X5J5S5_MOUSE Loading...

IgA heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J5S5, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 89 aa.

						>X5J5S5_MOUSE|X5J5S5
PGLVAPSQSLSITCTVSGFSLTSYGVSWVRQPPGKGLEWLGVIWGDGSTNYHSALMSRLSISKDNSKSQVFLKLNSLQTDDPATYYCAK
					

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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	P	48.2	Very low	65.5	Low	185 Å²	185	93.8 Å²	93.8	100%	1.201	61%	0.608	S	S	*	*				0	113.3	0	2.6	19.5	0	0	0	109.9
2	G	57.3	Low	67.7	Low	71 Å²	71	89.3 Å²	89.3	73%	0.732	57%	0.574	S	S	*	*			trans	-91.9	132.7	-177.1	0	0	0	0	0	112
3	L	54.4	Low	69.9	Low	186 Å²	186	88 Å²	88	97%	0.974	56%	0.564	S	S	*	*			trans	-66.6	126.5	166.9	-107.6	87.6	0	0	0	108.7
4	V	57.8	Low	71.7	Confident	60 Å²	60	82.4 Å²	82.4	36%	0.364	53%	0.529	S	S	.	.			trans	-110	132.8	176.8	-165.7	0	0	0	0	108.2	Q8 L10 L77	V4-Q8 HydrophobicContact CG1-CB 3.72Å; V4-L10 HydrophobicContact CG2-CD1 3.92Å; V4-L77 HydrophobicContact CB-CD1 3.83Å; V4-L77 HydrophobicContact CG1-CD1 3.49Å; V4-L77 VanDerWaalsContact CG1-CD1 3.49Å
5	A	59.9	Low	73.3	Confident	49 Å²	49	83.3 Å²	83.3	41%	0.405	53%	0.533	S	S	.	.			trans	-75.8	151.9	-176.6	0	0	0	0	0	111.9	S7 Q8	A5-S7 PolarHBondContact O-N 3.46Å; A5-Q8 WeakPolarHBondContact O-CB 3.45Å; A5-Q8 PolarHBondContact O-N 3.29Å; A5-Q8 VanDerWaalsContact O-N 3.17Å
6	P	54.8	Low	74.6	Confident	97 Å²	97	79.1 Å²	79.1	63%	0.63	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	138	172.4	-18.4	29.6	0	0	0	110.1
7	S	59.9	Low	75.8	Confident	109 Å²	109	80.9 Å²	80.9	76%	0.762	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-3.3	-173.3	-30.5	0	0	0	0	117	A5	A5-S7 PolarHBondContact O-N 3.46Å
8	Q	74.1	Confident	76.7	Confident	108 Å²	108	81.4 Å²	81.4	51%	0.505	54%	0.543	S	S	.	.	S	Bend	trans	-87.1	159.6	167.4	-74.2	-178.2	-28.5	0	0	111.3	V4 A5 L77	V4-Q8 HydrophobicContact CG1-CB 3.72Å; A5-Q8 WeakPolarHBondContact O-CB 3.45Å; A5-Q8 PolarHBondContact O-N 3.29Å; A5-Q8 VanDerWaalsContact O-N 3.17Å; Q8-L77 WeakPolarHBondContact O-CD1 3.33Å
9	S	79.7	Confident	77.5	Confident	62 Å²	62	79.2 Å²	79.2	43%	0.434	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-85.9	127.9	169.9	58.7	0	0	0	0	110	L74	S9-L74 CarbonylContact C-O 3.49Å; S9-L74 VanDerWaalsContact CA-O 3.29Å; S9-L74 WeakPolarHBondContact CA-O 3.3Å
10	L	84.5	Confident	78.2	Confident	30 Å²	30	78 Å²	78	16%	0.157	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	131.6	167.8	176.8	62	0	0	0	108.8	V4 I12 K73 L74 L77 Y85	V4-L10 HydrophobicContact CG2-CD1 3.92Å; L10-I12 HydrophobicContact CD1-CD1 4.42Å; L10-I12 HydrophobicContact CD1-CG1 4.01Å; L10-I12 HydrophobicContact CD2-CD1 3.72Å; L10-I12 HydrophobicContact CD2-CG1 4.19Å; L10-I12 HydrophobicContact CG-CD1 4.01Å; L10-I12 HydrophobicContact CG-CG1 3.92Å; L10-K73 CarbonylContact O-C 3.54Å; L10-K73 VanDerWaalsContact O-CA 3.31Å; L10-K73 WeakPolarHBondContact O-CA 3.23Å; L10-L74 HydrophobicContact CB-CB 4.36Å; L10-L74 PolarHBondContact N-O 3.03Å; L10-L74 PolarHBondContact O-N 3.26Å; L10-L77 HydrophobicContact CB-CD1 3.81Å; L10-L77 HydrophobicContact CB-CD2 4.1Å; L10-L77 HydrophobicContact CB-CG 4.12Å; L10-L77 HydrophobicContact CD2-CD2 4.28Å; L10-Y85 HydrophobicContact CD2-CE2 3.93Å
11	S	89.6	Confident	79	Confident	75 Å²	75	74.4 Å²	74.4	52%	0.524	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.2	168.6	-170.9	0	0	0	0	108.9	L72	S11-L72 CarbonylContact C-O 3.4Å; S11-L72 WeakPolarHBondContact CA-O 3.3Å
12	I	92.2	Very high	81.2	Confident	39 Å²	39	69.3 Å²	69.3	20%	0.2	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	136.4	177.6	-59	160.3	0	0	0	108.1	L10 W28 F71 L72 Y85	L10-I12 HydrophobicContact CD1-CD1 4.42Å; L10-I12 HydrophobicContact CD1-CG1 4.01Å; L10-I12 HydrophobicContact CD2-CD1 3.72Å; L10-I12 HydrophobicContact CD2-CG1 4.19Å; L10-I12 HydrophobicContact CG-CD1 4.01Å; L10-I12 HydrophobicContact CG-CG1 3.92Å; I12-W28 HydrophobicContact CB-CH2 4.24Å; I12-W28 HydrophobicContact CB-CZ3 4.28Å; I12-W28 HydrophobicContact CG2-CH2 3.79Å; I12-W28 HydrophobicContact CG2-CZ3 3.75Å; I12-F71 CarbonylContact O-C 3.53Å; I12-F71 WeakPolarHBondContact O-CA 3.33Å; I12-L72 HydrophobicContact CB-CB 4.4Å; I12-L72 HydrophobicContact CD1-CD2 4.19Å; I12-L72 PolarHBondContact N-O 2.79Å; I12-L72 PolarHBondContact O-N 3.19Å; I12-Y85 HydrophobicContact CD1-CD1 3.71Å; I12-Y85 HydrophobicContact CD1-CD2 3.67Å; I12-Y85 HydrophobicContact CD1-CE1 4.29Å; I12-Y85 HydrophobicContact CD1-CE2 4.29Å; I12-Y85 HydrophobicContact CD1-CG 3.36Å
13	T	95.8	Very high	83	Confident	73 Å²	73	70.1 Å²	70.1	45%	0.448	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.9	176	-55	0	0	0	0	109.2	Q69 F71	T13-Q69 HydrophobicContact CG2-CB 4.2Å; T13-Q69 HydrophobicContact CG2-CG 3.98Å; T13-F71 HydrophobicContact CG2-CD1 3.9Å; T13-F71 HydrophobicContact CG2-CE1 3.56Å; T13-F71 HydrophobicContact CG2-CZ 4.35Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.46Å
14	C	95.6	Very high	84.8	Confident	10 Å²	10	67.1 Å²	67.1	7%	0.068	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.1	169.4	173.4	0	0	0	0	109.1	W28 Q69 V70 C87	C14-W28 HydrophobicContact CB-CH2 3.48Å; C14-W28 VanDerWaalsContact CB-CH2 3.48Å; C14-W28 HydrophobicContact CB-CZ2 3.71Å; C14-W28 HydrophobicContact CB-CZ3 4.35Å; C14-Q69 CarbonylContact O-C 3.59Å; C14-Q69 WeakPolarHBondContact O-CA 3.47Å; C14-V70 PolarHBondContact N-O 2.78Å; C14-V70 PolarHBondContact O-N 2.87Å; C14-C87 HydrophobicContact CB-CB 3.49Å; C14-C87 VanDerWaalsContact CB-CB 3.49Å; C14-C87 WeakPolarHBondContact CB-SG 3.35Å; C14-C87 WeakPolarHBondContact SG-CB 3.4Å; C14-C87 CovalentContact SG-SG 2.02Å; C14-C87 PolarHBondContact SG-SG 3.32Å
15	T	96.4	Very high	86.6	Confident	96 Å²	96	64.8 Å²	64.8	59%	0.589	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.5	171.5	-53.1	0	0	0	0	108.3	S68 Q69	T15-S68 WeakPolarHBondContact CA-O 3.41Å; T15-Q69 HydrophobicContact CG2-CG 4.33Å; T15-Q69 PolarHBondContact OG1-NE2 3.03Å
