A0A096MBT4_POEFO Loading...

RALY RNA binding protein like

AlphaFold DB , UniProt , Accession A0A096MBT4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 105 aa.

						>A0A096MBT4_POEFO|A0A096MBT4
MTGKTQTSNVTNKNDPRSLNSRVFIGNLNTAIVKKTDIEVIFAKYGKIVGCSVHKGYAFVQYINERNARAAVAGENARIIAGQPLVIYRVFYYIQNQTHLPSPST
					

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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	38.1	Very low	65.8	Low	244 Å²	244	115.2 Å²	115.2	100%	1.202	64%	0.642	S	S	*	*				0	90.1	0	-69.5	176.9	-90	0	0	108.3	G3	M1-G3 PolarHBondContact O-N 3.28Å
2	T	43.3	Very low	67.4	Low	143 Å²	143	111.7 Å²	111.7	88%	0.877	62%	0.621	S	S	*	*			trans	-78.5	107.1	177.7	37.2	0	0	0	0	108.5	K4	T2-K4 PolarHBondContact O-N 3.14Å; T2-K4 VanDerWaalsContact O-N 3.14Å
3	G	43.1	Very low	68.6	Low	68 Å²	68	114.5 Å²	114.5	70%	0.701	62%	0.623	S	S	*	*			trans	-56.8	117.3	177.8	0	0	0	0	0	110	M1 T5	M1-G3 PolarHBondContact O-N 3.28Å; G3-T5 VanDerWaalsContact C-N 3.32Å; G3-T5 PolarHBondContact O-N 2.88Å
4	K	48.2	Very low	69.6	Low	204 Å²	204	116.2 Å²	116.2	89%	0.887	63%	0.631	S	S	*	*			trans	-61.1	98.5	168.1	-76.8	178.6	175.2	174.1	0	107.1	T2 Q6	T2-K4 PolarHBondContact O-N 3.14Å; T2-K4 VanDerWaalsContact O-N 3.14Å; K4-Q6 PolarHBondContact O-N 3.24Å
5	T	55.2	Low	70.4	Confident	97 Å²	97	112.2 Å²	112.2	60%	0.595	61%	0.609	S	S	*	*			trans	-53.5	115.3	166.6	2.1	0	0	0	0	107.3	G3 T7	G3-T5 VanDerWaalsContact C-N 3.32Å; G3-T5 PolarHBondContact O-N 2.88Å; T5-T7 PolarHBondContact O-N 3.14Å; T5-T7 VanDerWaalsContact O-N 3.11Å
6	Q	65.9	Low	70.9	Confident	194 Å²	194	110.3 Å²	110.3	91%	0.907	60%	0.604	S	S	*	*			trans	-68.7	108.9	-173.1	-164.1	171.1	30.6	0	0	109.1	K4 S8	K4-Q6 PolarHBondContact O-N 3.24Å; Q6-S8 PolarHBondContact O-N 3.16Å
7	T	81.1	Confident	71.2	Confident	27 Å²	27	116.1 Å²	116.1	17%	0.166	62%	0.615	C	S	.	*			trans	-68.1	126.5	173.9	-55.8	0	0	0	0	109.2	T5 K35 E39 I48 C51	T5-T7 PolarHBondContact O-N 3.14Å; T5-T7 VanDerWaalsContact O-N 3.11Å; T7-K35 PolarHBondContact O-NZ 3.12Å; T7-E39 VanDerWaalsContact CB-OE1 3.22Å; T7-E39 WeakPolarHBondContact CB-OE1 3.07Å; T7-E39 HydrophobicContact CG2-CG 4.39Å; T7-E39 VanDerWaalsContact CG2-OE1 3.29Å; T7-E39 WeakPolarHBondContact CG2-OE1 3.39Å; T7-I48 HydrophobicContact CG2-CB 4.24Å; T7-I48 HydrophobicContact CG2-CG2 3.53Å; T7-C51 HydrophobicContact CG2-CB 3.88Å
8	S	89.1	Confident	71.8	Confident	49 Å²	49	110.7 Å²	110.7	34%	0.343	59%	0.588	S	S	.	*	B	Isolated β-bridge	trans	-59.6	146	176.5	-177.6	0	0	0	0	111.5	Q6 V10 V49 G50 C51	Q6-S8 PolarHBondContact O-N 3.16Å; S8-V10 PolarHBondContact O-N 3.48Å; S8-V10 VanDerWaalsContact OG-CG2 3.26Å; S8-V10 WeakPolarHBondContact OG-CG2 3.28Å; S8-V10 PolarHBondContact OG-N 2.86Å; S8-V10 PolarHBondContact OG-O 2.93Å; S8-V49 WeakPolarHBondContact CB-O 3.36Å; S8-V49 PolarHBondContact N-O 3.23Å; S8-G50 CarbonylContact O-C 3.53Å; S8-G50 WeakPolarHBondContact O-CA 3.48Å; S8-C51 PolarHBondContact O-N 3.02Å
9	N	87.8	Confident	72.3	Confident	115 Å²	115	106.4 Å²	106.4	62%	0.615	57%	0.565	S	S	*	*	S	Bend	trans	-79.4	-3.1	173.4	-66.7	-30.5	0	0	0	112.9	K35 C51 S52	N9-K35 WeakPolarHBondContact OD1-CE 3.41Å; N9-K35 PolarHBondContact OD1-NZ 3.34Å; N9-C51 CarbonylContact C-O 3.33Å; N9-C51 WeakPolarHBondContact CA-O 3.27Å; N9-S52 WeakPolarHBondContact O-CB 3.28Å
10	V	85.6	Confident	73	Confident	103 Å²	103	102.8 Å²	102.8	62%	0.624	55%	0.546	S	S	*	.			trans	-127	151.7	-179.4	-65.8	0	0	0	0	111	S8	S8-V10 PolarHBondContact O-N 3.48Å; S8-V10 VanDerWaalsContact OG-CG2 3.26Å; S8-V10 WeakPolarHBondContact OG-CG2 3.28Å; S8-V10 PolarHBondContact OG-N 2.86Å; S8-V10 PolarHBondContact OG-O 2.93Å
11	T	86.6	Confident	73.9	Confident	23 Å²	23	98.2 Å²	98.2	14%	0.141	52%	0.522	C	S	.	.			trans	-117.7	141.5	176.4	56.8	0	0	0	0	110	R22 F59 Q61	T11-R22 PolarHBondContact OG1-NE 3.37Å; T11-R22 VanDerWaalsContact OG1-NE 3.13Å; T11-R22 PolarHBondContact OG1-NH1 2.95Å; T11-R22 PolarHBondContact OG1-NH2 3.39Å; T11-F59 HydrophobicContact CG2-CB 4.01Å; T11-Q61 HydrophobicContact CG2-CB 3.81Å
12	N	85.3	Confident	76.5	Confident	73 Å²	73	87.5 Å²	87.5	39%	0.39	47%	0.468	S	S	.	.			trans	-75.2	134.5	178.7	-170.1	-16.9	0	0	0	110.7	N14 D15 R22 Q61	N12-N14 PolarHBondContact OD1-N 2.81Å; N12-D15 PolarHBondContact OD1-N 3.41Å; N12-R22 PolarHBondContact O-NH1 3.41Å; N12-Q61 PolarHBondContact O-OE1 3Å
13	K	82.4	Confident	79	Confident	149 Å²	149	80.7 Å²	80.7	65%	0.648	43%	0.426	S	S	*	.	S	Bend	trans	-117.1	-7.7	178.4	67.1	-175	177	174.8	0	113.9
14	N	82.3	Confident	81.4	Confident	138 Å²	138	80.1 Å²	80.1	74%	0.738	41%	0.405	S	S	*	.	S	Bend	trans	-97.8	-28.1	-172.7	-61.3	-16.9	0	0	0	112.2	N12	N12-N14 PolarHBondContact OD1-N 2.81Å
15	D	82.2	Confident	83.6	Confident	56 Å²	56	70.4 Å²	70.4	30%	0.299	36%	0.363	S	S	.	.			trans	-87.3	121.8	178.5	165.8	33.5	0	0	0	111.2	N12 R17 S18 L19	N12-D15 PolarHBondContact OD1-N 3.41Å; D15-R17 PolarHBondContact O-N 2.9Å; D15-R17 PolarHBondContact OD1-N 2.76Å; D15-S18 WeakPolarHBondContact O-CA 3.47Å; D15-S18 WeakPolarHBondContact O-CB 3.22Å; D15-S18 PolarHBondContact O-N 2.86Å; D15-S18 VanDerWaalsContact O-N 3.08Å; D15-S18 WeakPolarHBondContact OD2-CB 3.42Å; D15-S18 PolarHBondContact OD2-N 2.95Å; D15-S18 PolarHBondContact OD2-OG 3.13Å; D15-L19 PolarHBondContact O-N 3.04Å
16	P	77.9	Confident	85.4	Confident	81 Å²	81	66 Å²	66	53%	0.526	34%	0.336	S	S	.	.	H	α-helix	trans	-56.2	-34	177.2	-25.7	34.5	0	0	0	114.2	L19 N20	P16-L19 PolarHBondContact O-N 3.48Å; P16-N20 PolarHBondContact O-N 3.02Å; P16-N20 PolarHBondContact O-ND2 3.21Å
17	R	77	Confident	86.8	Confident	209 Å²	209	60.1 Å²	60.1	79%	0.789	31%	0.311	S	S	*	.	H	α-helix	trans	-67.7	-41.2	177.2	-66	-179.8	178	176.5	0.2	110.8	D15 N20 S21	D15-R17 PolarHBondContact O-N 2.9Å; D15-R17 PolarHBondContact OD1-N 2.76Å; R17-N20 WeakPolarHBondContact O-CB 3.47Å; R17-N20 PolarHBondContact O-N 3.17Å; R17-S21 PolarHBondContact O-N 2.64Å; R17-S21 PolarHBondContact O-OG 2.94Å
18	S	80.6	Confident	87.4	Confident	20 Å²	20	59.2 Å²	59.2	14%	0.14	31%	0.305	C	S	.	.	H	α-helix	trans	-61.9	-41	172	-61.6	0	0	0	0	111.7	D15 N20 S21 R22 Q61	D15-S18 WeakPolarHBondContact O-CA 3.47Å; D15-S18 WeakPolarHBondContact O-CB 3.22Å; D15-S18 PolarHBondContact O-N 2.86Å; D15-S18 VanDerWaalsContact O-N 3.08Å; D15-S18 WeakPolarHBondContact OD2-CB 3.42Å; D15-S18 PolarHBondContact OD2-N 2.95Å; D15-S18 PolarHBondContact OD2-OG 3.13Å; S18-N20 PolarHBondContact O-N 3.11Å; S18-S21 PolarHBondContact O-N 2.99Å; S18-S21 PolarHBondContact O-OG 2.88Å; S18-R22 WeakPolarHBondContact O-CB 3.24Å; S18-R22 PolarHBondContact O-N 3.25Å; S18-R22 VanDerWaalsContact O-N 3.14Å; S18-Q61 PolarHBondContact O-NE2 2.83Å; S18-Q61 PolarHBondContact O-OE1 3.18Å
19	L	82	Confident	87.6	Confident	29 Å²	29	58.9 Å²	58.9	15%	0.152	30%	0.299	C	S	.	.	H	α-helix	trans	-59.8	-35.4	175.5	-66.9	175.3	0	0	0	112.8	D15 P16 R22 V90 F91	D15-L19 PolarHBondContact O-N 3.04Å; P16-L19 PolarHBondContact O-N 3.48Å; L19-R22 PolarHBondContact O-N 3.24Å; L19-V90 HydrophobicContact CD2-CG1 3.97Å; L19-F91 HydrophobicContact CB-CB 4.18Å; L19-F91 HydrophobicContact CB-CD2 4.23Å; L19-F91 WeakPolarHBondContact O-CB 3.45Å; L19-F91 PolarHBondContact O-N 3.44Å
