; W114-R116 HydrophobicContact CE3-CG 4.14Å; W114-R116 HydrophobicContact CZ3-CB 4.43Å; W114-R116 HydrophobicContact CZ3-CG 4.06Å; W114-L126 HydrophobicContact CB-CD1 4.24Å; W114-T127 CarbonylContact C-O 3.55Å; W114-T127 WeakPolarHBondContact CA-O 3.45Å; W114-T127 WeakPolarHBondContact CB-O 3.02Å; W114-M128 HydrophobicContact CB-CG 4.19Å
115	T	98.1	Very high	88.5	Confident	19 Å²	19	65.9 Å²	65.9	12%	0.117	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	146.3	168.6	70.9	0	0	0	0	110.6	I98 L126 T127	I98-T115 CarbonylContact O-C 3.58Å; I98-T115 WeakPolarHBondContact O-CA 3.22Å; I98-T115 WeakPolarHBondContact O-CB 3.4Å; T115-L126 WeakPolarHBondContact O-CA 3.37Å; T115-L126 WeakPolarHBondContact O-CD1 3.49Å; T115-T127 PolarHBondContact N-O 3.48Å; T115-T127 PolarHBondContact O-N 3.49Å; T115-T127 WeakPolarHBondContact OG1-CB 3.49Å
116	R	98	Very high	89.5	Confident	24 Å²	24	62.1 Å²	62.1	9%	0.091	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.1	167.9	-74.4	-179.3	177.2	-111.9	-2.2	109.2	F8 K97 I98 W114 L124 I125 L126	F8-R116 HydrophobicContact CE1-CB 4.39Å; K97-R116 CarbonylContact C-O 3.6Å; K97-R116 WeakPolarHBondContact CA-O 3.41Å; I98-R116 PolarHBondContact N-O 2.93Å; I98-R116 PolarHBondContact O-N 2.86Å; W114-R116 HydrophobicContact CE3-CG 4.14Å; W114-R116 HydrophobicContact CZ3-CB 4.43Å; W114-R116 HydrophobicContact CZ3-CG 4.06Å; R116-L124 HydrophobicContact CB-CD1 4.34Å; R116-I125 CarbonylContact C-O 3.6Å; R116-I125 WeakPolarHBondContact CA-O 3.49Å; R116-L126 HydrophobicContact CG-CD1 4.03Å
117	E	98.1	Very high	90.7	Very high	62 Å²	62	54.2 Å²	54.2	29%	0.29	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	128.5	-178.4	-175.1	167.2	-176.8	0	0	110.1	R96 K97 I125	R96-E117 CarbonylContact O-C 3.56Å; R96-E117 VanDerWaalsContact O-CA 3.27Å; R96-E117 WeakPolarHBondContact O-CA 3.46Å; K97-E117 HydrophobicContact CB-CB 4.33Å; K97-E117 HydrophobicContact CB-CG 4.13Å; K97-E117 HydrophobicContact CD-CB 4.44Å; K97-E117 HydrophobicContact CD-CG 4.36Å; K97-E117 WeakPolarHBondContact CD-OE2 3.32Å; K97-E117 WeakPolarHBondContact CE-OE2 3.12Å; K97-E117 HydrophobicContact CG-CB 4.08Å; K97-E117 HydrophobicContact CG-CG 4.27Å; K97-E117 IonicContact NZ-OE2 2.74Å; K97-E117 PolarHBondContact NZ-OE2 3.28Å; E117-I125 PolarHBondContact N-O 2.92Å; E117-I125 PolarHBondContact O-N 2.78Å
118	L	97.8	Very high	92.3	Very high	14 Å²	14	52 Å²	52	7%	0.073	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	110	171	-170.8	70.6	0	0	0	109.4	T6 F8 W12 R96 E123 L124	T6-L118 HydrophobicContact CG2-CD2 3.49Å; T6-L118 VanDerWaalsContact CG2-CD2 3.49Å; F8-L118 HydrophobicContact CD1-CB 4.2Å; F8-L118 HydrophobicContact CE1-CB 3.82Å; F8-L118 HydrophobicContact CE2-CB 4.45Å; F8-L118 HydrophobicContact CZ-CB 3.97Å; W12-L118 HydrophobicContact CH2-CD1 3.31Å; W12-L118 HydrophobicContact CZ2-CD1 3.84Å; W12-L118 HydrophobicContact CZ3-CD1 4.19Å; R96-L118 PolarHBondContact O-N 2.97Å; L118-E123 WeakPolarHBondContact CD1-O 3.32Å; L118-L124 HydrophobicContact CD1-CB 4.42Å