16	V	93.6	Very high	88.3	Confident	16 Å²	16	62.6 Å²	62.6	10%	0.097	40%	0.399	C	S	.	.			trans	-103.2	153.2	-179.7	-57.5	0	0	0	0	111.1	F19 L21 V26 S68	V16-F19 HydrophobicContact CB-CE1 3.64Å; V16-F19 HydrophobicContact CB-CE2 4.29Å; V16-F19 HydrophobicContact CB-CZ 3.51Å; V16-F19 HydrophobicContact CG1-CE1 4.1Å; V16-F19 HydrophobicContact CG1-CE2 4.49Å; V16-F19 HydrophobicContact CG1-CZ 3.61Å; V16-F19 HydrophobicContact CG2-CE1 4.19Å; V16-F19 HydrophobicContact CG2-CE2 4.08Å; V16-F19 HydrophobicContact CG2-CZ 3.81Å; V16-L21 HydrophobicContact CG1-CD2 4.4Å; V16-L21 HydrophobicContact CG2-CD1 4.17Å; V16-L21 HydrophobicContact CG2-CD2 3.56Å; V16-L21 HydrophobicContact CG2-CG 3.72Å; V16-V26 HydrophobicContact CG1-CG2 4.35Å; V16-S68 WeakPolarHBondContact CG2-O 3.37Å; V16-S68 PolarHBondContact N-O 2.85Å; V16-S68 WeakPolarHBondContact O-CB 3.35Å
17	S	94.1	Very high	90.3	Very high	109 Å²	109	59.3 Å²	59.3	76%	0.762	38%	0.379	S	S	*	.			trans	-143.4	156.6	176	63.3	0	0	0	0	110.4	F19	S17-F19 VanDerWaalsContact C-N 3.31Å; S17-F19 WeakPolarHBondContact O-CD1 3.35Å; S17-F19 PolarHBondContact O-N 3.32Å
18	G	92.8	Very high	92	Very high	90 Å²	90	54.3 Å²	54.3	93%	0.928	34%	0.343	S	S	*	.	S	Bend	trans	80.6	2.1	179.2	0	0	0	0	0	115.6
19	F	91.1	Very high	93	Very high	39 Å²	39	50.3 Å²	50.3	17%	0.171	33%	0.326	C	S	.	.	S	Bend	trans	-155.1	162.2	172.8	67.4	-84.6	0	0	0	111.8	V16 S17 L21 Y24 V26 K89	V16-F19 HydrophobicContact CB-CE1 3.64Å; V16-F19 HydrophobicContact CB-CE2 4.29Å; V16-F19 HydrophobicContact CB-CZ 3.51Å; V16-F19 HydrophobicContact CG1-CE1 4.1Å; V16-F19 HydrophobicContact CG1-CE2 4.49Å; V16-F19 HydrophobicContact CG1-CZ 3.61Å; V16-F19 HydrophobicContact CG2-CE1 4.19Å; V16-F19 HydrophobicContact CG2-CE2 4.08Å; V16-F19 HydrophobicContact CG2-CZ 3.81Å; S17-F19 VanDerWaalsContact C-N 3.31Å; S17-F19 WeakPolarHBondContact O-CD1 3.35Å; S17-F19 PolarHBondContact O-N 3.32Å; F19-L21 HydrophobicContact CE2-CD2 3.99Å; F19-Y24 HydrophobicContact CB-CD2 3.8Å; F19-Y24 HydrophobicContact CB-CE2 4.07Å; F19-Y24 HydrophobicContact CB-CG 4.46Å; F19-Y24 AromaticContact CD2-CD2 3.93Å; F19-Y24 HydrophobicContact CD2-CD2 3.93Å; F19-Y24 HydrophobicContact CD2-CG 4.01Å; F19-Y24 HydrophobicContact CG-CD2 4.26Å; F19-V26 HydrophobicContact CE2-CG2 3.91Å; F19-V26 HydrophobicContact CZ-CG2 3.95Å; F19-K89 HydrophobicContact CD1-CD 3.57Å; F19-K89 HydrophobicContact CE1-CB 3.98Å; F19-K89 HydrophobicContact CE1-CD 3.52Å; F19-K89 HydrophobicContact CE1-CG 4.29Å; F19-K89 HydrophobicContact CE2-CB 4.24Å; F19-K89 HydrophobicContact CG-CD 4.23Å; F19-K89 HydrophobicContact CZ-CB 3.71Å; F19-K89 HydrophobicContact CZ-CD 4.12Å
20	S	93.3	Very high	93.6	Very high	55 Å²	55	48.4 Å²	48.4	39%	0.385	31%	0.309	S	S	.	.			trans	-92.1	132.7	174.8	-178.4	0	0	0	0	111.8	T22 S23 Y24	S20-T22 PolarHBondContact O-N 3.49Å; S20-T22 PolarHBondContact OG-N 2.93Å; S20-T22 PolarHBondContact OG-OG1 2.82Å; S20-S23 PolarHBondContact O-N 3.38Å; S20-Y24 PolarHBondContact O-N 2.85Å; S20-Y24 VanDerWaalsContact O-N 3.17Å
21	L	94.8	Very high	94	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.4	173	-70.7	-179.1	0	0	0	114	V16 F19 V26 G45 K63 N65 Q69 V70	V16-L21 HydrophobicContact CG1-CD2 4.4Å; V16-L21 HydrophobicContact CG2-CD1 4.17Å; V16-L21 HydrophobicContact CG2-CD2 3.56Å; V16-L21 HydrophobicContact CG2-CG 3.72Å; F19-L21 HydrophobicContact CE2-CD2 3.99Å; L21-V26 HydrophobicContact CD2-CG2 3.56Å; L21-G45 WeakPolarHBondContact O-CA 3.43Å; L21-K63 HydrophobicContact CB-CD 4.41Å; L21-K63 HydrophobicContact CD1-CB 4.37Å; L21-K63 PolarHBondContact O-NZ 3.12Å; L21-N65 VanDerWaalsContact CB-OD1 3.3Å; L21-N65 WeakPolarHBondContact CB-OD1 3.03Å; L21-Q69 WeakPolarHBondContact CD1-O 3.29Å; L21-V70 HydrophobicContact CD1-CG2 3.93Å; L21-V70 HydrophobicContact CD2-CG2 3.58Å; L21-V70 HydrophobicContact CG-CG2 4.45Å
22	T	94.8	Very high	94.1	Very high	78 Å²	78	47.3 Å²	47.3	48%	0.479	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-18.9	171.5	57.5	0	0	0	0	112.8	S20 G45 N65	S20-T22 PolarHBondContact O-N 3.49Å; S20-T22 PolarHBondContact OG-N 2.93Å; S20-T22 PolarHBondContact OG-OG1 2.82Å; T22-G45 CarbonylContact O-C 3.56Å; T22-G45 WeakPolarHBondContact O-CA 3.31Å; T22-N65 HydrophobicContact CG2-CB 4.43Å; T22-N65 WeakPolarHBondContact CG2-ND2 3.43Å
23	S	93.3	Very high	94	Very high	87 Å²	87	50.7 Å²	50.7	61%	0.608	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-22.2	-174.6	-52.7	0	0	0	0	113.4	S20	S20-S23 PolarHBondContact O-N 3.38Å
24	Y	93	Very high	93.9	Very high	124 Å²	124	51.8 Å²	51.8	49%	0.486	35%	0.346	S	S	.	.	S	Bend	trans	-126.4	148.7	-177.8	-66.6	-92.5	0	0	0	111.5	F19 S20	F19-Y24 HydrophobicContact CB-CD2 3.8Å; F19-Y24 HydrophobicContact CB-CE2 4.07Å; F19-Y24 HydrophobicContact CB-CG 4.46Å; F19-Y24 AromaticContact CD2-CD2 3.93Å; F19-Y24 HydrophobicContact CD2-CD2 3.93Å; F19-Y24 HydrophobicContact CD2-CG 4.01Å; F19-Y24 HydrophobicContact CG-CD2 4.26Å; S20-Y24 PolarHBondContact O-N 2.85Å; S20-Y24 VanDerWaalsContact O-N 3.17Å
25	G	94.8	Very high	93.6	Very high	11 Å²	11	57 Å²	57	11%	0.113	37%	0.367	C	S	.	.			trans	-80.3	154.3	167.8	0	0	0	0	0	111.6	I43	G25-I43 CarbonylContact C-O 3.54Å; G25-I43 WeakPolarHBondContact CA-O 3.28Å
26	V	97.1	Very high	93.4	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.012	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	119.2	171.7	179.3	0	0	0	0	108.5	V16 F19 L21 V42 I43 V70 C87 A88	V16-V26 HydrophobicContact CG1-CG2 4.35Å; F19-V26 HydrophobicContact CE2-CG2 3.91Å; F19-V26 HydrophobicContact CZ-CG2 3.95Å; L21-V26 HydrophobicContact CD2-CG2 3.56Å; V26-V42 WeakPolarHBondContact O-CA 3.33Å; V26-V42 WeakPolarHBondContact O-CG2 2.99Å; V26-I43 PolarHBondContact N-O 2.78Å; V26-I43 PolarHBondContact O-N 3.29Å; V26-V70 HydrophobicContact CB-CG1 4.46Å; V26-V70 HydrophobicContact CB-CG2 3.96Å; V26-V70 HydrophobicContact CG1-CB 4.36Å; V26-V70 HydrophobicContact CG1-CG1 4.34Å; V26-V70 HydrophobicContact CG1-CG2 4.09Å; V26-V70 HydrophobicContact CG2-CG2 3.94Å; V26-C87 HydrophobicContact CG1-CB 4.1Å; V26-A88 CarbonylContact C-O 3.52Å; V26-A88 WeakPolarHBondContact CA-O 3.22Å
