X5J5R8_MOUSE Loading...

IgA heavy chain VDJ region

AlphaFold DB , UniProt , Accession X5J5R8, Species MOUSE (Mus musculus, Mouse), Gene n/a, Length 81 aa.

						>X5J5R8_MOUSE|X5J5R8
PGLVKPSQTVSLTCTVTGYSITNGNHWWNWIRQVSGSKLEWIGYISSSGSTDSNPSLKSRISITRDTSKNQLFLQLNSVTT
					

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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	63	Low	83.5	Confident	147 Å²	147	94.6 Å²	94.6	96%	0.955	57%	0.574	S	S	*	*				0	139.3	0	-8.9	28.1	0	0	0	109.9	L12	P1-L12 HydrophobicContact CB-CD2 3.84Å; P1-L12 HydrophobicContact CG-CD2 3.34Å
2	G	77.2	Confident	84.5	Confident	67 Å²	67	91 Å²	91	69%	0.691	55%	0.548	S	S	*	.			trans	-85.9	172.5	176.8	0	0	0	0	0	112.3	V4	G2-V4 PolarHBondContact O-N 3.4Å
3	L	82	Confident	85.4	Confident	181 Å²	181	89.9 Å²	89.9	95%	0.948	54%	0.542	S	S	*	.			trans	-61.5	128	169.5	-177.3	67.2	0	0	0	109.4
4	V	83.2	Confident	86.2	Confident	54 Å²	54	86.9 Å²	86.9	33%	0.327	53%	0.527	S	S	.	.			trans	-112.6	149.8	175.6	-68	0	0	0	0	110.9	G2 V10 V79	G2-V4 PolarHBondContact O-N 3.4Å; V4-V10 HydrophobicContact CB-CG2 3.98Å; V4-V10 HydrophobicContact CG1-CG2 3.57Å; V4-V10 HydrophobicContact CG2-CG2 3.49Å; V4-V10 VanDerWaalsContact CG2-CG2 3.49Å; V4-V79 HydrophobicContact CG2-CB 4.5Å; V4-V79 HydrophobicContact CG2-CG1 4.22Å; V4-V79 HydrophobicContact CG2-CG2 4.47Å
5	K	83.5	Confident	86.9	Confident	155 Å²	155	86.3 Å²	86.3	67%	0.674	52%	0.524	S	S	*	.			trans	-75	152.7	172.2	-64.8	178.9	-178.8	-179.2	0	109.6	Q8	K5-Q8 HydrophobicContact CB-CG 4.13Å; K5-Q8 WeakPolarHBondContact O-CB 3.44Å; K5-Q8 WeakPolarHBondContact O-CG 3.38Å; K5-Q8 PolarHBondContact O-N 3.35Å
6	P	84.2	Confident	87.4	Confident	74 Å²	74	82.3 Å²	82.3	48%	0.481	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	152.9	169.8	-25.4	34.7	0	0	0	112	Q8 V79	P6-Q8 PolarHBondContact O-N 3.25Å; P6-Q8 VanDerWaalsContact O-N 3.1Å; P6-V79 CarbonylContact C-O 3.52Å; P6-V79 VanDerWaalsContact CA-O 3.28Å; P6-V79 WeakPolarHBondContact CA-O 3.3Å
7	S	84.8	Confident	87.9	Confident	96 Å²	96	84.8 Å²	84.8	67%	0.671	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-2.1	-178.4	-52.2	0	0	0	0	115.9	V79	S7-V79 PolarHBondContact N-O 3.44Å
8	Q	87.5	Confident	88.2	Confident	92 Å²	92	85.3 Å²	85.3	43%	0.43	54%	0.54	S	S	.	.			trans	-77.9	158.2	171.5	-63.6	-169.8	-53.3	0	0	111.4	K5 P6 S78 V79	K5-Q8 HydrophobicContact CB-CG 4.13Å; K5-Q8 WeakPolarHBondContact O-CB 3.44Å; K5-Q8 WeakPolarHBondContact O-CG 3.38Å; K5-Q8 PolarHBondContact O-N 3.35Å; P6-Q8 PolarHBondContact O-N 3.25Å; P6-Q8 VanDerWaalsContact O-N 3.1Å; Q8-S78 PolarHBondContact O-N 2.7Å; Q8-V79 WeakPolarHBondContact O-CG2 3.44Å; Q8-V79 PolarHBondContact O-N 2.93Å; Q8-V79 VanDerWaalsContact O-N 3.07Å