20	N	85.6	Confident	87.9	Confident	34 Å²	34	55 Å²	55	18%	0.182	28%	0.28	C	S	.	.	H	α-helix	trans	-69.9	-30.9	179.5	-86.4	-45.5	0	0	0	114.4	P16 R17 S18 E65 R89 F91	P16-N20 PolarHBondContact O-N 3.02Å; P16-N20 PolarHBondContact O-ND2 3.21Å; R17-N20 WeakPolarHBondContact O-CB 3.47Å; R17-N20 PolarHBondContact O-N 3.17Å; S18-N20 PolarHBondContact O-N 3.11Å; N20-E65 HydrophobicContact CB-CB 4.49Å; N20-R89 PolarHBondContact O-NE 3.21Å; N20-R89 PolarHBondContact O-NH2 2.69Å; N20-R89 PolarHBondContact OD1-NH2 3.33Å; N20-F91 VanDerWaalsContact OD1-CB 3.29Å; N20-F91 WeakPolarHBondContact OD1-CB 3.32Å; N20-F91 WeakPolarHBondContact OD1-CD1 2.98Å; N20-F91 WeakPolarHBondContact OD1-CG 2.83Å
21	S	92.3	Very high	88.2	Confident	6 Å²	6	53.8 Å²	53.8	4%	0.042	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	10.7	177.8	58.7	0	0	0	0	113.8	R17 S18 Q61 Y62 N64	R17-S21 PolarHBondContact O-N 2.64Å; R17-S21 PolarHBondContact O-OG 2.94Å; S18-S21 PolarHBondContact O-N 2.99Å; S18-S21 PolarHBondContact O-OG 2.88Å; S21-Q61 PolarHBondContact O-NE2 2.85Å; S21-Q61 PolarHBondContact OG-NE2 3.15Å; S21-Y62 WeakPolarHBondContact CB-O 3.23Å; S21-Y62 PolarHBondContact O-N 3Å; S21-Y62 PolarHBondContact OG-O 2.76Å; S21-N64 VanDerWaalsContact CB-C 3.49Å
22	R	93.6	Very high	88.6	Confident	19 Å²	19	57.6 Å²	57.6	7%	0.072	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.5	177.9	-164	174.3	167.6	-172.2	-7.3	112	T11 N12 S18 L19 F59 V60 V90	T11-R22 PolarHBondContact OG1-NE 3.37Å; T11-R22 VanDerWaalsContact OG1-NE 3.13Å; T11-R22 PolarHBondContact OG1-NH1 2.95Å; T11-R22 PolarHBondContact OG1-NH2 3.39Å; N12-R22 PolarHBondContact O-NH1 3.41Å; S18-R22 WeakPolarHBondContact O-CB 3.24Å; S18-R22 PolarHBondContact O-N 3.25Å; S18-R22 VanDerWaalsContact O-N 3.14Å; L19-R22 PolarHBondContact O-N 3.24Å; R22-F59 HydrophobicContact CG-CD1 4.36Å; R22-F59 VanDerWaalsContact NE-CD1 3.34Å; R22-F59 VanDerWaalsContact NH2-CE2 3.3Å; R22-V60 CarbonylContact C-O 3.59Å; R22-V60 WeakPolarHBondContact CA-O 3.34Å; R22-V90 HydrophobicContact CB-CB 4.23Å; R22-V90 HydrophobicContact CB-CG2 4.04Å; R22-V90 HydrophobicContact CG-CB 4.49Å; R22-V90 HydrophobicContact CG-CG2 3.83Å; R22-V90 PolarHBondContact O-N 3.5Å
23	V	94.8	Very high	89	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134	179.3	-178.5	0	0	0	0	109.2	I25 F59 V60 Y62 A68 A71 V72 I87 Y88	V23-I25 HydrophobicContact CG1-CG1 4.38Å; V23-F59 VanDerWaalsContact O-CA 3.28Å; V23-F59 WeakPolarHBondContact O-CA 3.31Å; V23-V60 PolarHBondContact N-O 3.37Å; V23-V60 PolarHBondContact O-N 3.06Å; V23-Y62 HydrophobicContact CG2-CD2 4.33Å; V23-Y62 HydrophobicContact CG2-CE2 4.01Å; V23-A68 HydrophobicContact CG2-CB 3.56Å; V23-A71 HydrophobicContact CG2-CB 4.49Å; V23-V72 HydrophobicContact CG1-CG2 4.03Å; V23-V72 HydrophobicContact CG2-CG2 4.31Å; V23-I87 HydrophobicContact CG1-CG2 3.19Å; V23-Y88 CarbonylContact C-O 3.44Å; V23-Y88 WeakPolarHBondContact CA-O 3.49Å
24	F	94.3	Very high	89.6	Confident	56 Å²	56	52.5 Å²	52.5	25%	0.246	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	137	167	171.5	-96.9	0	0	0	109.5	G26 Y57 F59 I87 Y88 V90	F24-G26 VanDerWaalsContact CE1-CA 3.47Å; F24-Y57 HydrophobicContact CD2-CD2 4.34Å; F24-Y57 AromaticContact CE2-CD2 3.73Å; F24-Y57 HydrophobicContact CE2-CD2 3.73Å; F24-Y57 AromaticContact CE2-CG 3.82Å; F24-Y57 HydrophobicContact CE2-CG 3.82Å; F24-Y57 HydrophobicContact CZ-CG 4.4Å; F24-F59 HydrophobicContact CB-CD1 4.19Å; F24-F59 HydrophobicContact CB-CE1 3.96Å; F24-F59 HydrophobicContact CD2-CD1 4.26Å; F24-F59 AromaticContact CD2-CE1 3.63Å; F24-F59 HydrophobicContact CD2-CE1 3.63Å; F24-F59 AromaticContact CD2-CZ 3.89Å; F24-F59 HydrophobicContact CD2-CZ 3.89Å; F24-F59 HydrophobicContact CG-CE1 4.29Å; F24-I87 WeakPolarHBondContact O-CA 3.45Å; F24-I87 VanDerWaalsContact O-CG2 3.31Å; F24-I87 WeakPolarHBondContact O-CG2 3.4Å; F24-Y88 HydrophobicContact CD1-CD2 4.18Å; F24-Y88 PolarHBondContact N-O 3.44Å; F24-Y88 PolarHBondContact O-N 2.82Å; F24-Y88 VanDerWaalsContact O-N 3.11Å; F24-V90 HydrophobicContact CB-CG2 4.21Å
25	I	94.9	Very high	90.1	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	104.2	177.8	-52.7	162.5	0	0	0	107.2	V23 I38 F42 Y57 A58 V60 L85	V23-I25 HydrophobicContact CG1-CG1 4.38Å; I25-I38 HydrophobicContact CD1-CG2 3.7Å; I25-F42 HydrophobicContact CD1-CD1 4.29Å; I25-F42 HydrophobicContact CD1-CD2 4.04Å; I25-F42 HydrophobicContact CD1-CE1 3.79Å; I25-F42 HydrophobicContact CD1-CE2 3.5Å; I25-F42 VanDerWaalsContact CD1-CE2 3.5Å; I25-F42 HydrophobicContact CD1-CG 4.42Å; I25-F42 HydrophobicContact CD1-CZ 3.36Å; I25-F42 HydrophobicContact CG1-CE1 4.04Å; I25-F42 HydrophobicContact CG1-CE2 4.27Å; I25-F42 HydrophobicContact CG1-CZ 3.67Å; I25-F42 HydrophobicContact CG2-CZ 4.39Å; I25-Y57 CarbonylContact O-C 3.52Å; I25-Y57 WeakPolarHBondContact O-CA 3.22Å; I25-Y57 VanDerWaalsContact O-CB 3.26Å; I25-Y57 WeakPolarHBondContact O-CB 3.48Å; I25-A58 HydrophobicContact CB-CB 4.46Å; I25-A58 HydrophobicContact CD1-CB 4.44Å; I25-A58 PolarHBondContact N-O 3.02Å; I25-A58 PolarHBondContact O-N 3.36Å; I25-V60 HydrophobicContact CD1-CB 4.43Å; I25-V60 HydrophobicContact CD1-CG2 3.65Å; I25-L85 HydrophobicContact CG2-CD1 4.15Å; I25-L85 HydrophobicContact CG2-CD2 4.14Å
26	G	93.2	Very high	90.7	Very high	3 Å²	3	49.7 Å²	49.7	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	175.6	179.8	0	0	0	0	0	113.1	F24 L28 V86	F24-G26 VanDerWaalsContact CE1-CA 3.47Å; G26-L28 PolarHBondContact O-N 3.36Å; G26-V86 PolarHBondContact N-O 3.3Å; G26-V86 PolarHBondContact O-N 2.87Å; G26-V86 VanDerWaalsContact O-N 3.07Å
27	N	94.6	Very high	91.5	Very high	72 Å²	72	49 Å²	49	39%	0.385	25%	0.252	S	S	.	.	S	Bend	trans	53.1	40.8	-173.3	-162.4	36.6	0	0	0	112.2	G56 Q83 P84 V86	N27-G56 PolarHBondContact N-O 2.8Å; N27-Q83 WeakPolarHBondContact O-CB 3.29Å; N27-Q83 PolarHBondContact O-OE1 3.24Å; N27-P84 WeakPolarHBondContact CB-O 2.9Å; N27-P84 WeakPolarHBondContact ND2-CD 3.01Å; N27-P84 PolarHBondContact ND2-O 3.32Å; N27-V86 HydrophobicContact CB-CG2 4.03Å
28	L	93.3	Very high	92.3	Very high	7 Å²	7	39.3 Å²	39.3	4%	0.037	22%	0.216	C	C	.	.			trans	-98.2	123.4	-175.4	-175	67.7	0	0	0	110.1	G26 T30 V33 I38 G56 A58 L85	G26-L28 PolarHBondContact O-N 3.36Å; L28-T30 VanDerWaalsContact C-N 3.31Å; L28-T30 HydrophobicContact CB-CG2 4.27Å; L28-T30 HydrophobicContact CD2-CG2 3.74Å; L28-T30 HydrophobicContact CG-CG2 3.89Å; L28-T30 PolarHBondContact O-N 3.48Å; L28-V33 HydrophobicContact CD1-CB 3.91Å; L28-V33 HydrophobicContact CD1-CG1 3.88Å; L28-V33 HydrophobicContact CD1-CG2 3.97Å; L28-V33 HydrophobicContact CG-CB 4.33Å; L28-I38 HydrophobicContact CD2-CD1 3.69Å; L28-I38 HydrophobicContact CD2-CG1 4.36Å; L28-G56 PolarHBondContact N-O 2.97Å; L28-G56 VanDerWaalsContact N-O 3.09Å; L28-G56 CarbonylContact O-C 3.59Å; L28-G56 VanDerWaalsContact O-CA 3.32Å; L28-G56 WeakPolarHBondContact O-CA 3.17Å; L28-A58 HydrophobicContact CD2-CB 3.96Å; L28-L85 HydrophobicContact CD1-CD2 3.84Å
29	N	94	Very high	93	Very high	42 Å²	42	40.2 Å²	40.2	23%	0.225	22%	0.218	C	C	.	.			trans	-75.2	81.8	173.8	-168.3	-17	0	0	0	111	A31 I32 V33 A81 Q83	N29-A31 PolarHBondContact O-N 2.94Å; N29-A31 VanDerWaalsContact O-N 3.16Å; N29-A31 WeakPolarHBondContact OD1-CB 3.41Å; N29-A31 PolarHBondContact OD1-N 3.39Å; N29-I32 WeakPolarHBondContact ND2-CD1 3.26Å; N29-I32 PolarHBondContact O-N 2.82Å; N29-V33 PolarHBondContact O-N 3.03Å; N29-A81 HydrophobicContact CB-CB 4.11Å; N29-Q83 VanDerWaalsContact CB-OE1 3.3Å