27	S	96.4	Very high	93.4	Very high	29 Å²	29	59.8 Å²	59.8	20%	0.203	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	146.2	176	-69.1	0	0	0	0	111.2	G41 V42 C87 A88	S27-G41 CarbonylContact C-O 3.54Å; S27-G41 WeakPolarHBondContact CA-O 3.39Å; S27-V42 WeakPolarHBondContact OG-CG2 3.26Å; S27-C87 CarbonylContact O-C 3.56Å; S27-C87 WeakPolarHBondContact O-CA 3.42Å; S27-A88 PolarHBondContact N-O 3.34Å; S27-A88 PolarHBondContact O-N 2.58Å
28	W	95.8	Very high	93.3	Very high	3 Å²	3	57.4 Å²	57.4	1%	0.011	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	134.9	169	-72	94.4	0	0	0	109.9	I12 C14 L40 G41 V70 L72 Y86 C87	I12-W28 HydrophobicContact CB-CH2 4.24Å; I12-W28 HydrophobicContact CB-CZ3 4.28Å; I12-W28 HydrophobicContact CG2-CH2 3.79Å; I12-W28 HydrophobicContact CG2-CZ3 3.75Å; C14-W28 HydrophobicContact CB-CH2 3.48Å; C14-W28 VanDerWaalsContact CB-CH2 3.48Å; C14-W28 HydrophobicContact CB-CZ2 3.71Å; C14-W28 HydrophobicContact CB-CZ3 4.35Å; W28-L40 HydrophobicContact CB-CB 4.06Å; W28-L40 HydrophobicContact CB-CD1 4.34Å; W28-L40 WeakPolarHBondContact O-CB 3.47Å; W28-L40 PolarHBondContact O-N 3.17Å; W28-G41 PolarHBondContact N-O 3.24Å; W28-V70 HydrophobicContact CZ2-CB 4.32Å; W28-V70 HydrophobicContact CZ2-CG1 4.11Å; W28-L72 HydrophobicContact CB-CD1 4.14Å; W28-L72 HydrophobicContact CB-CD2 4.37Å; W28-L72 HydrophobicContact CD2-CB 3.7Å; W28-L72 HydrophobicContact CD2-CD1 4.24Å; W28-L72 HydrophobicContact CD2-CD2 4Å; W28-L72 HydrophobicContact CD2-CG 4.21Å; W28-L72 HydrophobicContact CE3-CB 3.96Å; W28-L72 HydrophobicContact CE3-CD2 3.8Å; W28-L72 HydrophobicContact CE3-CG 4.42Å; W28-L72 HydrophobicContact CG-CB 4.23Å; W28-L72 HydrophobicContact CG-CD1 3.89Å; W28-L72 HydrophobicContact CG-CD2 4.26Å; W28-L72 HydrophobicContact CG-CG 4.37Å; W28-L72 HydrophobicContact CH2-CB 4.01Å; W28-L72 HydrophobicContact CZ2-CB 3.79Å; W28-L72 HydrophobicContact CZ3-CB 4.11Å; W28-L72 HydrophobicContact CZ3-CD2 4.38Å; W28-Y86 WeakPolarHBondContact CA-O 3.48Å; W28-C87 HydrophobicContact CD2-CB 4.38Å; W28-C87 HydrophobicContact CE3-CB 4.15Å; W28-C87 HydrophobicContact CH2-CB 4.21Å; W28-C87 HydrophobicContact CZ2-CB 4.39Å; W28-C87 HydrophobicContact CZ3-CB 4.07Å
29	V	94.6	Very high	93.3	Very high	24 Å²	24	57.5 Å²	57.5	15%	0.145	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.6	180	-175.2	0	0	0	0	107.6	L37 E38 Y86	V29-L37 HydrophobicContact CG1-CB 3.79Å; V29-L37 HydrophobicContact CG1-CD2 3.68Å; V29-L37 HydrophobicContact CG1-CG 4.25Å; V29-E38 CarbonylContact C-O 3.54Å; V29-E38 WeakPolarHBondContact CA-O 3.42Å; V29-E38 WeakPolarHBondContact CG1-O 3.17Å; V29-Y86 PolarHBondContact N-O 3.28Å; V29-Y86 PolarHBondContact O-N 3.05Å
30	R	92.8	Very high	93.4	Very high	22 Å²	22	55.7 Å²	55.7	8%	0.083	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	155.2	170.3	70.7	173.5	-179.4	-176.3	7.9	111.5	E38 L40 D81 A83 T84 Y85	R30-E38 HydrophobicContact CG-CB 3.97Å; R30-E38 IonicContact CZ-OE2 2.87Å; R30-E38 VanDerWaalsContact CZ-OE2 3.31Å; R30-E38 PolarHBondContact N-O 2.9Å; R30-E38 IonicContact NE-OE2 3.61Å; R30-E38 PolarHBondContact NE-OE2 2.84Å; R30-E38 IonicContact NH2-OE2 2.85Å; R30-E38 PolarHBondContact NH2-OE2 2.96Å; R30-E38 PolarHBondContact O-N 3.06Å; R30-L40 HydrophobicContact CB-CD1 4.07Å; R30-L40 HydrophobicContact CB-CD2 4.45Å; R30-L40 HydrophobicContact CB-CG 4.34Å; R30-L40 HydrophobicContact CG-CD1 4.29Å; R30-L40 HydrophobicContact CG-CD2 3.77Å; R30-L40 HydrophobicContact CG-CG 4.14Å; R30-D81 IonicContact NH1-OD1 3.25Å; R30-D81 PolarHBondContact NH1-OD1 3.4Å; R30-A83 HydrophobicContact CB-CB 3.89Å; R30-A83 HydrophobicContact CG-CB 4.3Å; R30-T84 CarbonylContact C-O 3.42Å; R30-T84 WeakPolarHBondContact CA-O 3.36Å; R30-Y85 HydrophobicContact CB-CD1 3.98Å; R30-Y85 HydrophobicContact CB-CE1 4.01Å; R30-Y85 HydrophobicContact CB-CG 4.46Å
31	Q	93.1	Very high	93.5	Very high	72 Å²	72	53.1 Å²	53.1	34%	0.336	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	101.7	171.8	-168.8	176.5	22.4	0	0	109.7	K35 L37 A83 T84 Y86	Q31-K35 WeakPolarHBondContact CG-O 3.33Å; Q31-K35 PolarHBondContact NE2-O 3.13Å; Q31-L37 HydrophobicContact CB-CD2 3.94Å; Q31-L37 HydrophobicContact CG-CD2 4.4Å; Q31-A83 WeakPolarHBondContact O-CA 3.24Å; Q31-A83 WeakPolarHBondContact O-CB 3.2Å; Q31-T84 PolarHBondContact N-O 3.04Å; Q31-T84 PolarHBondContact O-N 2.72Å; Q31-Y86 HydrophobicContact CB-CE2 3.86Å; Q31-Y86 PolarHBondContact OE1-OH 2.76Å
32	P	91	Very high	93.6	Very high	10 Å²	10	53.1 Å²	53.1	7%	0.065	31%	0.313	C	S	.	.			trans	-65.5	151.3	171.3	-17.6	30.7	0	0	0	111.1	G34 K35 A83	P32-G34 PolarHBondContact O-N 2.9Å; P32-K35 HydrophobicContact CB-CB 4.03Å; P32-K35 HydrophobicContact CB-CD 3.99Å; P32-K35 HydrophobicContact CB-CG 4.21Å; P32-K35 HydrophobicContact CG-CB 4.21Å; P32-K35 HydrophobicContact CG-CD 4.15Å; P32-K35 PolarHBondContact O-N 3.25Å; P32-A83 HydrophobicContact CB-CB 4.45Å; P32-A83 HydrophobicContact CG-CB 4.31Å
33	P	91	Very high	93.7	Very high	111 Å²	111	49.8 Å²	49.8	72%	0.721	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	126.8	176.5	-24.8	33.5	0	0	0	111.8	K35 P82	P33-K35 PolarHBondContact O-N 3.05Å; P33-P82 VanDerWaalsContact CD-O 3.23Å; P33-P82 WeakPolarHBondContact CD-O 3.38Å
34	G	91.8	Very high	93.9	Very high	95 Å²	95	51.8 Å²	51.8	98%	0.979	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	6.7	-179.8	0	0	0	0	0	115.4	P32	P32-G34 PolarHBondContact O-N 2.9Å
35	K	90.3	Very high	94	Very high	119 Å²	119	46.7 Å²	46.7	52%	0.517	27%	0.272	S	S	.	.	S	Bend	trans	-115.9	166.1	176.2	-62.2	-170.3	-177.8	176.2	0	112.1	Q31 P32 P33	Q31-K35 WeakPolarHBondContact CG-O 3.33Å; Q31-K35 PolarHBondContact NE2-O 3.13Å; P32-K35 HydrophobicContact CB-CB 4.03Å; P32-K35 HydrophobicContact CB-CD 3.99Å; P32-K35 HydrophobicContact CB-CG 4.21Å; P32-K35 HydrophobicContact CG-CB 4.21Å; P32-K35 HydrophobicContact CG-CD 4.15Å; P32-K35 PolarHBondContact O-N 3.25Å; P33-K35 PolarHBondContact O-N 3.05Å
36	G	91.8	Very high	93.9	Very high	50 Å²	50	52.5 Å²	52.5	52%	0.515	30%	0.3	S	S	.	.			trans	-72.1	179	173.4	0	0	0	0	0	113.1