119	T	96.1	Very high	93.8	Very high	23 Å²	23	45 Å²	45	14%	0.141	25%	0.245	C	C	.	.			trans	-72.2	164.3	-177.5	62.6	0	0	0	0	111.5	D121 G122 E123 I125	T119-D121 VanDerWaalsContact C-N 3.26Å; T119-D121 WeakPolarHBondContact CB-OD1 3.38Å; T119-D121 PolarHBondContact O-N 3.15Å; T119-D121 PolarHBondContact OG1-OD1 3Å; T119-G122 PolarHBondContact O-N 3.39Å; T119-G122 VanDerWaalsContact O-N 3.14Å; T119-E123 PolarHBondContact N-O 2.87Å; T119-E123 WeakPolarHBondContact OG1-CA 3.23Å; T119-E123 WeakPolarHBondContact OG1-CB 3.38Å; T119-E123 PolarHBondContact OG1-N 2.71Å; T119-E123 PolarHBondContact OG1-O 3.16Å; T119-E123 VanDerWaalsContact OG1-O 3.06Å; T119-I125 HydrophobicContact CG2-CD1 3.43Å; T119-I125 VanDerWaalsContact CG2-CD1 3.43Å; T119-I125 HydrophobicContact CG2-CG1 3.89Å
120	N	92.7	Very high	94.8	Very high	141 Å²	141	43.5 Å²	43.5	75%	0.754	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-25	179.6	-71.4	-39.5	0	0	0	113.4	R96 G122	R96-N120 PolarHBondContact NH1-OD1 3.15Å; N120-G122 VanDerWaalsContact C-N 3.28Å
121	D	92	Very high	95.2	Very high	125 Å²	125	41.6 Å²	41.6	67%	0.668	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.3	2.3	174	58.5	-19.3	0	0	0	113.3	T119	T119-D121 VanDerWaalsContact C-N 3.26Å; T119-D121 WeakPolarHBondContact CB-OD1 3.38Å; T119-D121 PolarHBondContact O-N 3.15Å; T119-D121 PolarHBondContact OG1-OD1 3Å
122	G	94.4	Very high	95.6	Very high	33 Å²	33	43.6 Å²	43.6	34%	0.34	25%	0.246	S	C	.	.	S	Bend	trans	89.6	14.3	169.3	0	0	0	0	0	115.1	W12 T119 N120	W12-G122 VanDerWaalsContact CZ3-O 3.32Å; W12-G122 WeakPolarHBondContact CZ3-O 3.26Å; T119-G122 PolarHBondContact O-N 3.39Å; T119-G122 VanDerWaalsContact O-N 3.14Å; N120-G122 VanDerWaalsContact C-N 3.28Å
123	E	97.4	Very high	95.8	Very high	38 Å²	38	45.1 Å²	45.1	18%	0.178	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-85.4	144.2	171.7	-57.6	-168.5	145.6	0	0	111	K15 L118 T119 V138 Y139	K15-E123 WeakPolarHBondContact CD-OE1 3.37Å; K15-E123 IonicContact NZ-OE1 2.78Å; K15-E123 PolarHBondContact NZ-OE1 3.44Å; L118-E123 WeakPolarHBondContact CD1-O 3.32Å; T119-E123 PolarHBondContact N-O 2.87Å; T119-E123 WeakPolarHBondContact OG1-CA 3.23Å; T119-E123 WeakPolarHBondContact OG1-CB 3.38Å; T119-E123 PolarHBondContact OG1-N 2.71Å; T119-E123 PolarHBondContact OG1-O 3.16Å; T119-E123 VanDerWaalsContact OG1-O 3.06Å; E123-V138 HydrophobicContact CB-CG1 4.14Å; E123-V138 HydrophobicContact CG-CG1 4.42Å; E123-V138 WeakPolarHBondContact OE2-CG1 3.44Å; E123-Y139 WeakPolarHBondContact CA-O 3.34Å