30	T	92.6	Very high	93.6	Very high	34 Å²	34	44.4 Å²	44.4	21%	0.209	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-5.7	-176.7	57.1	0	0	0	0	114.7	L28 I32 V53 H54 G56	L28-T30 VanDerWaalsContact C-N 3.31Å; L28-T30 HydrophobicContact CB-CG2 4.27Å; L28-T30 HydrophobicContact CD2-CG2 3.74Å; L28-T30 HydrophobicContact CG-CG2 3.89Å; L28-T30 PolarHBondContact O-N 3.48Å; T30-I32 VanDerWaalsContact C-N 3.3Å; T30-V53 HydrophobicContact CG2-CG1 4Å; T30-H54 VanDerWaalsContact CG2-O 3.23Å; T30-H54 WeakPolarHBondContact CG2-O 3.4Å; T30-G56 PolarHBondContact OG1-N 2.93Å
31	A	93.6	Very high	93.9	Very high	77 Å²	77	44.1 Å²	44.1	64%	0.636	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-37.5	167.1	0	0	0	0	0	110.5	N29 K34	N29-A31 PolarHBondContact O-N 2.94Å; N29-A31 VanDerWaalsContact O-N 3.16Å; N29-A31 WeakPolarHBondContact OD1-CB 3.41Å; N29-A31 PolarHBondContact OD1-N 3.39Å; A31-K34 PolarHBondContact O-NZ 3.34Å
32	I	94.1	Very high	94.1	Very high	104 Å²	104	44 Å²	44	53%	0.533	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-55.5	-177.2	-59	179.5	0	0	0	110.5	N29 T30 K34 A81	N29-I32 WeakPolarHBondContact ND2-CD1 3.26Å; N29-I32 PolarHBondContact O-N 2.82Å; T30-I32 VanDerWaalsContact C-N 3.3Å; I32-K34 PolarHBondContact O-N 3.16Å; I32-A81 HydrophobicContact CB-CB 4.12Å; I32-A81 HydrophobicContact CD1-CB 4.21Å; I32-A81 HydrophobicContact CG2-CB 3.95Å
33	V	93.9	Very high	94.2	Very high	7 Å²	7	45.7 Å²	45.7	4%	0.042	26%	0.259	C	S	.	.			trans	-77.3	125	-173.4	-171.3	0	0	0	0	110.8	L28 N29 D37 I38 I80 A81	L28-V33 HydrophobicContact CD1-CB 3.91Å; L28-V33 HydrophobicContact CD1-CG1 3.88Å; L28-V33 HydrophobicContact CD1-CG2 3.97Å; L28-V33 HydrophobicContact CG-CB 4.33Å; N29-V33 PolarHBondContact O-N 3.03Å; V33-D37 HydrophobicContact CG1-CB 3.87Å; V33-I38 HydrophobicContact CG1-CG1 4Å; V33-I80 HydrophobicContact CG2-CG2 3.65Å; V33-A81 HydrophobicContact CG2-CB 3.87Å
34	K	94.4	Very high	94.2	Very high	107 Å²	107	52.1 Å²	52.1	47%	0.465	29%	0.287	S	S	.	.			trans	-102.8	165.8	179.1	-53.4	-55.5	171.1	-165.9	0	111.4	A31 I32 T36 D37 I38	A31-K34 PolarHBondContact O-NZ 3.34Å; I32-K34 PolarHBondContact O-N 3.16Å; K34-T36 PolarHBondContact O-N 2.89Å; K34-D37 PolarHBondContact N-OD2 3.45Å; K34-D37 WeakPolarHBondContact O-CB 3.36Å; K34-D37 PolarHBondContact O-N 3.3Å; K34-I38 PolarHBondContact O-N 2.83Å
35	K	93.4	Very high	94.3	Very high	49 Å²	49	51.3 Å²	51.3	21%	0.213	28%	0.283	C	S	.	.	H	α-helix	trans	-50.9	-42.2	175.7	-171.5	-171.5	-171.3	-122	0	112.2	T7 N9 D37 I38 E39 C51 V53	T7-K35 PolarHBondContact O-NZ 3.12Å; N9-K35 WeakPolarHBondContact OD1-CE 3.41Å; N9-K35 PolarHBondContact OD1-NZ 3.34Å; K35-D37 VanDerWaalsContact C-N 3.31Å; K35-D37 PolarHBondContact O-N 3.13Å; K35-I38 WeakPolarHBondContact O-CB 3.22Å; K35-I38 PolarHBondContact O-N 3.22Å; K35-E39 WeakPolarHBondContact CE-OE1 3.39Å; K35-E39 HydrophobicContact CG-CG 4.45Å; K35-E39 IonicContact NZ-OE1 2.69Å; K35-E39 PolarHBondContact NZ-OE1 3.45Å; K35-E39 WeakPolarHBondContact O-CG 3.44Å; K35-E39 PolarHBondContact O-N 3.17Å; K35-C51 WeakPolarHBondContact CE-O 2.97Å; K35-C51 HydrophobicContact CG-CB 4.41Å; K35-V53 HydrophobicContact CB-CG2 3.83Å; K35-V53 HydrophobicContact CG-CG2 4.02Å
36	T	94	Very high	94.2	Very high	86 Å²	86	52.3 Å²	52.3	53%	0.528	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-38.5	179.6	47	0	0	0	0	112.5	K34 E39 V40	K34-T36 PolarHBondContact O-N 2.89Å; T36-E39 PolarHBondContact O-N 3.36Å; T36-V40 WeakPolarHBondContact O-CB 3.24Å; T36-V40 VanDerWaalsContact O-CG2 3.27Å; T36-V40 WeakPolarHBondContact O-CG2 3.37Å; T36-V40 PolarHBondContact O-N 2.77Å
37	D	94.4	Very high	94.3	Very high	68 Å²	68	57.4 Å²	57.4	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-67	-42.4	178.2	-53.4	-43	0	0	0	110.5	V33 K34 K35 V40 I41	V33-D37 HydrophobicContact CG1-CB 3.87Å; K34-D37 PolarHBondContact N-OD2 3.45Å; K34-D37 WeakPolarHBondContact O-CB 3.36Å; K34-D37 PolarHBondContact O-N 3.3Å; K35-D37 VanDerWaalsContact C-N 3.31Å; K35-D37 PolarHBondContact O-N 3.13Å; D37-V40 PolarHBondContact O-N 3.19Å; D37-I41 WeakPolarHBondContact O-CB 3.42Å; D37-I41 WeakPolarHBondContact O-CD1 3.34Å; D37-I41 VanDerWaalsContact O-CG1 3.22Å; D37-I41 WeakPolarHBondContact O-CG1 3.41Å; D37-I41 PolarHBondContact O-N 2.71Å
38	I	94.8	Very high	94.3	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-61.8	-48.4	175.8	-57.9	167.8	0	0	0	109.7	I25 L28 V33 K34 K35 V40 I41 F42 V53 A58 V60	I25-I38 HydrophobicContact CD1-CG2 3.7Å; L28-I38 HydrophobicContact CD2-CD1 3.69Å; L28-I38 HydrophobicContact CD2-CG1 4.36Å; V33-I38 HydrophobicContact CG1-CG1 4Å; K34-I38 PolarHBondContact O-N 2.83Å; K35-I38 WeakPolarHBondContact O-CB 3.22Å; K35-I38 PolarHBondContact O-N 3.22Å; I38-V40 VanDerWaalsContact C-N 3.33Å; I38-V40 PolarHBondContact O-N 3.45Å; I38-I41 PolarHBondContact O-N 3.35Å; I38-F42 HydrophobicContact CG2-CD2 3.89Å; I38-F42 HydrophobicContact CG2-CE2 4.26Å; I38-F42 WeakPolarHBondContact O-CB 3.33Å; I38-F42 VanDerWaalsContact O-CD2 3.22Å; I38-F42 WeakPolarHBondContact O-CD2 3.48Å; I38-F42 PolarHBondContact O-N 2.94Å; I38-V53 HydrophobicContact CD1-CG1 4.44Å; I38-V53 HydrophobicContact CD1-CG2 3.65Å; I38-A58 HydrophobicContact CD1-CB 3.59Å; I38-V60 HydrophobicContact CG2-CG2 3.61Å
39	E	94.6	Very high	94.3	Very high	40 Å²	40	57.2 Å²	57.2	19%	0.187	32%	0.315	C	S	.	.	H	α-helix	trans	-59.1	-44.1	178.2	-73.9	176.6	173.6	0	0	111.7	T7 K35 T36 A43 I48 C51	T7-E39 VanDerWaalsContact CB-OE1 3.22Å; T7-E39 WeakPolarHBondContact CB-OE1 3.07Å; T7-E39 HydrophobicContact CG2-CG 4.39Å; T7-E39 VanDerWaalsContact CG2-OE1 3.29Å; T7-E39 WeakPolarHBondContact CG2-OE1 3.39Å; K35-E39 WeakPolarHBondContact CE-OE1 3.39Å; K35-E39 HydrophobicContact CG-CG 4.45Å; K35-E39 IonicContact NZ-OE1 2.69Å; K35-E39 PolarHBondContact NZ-OE1 3.45Å; K35-E39 WeakPolarHBondContact O-CG 3.44Å; K35-E39 PolarHBondContact O-N 3.17Å; T36-E39 PolarHBondContact O-N 3.36Å; E39-A43 WeakPolarHBondContact O-CB 3.4Å; E39-A43 PolarHBondContact O-N 2.85Å; E39-I48 HydrophobicContact CB-CD1 4.5Å; E39-C51 HydrophobicContact CG-CB 4.09Å
40	V	94.3	Very high	94.3	Very high	116 Å²	116	55.2 Å²	55.2	70%	0.703	31%	0.305	S	S	*	.	H	α-helix	trans	-63.2	-46.8	178.3	167.2	0	0	0	0	111.6	T36 D37 I38 F42	T36-V40 WeakPolarHBondContact O-CB 3.24Å; T36-V40 VanDerWaalsContact O-CG2 3.27Å; T36-V40 WeakPolarHBondContact O-CG2 3.37Å; T36-V40 PolarHBondContact O-N 2.77Å; D37-V40 PolarHBondContact O-N 3.19Å; I38-V40 VanDerWaalsContact C-N 3.33Å; I38-V40 PolarHBondContact O-N 3.45Å; V40-F42 VanDerWaalsContact C-N 3.35Å; V40-F42 PolarHBondContact O-N 3.39Å
41	I	93.8	Very high	94.5	Very high	28 Å²	28	53.6 Å²	53.6	14%	0.144	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-42.7	-178.5	-71	167.3	0	0	0	111.1	D37 I38 K44 E75 I80	D37-I41 WeakPolarHBondContact O-CB 3.42Å; D37-I41 WeakPolarHBondContact O-CD1 3.34Å; D37-I41 VanDerWaalsContact O-CG1 3.22Å; D37-I41 WeakPolarHBondContact O-CG1 3.41Å; D37-I41 PolarHBondContact O-N 2.71Å; I38-I41 PolarHBondContact O-N 3.35Å; I41-K44 VanDerWaalsContact O-CE 3.28Å; I41-K44 WeakPolarHBondContact O-CE 3.5Å; I41-K44 WeakPolarHBondContact O-CG 3.49Å; I41-E75 HydrophobicContact CG2-CG 4.34Å; I41-I80 HydrophobicContact CD1-CD1 3.5Å