37	L	93.3	Very high	93.8	Very high	121 Å²	121	54 Å²	54	63%	0.634	32%	0.317	S	S	*	.			trans	-71.1	129.6	172.9	-70.7	167.2	0	0	0	110.2	V29 Q31 Y86	V29-L37 HydrophobicContact CG1-CB 3.79Å; V29-L37 HydrophobicContact CG1-CD2 3.68Å; V29-L37 HydrophobicContact CG1-CG 4.25Å; Q31-L37 HydrophobicContact CB-CD2 3.94Å; Q31-L37 HydrophobicContact CG-CD2 4.4Å; L37-Y86 HydrophobicContact CD2-CD2 4.13Å; L37-Y86 HydrophobicContact CD2-CE2 4.1Å
38	E	92.2	Very high	93.7	Very high	60 Å²	60	55.1 Å²	55.1	28%	0.28	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	120.5	175.6	-67.2	-179.8	-177.7	0	0	109.3	V29 R30	V29-E38 CarbonylContact C-O 3.54Å; V29-E38 WeakPolarHBondContact CA-O 3.42Å; V29-E38 WeakPolarHBondContact CG1-O 3.17Å; R30-E38 HydrophobicContact CG-CB 3.97Å; R30-E38 IonicContact CZ-OE2 2.87Å; R30-E38 VanDerWaalsContact CZ-OE2 3.31Å; R30-E38 PolarHBondContact N-O 2.9Å; R30-E38 IonicContact NE-OE2 3.61Å; R30-E38 PolarHBondContact NE-OE2 2.84Å; R30-E38 IonicContact NH2-OE2 2.85Å; R30-E38 PolarHBondContact NH2-OE2 2.96Å; R30-E38 PolarHBondContact O-N 3.06Å
39	W	93.6	Very high	93.7	Very high	92 Å²	92	57.8 Å²	57.8	35%	0.348	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	135.3	173.9	179.6	83.5	0	0	0	110.5	G41 V42 N50 Y51 H52	W39-G41 VanDerWaalsContact CZ2-C 3.41Å; W39-G41 PolarHBondContact NE1-O 3.01Å; W39-V42 HydrophobicContact CZ2-CB 4.07Å; W39-V42 HydrophobicContact CZ2-CG1 3.88Å; W39-N50 HydrophobicContact CH2-CB 4.23Å; W39-Y51 VanDerWaalsContact CZ3-C 3.45Å; W39-H52 HydrophobicContact CE3-CB 3.99Å; W39-H52 HydrophobicContact CZ3-CB 4.16Å; W39-H52 VanDerWaalsContact CZ3-N 3.34Å; W39-H52 VanDerWaalsContact O-CB 3.31Å; W39-H52 WeakPolarHBondContact O-CB 3.28Å
40	L	93.3	Very high	93.7	Very high	1 Å²	1	61 Å²	61	1%	0.005	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-38.6	-177.6	-64.3	-175.9	0	0	0	112.8	W28 R30 H52 L55 L59 L72 Y85	W28-L40 HydrophobicContact CB-CB 4.06Å; W28-L40 HydrophobicContact CB-CD1 4.34Å; W28-L40 WeakPolarHBondContact O-CB 3.47Å; W28-L40 PolarHBondContact O-N 3.17Å; R30-L40 HydrophobicContact CB-CD1 4.07Å; R30-L40 HydrophobicContact CB-CD2 4.45Å; R30-L40 HydrophobicContact CB-CG 4.34Å; R30-L40 HydrophobicContact CG-CD1 4.29Å; R30-L40 HydrophobicContact CG-CD2 3.77Å; R30-L40 HydrophobicContact CG-CG 4.14Å; L40-H52 PolarHBondContact O-N 2.99Å; L40-L55 HydrophobicContact CD2-CD1 3.33Å; L40-L59 HydrophobicContact CB-CD1 3.99Å; L40-L59 HydrophobicContact CD2-CD1 4.25Å; L40-L72 HydrophobicContact CD1-CD2 3.78Å; L40-Y85 HydrophobicContact CD1-CD1 3.8Å; L40-Y85 HydrophobicContact CD1-CE1 3.78Å
41	G	95.3	Very high	93.8	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.2	174.2	-174.2	0	0	0	0	0	112.2	S27 W28 W39 N50	S27-G41 CarbonylContact C-O 3.54Å; S27-G41 WeakPolarHBondContact CA-O 3.39Å; W28-G41 PolarHBondContact N-O 3.24Å; W39-G41 VanDerWaalsContact CZ2-C 3.41Å; W39-G41 PolarHBondContact NE1-O 3.01Å; G41-N50 CarbonylContact C-O 3.56Å; G41-N50 WeakPolarHBondContact CA-O 3.49Å
42	V	96.4	Very high	93.6	Very high	4 Å²	4	62.4 Å²	62.4	2%	0.024	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	145.6	178.2	65.2	0	0	0	0	109.4	V26 S27 W39 W44 T49 N50	V26-V42 WeakPolarHBondContact O-CA 3.33Å; V26-V42 WeakPolarHBondContact O-CG2 2.99Å; S27-V42 WeakPolarHBondContact OG-CG2 3.26Å; W39-V42 HydrophobicContact CZ2-CB 4.07Å; W39-V42 HydrophobicContact CZ2-CG1 3.88Å; V42-W44 HydrophobicContact CG1-CD2 4.36Å; V42-W44 HydrophobicContact CG1-CZ2 3.75Å; V42-W44 HydrophobicContact CG2-CD2 4.19Å; V42-W44 HydrophobicContact CG2-CE3 4.36Å; V42-W44 HydrophobicContact CG2-CH2 4.44Å; V42-W44 HydrophobicContact CG2-CZ2 4.28Å; V42-W44 HydrophobicContact CG2-CZ3 4.48Å; V42-T49 VanDerWaalsContact O-CA 3.28Å; V42-T49 WeakPolarHBondContact O-CA 3.01Å; V42-N50 HydrophobicContact CG1-CB 3.94Å; V42-N50 PolarHBondContact N-O 2.87Å; V42-N50 PolarHBondContact O-N 3.33Å
43	I	97.2	Very high	93.3	Very high	9 Å²	9	66.9 Å²	66.9	5%	0.046	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.5	162.5	-172.2	163.1	0	0	0	108.9	G25 V26 S48 T49 I61 K63 V70	G25-I43 CarbonylContact C-O 3.54Å; G25-I43 WeakPolarHBondContact CA-O 3.28Å; V26-I43 PolarHBondContact N-O 2.78Å; V26-I43 PolarHBondContact O-N 3.29Å; I43-S48 WeakPolarHBondContact CA-O 3.31Å; I43-T49 HydrophobicContact CB-CG2 3.95Å; I43-T49 HydrophobicContact CD1-CG2 3.96Å; I43-T49 HydrophobicContact CG1-CG2 3.78Å; I43-I61 HydrophobicContact CB-CG2 3.72Å; I43-I61 HydrophobicContact CG2-CG2 3.69Å; I43-K63 HydrophobicContact CD1-CB 4.04Å; I43-K63 HydrophobicContact CD1-CD 3.86Å; I43-K63 HydrophobicContact CD1-CG 3.72Å; I43-K63 HydrophobicContact CG1-CD 4.08Å; I43-K63 HydrophobicContact CG1-CG 4.49Å; I43-V70 HydrophobicContact CG2-CG1 3.74Å
44	W	96.8	Very high	92.9	Very high	128 Å²	128	65 Å²	65	49%	0.485	39%	0.389	S	S	.	.			trans	-85.3	169.7	-177.1	-62.9	108	0	0	0	112.1	V42 D46 G47 S48 K63	V42-W44 HydrophobicContact CG1-CD2 4.36Å; V42-W44 HydrophobicContact CG1-CZ2 3.75Å; V42-W44 HydrophobicContact CG2-CD2 4.19Å; V42-W44 HydrophobicContact CG2-CE3 4.36Å; V42-W44 HydrophobicContact CG2-CH2 4.44Å; V42-W44 HydrophobicContact CG2-CZ2 4.28Å; V42-W44 HydrophobicContact CG2-CZ3 4.48Å; W44-D46 VanDerWaalsContact C-N 3.25Å; W44-D46 VanDerWaalsContact CB-OD1 3.26Å; W44-D46 WeakPolarHBondContact CB-OD1 3.45Å; W44-D46 PolarHBondContact O-N 2.89Å; W44-G47 WeakPolarHBondContact O-CA 3.49Å; W44-G47 PolarHBondContact O-N 3.01Å; W44-S48 PolarHBondContact N-O 3.02Å; W44-K63 PolarHBondContact O-NZ 2.75Å
45	G	94.6	Very high	92.4	Very high	18 Å²	18	61 Å²	61	19%	0.186	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-36.6	-179.9	0	0	0	0	0	113.7	L21 T22 G47 K63	L21-G45 WeakPolarHBondContact O-CA 3.43Å; T22-G45 CarbonylContact O-C 3.56Å; T22-G45 WeakPolarHBondContact O-CA 3.31Å; G45-G47 PolarHBondContact O-N 2.74Å; G45-K63 VanDerWaalsContact C-NZ 3.27Å; G45-K63 PolarHBondContact O-NZ 2.86Å