9	T	89.7	Confident	88.4	Confident	72 Å²	72	85.4 Å²	85.4	44%	0.442	53%	0.529	S	S	.	.			trans	-91	131.2	170	-66.1	0	0	0	0	109.8	Q75 L76 N77	T9-Q75 HydrophobicContact CG2-CG 3.51Å; T9-L76 WeakPolarHBondContact CA-O 3.28Å; T9-N77 WeakPolarHBondContact CG2-OD1 3.38Å; T9-N77 PolarHBondContact OG1-OD1 2.94Å
10	V	91	Very high	88.7	Confident	27 Å²	27	83.5 Å²	83.5	16%	0.164	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136	171.9	172.4	0	0	0	0	108.9	V4 L12 Q75 L76 V79	V4-V10 HydrophobicContact CB-CG2 3.98Å; V4-V10 HydrophobicContact CG1-CG2 3.57Å; V4-V10 HydrophobicContact CG2-CG2 3.49Å; V4-V10 VanDerWaalsContact CG2-CG2 3.49Å; V10-L12 HydrophobicContact CG1-CD2 3.87Å; V10-L12 HydrophobicContact CG1-CG 4.15Å; V10-Q75 CarbonylContact O-C 3.55Å; V10-Q75 WeakPolarHBondContact O-CA 3.36Å; V10-L76 PolarHBondContact N-O 3.1Å; V10-L76 PolarHBondContact O-N 2.98Å; V10-V79 HydrophobicContact CB-CG2 4.21Å; V10-V79 HydrophobicContact CG2-CG2 3.75Å
11	S	92.8	Very high	89	Confident	76 Å²	76	79.5 Å²	79.5	53%	0.531	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.6	166.8	-172.3	0	0	0	0	109.2	L74	S11-L74 CarbonylContact C-O 3.55Å; S11-L74 WeakPolarHBondContact CA-O 3.3Å
12	L	95	Very high	90.5	Very high	51 Å²	51	75.3 Å²	75.3	27%	0.267	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	142.2	172.6	-58.8	-176.6	0	0	0	109.1	P1 V10 W30 F73 L74	P1-L12 HydrophobicContact CB-CD2 3.84Å; P1-L12 HydrophobicContact CG-CD2 3.34Å; V10-L12 HydrophobicContact CG1-CD2 3.87Å; V10-L12 HydrophobicContact CG1-CG 4.15Å; L12-W30 HydrophobicContact CB-CH2 3.82Å; L12-W30 HydrophobicContact CB-CZ3 3.75Å; L12-W30 HydrophobicContact CD1-CE3 4.46Å; L12-W30 HydrophobicContact CD1-CZ3 3.98Å; L12-F73 VanDerWaalsContact O-CA 3.28Å; L12-F73 WeakPolarHBondContact O-CA 3.48Å; L12-L74 HydrophobicContact CB-CB 4.4Å; L12-L74 HydrophobicContact CD1-CD2 4.28Å; L12-L74 PolarHBondContact N-O 2.83Å; L12-L74 PolarHBondContact O-N 2.86Å
13	T	96.8	Very high	91.2	Very high	77 Å²	77	76.4 Å²	76.4	47%	0.472	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.1	177.1	-53.3	0	0	0	0	109.3	Q71 L72 F73	T13-Q71 HydrophobicContact CG2-CB 4.45Å; T13-Q71 HydrophobicContact CG2-CG 4.29Å; T13-L72 WeakPolarHBondContact CA-O 3.33Å; T13-F73 HydrophobicContact CG2-CD1 3.98Å; T13-F73 HydrophobicContact CG2-CE1 3.57Å; T13-F73 HydrophobicContact CG2-CZ 4.3Å; T13-F73 WeakPolarHBondContact OG1-CD1 3.38Å