42	F	95.6	Very high	94.6	Very high	4 Å²	4	50.6 Å²	50.6	2%	0.018	27%	0.269	C	S	.	.	H	α-helix	trans	-88.1	-17.9	-172.5	-76	-99.1	0	0	0	112.8	I25 I38 V40 K44 Y45 I48 V60 Y62 A71 E75 I87	I25-F42 HydrophobicContact CD1-CD1 4.29Å; I25-F42 HydrophobicContact CD1-CD2 4.04Å; I25-F42 HydrophobicContact CD1-CE1 3.79Å; I25-F42 HydrophobicContact CD1-CE2 3.5Å; I25-F42 VanDerWaalsContact CD1-CE2 3.5Å; I25-F42 HydrophobicContact CD1-CG 4.42Å; I25-F42 HydrophobicContact CD1-CZ 3.36Å; I25-F42 HydrophobicContact CG1-CE1 4.04Å; I25-F42 HydrophobicContact CG1-CE2 4.27Å; I25-F42 HydrophobicContact CG1-CZ 3.67Å; I25-F42 HydrophobicContact CG2-CZ 4.39Å; I38-F42 HydrophobicContact CG2-CD2 3.89Å; I38-F42 HydrophobicContact CG2-CE2 4.26Å; I38-F42 WeakPolarHBondContact O-CB 3.33Å; I38-F42 VanDerWaalsContact O-CD2 3.22Å; I38-F42 WeakPolarHBondContact O-CD2 3.48Å; I38-F42 PolarHBondContact O-N 2.94Å; V40-F42 VanDerWaalsContact C-N 3.35Å; V40-F42 PolarHBondContact O-N 3.39Å; F42-K44 PolarHBondContact O-N 2.8Å; F42-K44 VanDerWaalsContact O-N 3.16Å; F42-Y45 PolarHBondContact O-N 3.04Å; F42-Y45 VanDerWaalsContact O-N 3.12Å; F42-I48 HydrophobicContact CB-CD1 3.91Å; F42-V60 HydrophobicContact CB-CG1 4.25Å; F42-V60 HydrophobicContact CB-CG2 4.33Å; F42-V60 HydrophobicContact CD1-CG2 4.45Å; F42-V60 HydrophobicContact CG-CG2 4.22Å; F42-Y62 WeakPolarHBondContact CB-OH 3.32Å; F42-Y62 WeakPolarHBondContact CD1-OH 3.49Å; F42-Y62 PolarHBondContact O-OH 3.07Å; F42-A71 HydrophobicContact CD1-CB 3.99Å; F42-A71 HydrophobicContact CE1-CB 4.19Å; F42-E75 HydrophobicContact CE1-CB 4.37Å; F42-E75 HydrophobicContact CE1-CG 4.24Å; F42-E75 HydrophobicContact CZ-CB 4.16Å; F42-E75 HydrophobicContact CZ-CG 4.18Å; F42-I87 HydrophobicContact CE1-CD1 4.2Å; F42-I87 HydrophobicContact CZ-CD1 3.83Å
43	A	95.2	Very high	94.6	Very high	55 Å²	55	48.2 Å²	48.2	46%	0.455	26%	0.259	S	S	.	.	H	α-helix	trans	-60.7	-26.2	178.5	0	0	0	0	0	113.8	E39 Y45 G46	E39-A43 WeakPolarHBondContact O-CB 3.4Å; E39-A43 PolarHBondContact O-N 2.85Å; A43-Y45 PolarHBondContact O-N 3.37Å; A43-G46 PolarHBondContact O-N 2.83Å; A43-G46 VanDerWaalsContact O-N 3.14Å
44	K	94.9	Very high	94.6	Very high	134 Å²	134	51.4 Å²	51.4	58%	0.583	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.2	177.5	70.2	-177.6	164.5	164.9	0	113.9	I41 F42 E75	I41-K44 VanDerWaalsContact O-CE 3.28Å; I41-K44 WeakPolarHBondContact O-CE 3.5Å; I41-K44 WeakPolarHBondContact O-CG 3.49Å; F42-K44 PolarHBondContact O-N 2.8Å; F42-K44 VanDerWaalsContact O-N 3.16Å; K44-E75 WeakPolarHBondContact CE-OE1 3.44Å; K44-E75 IonicContact NZ-OE1 3.15Å; K44-E75 PolarHBondContact NZ-OE1 2.93Å
45	Y	96	Very high	94.5	Very high	40 Å²	40	55.6 Å²	55.6	16%	0.157	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-15.4	177.6	-59.7	-71.6	0	0	0	112.8	F42 A43 N67 A70 A71 E75	F42-Y45 PolarHBondContact O-N 3.04Å; F42-Y45 VanDerWaalsContact O-N 3.12Å; A43-Y45 PolarHBondContact O-N 3.37Å; Y45-N67 VanDerWaalsContact O-CB 3.26Å; Y45-N67 WeakPolarHBondContact O-CB 3.16Å; Y45-N67 PolarHBondContact O-OD1 3.45Å; Y45-A70 HydrophobicContact CD1-CB 3.84Å; Y45-A70 WeakPolarHBondContact CE1-O 3.34Å; Y45-A71 HydrophobicContact CD1-CB 4.37Å; Y45-A71 HydrophobicContact CD2-CB 3.67Å; Y45-A71 HydrophobicContact CE2-CB 4.18Å; Y45-A71 HydrophobicContact CG-CB 3.79Å; Y45-E75 HydrophobicContact CE2-CG 3.5Å; Y45-E75 VanDerWaalsContact CE2-CG 3.5Å; Y45-E75 VanDerWaalsContact OH-CG 3.32Å; Y45-E75 WeakPolarHBondContact OH-CG 3.14Å; Y45-E75 PolarHBondContact OH-OE1 2.84Å
46	G	94.1	Very high	94.5	Very high	21 Å²	21	54.7 Å²	54.7	22%	0.216	30%	0.297	C	S	.	.	S	Bend	trans	145	-178	174.8	0	0	0	0	0	113.1	A43 I48 Y62	A43-G46 PolarHBondContact O-N 2.83Å; A43-G46 VanDerWaalsContact O-N 3.14Å; G46-I48 PolarHBondContact O-N 3.43Å; G46-Y62 WeakPolarHBondContact O-CE1 3.38Å
47	K	94.4	Very high	94.6	Very high	110 Å²	110	54.6 Å²	54.6	48%	0.478	29%	0.287	S	S	.	.			trans	-65.2	118.7	-176.2	-178.9	163.7	168.1	-172.7	0	111.7	I63	K47-I63 HydrophobicContact CB-CD1 3.82Å; K47-I63 HydrophobicContact CB-CG1 4.25Å; K47-I63 HydrophobicContact CD-CD1 3.57Å; K47-I63 HydrophobicContact CG-CD1 3.73Å; K47-I63 HydrophobicContact CG-CG1 4.24Å; K47-I63 PolarHBondContact O-N 3.35Å
48	I	94.8	Very high	94.6	Very high	15 Å²	15	51.3 Å²	51.3	8%	0.077	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	129.4	172.4	-55.1	175	0	0	0	108.2	T7 E39 F42 G46 G50 C51 V60 Q61 Y62	T7-I48 HydrophobicContact CG2-CB 4.24Å; T7-I48 HydrophobicContact CG2-CG2 3.53Å; E39-I48 HydrophobicContact CB-CD1 4.5Å; F42-I48 HydrophobicContact CB-CD1 3.91Å; G46-I48 PolarHBondContact O-N 3.43Å; I48-G50 VanDerWaalsContact CG2-O 3.27Å; I48-G50 WeakPolarHBondContact CG2-O 3.27Å; I48-C51 HydrophobicContact CG2-CB 4.37Å; I48-V60 HydrophobicContact CD1-CG1 4.03Å; I48-V60 HydrophobicContact CG1-CG1 3.96Å; I48-V60 HydrophobicContact CG2-CG1 3.96Å; I48-Q61 WeakPolarHBondContact CA-O 3.26Å; I48-Y62 HydrophobicContact CG1-CD1 4.2Å; I48-Y62 HydrophobicContact CG1-CE1 3.83Å
49	V	94.3	Very high	94.7	Very high	60 Å²	60	52.8 Å²	52.8	36%	0.364	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-19.7	175.4	-65.8	0	0	0	0	112.5	S8 Q61 I63	S8-V49 WeakPolarHBondContact CB-O 3.36Å; S8-V49 PolarHBondContact N-O 3.23Å; V49-Q61 HydrophobicContact CG2-CB 4.05Å; V49-Q61 HydrophobicContact CG2-CG 3.52Å; V49-Q61 WeakPolarHBondContact CG2-O 3.11Å; V49-Q61 PolarHBondContact N-O 3.07Å; V49-I63 HydrophobicContact CG1-CD1 4.17Å; V49-I63 HydrophobicContact CG1-CG1 3.4Å; V49-I63 VanDerWaalsContact CG1-CG1 3.4Å
50	G	94.2	Very high	94.7	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	142.7	174.2	0	0	0	0	0	112	S8 I48 Q61	S8-G50 CarbonylContact O-C 3.53Å; S8-G50 WeakPolarHBondContact O-CA 3.48Å; I48-G50 VanDerWaalsContact CG2-O 3.27Å; I48-G50 WeakPolarHBondContact CG2-O 3.27Å; G50-Q61 PolarHBondContact N-O 3.11Å; G50-Q61 PolarHBondContact O-N 3.29Å
51	C	95.8	Very high	94.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	121.4	172.7	178.6	0	0	0	0	108.9	T7 S8 N9 K35 E39 I48 F59	T7-C51 HydrophobicContact CG2-CB 3.88Å; S8-C51 PolarHBondContact O-N 3.02Å; N9-C51 CarbonylContact C-O 3.33Å; N9-C51 WeakPolarHBondContact CA-O 3.27Å; K35-C51 WeakPolarHBondContact CE-O 2.97Å; K35-C51 HydrophobicContact CG-CB 4.41Å; E39-C51 HydrophobicContact CG-CB 4.09Å; I48-C51 HydrophobicContact CG2-CB 4.37Å; C51-F59 VanDerWaalsContact CA-O 3.28Å; C51-F59 WeakPolarHBondContact CA-O 3.41Å
52	S	94.8	Very high	94.8	Very high	13 Å²	13	44.5 Å²	44.5	9%	0.091	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.7	176.4	73.6	0	0	0	0	110	N9 H54 A58 F59	N9-S52 WeakPolarHBondContact O-CB 3.28Å; S52-H54 PolarHBondContact OG-NE2 2.97Å; S52-H54 VanDerWaalsContact OG-NE2 3.13Å; S52-A58 CarbonylContact O-C 3.58Å; S52-A58 VanDerWaalsContact O-CA 3.26Å; S52-A58 WeakPolarHBondContact O-CA 3.36Å; S52-A58 WeakPolarHBondContact O-CB 3.42Å; S52-F59 PolarHBondContact N-O 3.36Å; S52-F59 PolarHBondContact O-N 3.31Å
53	V	94.6	Very high	94.7	Very high	54 Å²	54	48.5 Å²	48.5	33%	0.327	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	135.6	-176.6	-175	0	0	0	0	109.2	T30 K35 I38 A58	T30-V53 HydrophobicContact CG2-CG1 4Å; K35-V53 HydrophobicContact CB-CG2 3.83Å; K35-V53 HydrophobicContact CG-CG2 4.02Å; I38-V53 HydrophobicContact CD1-CG1 4.44Å; I38-V53 HydrophobicContact CD1-CG2 3.65Å; V53-A58 HydrophobicContact CG2-CB 4.22Å