46	D	94.5	Very high	92	Very high	132 Å²	132	61 Å²	61	71%	0.706	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-7.7	175.7	66.7	-6	0	0	0	114	W44 S48	W44-D46 VanDerWaalsContact C-N 3.25Å; W44-D46 VanDerWaalsContact CB-OD1 3.26Å; W44-D46 WeakPolarHBondContact CB-OD1 3.45Å; W44-D46 PolarHBondContact O-N 2.89Å; D46-S48 WeakPolarHBondContact OD1-CB 3.48Å; D46-S48 PolarHBondContact OD1-N 2.77Å; D46-S48 PolarHBondContact OD1-OG 2.83Å; D46-S48 PolarHBondContact OD2-OG 2.8Å
47	G	94	Very high	91.8	Very high	35 Å²	35	64 Å²	64	36%	0.361	36%	0.361	S	S	.	.	S	Bend	trans	89.8	-1.4	-178.5	0	0	0	0	0	114.4	W44 G45	W44-G47 WeakPolarHBondContact O-CA 3.49Å; W44-G47 PolarHBondContact O-N 3.01Å; G45-G47 PolarHBondContact O-N 2.74Å
48	S	95.2	Very high	91.6	Very high	52 Å²	52	59.5 Å²	59.5	36%	0.364	34%	0.336	S	S	.	.			trans	-64.2	146.4	171.2	65.1	0	0	0	0	110.4	I43 W44 D46	I43-S48 WeakPolarHBondContact CA-O 3.31Å; W44-S48 PolarHBondContact N-O 3.02Å; D46-S48 WeakPolarHBondContact OD1-CB 3.48Å; D46-S48 PolarHBondContact OD1-N 2.77Å; D46-S48 PolarHBondContact OD1-OG 2.83Å; D46-S48 PolarHBondContact OD2-OG 2.8Å
49	T	95.7	Very high	91.5	Very high	59 Å²	59	57.2 Å²	57.2	36%	0.362	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145.6	-178.5	51.7	0	0	0	0	110.9	V42 I43 Y51	V42-T49 VanDerWaalsContact O-CA 3.28Å; V42-T49 WeakPolarHBondContact O-CA 3.01Å; I43-T49 HydrophobicContact CB-CG2 3.95Å; I43-T49 HydrophobicContact CD1-CG2 3.96Å; I43-T49 HydrophobicContact CG1-CG2 3.78Å; T49-Y51 VanDerWaalsContact OG1-CE2 3.31Å; T49-Y51 WeakPolarHBondContact OG1-CE2 2.98Å; T49-Y51 PolarHBondContact OG1-OH 2.69Å
50	N	94.8	Very high	91.5	Very high	92 Å²	92	55.2 Å²	55.2	49%	0.492	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	144.8	168.9	-164.9	-8.5	0	0	0	108.5	W39 G41 V42	W39-N50 HydrophobicContact CH2-CB 4.23Å; G41-N50 CarbonylContact C-O 3.56Å; G41-N50 WeakPolarHBondContact CA-O 3.49Å; V42-N50 HydrophobicContact CG1-CB 3.94Å; V42-N50 PolarHBondContact N-O 2.87Å; V42-N50 PolarHBondContact O-N 3.33Å
51	Y	93.2	Very high	91.6	Very high	46 Å²	46	55.6 Å²	55.6	18%	0.18	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.6	-172.3	-61.2	-84.8	0	0	0	110.7	W39 T49 S53 M56 L59 I61	W39-Y51 VanDerWaalsContact CZ3-C 3.45Å; T49-Y51 VanDerWaalsContact OG1-CE2 3.31Å; T49-Y51 WeakPolarHBondContact OG1-CE2 2.98Å; T49-Y51 PolarHBondContact OG1-OH 2.69Å; Y51-S53 PolarHBondContact O-N 3.38Å; Y51-M56 HydrophobicContact CD2-CG 4.19Å; Y51-M56 HydrophobicContact CG-CG 4.25Å; Y51-L59 HydrophobicContact CD1-CB 3.94Å; Y51-L59 HydrophobicContact CE1-CB 4.21Å; Y51-I61 HydrophobicContact CD1-CD1 4.07Å; Y51-I61 HydrophobicContact CD1-CG1 4.48Å; Y51-I61 HydrophobicContact CE1-CB 4.21Å; Y51-I61 HydrophobicContact CE1-CD1 3.81Å; Y51-I61 HydrophobicContact CE1-CG1 3.81Å; Y51-I61 PolarHBondContact OH-N 3.17Å
52	H	89.6	Confident	91.6	Very high	76 Å²	76	58.4 Å²	58.4	35%	0.352	35%	0.347	S	S	.	.			trans	-65.6	123.4	165.7	-171.1	-111.9	0	0	0	109.2	W39 L40 A54 L55 M56	W39-H52 HydrophobicContact CE3-CB 3.99Å; W39-H52 HydrophobicContact CZ3-CB 4.16Å; W39-H52 VanDerWaalsContact CZ3-N 3.34Å; W39-H52 VanDerWaalsContact O-CB 3.31Å; W39-H52 WeakPolarHBondContact O-CB 3.28Å; L40-H52 PolarHBondContact O-N 2.99Å; H52-A54 PolarHBondContact O-N 3.43Å; H52-A54 VanDerWaalsContact O-N 3.12Å; H52-L55 PolarHBondContact O-N 2.82Å; H52-M56 PolarHBondContact O-N 2.84Å
53	S	85.2	Confident	91.6	Very high	104 Å²	104	60.3 Å²	60.3	73%	0.727	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-54	-38.3	-170.2	54	0	0	0	0	113.3	Y51 L55	Y51-S53 PolarHBondContact O-N 3.38Å; S53-L55 PolarHBondContact O-N 2.02Å
54	A	83.1	Confident	91.5	Very high	73 Å²	73	61.9 Å²	61.9	60%	0.603	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-67	-18.9	179.3	0	0	0	0	0	114.3	H52	H52-A54 PolarHBondContact O-N 3.43Å; H52-A54 VanDerWaalsContact O-N 3.12Å
55	L	80.2	Confident	91.4	Very high	10 Å²	10	59.1 Å²	59.1	5%	0.052	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-119.4	-1.4	-174.4	-61.4	173.6	0	0	0	112.9	L40 H52 S53 S57 R58 L59	L40-L55 HydrophobicContact CD2-CD1 3.33Å; H52-L55 PolarHBondContact O-N 2.82Å; S53-L55 PolarHBondContact O-N 2.02Å; L55-S57 PolarHBondContact O-N 3.17Å; L55-R58 VanDerWaalsContact CD2-NH2 3.29Å; L55-R58 PolarHBondContact O-N 2.88Å; L55-L59 HydrophobicContact CB-CD1 3.36Å; L55-L59 HydrophobicContact CB-CG 3.93Å; L55-L59 HydrophobicContact CD1-CD1 4.1Å; L55-L59 HydrophobicContact CG-CD1 4.37Å; L55-L59 WeakPolarHBondContact O-CB 3.13Å; L55-L59 PolarHBondContact O-N 2.88Å
56	M	82.5	Confident	91.4	Very high	120 Å²	120	63.3 Å²	63.3	59%	0.591	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-33.2	-174.5	-170.1	178.7	97.6	0	0	113.6	Y51 H52 R58	Y51-M56 HydrophobicContact CD2-CG 4.19Å; Y51-M56 HydrophobicContact CG-CG 4.25Å; H52-M56 PolarHBondContact O-N 2.84Å; M56-R58 VanDerWaalsContact C-N 3.29Å; M56-R58 PolarHBondContact O-N 3.01Å
57	S	86.3	Confident	91.4	Very high	112 Å²	112	62.9 Å²	62.9	78%	0.783	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-17.9	179.7	59.7	0	0	0	0	114	L55	L55-S57 PolarHBondContact O-N 3.17Å
58	R	89.4	Confident	91.5	Very high	26 Å²	26	63.3 Å²	63.3	10%	0.098	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-20.4	-174.2	-61.7	-166.8	-62.1	129.9	1.6	113.2	L55 M56 L74 N75 S76 D81	L55-R58 VanDerWaalsContact CD2-NH2 3.29Å; L55-R58 PolarHBondContact O-N 2.88Å; M56-R58 VanDerWaalsContact C-N 3.29Å; M56-R58 PolarHBondContact O-N 3.01Å; R58-L74 HydrophobicContact CB-CD1 3.92Å; R58-L74 WeakPolarHBondContact O-CA 3.37Å; R58-N75 WeakPolarHBondContact CB-O 3.39Å; R58-N75 PolarHBondContact O-N 2.84Å; R58-S76 PolarHBondContact NH1-O 2.86Å; R58-D81 IonicContact CZ-OD2 3.55Å; R58-D81 IonicContact NH1-OD1 3.34Å; R58-D81 IonicContact NH1-OD2 2.9Å; R58-D81 PolarHBondContact NH1-OD2 3.35Å; R58-D81 IonicContact NH2-OD1 3.81Å; R58-D81 PolarHBondContact NH2-OD1 2.99Å; R58-D81 IonicContact NH2-OD2 2.72Å