124	L	98.1	Very high	95.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.4	170.6	171.8	67.7	0	0	0	108.9	F8 W12 I48 R116 L118 Y139	F8-L124 HydrophobicContact CD1-CD1 3.78Å; F8-L124 HydrophobicContact CE1-CD1 3.96Å; W12-L124 HydrophobicContact CB-CD2 4.43Å; W12-L124 HydrophobicContact CD2-CB 3.87Å; W12-L124 HydrophobicContact CD2-CD2 3.81Å; W12-L124 HydrophobicContact CE3-CB 3.55Å; W12-L124 HydrophobicContact CE3-CD2 4.33Å; W12-L124 HydrophobicContact CG-CD2 3.84Å; W12-L124 HydrophobicContact CH2-CB 3.98Å; W12-L124 HydrophobicContact CZ2-CB 4.23Å; W12-L124 HydrophobicContact CZ3-CB 3.61Å; I48-L124 HydrophobicContact CD1-CD2 3.62Å; R116-L124 HydrophobicContact CB-CD1 4.34Å; L118-L124 HydrophobicContact CD1-CB 4.42Å; L124-Y139 PolarHBondContact N-O 3.17Å; L124-Y139 WeakPolarHBondContact O-CD2 3.45Å; L124-Y139 PolarHBondContact O-N 3.38Å
125	I	98.3	Very high	95.9	Very high	39 Å²	39	44.5 Å²	44.5	20%	0.2	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.9	177.6	-57	178.6	0	0	0	109.3	R116 E117 T119 T136	R116-I125 CarbonylContact C-O 3.6Å; R116-I125 WeakPolarHBondContact CA-O 3.49Å; E117-I125 PolarHBondContact N-O 2.92Å; E117-I125 PolarHBondContact O-N 2.78Å; T119-I125 HydrophobicContact CG2-CD1 3.43Å; T119-I125 VanDerWaalsContact CG2-CD1 3.43Å; T119-I125 HydrophobicContact CG2-CG1 3.89Å; I125-T136 HydrophobicContact CG2-CG2 3.91Å
126	L	97.7	Very high	95.9	Very high	14 Å²	14	45.5 Å²	45.5	7%	0.073	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	118.8	168	171.4	64.3	0	0	0	108.9	W114 T115 R116 M128 T136 R137 Y139	W114-L126 HydrophobicContact CB-CD1 4.24Å; T115-L126 WeakPolarHBondContact O-CA 3.37Å; T115-L126 WeakPolarHBondContact O-CD1 3.49Å; R116-L126 HydrophobicContact CG-CD1 4.03Å; L126-M128 HydrophobicContact CD1-CG 4.18Å; L126-M128 HydrophobicContact CD2-CE 4.38Å; L126-M128 HydrophobicContact CD2-CG 4.48Å; L126-M128 HydrophobicContact CD2-SD 4.23Å; L126-M128 HydrophobicContact CG-CG 4.17Å; L126-T136 CarbonylContact O-C 3.59Å; L126-T136 WeakPolarHBondContact O-CA 3.41Å; L126-R137 HydrophobicContact CB-CB 4.24Å; L126-R137 PolarHBondContact N-O 3.33Å; L126-R137 PolarHBondContact O-N 3.05Å; L126-Y139 HydrophobicContact CB-CE2 4.01Å; L126-Y139 HydrophobicContact CD2-CE2 4.41Å
127	T	98	Very high	95.9	Very high	31 Å²	31	45.2 Å²	45.2	19%	0.19	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	135.2	169.5	-54.4	0	0	0	0	108.9	W114 T115 T129 V134 C135	W114-T127 CarbonylContact C-O 3.55Å; W114-T127 WeakPolarHBondContact CA-O 3.45Å; W114-T127 WeakPolarHBondContact CB-O 3.02Å; T115-T127 PolarHBondContact N-O 3.48Å; T115-T127 PolarHBondContact O-N 3.49Å; T115-T127 WeakPolarHBondContact OG1-CB 3.49Å; T127-T129 HydrophobicContact CG2-CG2 4.43Å; T127-V134 HydrophobicContact CG2-CG1 3.46Å; T127-V134 VanDerWaalsContact CG2-CG1 3.46Å; T127-C135 CarbonylContact C-O 3.45Å; T127-C135 WeakPolarHBondContact CA-O 3.34Å