54	H	94.2	Very high	94.4	Very high	74 Å²	74	50.3 Å²	50.3	34%	0.343	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	164.3	-177.9	-55.6	-91.3	0	0	0	109	T30 S52 G56 Y57 F59	T30-H54 VanDerWaalsContact CG2-O 3.23Å; T30-H54 WeakPolarHBondContact CG2-O 3.4Å; S52-H54 PolarHBondContact OG-NE2 2.97Å; S52-H54 VanDerWaalsContact OG-NE2 3.13Å; H54-G56 PolarHBondContact O-N 3.33Å; H54-Y57 CarbonylContact C-O 3.43Å; H54-Y57 WeakPolarHBondContact CA-O 3.42Å; H54-Y57 HydrophobicContact CB-CD1 4.05Å; H54-Y57 HydrophobicContact CB-CD2 3.88Å; H54-Y57 HydrophobicContact CB-CE1 3.6Å; H54-Y57 HydrophobicContact CB-CE2 3.4Å; H54-Y57 HydrophobicContact CB-CG 4.18Å; H54-Y57 AromaticContact CD2-CD2 3.98Å; H54-Y57 AromaticContact CD2-CE2 3.43Å; H54-Y57 VanDerWaalsContact CD2-CE2 3.43Å; H54-Y57 WeakPolarHBondContact CD2-CE2 3.41Å; H54-Y57 AromaticContact CG-CE2 3.45Å; H54-Y57 VanDerWaalsContact CG-CE2 3.45Å; H54-Y57 AromaticContact CG-CZ 3.62Å; H54-Y57 PolarHBondContact N-O 3.05Å; H54-Y57 PolarHBondContact O-N 2.82Å; H54-Y57 VanDerWaalsContact O-N 3.15Å; H54-F59 AromaticContact NE2-CD2 4Å
55	K	93.4	Very high	94.3	Very high	195 Å²	195	47.8 Å²	47.8	85%	0.848	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	114.8	180	-172.7	179	179.2	-178.2	0	110.5	Y57	K55-Y57 VanDerWaalsContact O-CD1 3.29Å; K55-Y57 WeakPolarHBondContact O-CD1 3.26Å
56	G	93.1	Very high	94.2	Very high	31 Å²	31	54.7 Å²	54.7	32%	0.32	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.8	-4.8	178.1	0	0	0	0	0	116.3	N27 L28 T30 H54	N27-G56 PolarHBondContact N-O 2.8Å; L28-G56 PolarHBondContact N-O 2.97Å; L28-G56 VanDerWaalsContact N-O 3.09Å; L28-G56 CarbonylContact O-C 3.59Å; L28-G56 VanDerWaalsContact O-CA 3.32Å; L28-G56 WeakPolarHBondContact O-CA 3.17Å; T30-G56 PolarHBondContact OG1-N 2.93Å; H54-G56 PolarHBondContact O-N 3.33Å
57	Y	94.9	Very high	94.3	Very high	83 Å²	83	55.2 Å²	55.2	33%	0.325	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	167.3	-177.4	66	-86	0	0	0	113.8	F24 I25 H54 K55 F59	F24-Y57 HydrophobicContact CD2-CD2 4.34Å; F24-Y57 AromaticContact CE2-CD2 3.73Å; F24-Y57 HydrophobicContact CE2-CD2 3.73Å; F24-Y57 AromaticContact CE2-CG 3.82Å; F24-Y57 HydrophobicContact CE2-CG 3.82Å; F24-Y57 HydrophobicContact CZ-CG 4.4Å; I25-Y57 CarbonylContact O-C 3.52Å; I25-Y57 WeakPolarHBondContact O-CA 3.22Å; I25-Y57 VanDerWaalsContact O-CB 3.26Å; I25-Y57 WeakPolarHBondContact O-CB 3.48Å; H54-Y57 CarbonylContact C-O 3.43Å; H54-Y57 WeakPolarHBondContact CA-O 3.42Å; H54-Y57 HydrophobicContact CB-CD1 4.05Å; H54-Y57 HydrophobicContact CB-CD2 3.88Å; H54-Y57 HydrophobicContact CB-CE1 3.6Å; H54-Y57 HydrophobicContact CB-CE2 3.4Å; H54-Y57 HydrophobicContact CB-CG 4.18Å; H54-Y57 AromaticContact CD2-CD2 3.98Å; H54-Y57 AromaticContact CD2-CE2 3.43Å; H54-Y57 VanDerWaalsContact CD2-CE2 3.43Å; H54-Y57 WeakPolarHBondContact CD2-CE2 3.41Å; H54-Y57 AromaticContact CG-CE2 3.45Å; H54-Y57 VanDerWaalsContact CG-CE2 3.45Å; H54-Y57 AromaticContact CG-CZ 3.62Å; H54-Y57 PolarHBondContact N-O 3.05Å; H54-Y57 PolarHBondContact O-N 2.82Å; H54-Y57 VanDerWaalsContact O-N 3.15Å; K55-Y57 VanDerWaalsContact O-CD1 3.29Å; K55-Y57 WeakPolarHBondContact O-CD1 3.26Å; Y57-F59 HydrophobicContact CD2-CD2 4.44Å; Y57-F59 AromaticContact CD2-CE2 3.98Å; Y57-F59 HydrophobicContact CD2-CE2 3.98Å; Y57-F59 HydrophobicContact CD2-CZ 4.46Å; Y57-F59 HydrophobicContact CE2-CD2 4.35Å; Y57-F59 AromaticContact CE2-CE2 3.65Å; Y57-F59 HydrophobicContact CE2-CE2 3.65Å; Y57-F59 HydrophobicContact CE2-CZ 4.29Å
58	A	95.3	Very high	94.2	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	166	174.6	0	0	0	0	0	112	I25 L28 I38 S52 V53	I25-A58 HydrophobicContact CB-CB 4.46Å; I25-A58 HydrophobicContact CD1-CB 4.44Å; I25-A58 PolarHBondContact N-O 3.02Å; I25-A58 PolarHBondContact O-N 3.36Å; L28-A58 HydrophobicContact CD2-CB 3.96Å; I38-A58 HydrophobicContact CD1-CB 3.59Å; S52-A58 CarbonylContact O-C 3.58Å; S52-A58 VanDerWaalsContact O-CA 3.26Å; S52-A58 WeakPolarHBondContact O-CA 3.36Å; S52-A58 WeakPolarHBondContact O-CB 3.42Å; V53-A58 HydrophobicContact CG2-CB 4.22Å
59	F	95.6	Very high	94.1	Very high	35 Å²	35	55 Å²	55	15%	0.154	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.1	169	-64.5	-80.8	0	0	0	111.1	T11 R22 V23 F24 C51 S52 H54 Y57 V90	T11-F59 HydrophobicContact CG2-CB 4.01Å; R22-F59 HydrophobicContact CG-CD1 4.36Å; R22-F59 VanDerWaalsContact NE-CD1 3.34Å; R22-F59 VanDerWaalsContact NH2-CE2 3.3Å; V23-F59 VanDerWaalsContact O-CA 3.28Å; V23-F59 WeakPolarHBondContact O-CA 3.31Å; F24-F59 HydrophobicContact CB-CD1 4.19Å; F24-F59 HydrophobicContact CB-CE1 3.96Å; F24-F59 HydrophobicContact CD2-CD1 4.26Å; F24-F59 AromaticContact CD2-CE1 3.63Å; F24-F59 HydrophobicContact CD2-CE1 3.63Å; F24-F59 AromaticContact CD2-CZ 3.89Å; F24-F59 HydrophobicContact CD2-CZ 3.89Å; F24-F59 HydrophobicContact CG-CE1 4.29Å; C51-F59 VanDerWaalsContact CA-O 3.28Å; C51-F59 WeakPolarHBondContact CA-O 3.41Å; S52-F59 PolarHBondContact N-O 3.36Å; S52-F59 PolarHBondContact O-N 3.31Å; H54-F59 AromaticContact NE2-CD2 4Å; Y57-F59 HydrophobicContact CD2-CD2 4.44Å; Y57-F59 AromaticContact CD2-CE2 3.98Å; Y57-F59 HydrophobicContact CD2-CE2 3.98Å; Y57-F59 HydrophobicContact CD2-CZ 4.46Å; Y57-F59 HydrophobicContact CE2-CD2 4.35Å; Y57-F59 AromaticContact CE2-CE2 3.65Å; Y57-F59 HydrophobicContact CE2-CE2 3.65Å; Y57-F59 HydrophobicContact CE2-CZ 4.29Å; F59-V90 HydrophobicContact CD1-CG2 3.93Å; F59-V90 HydrophobicContact CE1-CG2 3.83Å
60	V	96.3	Very high	94.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.4	170.9	171.2	0	0	0	0	108.4	R22 V23 I25 I38 F42 I48 Y62	R22-V60 CarbonylContact C-O 3.59Å; R22-V60 WeakPolarHBondContact CA-O 3.34Å; V23-V60 PolarHBondContact N-O 3.37Å; V23-V60 PolarHBondContact O-N 3.06Å; I25-V60 HydrophobicContact CD1-CB 4.43Å; I25-V60 HydrophobicContact CD1-CG2 3.65Å; I38-V60 HydrophobicContact CG2-CG2 3.61Å; F42-V60 HydrophobicContact CB-CG1 4.25Å; F42-V60 HydrophobicContact CB-CG2 4.33Å; F42-V60 HydrophobicContact CD1-CG2 4.45Å; F42-V60 HydrophobicContact CG-CG2 4.22Å; I48-V60 HydrophobicContact CD1-CG1 4.03Å; I48-V60 HydrophobicContact CG1-CG1 3.96Å; I48-V60 HydrophobicContact CG2-CG1 3.96Å; V60-Y62 HydrophobicContact CG1-CD2 4.17Å; V60-Y62 HydrophobicContact CG1-CE1 4.19Å; V60-Y62 HydrophobicContact CG1-CE2 3.68Å
61	Q	95	Very high	94.1	Very high	7 Å²	7	54.1 Å²	54.1	3%	0.033	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.3	177.7	-175.8	74.2	67.9	0	0	108.8	T11 N12 S18 S21 I48 V49 G50	T11-Q61 HydrophobicContact CG2-CB 3.81Å; N12-Q61 PolarHBondContact O-OE1 3Å; S18-Q61 PolarHBondContact O-NE2 2.83Å; S18-Q61 PolarHBondContact O-OE1 3.18Å; S21-Q61 PolarHBondContact O-NE2 2.85Å; S21-Q61 PolarHBondContact OG-NE2 3.15Å; I48-Q61 WeakPolarHBondContact CA-O 3.26Å; V49-Q61 HydrophobicContact CG2-CB 4.05Å; V49-Q61 HydrophobicContact CG2-CG 3.52Å; V49-Q61 WeakPolarHBondContact CG2-O 3.11Å; V49-Q61 PolarHBondContact N-O 3.07Å; G50-Q61 PolarHBondContact N-O 3.11Å; G50-Q61 PolarHBondContact O-N 3.29Å
62	Y	95.3	Very high	94	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	164.8	172.3	-65.3	-79.1	0	0	0	111.7	S21 V23 F42 G46 I48 V60 N64 N67 A68 A71	S21-Y62 WeakPolarHBondContact CB-O 3.23Å; S21-Y62 PolarHBondContact O-N 3Å; S21-Y62 PolarHBondContact OG-O 2.76Å; V23-Y62 HydrophobicContact CG2-CD2 4.33Å; V23-Y62 HydrophobicContact CG2-CE2 4.01Å; F42-Y62 WeakPolarHBondContact CB-OH 3.32Å; F42-Y62 WeakPolarHBondContact CD1-OH 3.49Å; F42-Y62 PolarHBondContact O-OH 3.07Å; G46-Y62 WeakPolarHBondContact O-CE1 3.38Å; I48-Y62 HydrophobicContact CG1-CD1 4.2Å; I48-Y62 HydrophobicContact CG1-CE1 3.83Å; V60-Y62 HydrophobicContact CG1-CD2 4.17Å; V60-Y62 HydrophobicContact CG1-CE1 4.19Å; V60-Y62 HydrophobicContact CG1-CE2 3.68Å; Y62-N64 VanDerWaalsContact C-N 3.33Å; Y62-N67 HydrophobicContact CD1-CB 3.75Å; Y62-N67 HydrophobicContact CD2-CB 4.18Å; Y62-N67 HydrophobicContact CE1-CB 4.27Å; Y62-N67 HydrophobicContact CG-CB 3.67Å; Y62-A68 HydrophobicContact CD2-CB 4Å; Y62-A71 HydrophobicContact CE2-CB 3.92Å; Y62-A71 WeakPolarHBondContact OH-CB 3.26Å