59	L	90.8	Very high	91.6	Very high	12 Å²	12	63 Å²	63	6%	0.063	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	143.9	-178.5	-76.9	173.3	0	0	0	112.7	L40 Y51 L55 L72 K73 L74	L40-L59 HydrophobicContact CB-CD1 3.99Å; L40-L59 HydrophobicContact CD2-CD1 4.25Å; Y51-L59 HydrophobicContact CD1-CB 3.94Å; Y51-L59 HydrophobicContact CE1-CB 4.21Å; L55-L59 HydrophobicContact CB-CD1 3.36Å; L55-L59 HydrophobicContact CB-CG 3.93Å; L55-L59 HydrophobicContact CD1-CD1 4.1Å; L55-L59 HydrophobicContact CG-CD1 4.37Å; L55-L59 WeakPolarHBondContact O-CB 3.13Å; L55-L59 PolarHBondContact O-N 2.88Å; L59-L72 HydrophobicContact CD2-CD1 3.72Å; L59-L72 HydrophobicContact CD2-CG 4.31Å; L59-K73 CarbonylContact C-O 3.49Å; L59-K73 WeakPolarHBondContact CA-O 3.34Å; L59-L74 HydrophobicContact CD2-CB 4.14Å; L59-L74 HydrophobicContact CD2-CD1 3.54Å; L59-L74 HydrophobicContact CD2-CG 4.38Å; L59-L74 HydrophobicContact CG-CD1 3.85Å
60	S	93.1	Very high	91.6	Very high	51 Å²	51	60.2 Å²	60.2	36%	0.357	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	128.9	167.7	176.7	0	0	0	0	108.6	K73	S60-K73 PolarHBondContact N-O 2.9Å; S60-K73 PolarHBondContact O-N 3.46Å
61	I	95.3	Very high	91.7	Very high	8 Å²	8	58 Å²	58	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131.2	176.5	-58.9	163.5	0	0	0	107.9	I43 Y51 V70 F71 L72	I43-I61 HydrophobicContact CB-CG2 3.72Å; I43-I61 HydrophobicContact CG2-CG2 3.69Å; Y51-I61 HydrophobicContact CD1-CD1 4.07Å; Y51-I61 HydrophobicContact CD1-CG1 4.48Å; Y51-I61 HydrophobicContact CE1-CB 4.21Å; Y51-I61 HydrophobicContact CE1-CD1 3.81Å; Y51-I61 HydrophobicContact CE1-CG1 3.81Å; Y51-I61 PolarHBondContact OH-N 3.17Å; I61-V70 HydrophobicContact CG2-CG1 4.04Å; I61-F71 WeakPolarHBondContact CA-O 3.35Å; I61-L72 HydrophobicContact CD1-CD1 4.36Å; I61-L72 HydrophobicContact CG1-CD1 3.7Å
62	S	95.4	Very high	91.7	Very high	59 Å²	59	55.9 Å²	55.9	41%	0.413	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	167.8	175.9	66.4	0	0	0	0	110.9	V70 F71	S62-V70 CarbonylContact O-C 3.58Å; S62-V70 WeakPolarHBondContact O-CA 3.44Å; S62-V70 WeakPolarHBondContact O-CG1 3.49Å; S62-F71 PolarHBondContact N-O 3.24Å; S62-F71 PolarHBondContact O-N 2.76Å
63	K	95.8	Very high	91.9	Very high	45 Å²	45	56.6 Å²	56.6	20%	0.196	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	150.4	178.4	69.7	-176.3	-174.5	-179.7	0	112.1	L21 I43 W44 G45 N65 Q69 V70	L21-K63 HydrophobicContact CB-CD 4.41Å; L21-K63 HydrophobicContact CD1-CB 4.37Å; L21-K63 PolarHBondContact O-NZ 3.12Å; I43-K63 HydrophobicContact CD1-CB 4.04Å; I43-K63 HydrophobicContact CD1-CD 3.86Å; I43-K63 HydrophobicContact CD1-CG 3.72Å; I43-K63 HydrophobicContact CG1-CD 4.08Å; I43-K63 HydrophobicContact CG1-CG 4.49Å; W44-K63 PolarHBondContact O-NZ 2.75Å; G45-K63 VanDerWaalsContact C-NZ 3.27Å; G45-K63 PolarHBondContact O-NZ 2.86Å; K63-N65 WeakPolarHBondContact CD-OD1 3.35Å; K63-N65 WeakPolarHBondContact CE-OD1 3.31Å; K63-Q69 CarbonylContact C-O 3.56Å; K63-Q69 VanDerWaalsContact CA-O 3.3Å; K63-Q69 WeakPolarHBondContact CA-O 3.39Å; K63-V70 HydrophobicContact CB-CG2 4.23Å
64	D	95.8	Very high	92.1	Very high	41 Å²	41	51.8 Å²	51.8	22%	0.219	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	100.4	169.5	-176.3	-16.9	0	0	0	108	S66 K67 S68 Q69 F71	D64-S66 PolarHBondContact O-N 2.94Å; D64-S66 WeakPolarHBondContact OD1-CB 3.37Å; D64-S66 PolarHBondContact OD1-N 3.36Å; D64-S66 PolarHBondContact OD1-OG 2.9Å; D64-K67 HydrophobicContact CB-CB 4.37Å; D64-K67 PolarHBondContact O-N 2.76Å; D64-K67 PolarHBondContact OD1-N 3.24Å; D64-K67 WeakPolarHBondContact OD2-CD 3.47Å; D64-K67 WeakPolarHBondContact OD2-CE 3.5Å; D64-K67 WeakPolarHBondContact OD2-CG 3.48Å; D64-K67 IonicContact OD2-NZ 3.31Å; D64-K67 PolarHBondContact OD2-NZ 3.43Å; D64-S68 PolarHBondContact O-N 2.87Å; D64-Q69 PolarHBondContact N-O 2.79Å; D64-Q69 PolarHBondContact O-N 2.84Å; D64-F71 HydrophobicContact CB-CE2 3.82Å; D64-F71 HydrophobicContact CB-CZ 4.37Å
65	N	94.7	Very high	92.3	Very high	71 Å²	71	51.1 Å²	51.1	38%	0.38	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-63.2	-32	-179	-63.7	-22.2	0	0	0	111.8	L21 T22 K63 K67 S68	L21-N65 VanDerWaalsContact CB-OD1 3.3Å; L21-N65 WeakPolarHBondContact CB-OD1 3.03Å; T22-N65 HydrophobicContact CG2-CB 4.43Å; T22-N65 WeakPolarHBondContact CG2-ND2 3.43Å; K63-N65 WeakPolarHBondContact CD-OD1 3.35Å; K63-N65 WeakPolarHBondContact CE-OD1 3.31Å; N65-K67 VanDerWaalsContact C-N 3.26Å; N65-K67 PolarHBondContact O-N 3.3Å; N65-S68 PolarHBondContact O-N 2.85Å
66	S	94.4	Very high	92.4	Very high	105 Å²	105	54.3 Å²	54.3	73%	0.734	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-68	-29.9	-178.7	74.1	0	0	0	0	112.1	D64	D64-S66 PolarHBondContact O-N 2.94Å; D64-S66 WeakPolarHBondContact OD1-CB 3.37Å; D64-S66 PolarHBondContact OD1-N 3.36Å; D64-S66 PolarHBondContact OD1-OG 2.9Å
67	K	95.4	Very high	92.3	Very high	123 Å²	123	49.7 Å²	49.7	54%	0.535	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-100.7	-2	178.8	-63	-178.8	-169.2	151.5	0	113.6	D64 N65 Q69	D64-K67 HydrophobicContact CB-CB 4.37Å; D64-K67 PolarHBondContact O-N 2.76Å; D64-K67 PolarHBondContact OD1-N 3.24Å; D64-K67 WeakPolarHBondContact OD2-CD 3.47Å; D64-K67 WeakPolarHBondContact OD2-CE 3.5Å; D64-K67 WeakPolarHBondContact OD2-CG 3.48Å; D64-K67 IonicContact OD2-NZ 3.31Å; D64-K67 PolarHBondContact OD2-NZ 3.43Å; N65-K67 VanDerWaalsContact C-N 3.26Å; N65-K67 PolarHBondContact O-N 3.3Å; K67-Q69 HydrophobicContact CB-CB 4.26Å; K67-Q69 HydrophobicContact CB-CG 4.07Å; K67-Q69 PolarHBondContact O-N 2.8Å
68	S	95.5	Very high	92.1	Very high	44 Å²	44	49.2 Å²	49.2	31%	0.308	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	44.1	-170.9	-58.2	0	0	0	0	111.9	T15 V16 D64 N65	T15-S68 WeakPolarHBondContact CA-O 3.41Å; V16-S68 WeakPolarHBondContact CG2-O 3.37Å; V16-S68 PolarHBondContact N-O 2.85Å; V16-S68 WeakPolarHBondContact O-CB 3.35Å; D64-S68 PolarHBondContact O-N 2.87Å; N65-S68 PolarHBondContact O-N 2.85Å
69	Q	97.1	Very high	91.5	Very high	47 Å²	47	53.7 Å²	53.7	22%	0.22	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	142.1	-177.2	-76.8	176.3	-12.5	0	0	112	T13 C14 T15 L21 K63 D64 K67 F71	T13-Q69 HydrophobicContact CG2-CB 4.2Å; T13-Q69 HydrophobicContact CG2-CG 3.98Å; C14-Q69 CarbonylContact O-C 3.59Å; C14-Q69 WeakPolarHBondContact O-CA 3.47Å; T15-Q69 HydrophobicContact CG2-CG 4.33Å; T15-Q69 PolarHBondContact OG1-NE2 3.03Å; L21-Q69 WeakPolarHBondContact CD1-O 3.29Å; K63-Q69 CarbonylContact C-O 3.56Å; K63-Q69 VanDerWaalsContact CA-O 3.3Å; K63-Q69 WeakPolarHBondContact CA-O 3.39Å; D64-Q69 PolarHBondContact N-O 2.79Å; D64-Q69 PolarHBondContact O-N 2.84Å; K67-Q69 HydrophobicContact CB-CB 4.26Å; K67-Q69 HydrophobicContact CB-CG 4.07Å; K67-Q69 PolarHBondContact O-N 2.8Å; Q69-F71 HydrophobicContact CB-CE1 4.31Å; Q69-F71 HydrophobicContact CB-CE2 3.91Å; Q69-F71 HydrophobicContact CB-CZ 3.63Å