128	M	96.6	Very high	95.9	Very high	22 Å²	22	43.1 Å²	43.1	11%	0.108	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138.7	175.4	-64.5	174	-68.1	0	0	109	F20 L23 V81 M113 W114 L126 C135 R137	F20-M128 HydrophobicContact CD2-CE 3.98Å; F20-M128 HydrophobicContact CE2-CE 4.12Å; L23-M128 HydrophobicContact CD1-CB 4.48Å; L23-M128 HydrophobicContact CD2-CB 3.73Å; L23-M128 HydrophobicContact CD2-CE 4.03Å; L23-M128 HydrophobicContact CD2-SD 4.22Å; V81-M128 HydrophobicContact CG2-SD 4.39Å; M113-M128 WeakPolarHBondContact O-CA 3.32Å; W114-M128 HydrophobicContact CB-CG 4.19Å; L126-M128 HydrophobicContact CD1-CG 4.18Å; L126-M128 HydrophobicContact CD2-CE 4.38Å; L126-M128 HydrophobicContact CD2-CG 4.48Å; L126-M128 HydrophobicContact CD2-SD 4.23Å; L126-M128 HydrophobicContact CG-CG 4.17Å; M128-C135 HydrophobicContact CB-CB 4.46Å; M128-C135 HydrophobicContact CE-CB 4.27Å; M128-C135 VanDerWaalsContact CE-SG 3.54Å; M128-C135 PolarHBondContact N-O 3.48Å; M128-C135 PolarHBondContact O-N 2.88Å; M128-R137 HydrophobicContact CE-CG 4.49Å
129	T	95.8	Very high	95.9	Very high	36 Å²	36	42.7 Å²	42.7	22%	0.221	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	145.2	-177.9	62.2	0	0	0	0	111.5	T112 M113 T127 V133 V134	T112-T129 VanDerWaalsContact CA-O 3.24Å; T112-T129 WeakPolarHBondContact CA-O 3.42Å; T112-T129 WeakPolarHBondContact CB-O 3.23Å; M113-T129 WeakPolarHBondContact CB-OG1 3.45Å; M113-T129 PolarHBondContact N-O 2.76Å; M113-T129 PolarHBondContact N-OG1 3.08Å; M113-T129 PolarHBondContact O-N 3.43Å; M113-T129 PolarHBondContact O-OG1 3.48Å; T127-T129 HydrophobicContact CG2-CG2 4.43Å; T129-V133 VanDerWaalsContact CA-O 3.28Å; T129-V133 WeakPolarHBondContact CA-O 3.24Å; T129-V134 HydrophobicContact CG2-CG1 4.39Å; T129-V134 HydrophobicContact CG2-CG2 4.12Å
130	A	93.1	Very high	95.9	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	102.7	170.6	0	0	0	0	0	108.6	L23 A26 L27 T112 D132 V133	L23-A130 HydrophobicContact CD1-CB 3.73Å; A26-A130 HydrophobicContact CB-CB 4.38Å; L27-A130 HydrophobicContact CD2-CB 3.67Å; L27-A130 HydrophobicContact CG-CB 3.96Å; T112-A130 HydrophobicContact CG2-CB 4.08Å; A130-D132 PolarHBondContact O-N 3.47Å; A130-V133 PolarHBondContact N-O 2.86Å; A130-V133 PolarHBondContact O-N 3.48Å
131	G	89.4	Confident	96	Very high	39 Å²	39	43.7 Å²	43.7	40%	0.402	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.5	-128.7	-166.3	0	0	0	0	0	111.1	K111 V133	K111-G131 PolarHBondContact O-N 3.47Å; G131-V133 VanDerWaalsContact C-N 3.31Å
132	D	91.9	Very high	95.9	Very high	168 Å²	168	45.9 Å²	45.9	90%	0.898	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-4.7	179.8	-57	-41.3	0	0	0	113.7	A130	A130-D132 PolarHBondContact O-N 3.47Å
133	V	96.2	Very high	96	Very high	39 Å²	39	46.6 Å²	46.6	24%	0.236	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	128.3	-178.7	-179.7	0	0	0	0	110.3	E22 L23 A26 T129 A130 G131	E22-V133 HydrophobicContact CB-CG1 4.24Å; L23-V133 HydrophobicContact CB-CG1 4.34Å; L23-V133 HydrophobicContact CD1-CG1 4.45Å; A26-V133 HydrophobicContact CB-CB 4.14Å; A26-V133 HydrophobicContact CB-CG2 3.84Å; T129-V133 VanDerWaalsContact CA-O 3.28Å; T129-V133 WeakPolarHBondContact CA-O 3.24Å; A130-V133 PolarHBondContact N-O 2.86Å; A130-V133 PolarHBondContact O-N 3.48Å; G131-V133 VanDerWaalsContact C-N 3.31Å