63	I	91.6	Very high	93.9	Very high	88 Å²	88	59.3 Å²	59.3	45%	0.451	30%	0.301	S	S	.	.	S	Bend	trans	-61.1	-44.6	168	-57.8	-176.9	0	0	0	110.4	K47 V49	K47-I63 HydrophobicContact CB-CD1 3.82Å; K47-I63 HydrophobicContact CB-CG1 4.25Å; K47-I63 HydrophobicContact CD-CD1 3.57Å; K47-I63 HydrophobicContact CG-CD1 3.73Å; K47-I63 HydrophobicContact CG-CG1 4.24Å; K47-I63 PolarHBondContact O-N 3.35Å; V49-I63 HydrophobicContact CG1-CD1 4.17Å; V49-I63 HydrophobicContact CG1-CG1 3.4Å; V49-I63 VanDerWaalsContact CG1-CG1 3.4Å
64	N	90.5	Very high	93.7	Very high	94 Å²	94	58.8 Å²	58.8	50%	0.503	31%	0.306	S	S	.	.	S	Bend	trans	-123.8	147.3	-170.8	-65.7	-14.1	0	0	0	112.4	S21 Y62 R66 N67	S21-N64 VanDerWaalsContact CB-C 3.49Å; Y62-N64 VanDerWaalsContact C-N 3.33Å; N64-R66 VanDerWaalsContact C-N 3.28Å; N64-R66 PolarHBondContact O-N 3.25Å; N64-N67 PolarHBondContact O-N 2.8Å
65	E	92.2	Very high	93.7	Very high	81 Å²	81	55.3 Å²	55.3	38%	0.379	29%	0.29	S	S	.	.	H	α-helix	trans	-57.4	-37.5	176.2	168.6	176.4	179.7	0	0	113.3	N20 N67 A68 R69 R89	N20-E65 HydrophobicContact CB-CB 4.49Å; E65-N67 PolarHBondContact O-N 2.7Å; E65-A68 WeakPolarHBondContact O-CB 3.34Å; E65-A68 PolarHBondContact O-N 3.09Å; E65-R69 HydrophobicContact CG-CG 4.37Å; E65-R69 PolarHBondContact O-N 3.49Å; E65-R89 IonicContact OE1-CZ 3.65Å; E65-R89 IonicContact OE1-NH1 2.69Å; E65-R89 PolarHBondContact OE1-NH1 3.3Å; E65-R89 IonicContact OE1-NH2 2.64Å; E65-R89 PolarHBondContact OE1-NH2 3.31Å; E65-R89 IonicContact OE2-NH2 2.93Å
66	R	93.8	Very high	93.5	Very high	184 Å²	184	50 Å²	50	69%	0.694	27%	0.271	S	S	*	.	H	α-helix	trans	-56.4	-39.4	-177.9	-174.4	-177.6	-65.8	-164.3	-0.3	111.7	N64 R69 A70	N64-R66 VanDerWaalsContact C-N 3.28Å; N64-R66 PolarHBondContact O-N 3.25Å; R66-R69 PolarHBondContact O-N 3.23Å; R66-A70 PolarHBondContact O-N 2.99Å
67	N	95.3	Very high	93.4	Very high	33 Å²	33	51.6 Å²	51.6	18%	0.176	28%	0.281	C	S	.	.	H	α-helix	trans	-68.8	-39.2	179.6	-58.6	-4.4	0	0	0	110.7	Y45 Y62 N64 E65 A70 A71	Y45-N67 VanDerWaalsContact O-CB 3.26Å; Y45-N67 WeakPolarHBondContact O-CB 3.16Å; Y45-N67 PolarHBondContact O-OD1 3.45Å; Y62-N67 HydrophobicContact CD1-CB 3.75Å; Y62-N67 HydrophobicContact CD2-CB 4.18Å; Y62-N67 HydrophobicContact CE1-CB 4.27Å; Y62-N67 HydrophobicContact CG-CB 3.67Å; N64-N67 PolarHBondContact O-N 2.8Å; E65-N67 PolarHBondContact O-N 2.7Å; N67-A70 PolarHBondContact O-N 3.29Å; N67-A71 WeakPolarHBondContact O-CB 3.45Å; N67-A71 PolarHBondContact O-N 3.34Å
68	A	93.1	Very high	93.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.4	-44.5	174.2	0	0	0	0	0	111.6	V23 Y62 E65 A71 V72	V23-A68 HydrophobicContact CG2-CB 3.56Å; Y62-A68 HydrophobicContact CD2-CB 4Å; E65-A68 WeakPolarHBondContact O-CB 3.34Å; E65-A68 PolarHBondContact O-N 3.09Å; A68-A71 PolarHBondContact O-N 3.13Å; A68-V72 WeakPolarHBondContact O-CG2 3.49Å; A68-V72 PolarHBondContact O-N 3.06Å
69	R	92.4	Very high	93.2	Very high	119 Å²	119	57.8 Å²	57.8	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-45.4	174.9	-71.7	-171.2	-65.4	105.4	-8.6	112.2	E65 R66 A71 V72 A73	E65-R69 HydrophobicContact CG-CG 4.37Å; E65-R69 PolarHBondContact O-N 3.49Å; R66-R69 PolarHBondContact O-N 3.23Å; R69-A71 VanDerWaalsContact C-N 3.33Å; R69-A71 PolarHBondContact O-N 3.44Å; R69-V72 PolarHBondContact O-N 3.47Å; R69-A73 PolarHBondContact O-N 3.31Å
70	A	94.7	Very high	93	Very high	44 Å²	44	57.3 Å²	57.3	36%	0.364	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-41.1	178.7	0	0	0	0	0	112	Y45 R66 N67 A73 G74	Y45-A70 HydrophobicContact CD1-CB 3.84Å; Y45-A70 WeakPolarHBondContact CE1-O 3.34Å; R66-A70 PolarHBondContact O-N 2.99Å; N67-A70 PolarHBondContact O-N 3.29Å; A70-A73 PolarHBondContact O-N 3Å; A70-G74 PolarHBondContact O-N 3.41Å
71	A	94.8	Very high	92.8	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-43.3	177.2	0	0	0	0	0	112.5	V23 F42 Y45 Y62 N67 A68 R69 G74 E75	V23-A71 HydrophobicContact CG2-CB 4.49Å; F42-A71 HydrophobicContact CD1-CB 3.99Å; F42-A71 HydrophobicContact CE1-CB 4.19Å; Y45-A71 HydrophobicContact CD1-CB 4.37Å; Y45-A71 HydrophobicContact CD2-CB 3.67Å; Y45-A71 HydrophobicContact CE2-CB 4.18Å; Y45-A71 HydrophobicContact CG-CB 3.79Å; Y62-A71 HydrophobicContact CE2-CB 3.92Å; Y62-A71 WeakPolarHBondContact OH-CB 3.26Å; N67-A71 WeakPolarHBondContact O-CB 3.45Å; N67-A71 PolarHBondContact O-N 3.34Å; A68-A71 PolarHBondContact O-N 3.13Å; R69-A71 VanDerWaalsContact C-N 3.33Å; R69-A71 PolarHBondContact O-N 3.44Å; A71-G74 PolarHBondContact O-N 3.14Å; A71-E75 WeakPolarHBondContact O-CB 3.28Å; A71-E75 PolarHBondContact O-N 3.23Å
72	V	93.1	Very high	92.7	Very high	31 Å²	31	62.2 Å²	62.2	19%	0.188	36%	0.358	C	S	.	.	H	α-helix	trans	-60.9	-48.3	175.3	173.6	0	0	0	0	111.1	V23 A68 R69 G74 N76 I87 R89	V23-V72 HydrophobicContact CG1-CG2 4.03Å; V23-V72 HydrophobicContact CG2-CG2 4.31Å; A68-V72 WeakPolarHBondContact O-CG2 3.49Å; A68-V72 PolarHBondContact O-N 3.06Å; R69-V72 PolarHBondContact O-N 3.47Å; V72-G74 VanDerWaalsContact C-N 3.28Å; V72-G74 PolarHBondContact O-N 3.13Å; V72-N76 VanDerWaalsContact O-CB 3.24Å; V72-N76 WeakPolarHBondContact O-CB 3.43Å; V72-N76 PolarHBondContact O-N 3.49Å; V72-I87 HydrophobicContact CB-CG2 4.44Å; V72-I87 HydrophobicContact CG2-CG2 3.84Å; V72-R89 HydrophobicContact CG2-CG 3.72Å
73	A	91.9	Very high	92.5	Very high	91 Å²	91	65 Å²	65	75%	0.752	37%	0.371	S	S	*	.	H	α-helix	trans	-64.7	-32.5	-179.6	0	0	0	0	0	113	R69 A70	R69-A73 PolarHBondContact O-N 3.31Å; A70-A73 PolarHBondContact O-N 3Å
74	G	92.1	Very high	92.5	Very high	43 Å²	43	63.5 Å²	63.5	44%	0.443	37%	0.367	S	S	.	.	H	α-helix	trans	-92.6	-21.2	-172.8	0	0	0	0	0	116	A70 A71 V72	A70-G74 PolarHBondContact O-N 3.41Å; A71-G74 PolarHBondContact O-N 3.14Å; V72-G74 VanDerWaalsContact C-N 3.28Å; V72-G74 PolarHBondContact O-N 3.13Å
75	E	92.9	Very high	92.6	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-118.8	-10.5	-173.7	-63.9	-65	152.4	0	0	113.7	I41 F42 K44 Y45 A71 A77 R78 I87	I41-E75 HydrophobicContact CG2-CG 4.34Å; F42-E75 HydrophobicContact CE1-CB 4.37Å; F42-E75 HydrophobicContact CE1-CG 4.24Å; F42-E75 HydrophobicContact CZ-CB 4.16Å; F42-E75 HydrophobicContact CZ-CG 4.18Å; K44-E75 WeakPolarHBondContact CE-OE1 3.44Å; K44-E75 IonicContact NZ-OE1 3.15Å; K44-E75 PolarHBondContact NZ-OE1 2.93Å; Y45-E75 HydrophobicContact CE2-CG 3.5Å; Y45-E75 VanDerWaalsContact CE2-CG 3.5Å; Y45-E75 VanDerWaalsContact OH-CG 3.32Å; Y45-E75 WeakPolarHBondContact OH-CG 3.14Å; Y45-E75 PolarHBondContact OH-OE1 2.84Å; A71-E75 WeakPolarHBondContact O-CB 3.28Å; A71-E75 PolarHBondContact O-N 3.23Å; E75-A77 PolarHBondContact O-N 2.84Å; E75-R78 VanDerWaalsContact O-CB 3.24Å; E75-R78 WeakPolarHBondContact O-CB 3.33Å; E75-R78 PolarHBondContact O-N 2.69Å; E75-R78 VanDerWaalsContact O-N 3.13Å; E75-R78 IonicContact OE1-NH1 3.17Å; E75-R78 PolarHBondContact OE1-NH1 2.99Å; E75-R78 WeakPolarHBondContact OE2-CD 3.29Å; E75-R78 IonicContact OE2-CZ 3.61Å; E75-R78 IonicContact OE2-NE 3.89Å; E75-R78 IonicContact OE2-NH1 2.76Å; E75-R78 PolarHBondContact OE2-NH1 2.79Å; E75-I87 HydrophobicContact CB-CD1 3.19Å; E75-I87 HydrophobicContact CG-CD1 4.47Å; E75-I87 WeakPolarHBondContact O-CD1 3.29Å