14	C	95.6	Very high	91.4	Very high	48 Å²	48	69.9 Å²	69.9	32%	0.324	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	116.6	168.7	178.7	0	0	0	0	107.9	W30 Q71 L72	C14-W30 HydrophobicContact CB-CH2 3.92Å; C14-W30 HydrophobicContact CB-CZ2 4.1Å; C14-Q71 CarbonylContact O-C 3.49Å; C14-Q71 WeakPolarHBondContact O-CA 3.4Å; C14-L72 HydrophobicContact CB-CB 4.22Å; C14-L72 PolarHBondContact N-O 3.35Å; C14-L72 PolarHBondContact O-N 2.99Å
15	T	97.1	Very high	91.6	Very high	78 Å²	78	72.5 Å²	72.5	48%	0.479	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124	175.8	-56.1	0	0	0	0	108.5	Q71	T15-Q71 HydrophobicContact CG2-CG 4.07Å; T15-Q71 PolarHBondContact OG1-NE2 3.21Å
16	V	95.5	Very high	91.9	Very high	22 Å²	22	69.3 Å²	69.3	13%	0.133	43%	0.432	C	S	.	.			trans	-97.6	136.5	178.5	-177.2	0	0	0	0	108.6	Y19 I21 W28 N70 L72	V16-Y19 VanDerWaalsContact CG1-O 3.32Å; V16-Y19 WeakPolarHBondContact CG1-O 3.36Å; V16-I21 HydrophobicContact CB-CG2 3.75Å; V16-I21 HydrophobicContact CG1-CG2 4.36Å; V16-I21 HydrophobicContact CG2-CG2 3.54Å; V16-W28 HydrophobicContact CB-CH2 4.4Å; V16-W28 HydrophobicContact CG1-CH2 3.88Å; V16-W28 HydrophobicContact CG1-CZ2 4.49Å; V16-W28 HydrophobicContact CG2-CE3 4.42Å; V16-W28 HydrophobicContact CG2-CH2 3.67Å; V16-W28 HydrophobicContact CG2-CZ2 4.29Å; V16-W28 HydrophobicContact CG2-CZ3 3.74Å; V16-N70 PolarHBondContact N-O 3.35Å; V16-N70 PolarHBondContact O-ND2 3.06Å; V16-L72 HydrophobicContact CG2-CD1 4.41Å
17	T	96	Very high	92.4	Very high	125 Å²	125	72 Å²	72	77%	0.767	43%	0.433	S	S	*	.			trans	-125.8	146.1	177.8	57.2	0	0	0	0	109.4	Y19	T17-Y19 PolarHBondContact O-N 2.91Å
18	G	93.6	Very high	92.9	Very high	93 Å²	93	70.4 Å²	70.4	96%	0.959	41%	0.412	S	S	*	.	S	Bend	trans	74	-2.3	-178.8	0	0	0	0	0	115.9
19	Y	91	Very high	93.3	Very high	87 Å²	87	70.3 Å²	70.3	34%	0.341	42%	0.415	S	S	.	.	S	Bend	trans	-150.1	139.7	178.2	-169.7	-100.5	0	0	0	111.2	V16 T17 N23 H26 W28 N70	V16-Y19 VanDerWaalsContact CG1-O 3.32Å; V16-Y19 WeakPolarHBondContact CG1-O 3.36Å; T17-Y19 PolarHBondContact O-N 2.91Å; Y19-N23 HydrophobicContact CE1-CB 4.17Å; Y19-N23 HydrophobicContact CE2-CB 4.35Å; Y19-N23 PolarHBondContact OH-O 2.7Å; Y19-H26 AromaticContact CZ-CD2 3.99Å; Y19-H26 PolarHBondContact OH-CD2 3.46Å; Y19-H26 PolarHBondContact OH-NE2 2.9Å; Y19-W28 HydrophobicContact CD1-CZ2 4.26Å; Y19-N70 PolarHBondContact O-ND2 3.28Å