134	V	97.4	Very high	96	Very high	66 Å²	66	47 Å²	47	40%	0.4	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.9	177	-173.9	0	0	0	0	109.3	N19 T127 T129	N19-V134 WeakPolarHBondContact CB-O 3.2Å; N19-V134 PolarHBondContact ND2-O 3.44Å; T127-V134 HydrophobicContact CG2-CG1 3.46Å; T127-V134 VanDerWaalsContact CG2-CG1 3.46Å; T129-V134 HydrophobicContact CG2-CG1 4.39Å; T129-V134 HydrophobicContact CG2-CG2 4.12Å
135	C	97.6	Very high	95.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	133	168.8	168.9	0	0	0	0	109	E18 F20 L23 T127 M128	E18-C135 WeakPolarHBondContact O-CA 3.28Å; E18-C135 PolarHBondContact O-SG 2.91Å; F20-C135 VanDerWaalsContact CA-SG 3.56Å; L23-C135 HydrophobicContact CB-CB 3.92Å; L23-C135 HydrophobicContact CD1-CB 4.38Å; L23-C135 HydrophobicContact CD2-CB 3.9Å; L23-C135 HydrophobicContact CG-CB 4.29Å; T127-C135 CarbonylContact C-O 3.45Å; T127-C135 WeakPolarHBondContact CA-O 3.34Å; M128-C135 HydrophobicContact CB-CB 4.46Å; M128-C135 HydrophobicContact CE-CB 4.27Å; M128-C135 VanDerWaalsContact CE-SG 3.54Å; M128-C135 PolarHBondContact N-O 3.48Å; M128-C135 PolarHBondContact O-N 2.88Å
136	T	98.1	Very high	95.7	Very high	40 Å²	40	50.2 Å²	50.2	25%	0.245	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	132.7	178.6	-55.3	0	0	0	0	109.4	S17 E18 I125 L126 V138	S17-T136 WeakPolarHBondContact CA-O 3.37Å; E18-T136 PolarHBondContact N-O 2.86Å; E18-T136 PolarHBondContact O-N 2.83Å; I125-T136 HydrophobicContact CG2-CG2 3.91Å; L126-T136 CarbonylContact O-C 3.59Å; L126-T136 WeakPolarHBondContact O-CA 3.41Å; T136-V138 HydrophobicContact CG2-CG2 4.44Å
137	R	97.1	Very high	95.6	Very high	18 Å²	18	52.5 Å²	52.5	7%	0.068	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.9	175.9	-71.8	179.3	160.4	-157.8	-9.4	109	M14 S16 S17 F20 A41 L126 M128 Y139	M14-R137 HydrophobicContact CE-CB 4.3Å; M14-R137 HydrophobicContact CE-CG 4.01Å; S16-R137 WeakPolarHBondContact O-CA 3.37Å; S17-R137 WeakPolarHBondContact OG-CG 3.45Å; S17-R137 PolarHBondContact OG-NE 2.55Å; F20-R137 VanDerWaalsContact CE1-NH2 3.27Å; A41-R137 PolarHBondContact O-NH2 3.16Å; L126-R137 HydrophobicContact CB-CB 4.24Å; L126-R137 PolarHBondContact N-O 3.33Å; L126-R137 PolarHBondContact O-N 3.05Å; M128-R137 HydrophobicContact CE-CG 4.49Å; R137-Y139 HydrophobicContact CB-CD2 4.48Å; R137-Y139 HydrophobicContact CB-CE2 3.63Å
138	V	97.6	Very high	95.4	Very high	19 Å²	19	53.9 Å²	53.9	12%	0.115	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.7	179.1	-174.9	0	0	0	0	108.4	K15 S16 E123 T136	K15-V138 HydrophobicContact CB-CG1 4.48Å; K15-V138 HydrophobicContact CD-CG1 4.34Å; K15-V138 PolarHBondContact N-O 2.97Å; S16-V138 PolarHBondContact N-O 2.89Å; S16-V138 PolarHBondContact O-N 2.69Å; S16-V138 WeakPolarHBondContact OG-CB 3.46Å; S16-V138 WeakPolarHBondContact OG-CG2 3.29Å; E123-V138 HydrophobicContact CB-CG1 4.14Å; E123-V138 HydrophobicContact CG-CG1 4.42Å; E123-V138 WeakPolarHBondContact OE2-CG1 3.44Å; T136-V138 HydrophobicContact CG2-CG2 4.44Å