76	N	89.7	Confident	92.5	Very high	82 Å²	82	57.6 Å²	57.6	44%	0.439	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	137.6	178.7	-169.8	50.7	0	0	0	110.7	V72 R78 I87	V72-N76 VanDerWaalsContact O-CB 3.24Å; V72-N76 WeakPolarHBondContact O-CB 3.43Å; V72-N76 PolarHBondContact O-N 3.49Å; N76-R78 PolarHBondContact O-N 3.44Å; N76-R78 VanDerWaalsContact O-N 3.17Å; N76-I87 HydrophobicContact CB-CB 4.32Å; N76-I87 PolarHBondContact OD1-N 3.37Å
77	A	91.6	Very high	92.4	Very high	65 Å²	65	48.9 Å²	48.9	54%	0.537	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	4.5	-173.5	0	0	0	0	0	116.2	E75 I79 L85	E75-A77 PolarHBondContact O-N 2.84Å; A77-I79 PolarHBondContact O-N 3.02Å; A77-L85 WeakPolarHBondContact CA-O 3.48Å; A77-L85 PolarHBondContact N-O 3.27Å
78	R	92.6	Very high	92	Very high	105 Å²	105	52.6 Å²	52.6	40%	0.396	32%	0.319	S	S	.	.			trans	-63.2	135.4	172.9	-175.5	-177.2	178	-173	-3.6	110.3	E75 N76 I80 P84 L85	E75-R78 VanDerWaalsContact O-CB 3.24Å; E75-R78 WeakPolarHBondContact O-CB 3.33Å; E75-R78 PolarHBondContact O-N 2.69Å; E75-R78 VanDerWaalsContact O-N 3.13Å; E75-R78 IonicContact OE1-NH1 3.17Å; E75-R78 PolarHBondContact OE1-NH1 2.99Å; E75-R78 WeakPolarHBondContact OE2-CD 3.29Å; E75-R78 IonicContact OE2-CZ 3.61Å; E75-R78 IonicContact OE2-NE 3.89Å; E75-R78 IonicContact OE2-NH1 2.76Å; E75-R78 PolarHBondContact OE2-NH1 2.79Å; N76-R78 PolarHBondContact O-N 3.44Å; N76-R78 VanDerWaalsContact O-N 3.17Å; R78-I80 HydrophobicContact CG-CG1 4.34Å; R78-P84 WeakPolarHBondContact O-CA 3.48Å; R78-L85 PolarHBondContact O-N 3.03Å
79	I	92.9	Very high	91.7	Very high	108 Å²	108	54.3 Å²	54.3	55%	0.554	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	122.2	174.7	-51.7	-54.1	0	0	0	110.2	A77 Q83 P84	A77-I79 PolarHBondContact O-N 3.02Å; I79-Q83 WeakPolarHBondContact CA-O 3.46Å; I79-P84 HydrophobicContact CD1-CB 3.63Å; I79-P84 HydrophobicContact CD1-CG 4.34Å
80	I	91.4	Very high	91.1	Very high	25 Å²	25	49.5 Å²	49.5	13%	0.128	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130.4	171.5	-57.6	-163.8	0	0	0	109.1	V33 I41 R78 G82 Q83 L85	V33-I80 HydrophobicContact CG2-CG2 3.65Å; I41-I80 HydrophobicContact CD1-CD1 3.5Å; R78-I80 HydrophobicContact CG-CG1 4.34Å; I80-G82 PolarHBondContact O-N 2.72Å; I80-G82 VanDerWaalsContact O-N 3.13Å; I80-Q83 PolarHBondContact N-O 3.24Å; I80-Q83 PolarHBondContact O-N 3.04Å; I80-L85 HydrophobicContact CB-CD2 4.3Å; I80-L85 HydrophobicContact CB-CG 4.43Å; I80-L85 HydrophobicContact CD1-CD1 3.6Å; I80-L85 HydrophobicContact CD1-CD2 4.47Å; I80-L85 HydrophobicContact CD1-CG 4.14Å; I80-L85 HydrophobicContact CG1-CD1 4.06Å; I80-L85 HydrophobicContact CG1-CD2 4.44Å; I80-L85 HydrophobicContact CG1-CG 4.08Å
81	A	92.1	Very high	90.3	Very high	42 Å²	42	50.3 Å²	50.3	35%	0.347	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	38	-179.7	0	0	0	0	0	112.9	N29 I32 V33 Q83	N29-A81 HydrophobicContact CB-CB 4.11Å; I32-A81 HydrophobicContact CB-CB 4.12Å; I32-A81 HydrophobicContact CD1-CB 4.21Å; I32-A81 HydrophobicContact CG2-CB 3.95Å; V33-A81 HydrophobicContact CG2-CB 3.87Å; A81-Q83 VanDerWaalsContact C-N 3.33Å; A81-Q83 PolarHBondContact O-N 3.08Å
82	G	91.8	Very high	89.1	Confident	68 Å²	68	56.9 Å²	56.9	70%	0.701	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	4.8	-179.6	0	0	0	0	0	115.6	I80	I80-G82 PolarHBondContact O-N 2.72Å; I80-G82 VanDerWaalsContact O-N 3.13Å
83	Q	91.8	Very high	88	Confident	60 Å²	60	61.3 Å²	61.3	28%	0.28	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.3	-178.1	-65.2	-175.4	-30.3	0	0	112	N27 N29 I79 I80 A81 L85	N27-Q83 WeakPolarHBondContact O-CB 3.29Å; N27-Q83 PolarHBondContact O-OE1 3.24Å; N29-Q83 VanDerWaalsContact CB-OE1 3.3Å; I79-Q83 WeakPolarHBondContact CA-O 3.46Å; I80-Q83 PolarHBondContact N-O 3.24Å; I80-Q83 PolarHBondContact O-N 3.04Å; A81-Q83 VanDerWaalsContact C-N 3.33Å; A81-Q83 PolarHBondContact O-N 3.08Å; Q83-L85 PolarHBondContact O-N 2.96Å
84	P	92.3	Very high	87.1	Confident	58 Å²	58	60.4 Å²	60.4	38%	0.377	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	123.2	172	26.7	-31.3	0	0	0	110.6	N27 R78 I79	N27-P84 WeakPolarHBondContact CB-O 2.9Å; N27-P84 WeakPolarHBondContact ND2-CD 3.01Å; N27-P84 PolarHBondContact ND2-O 3.32Å; R78-P84 WeakPolarHBondContact O-CA 3.48Å; I79-P84 HydrophobicContact CD1-CB 3.63Å; I79-P84 HydrophobicContact CD1-CG 4.34Å
85	L	91.9	Very high	85.7	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	32%	0.324	C	S	.	.			trans	-66.1	141.9	176	-65.1	-170.4	0	0	0	111.6	I25 L28 A77 R78 I80 Q83 I87	I25-L85 HydrophobicContact CG2-CD1 4.15Å; I25-L85 HydrophobicContact CG2-CD2 4.14Å; L28-L85 HydrophobicContact CD1-CD2 3.84Å; A77-L85 WeakPolarHBondContact CA-O 3.48Å; A77-L85 PolarHBondContact N-O 3.27Å; R78-L85 PolarHBondContact O-N 3.03Å; I80-L85 HydrophobicContact CB-CD2 4.3Å; I80-L85 HydrophobicContact CB-CG 4.43Å; I80-L85 HydrophobicContact CD1-CD1 3.6Å; I80-L85 HydrophobicContact CD1-CD2 4.47Å; I80-L85 HydrophobicContact CD1-CG 4.14Å; I80-L85 HydrophobicContact CG1-CD1 4.06Å; I80-L85 HydrophobicContact CG1-CD2 4.44Å; I80-L85 HydrophobicContact CG1-CG 4.08Å; Q83-L85 PolarHBondContact O-N 2.96Å; L85-I87 HydrophobicContact CB-CD1 4.16Å; L85-I87 HydrophobicContact CB-CG1 4Å; L85-I87 HydrophobicContact CD1-CD1 4.06Å
86	V	90.9	Very high	84.2	Confident	48 Å²	48	66 Å²	66	29%	0.291	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115	171.6	176.5	0	0	0	0	108.2	G26 N27 Y88	G26-V86 PolarHBondContact N-O 3.3Å; G26-V86 PolarHBondContact O-N 2.87Å; G26-V86 VanDerWaalsContact O-N 3.07Å; N27-V86 HydrophobicContact CB-CG2 4.03Å; V86-Y88 HydrophobicContact CG1-CD2 4.02Å; V86-Y88 HydrophobicContact CG1-CE2 3.21Å
87	I	91.5	Very high	82.4	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.9	-170.3	-48.6	-174.1	0	0	0	111.6	V23 F24 F42 V72 E75 N76 L85	V23-I87 HydrophobicContact CG1-CG2 3.19Å; F24-I87 WeakPolarHBondContact O-CA 3.45Å; F24-I87 VanDerWaalsContact O-CG2 3.31Å; F24-I87 WeakPolarHBondContact O-CG2 3.4Å; F42-I87 HydrophobicContact CE1-CD1 4.2Å; F42-I87 HydrophobicContact CZ-CD1 3.83Å; V72-I87 HydrophobicContact CB-CG2 4.44Å; V72-I87 HydrophobicContact CG2-CG2 3.84Å; E75-I87 HydrophobicContact CB-CD1 3.19Å; E75-I87 HydrophobicContact CG-CD1 4.47Å; E75-I87 WeakPolarHBondContact O-CD1 3.29Å; N76-I87 HydrophobicContact CB-CB 4.32Å; N76-I87 PolarHBondContact OD1-N 3.37Å; L85-I87 HydrophobicContact CB-CD1 4.16Å; L85-I87 HydrophobicContact CB-CG1 4Å; L85-I87 HydrophobicContact CD1-CD1 4.06Å
88	Y	87.6	Confident	80.5	Confident	111 Å²	111	68.4 Å²	68.4	44%	0.435	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151.8	178.1	-58.9	-61.9	0	0	0	112	V23 F24 V86	V23-Y88 CarbonylContact C-O 3.44Å; V23-Y88 WeakPolarHBondContact CA-O 3.49Å; F24-Y88 HydrophobicContact CD1-CD2 4.18Å; F24-Y88 PolarHBondContact N-O 3.44Å; F24-Y88 PolarHBondContact O-N 2.82Å; F24-Y88 VanDerWaalsContact O-N 3.11Å; V86-Y88 HydrophobicContact CG1-CD2 4.02Å; V86-Y88 HydrophobicContact CG1-CE2 3.21Å