70	V	96.8	Very high	90.7	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.6	171.1	-173.8	0	0	0	0	107.9	C14 L21 V26 W28 I43 I61 S62 K63	C14-V70 PolarHBondContact N-O 2.78Å; C14-V70 PolarHBondContact O-N 2.87Å; L21-V70 HydrophobicContact CD1-CG2 3.93Å; L21-V70 HydrophobicContact CD2-CG2 3.58Å; L21-V70 HydrophobicContact CG-CG2 4.45Å; V26-V70 HydrophobicContact CB-CG1 4.46Å; V26-V70 HydrophobicContact CB-CG2 3.96Å; V26-V70 HydrophobicContact CG1-CB 4.36Å; V26-V70 HydrophobicContact CG1-CG1 4.34Å; V26-V70 HydrophobicContact CG1-CG2 4.09Å; V26-V70 HydrophobicContact CG2-CG2 3.94Å; W28-V70 HydrophobicContact CZ2-CB 4.32Å; W28-V70 HydrophobicContact CZ2-CG1 4.11Å; I43-V70 HydrophobicContact CG2-CG1 3.74Å; I61-V70 HydrophobicContact CG2-CG1 4.04Å; S62-V70 CarbonylContact O-C 3.58Å; S62-V70 WeakPolarHBondContact O-CA 3.44Å; S62-V70 WeakPolarHBondContact O-CG1 3.49Å; K63-V70 HydrophobicContact CB-CG2 4.23Å
71	F	95.8	Very high	90	Very high	46 Å²	46	56.2 Å²	56.2	20%	0.202	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	135.3	-176.6	-51.2	-88	0	0	0	109.8	I12 T13 I61 S62 D64 Q69	I12-F71 CarbonylContact O-C 3.53Å; I12-F71 WeakPolarHBondContact O-CA 3.33Å; T13-F71 HydrophobicContact CG2-CD1 3.9Å; T13-F71 HydrophobicContact CG2-CE1 3.56Å; T13-F71 HydrophobicContact CG2-CZ 4.35Å; T13-F71 WeakPolarHBondContact OG1-CD1 3.46Å; I61-F71 WeakPolarHBondContact CA-O 3.35Å; S62-F71 PolarHBondContact N-O 3.24Å; S62-F71 PolarHBondContact O-N 2.76Å; D64-F71 HydrophobicContact CB-CE2 3.82Å; D64-F71 HydrophobicContact CB-CZ 4.37Å; Q69-F71 HydrophobicContact CB-CE1 4.31Å; Q69-F71 HydrophobicContact CB-CE2 3.91Å; Q69-F71 HydrophobicContact CB-CZ 3.63Å
72	L	94.4	Very high	89.5	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.8	168.8	-177.5	72.2	0	0	0	108	S11 I12 W28 L40 L59 I61 Y85	S11-L72 CarbonylContact C-O 3.4Å; S11-L72 WeakPolarHBondContact CA-O 3.3Å; I12-L72 HydrophobicContact CB-CB 4.4Å; I12-L72 HydrophobicContact CD1-CD2 4.19Å; I12-L72 PolarHBondContact N-O 2.79Å; I12-L72 PolarHBondContact O-N 3.19Å; W28-L72 HydrophobicContact CB-CD1 4.14Å; W28-L72 HydrophobicContact CB-CD2 4.37Å; W28-L72 HydrophobicContact CD2-CB 3.7Å; W28-L72 HydrophobicContact CD2-CD1 4.24Å; W28-L72 HydrophobicContact CD2-CD2 4Å; W28-L72 HydrophobicContact CD2-CG 4.21Å; W28-L72 HydrophobicContact CE3-CB 3.96Å; W28-L72 HydrophobicContact CE3-CD2 3.8Å; W28-L72 HydrophobicContact CE3-CG 4.42Å; W28-L72 HydrophobicContact CG-CB 4.23Å; W28-L72 HydrophobicContact CG-CD1 3.89Å; W28-L72 HydrophobicContact CG-CD2 4.26Å; W28-L72 HydrophobicContact CG-CG 4.37Å; W28-L72 HydrophobicContact CH2-CB 4.01Å; W28-L72 HydrophobicContact CZ2-CB 3.79Å; W28-L72 HydrophobicContact CZ3-CB 4.11Å; W28-L72 HydrophobicContact CZ3-CD2 4.38Å; L40-L72 HydrophobicContact CD1-CD2 3.78Å; L59-L72 HydrophobicContact CD2-CD1 3.72Å; L59-L72 HydrophobicContact CD2-CG 4.31Å; I61-L72 HydrophobicContact CD1-CD1 4.36Å; I61-L72 HydrophobicContact CG1-CD1 3.7Å; L72-Y85 HydrophobicContact CD2-CD1 3.63Å; L72-Y85 HydrophobicContact CD2-CE1 4.02Å
73	K	92.2	Very high	89.2	Confident	91 Å²	91	58.2 Å²	58.2	40%	0.396	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.1	171.5	-169.7	175.7	-177	-180	0	109.4	L10 L59 S60 N75	L10-K73 CarbonylContact O-C 3.54Å; L10-K73 VanDerWaalsContact O-CA 3.31Å; L10-K73 WeakPolarHBondContact O-CA 3.23Å; L59-K73 CarbonylContact C-O 3.49Å; L59-K73 WeakPolarHBondContact CA-O 3.34Å; S60-K73 PolarHBondContact N-O 2.9Å; S60-K73 PolarHBondContact O-N 3.46Å; K73-N75 VanDerWaalsContact CE-OD1 3.31Å; K73-N75 WeakPolarHBondContact CE-OD1 3.49Å
74	L	89.3	Confident	89	Confident	3 Å²	3	59.7 Å²	59.7	2%	0.016	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	115.2	173.8	-178	67.8	0	0	0	108.3	S9 L10 R58 L59 L77 D81	S9-L74 CarbonylContact C-O 3.49Å; S9-L74 VanDerWaalsContact CA-O 3.29Å; S9-L74 WeakPolarHBondContact CA-O 3.3Å; L10-L74 HydrophobicContact CB-CB 4.36Å; L10-L74 PolarHBondContact N-O 3.03Å; L10-L74 PolarHBondContact O-N 3.26Å; R58-L74 HydrophobicContact CB-CD1 3.92Å; R58-L74 WeakPolarHBondContact O-CA 3.37Å; L59-L74 HydrophobicContact CD2-CB 4.14Å; L59-L74 HydrophobicContact CD2-CD1 3.54Å; L59-L74 HydrophobicContact CD2-CG 4.38Å; L59-L74 HydrophobicContact CG-CD1 3.85Å; L74-L77 HydrophobicContact CD2-CD2 3.9Å; L74-D81 HydrophobicContact CD2-CB 3.95Å
75	N	87.3	Confident	88.9	Confident	58 Å²	58	59.6 Å²	59.6	31%	0.31	33%	0.332	S	S	.	.			trans	-89.7	152.1	177.3	-58.6	-52	0	0	0	110.2	R58 K73	R58-N75 WeakPolarHBondContact CB-O 3.39Å; R58-N75 PolarHBondContact O-N 2.84Å; K73-N75 VanDerWaalsContact CE-OD1 3.31Å; K73-N75 WeakPolarHBondContact CE-OD1 3.49Å
76	S	82.8	Confident	88.8	Confident	77 Å²	77	60.7 Å²	60.7	54%	0.538	33%	0.331	S	S	.	.	S	Bend	trans	53.3	61.1	177.9	-56.1	0	0	0	0	112.1	R58 Q78	R58-S76 PolarHBondContact NH1-O 2.86Å; S76-Q78 PolarHBondContact O-N 2.8Å
77	L	81	Confident	88.9	Confident	23 Å²	23	58.1 Å²	58.1	12%	0.12	31%	0.313	C	S	.	.			trans	-50.6	125.4	173.9	-86.8	163	0	0	0	110.9	V4 Q8 L10 L74 D81	V4-L77 HydrophobicContact CB-CD1 3.83Å; V4-L77 HydrophobicContact CG1-CD1 3.49Å; V4-L77 VanDerWaalsContact CG1-CD1 3.49Å; Q8-L77 WeakPolarHBondContact O-CD1 3.33Å; L10-L77 HydrophobicContact CB-CD1 3.81Å; L10-L77 HydrophobicContact CB-CD2 4.1Å; L10-L77 HydrophobicContact CB-CG 4.12Å; L10-L77 HydrophobicContact CD2-CD2 4.28Å; L74-L77 HydrophobicContact CD2-CD2 3.9Å; L77-D81 HydrophobicContact CD2-CB 3.71Å
78	Q	82.2	Confident	88.8	Confident	102 Å²	102	54.5 Å²	54.5	48%	0.477	31%	0.306	S	S	.	.			trans	-102.7	164.6	176.6	-69.2	175.6	-14.6	0	0	110.4	S76 D80 D81	S76-Q78 PolarHBondContact O-N 2.8Å; Q78-D80 PolarHBondContact O-N 2.79Å; Q78-D80 VanDerWaalsContact O-N 3.13Å; Q78-D81 PolarHBondContact N-OD2 3.33Å; Q78-D81 WeakPolarHBondContact O-CB 3.44Å; Q78-D81 PolarHBondContact O-N 2.73Å