139	Y	97.4	Very high	95.3	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.016	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	142.4	177.8	-58.4	-102.4	0	0	0	109.9	W12 K13 M14 P44 V46 E123 L124 L126 R137	W12-Y139 HydrophobicContact CB-CD1 4.35Å; W12-Y139 HydrophobicContact CB-CG 4.49Å; K13-Y139 CarbonylContact O-C 3.59Å; K13-Y139 WeakPolarHBondContact O-CA 3.41Å; K13-Y139 WeakPolarHBondContact O-CB 3.4Å; M14-Y139 HydrophobicContact CB-CD1 4.1Å; M14-Y139 HydrophobicContact CB-CE1 3.97Å; M14-Y139 HydrophobicContact CE-CE1 3.99Å; M14-Y139 WeakPolarHBondContact CE-OH 3.42Å; P44-Y139 HydrophobicContact CG-CE1 4.2Å; V46-Y139 HydrophobicContact CB-CE1 4.42Å; V46-Y139 HydrophobicContact CG2-CD1 4.26Å; V46-Y139 HydrophobicContact CG2-CE1 3.64Å; E123-Y139 WeakPolarHBondContact CA-O 3.34Å; L124-Y139 PolarHBondContact N-O 3.17Å; L124-Y139 WeakPolarHBondContact O-CD2 3.45Å; L124-Y139 PolarHBondContact O-N 3.38Å; L126-Y139 HydrophobicContact CB-CE2 4.01Å; L126-Y139 HydrophobicContact CD2-CE2 4.41Å; R137-Y139 HydrophobicContact CB-CD2 4.48Å; R137-Y139 HydrophobicContact CB-CE2 3.63Å
140	E	96.3	Very high	95.3	Very high	67 Å²	67	57.8 Å²	57.8	31%	0.313	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	150.2	169.4	60.7	-177.7	-164.7	0	0	109.2	W12 K13 K15	W12-E140 WeakPolarHBondContact CA-O 3.5Å; K13-E140 HydrophobicContact CD-CG 4.03Å; K13-E140 WeakPolarHBondContact CD-OE1 3.25Å; K13-E140 WeakPolarHBondContact CE-OE1 3.45Å; K13-E140 HydrophobicContact CG-CG 3.63Å; K13-E140 WeakPolarHBondContact CG-O 3.48Å; K13-E140 PolarHBondContact N-O 3.45Å; K13-E140 IonicContact NZ-OE1 3.95Å; K13-E140 PolarHBondContact NZ-OE1 3.22Å; K13-E140 PolarHBondContact O-N 3.41Å; K15-E140 HydrophobicContact CB-CG 4.46Å
141	R	95.5	Very high	95.5	Very high	118 Å²	118	62.5 Å²	62.5	45%	0.445	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	136.8	176.8	-167.2	171.5	-76.4	-109.8	-0.9	109.1	S9 K11 W12	S9-R141 VanDerWaalsContact O-CZ 3.29Å; S9-R141 PolarHBondContact O-NH1 3.12Å; S9-R141 PolarHBondContact O-NH2 3.11Å; K11-R141 WeakPolarHBondContact O-CA 3.28Å; W12-R141 HydrophobicContact CE3-CB 4.22Å; W12-R141 HydrophobicContact CH2-CB 4.3Å; W12-R141 VanDerWaalsContact CZ2-NH2 3.29Å; W12-R141 HydrophobicContact CZ3-CB 3.93Å
142	E	91.1	Very high	96	Very high	172 Å²	172	64.6 Å²	64.6	80%	0.804	32%	0.322	S	S	*	.			trans	-72	0	172.9	-166.5	-178.4	172.4	0	0	111.5	K11	K11-E142 HydrophobicContact CB-CB 3.89Å; K11-E142 WeakPolarHBondContact CB-OE2 3.38Å; K11-E142 PolarHBondContact O-N 3.31Å

Retrieved 142 of 142 residues in 172.2 ms (Link to these results)

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