89	R	85.1	Confident	78.5	Confident	37 Å²	37	70.4 Å²	70.4	14%	0.14	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	130.7	164	-65.4	178.8	56.7	-155.3	-7.6	108.8	N20 E65 V72 F91 Y92 Y93	N20-R89 PolarHBondContact O-NE 3.21Å; N20-R89 PolarHBondContact O-NH2 2.69Å; N20-R89 PolarHBondContact OD1-NH2 3.33Å; E65-R89 IonicContact OE1-CZ 3.65Å; E65-R89 IonicContact OE1-NH1 2.69Å; E65-R89 PolarHBondContact OE1-NH1 3.3Å; E65-R89 IonicContact OE1-NH2 2.64Å; E65-R89 PolarHBondContact OE1-NH2 3.31Å; E65-R89 IonicContact OE2-NH2 2.93Å; V72-R89 HydrophobicContact CG2-CG 3.72Å; R89-F91 PolarHBondContact O-N 3.31Å; R89-Y92 PolarHBondContact O-N 3.24Å; R89-Y93 PolarHBondContact O-N 3.19Å
90	V	79.8	Confident	76.2	Confident	17 Å²	17	71 Å²	71	10%	0.103	37%	0.365	C	S	.	.	H	α-helix	trans	-61.9	-46.1	-175.5	176.1	0	0	0	0	111.1	L19 R22 F24 F59 Y92 Y93 I94	L19-V90 HydrophobicContact CD2-CG1 3.97Å; R22-V90 HydrophobicContact CB-CB 4.23Å; R22-V90 HydrophobicContact CB-CG2 4.04Å; R22-V90 HydrophobicContact CG-CB 4.49Å; R22-V90 HydrophobicContact CG-CG2 3.83Å; R22-V90 PolarHBondContact O-N 3.5Å; F24-V90 HydrophobicContact CB-CG2 4.21Å; F59-V90 HydrophobicContact CD1-CG2 3.93Å; F59-V90 HydrophobicContact CE1-CG2 3.83Å; V90-Y92 PolarHBondContact O-N 3.34Å; V90-Y93 PolarHBondContact O-N 3.44Å; V90-I94 HydrophobicContact CG1-CD1 3.7Å; V90-I94 HydrophobicContact CG1-CG1 4.47Å; V90-I94 VanDerWaalsContact O-CG1 3.3Å; V90-I94 WeakPolarHBondContact O-CG1 3.29Å; V90-I94 PolarHBondContact O-N 3Å; V90-I94 VanDerWaalsContact O-N 3.09Å
91	F	77.9	Confident	73.8	Confident	62 Å²	62	75.3 Å²	75.3	27%	0.272	40%	0.395	S	S	.	.	H	α-helix	trans	-59.4	-45.3	177.1	-175.7	-98.8	0	0	0	113	L19 N20 R89 Y93 I94 Q95	L19-F91 HydrophobicContact CB-CB 4.18Å; L19-F91 HydrophobicContact CB-CD2 4.23Å; L19-F91 WeakPolarHBondContact O-CB 3.45Å; L19-F91 PolarHBondContact O-N 3.44Å; N20-F91 VanDerWaalsContact OD1-CB 3.29Å; N20-F91 WeakPolarHBondContact OD1-CB 3.32Å; N20-F91 WeakPolarHBondContact OD1-CD1 2.98Å; N20-F91 WeakPolarHBondContact OD1-CG 2.83Å; R89-F91 PolarHBondContact O-N 3.31Å; F91-Y93 VanDerWaalsContact C-N 3.33Å; F91-Y93 PolarHBondContact O-N 3.43Å; F91-I94 PolarHBondContact O-N 3.29Å; F91-Q95 HydrophobicContact CD1-CG 3.97Å; F91-Q95 HydrophobicContact CE1-CG 3.63Å; F91-Q95 HydrophobicContact CE2-CG 4.24Å; F91-Q95 HydrophobicContact CG-CG 4.44Å; F91-Q95 HydrophobicContact CZ-CG 3.77Å; F91-Q95 VanDerWaalsContact O-CG 3.29Å; F91-Q95 WeakPolarHBondContact O-CG 3.3Å; F91-Q95 PolarHBondContact O-N 3.09Å
92	Y	70.9	Confident	71.6	Confident	138 Å²	138	77.9 Å²	77.9	54%	0.541	41%	0.41	S	S	.	.	H	α-helix	trans	-64.6	-38.3	-179.4	-171.1	-98.8	0	0	0	112.1	R89 V90 N96	R89-Y92 PolarHBondContact O-N 3.24Å; V90-Y92 PolarHBondContact O-N 3.34Å; Y92-N96 WeakPolarHBondContact CE1-ND2 3.47Å; Y92-N96 VanDerWaalsContact CZ-ND2 3.31Å; Y92-N96 WeakPolarHBondContact O-CB 3.08Å; Y92-N96 PolarHBondContact O-N 2.98Å; Y92-N96 PolarHBondContact OH-ND2 2.86Å
93	Y	69.2	Low	69.3	Low	124 Å²	124	80.7 Å²	80.7	49%	0.486	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-45.2	175	-176.4	-98.7	0	0	0	112.3	R89 V90 F91 N96 Q97	R89-Y93 PolarHBondContact O-N 3.19Å; V90-Y93 PolarHBondContact O-N 3.44Å; F91-Y93 VanDerWaalsContact C-N 3.33Å; F91-Y93 PolarHBondContact O-N 3.43Å; Y93-N96 PolarHBondContact O-N 3.46Å; Y93-Q97 HydrophobicContact CD1-CG 4.45Å; Y93-Q97 HydrophobicContact CE1-CG 4.13Å; Y93-Q97 WeakPolarHBondContact O-CG 3.49Å; Y93-Q97 PolarHBondContact O-N 3.35Å; Y93-Q97 PolarHBondContact OH-NE2 3.34Å
94	I	72.4	Confident	67.2	Low	72 Å²	72	83.1 Å²	83.1	37%	0.369	44%	0.44	S	S	.	.	H	α-helix	trans	-65.4	-41	179.5	-63	164.6	0	0	0	111	V90 F91 Q97 T98	V90-I94 HydrophobicContact CG1-CD1 3.7Å; V90-I94 HydrophobicContact CG1-CG1 4.47Å; V90-I94 VanDerWaalsContact O-CG1 3.3Å; V90-I94 WeakPolarHBondContact O-CG1 3.29Å; V90-I94 PolarHBondContact O-N 3Å; V90-I94 VanDerWaalsContact O-N 3.09Å; F91-I94 PolarHBondContact O-N 3.29Å; I94-Q97 PolarHBondContact O-N 2.69Å; I94-T98 PolarHBondContact O-N 3.39Å
95	Q	63.4	Low	65.1	Low	84 Å²	84	90.5 Å²	90.5	39%	0.393	48%	0.484	S	S	.	.	H	α-helix	trans	-65.7	-40.2	176.1	-66.2	-68.8	-62.7	0	0	112.2	F91 Q97 T98 H99	F91-Q95 HydrophobicContact CD1-CG 3.97Å; F91-Q95 HydrophobicContact CE1-CG 3.63Å; F91-Q95 HydrophobicContact CE2-CG 4.24Å; F91-Q95 HydrophobicContact CG-CG 4.44Å; F91-Q95 HydrophobicContact CZ-CG 3.77Å; F91-Q95 VanDerWaalsContact O-CG 3.29Å; F91-Q95 WeakPolarHBondContact O-CG 3.3Å; F91-Q95 PolarHBondContact O-N 3.09Å; Q95-Q97 VanDerWaalsContact C-N 3.33Å; Q95-Q97 PolarHBondContact O-N 3.37Å; Q95-T98 PolarHBondContact O-N 3.4Å; Q95-T98 PolarHBondContact O-OG1 3.31Å; Q95-H99 PolarHBondContact O-CD2 3.34Å
96	N	60.6	Low	63.8	Low	77 Å²	77	94.9 Å²	94.9	41%	0.412	51%	0.507	S	S	.	.	H	α-helix	trans	-72.6	-23.4	177.1	-86.6	-1.3	0	0	0	113.4	Y92 Y93 H99 L100	Y92-N96 WeakPolarHBondContact CE1-ND2 3.47Å; Y92-N96 VanDerWaalsContact CZ-ND2 3.31Å; Y92-N96 WeakPolarHBondContact O-CB 3.08Å; Y92-N96 PolarHBondContact O-N 2.98Å; Y92-N96 PolarHBondContact OH-ND2 2.86Å; Y93-N96 PolarHBondContact O-N 3.46Å; N96-H99 PolarHBondContact O-N 3.37Å; N96-L100 PolarHBondContact O-N 3.01Å
97	Q	53.6	Low	62.3	Low	99 Å²	99	97.4 Å²	97.4	46%	0.463	52%	0.519	S	S	.	.	H	α-helix	trans	-72.4	-28.7	171.4	-77.2	-164.1	-14.5	0	0	113.3	Y93 I94 Q95 H99 L100	Y93-Q97 HydrophobicContact CD1-CG 4.45Å; Y93-Q97 HydrophobicContact CE1-CG 4.13Å; Y93-Q97 WeakPolarHBondContact O-CG 3.49Å; Y93-Q97 PolarHBondContact O-N 3.35Å; Y93-Q97 PolarHBondContact OH-NE2 3.34Å; I94-Q97 PolarHBondContact O-N 2.69Å; Q95-Q97 VanDerWaalsContact C-N 3.33Å; Q95-Q97 PolarHBondContact O-N 3.37Å; Q97-H99 PolarHBondContact O-N 3.12Å; Q97-L100 HydrophobicContact CG-CD1 4.34Å; Q97-L100 PolarHBondContact O-N 3.41Å
98	T	51.2	Low	60.7	Low	98 Å²	98	102.7 Å²	102.7	60%	0.601	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.4	173.5	51.9	0	0	0	0	113.6	I94 Q95	I94-T98 PolarHBondContact O-N 3.39Å; Q95-T98 PolarHBondContact O-N 3.4Å; Q95-T98 PolarHBondContact O-OG1 3.31Å
99	H	49.2	Very low	59.1	Low	148 Å²	148	102.2 Å²	102.2	69%	0.685	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.2	2.8	176.7	-74.9	-70.3	0	0	0	113.8	Q95 N96 Q97	Q95-H99 PolarHBondContact O-CD2 3.34Å; N96-H99 PolarHBondContact O-N 3.37Å; Q97-H99 PolarHBondContact O-N 3.12Å
100	L	45.8	Very low	57.5	Low	120 Å²	120	106.3 Å²	106.3	63%	0.628	58%	0.58	S	S	*	*	S	Bend	trans	-67.7	124.5	165.8	-73.2	169.2	0	0	0	107.2	N96 Q97 S102	N96-L100 PolarHBondContact O-N 3.01Å; Q97-L100 HydrophobicContact CG-CD1 4.34Å; Q97-L100 PolarHBondContact O-N 3.41Å; L100-S102 PolarHBondContact O-N 3.35Å; L100-S102 VanDerWaalsContact O-N 3.12Å
101	P	41.7	Very low	56	Low	116 Å²	116	112.3 Å²	112.3	75%	0.753	61%	0.612	S	S	*	*			trans	-55.6	126.7	171.8	23.6	-30.4	0	0	0	106.8
102	S	44.8	Very low	54.5	Low	96 Å²	96	115.9 Å²	115.9	67%	0.671	64%	0.636	S	S	*	*			trans	-44.4	129	168.3	47	0	0	0	0	107.6	L100 S104	L100-S102 PolarHBondContact O-N 3.35Å; L100-S102 VanDerWaalsContact O-N 3.12Å; S102-S104 PolarHBondContact O-N 2.82Å
103	P	43.8	Very low	53.2	Low	126 Å²	126	114.2 Å²	114.2	82%	0.818	64%	0.643	S	S	*	*			trans	-55.1	110.9	173.6	21.5	-29.1	0	0	0	106	T105	P103-T105 PolarHBondContact O-N 3.3Å
104	S	47.6	Very low	51.9	Low	111 Å²	111	113.3 Å²	113.3	78%	0.776	66%	0.656	S	S	*	*			trans	-53.6	129.2	-178.6	31.7	0	0	0	0	108.3	S102	S102-S104 PolarHBondContact O-N 2.82Å
105	T	48.2	Very low	50	Low	213 Å²	213	117.1 Å²	117.1	100%	1.307	68%	0.682	S	S	*	*			trans	-41.9	0	176.7	-47.7	0	0	0	0	112.9	P103	P103-T105 PolarHBondContact O-N 3.3Å

Retrieved 105 of 105 residues in 89.9 ms (Link to these results)

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