79	T	75.8	Confident	88.5	Confident	121 Å²	121	61.1 Å²	61.1	74%	0.742	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-19.2	178.5	47.6	0	0	0	0	113.9	P82	T79-P82 VanDerWaalsContact C-CD 3.49Å; T79-P82 WeakPolarHBondContact O-CD 3.43Å
80	D	75.8	Confident	88	Confident	112 Å²	112	61.8 Å²	61.8	60%	0.599	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-4	178.4	-63.7	-24.1	0	0	0	113.5	Q78	Q78-D80 PolarHBondContact O-N 2.79Å; Q78-D80 VanDerWaalsContact O-N 3.13Å
81	D	77.8	Confident	87.6	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.016	35%	0.352	C	S	.	.			trans	-81.7	-11.7	176.4	-63.1	-37	0	0	0	116.4	R30 R58 L74 L77 Q78 A83 Y85	R30-D81 IonicContact NH1-OD1 3.25Å; R30-D81 PolarHBondContact NH1-OD1 3.4Å; R58-D81 IonicContact CZ-OD2 3.55Å; R58-D81 IonicContact NH1-OD1 3.34Å; R58-D81 IonicContact NH1-OD2 2.9Å; R58-D81 PolarHBondContact NH1-OD2 3.35Å; R58-D81 IonicContact NH2-OD1 3.81Å; R58-D81 PolarHBondContact NH2-OD1 2.99Å; R58-D81 IonicContact NH2-OD2 2.72Å; L74-D81 HydrophobicContact CD2-CB 3.95Å; L77-D81 HydrophobicContact CD2-CB 3.71Å; Q78-D81 PolarHBondContact N-OD2 3.33Å; Q78-D81 WeakPolarHBondContact O-CB 3.44Å; Q78-D81 PolarHBondContact O-N 2.73Å; D81-A83 PolarHBondContact O-N 3.39Å; D81-Y85 PolarHBondContact O-OH 3.35Å
82	P	83.5	Confident	87.1	Confident	85 Å²	85	66.1 Å²	66.1	55%	0.552	36%	0.36	S	S	*	.			trans	-59.1	109.1	168.2	-22.2	33.6	0	0	0	110.8	P33 T79	P33-P82 VanDerWaalsContact CD-O 3.23Å; P33-P82 WeakPolarHBondContact CD-O 3.38Å; T79-P82 VanDerWaalsContact C-CD 3.49Å; T79-P82 WeakPolarHBondContact O-CD 3.43Å
83	A	90.2	Very high	86.7	Confident	24 Å²	24	69.9 Å²	69.9	20%	0.198	38%	0.381	C	S	.	.			trans	-155	162	-177.5	0	0	0	0	0	109.6	R30 Q31 P32 D81 Y85	R30-A83 HydrophobicContact CB-CB 3.89Å; R30-A83 HydrophobicContact CG-CB 4.3Å; Q31-A83 WeakPolarHBondContact O-CA 3.24Å; Q31-A83 WeakPolarHBondContact O-CB 3.2Å; P32-A83 HydrophobicContact CB-CB 4.45Å; P32-A83 HydrophobicContact CG-CB 4.31Å; D81-A83 PolarHBondContact O-N 3.39Å; A83-Y85 HydrophobicContact CB-CE2 4.1Å; A83-Y85 WeakPolarHBondContact O-CD2 3.43Å; A83-Y85 VanDerWaalsContact O-CE2 3.28Å; A83-Y85 WeakPolarHBondContact O-CE2 3.31Å
84	T	91.7	Very high	86.3	Confident	76 Å²	76	68.6 Å²	68.6	47%	0.466	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	129.2	164.7	-49.5	0	0	0	0	108.6	R30 Q31 Y86	R30-T84 CarbonylContact C-O 3.42Å; R30-T84 WeakPolarHBondContact CA-O 3.36Å; Q31-T84 PolarHBondContact N-O 3.04Å; Q31-T84 PolarHBondContact O-N 2.72Å; T84-Y86 HydrophobicContact CG2-CE1 3.86Å; T84-Y86 HydrophobicContact CG2-CE2 3.73Å; T84-Y86 VanDerWaalsContact CG2-OH 3.24Å; T84-Y86 WeakPolarHBondContact CG2-OH 3.46Å
85	Y	92.8	Very high	86.1	Confident	40 Å²	40	73 Å²	73	16%	0.157	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.1	-179.3	-67.6	-99.8	0	0	0	110.3	L10 I12 R30 L40 L72 D81 A83	L10-Y85 HydrophobicContact CD2-CE2 3.93Å; I12-Y85 HydrophobicContact CD1-CD1 3.71Å; I12-Y85 HydrophobicContact CD1-CD2 3.67Å; I12-Y85 HydrophobicContact CD1-CE1 4.29Å; I12-Y85 HydrophobicContact CD1-CE2 4.29Å; I12-Y85 HydrophobicContact CD1-CG 3.36Å; R30-Y85 HydrophobicContact CB-CD1 3.98Å; R30-Y85 HydrophobicContact CB-CE1 4.01Å; R30-Y85 HydrophobicContact CB-CG 4.46Å; L40-Y85 HydrophobicContact CD1-CD1 3.8Å; L40-Y85 HydrophobicContact CD1-CE1 3.78Å; L72-Y85 HydrophobicContact CD2-CD1 3.63Å; L72-Y85 HydrophobicContact CD2-CE1 4.02Å; D81-Y85 PolarHBondContact O-OH 3.35Å; A83-Y85 HydrophobicContact CB-CE2 4.1Å; A83-Y85 WeakPolarHBondContact O-CD2 3.43Å; A83-Y85 VanDerWaalsContact O-CE2 3.28Å; A83-Y85 WeakPolarHBondContact O-CE2 3.31Å
86	Y	94.2	Very high	86.1	Confident	93 Å²	93	74.1 Å²	74.1	37%	0.365	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.5	-178.2	-54.9	-84.7	0	0	0	109.6	W28 V29 Q31 L37 T84	W28-Y86 WeakPolarHBondContact CA-O 3.48Å; V29-Y86 PolarHBondContact N-O 3.28Å; V29-Y86 PolarHBondContact O-N 3.05Å; Q31-Y86 HydrophobicContact CB-CE2 3.86Å; Q31-Y86 PolarHBondContact OE1-OH 2.76Å; L37-Y86 HydrophobicContact CD2-CD2 4.13Å; L37-Y86 HydrophobicContact CD2-CE2 4.1Å; T84-Y86 HydrophobicContact CG2-CE1 3.86Å; T84-Y86 HydrophobicContact CG2-CE2 3.73Å; T84-Y86 VanDerWaalsContact CG2-OH 3.24Å; T84-Y86 WeakPolarHBondContact CG2-OH 3.46Å
87	C	94.6	Very high	86.3	Confident	52 Å²	52	73.8 Å²	73.8	35%	0.351	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	139	163.4	56	0	0	0	0	109.2	C14 V26 S27 W28	C14-C87 HydrophobicContact CB-CB 3.49Å; C14-C87 VanDerWaalsContact CB-CB 3.49Å; C14-C87 WeakPolarHBondContact CB-SG 3.35Å; C14-C87 WeakPolarHBondContact SG-CB 3.4Å; C14-C87 CovalentContact SG-SG 2.02Å; C14-C87 PolarHBondContact SG-SG 3.32Å; V26-C87 HydrophobicContact CG1-CB 4.1Å; S27-C87 CarbonylContact O-C 3.56Å; S27-C87 WeakPolarHBondContact O-CA 3.42Å; W28-C87 HydrophobicContact CD2-CB 4.38Å; W28-C87 HydrophobicContact CE3-CB 4.15Å; W28-C87 HydrophobicContact CH2-CB 4.21Å; W28-C87 HydrophobicContact CZ2-CB 4.39Å; W28-C87 HydrophobicContact CZ3-CB 4.07Å
88	A	93.2	Very high	86.8	Confident	47 Å²	47	78.1 Å²	78.1	39%	0.388	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	143.9	-178.5	0	0	0	0	0	110.2	V26 S27	V26-A88 CarbonylContact C-O 3.52Å; V26-A88 WeakPolarHBondContact CA-O 3.22Å; S27-A88 PolarHBondContact N-O 3.34Å; S27-A88 PolarHBondContact O-N 2.58Å
89	K	89.5	Confident	87.2	Confident	182 Å²	182	75.9 Å²	75.9	79%	0.791	42%	0.421	S	S	*	.			trans	-96	0	170.8	74.8	-179.6	-174.9	65.6	0	110.2	F19	F19-K89 HydrophobicContact CD1-CD 3.57Å; F19-K89 HydrophobicContact CE1-CB 3.98Å; F19-K89 HydrophobicContact CE1-CD 3.52Å; F19-K89 HydrophobicContact CE1-CG 4.29Å; F19-K89 HydrophobicContact CE2-CB 4.24Å; F19-K89 HydrophobicContact CG-CD 4.23Å; F19-K89 HydrophobicContact CZ-CB 3.71Å; F19-K89 HydrophobicContact CZ-CD 4.12Å

Retrieved 89 of 89 residues in 27.6 ms (Link to these results)

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