20	S	94.2	Very high	93.6	Very high	47 Å²	47	68.5 Å²	68.5	33%	0.329	40%	0.4	S	S	.	.			trans	-81.8	129.7	177.4	171.1	0	0	0	0	111.7	T22 N23 N70	S20-T22 PolarHBondContact O-N 3.39Å; S20-T22 VanDerWaalsContact O-N 3.1Å; S20-T22 PolarHBondContact OG-N 3.49Å; S20-T22 PolarHBondContact OG-OG1 3.13Å; S20-N23 WeakPolarHBondContact O-CB 3.2Å; S20-N23 PolarHBondContact O-N 3.07Å; S20-N70 WeakPolarHBondContact CA-OD1 3.09Å
21	I	94.8	Very high	93.8	Very high	1 Å²	1	72 Å²	72	1%	0.005	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-15	178.2	64.6	175.2	0	0	0	114	V16 W28 R65 T67 N70 Q71 L72	V16-I21 HydrophobicContact CB-CG2 3.75Å; V16-I21 HydrophobicContact CG1-CG2 4.36Å; V16-I21 HydrophobicContact CG2-CG2 3.54Å; I21-W28 HydrophobicContact CB-CZ2 4.2Å; I21-W28 HydrophobicContact CG2-CH2 4.48Å; I21-W28 HydrophobicContact CG2-CZ2 3.88Å; I21-W28 PolarHBondContact O-NE1 3.31Å; I21-R65 HydrophobicContact CD1-CB 4.13Å; I21-T67 HydrophobicContact CD1-CG2 4.48Å; I21-N70 WeakPolarHBondContact CG1-OD1 3.34Å; I21-N70 WeakPolarHBondContact CG2-OD1 3.44Å; I21-N70 PolarHBondContact N-OD1 2.89Å; I21-Q71 WeakPolarHBondContact CD1-O 3.43Å; I21-L72 HydrophobicContact CD1-CD2 4.14Å; I21-L72 HydrophobicContact CD1-CG 4.33Å; I21-L72 HydrophobicContact CG2-CD1 4.29Å; I21-L72 HydrophobicContact CG2-CG 4.38Å
22	T	94.4	Very high	93.8	Very high	59 Å²	59	72 Å²	72	36%	0.362	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-4.7	177.2	59.8	0	0	0	0	113.5	S20 T67	S20-T22 PolarHBondContact O-N 3.39Å; S20-T22 VanDerWaalsContact O-N 3.1Å; S20-T22 PolarHBondContact OG-N 3.49Å; S20-T22 PolarHBondContact OG-OG1 3.13Å; T22-T67 HydrophobicContact CG2-CG2 3.35Å
23	N	92.1	Very high	93.6	Very high	90 Å²	90	75.8 Å²	75.8	48%	0.481	42%	0.421	S	S	.	.	S	Bend	trans	-76.6	141.6	-177.9	-167.9	9.3	0	0	0	111.3	Y19 S20 H26	Y19-N23 HydrophobicContact CE1-CB 4.17Å; Y19-N23 HydrophobicContact CE2-CB 4.35Å; Y19-N23 PolarHBondContact OH-O 2.7Å; S20-N23 WeakPolarHBondContact O-CB 3.2Å; S20-N23 PolarHBondContact O-N 3.07Å; N23-H26 PolarHBondContact O-CD2 2.71Å
24	G	87.1	Confident	93.1	Very high	44 Å²	44	76.1 Å²	76.1	45%	0.454	42%	0.423	S	S	.	.	S	Bend	trans	67.3	-161	178.1	0	0	0	0	0	114.6	S47	G24-S47 VanDerWaalsContact O-CB 3.3Å; G24-S47 WeakPolarHBondContact O-CB 3.49Å; G24-S47 PolarHBondContact O-OG 2.84Å
25	N	87.4	Confident	92.7	Very high	109 Å²	109	79.7 Å²	79.7	58%	0.583	45%	0.449	S	S	*	.	S	Bend	trans	-113	80.9	175.6	-170.7	29.7	0	0	0	109.1
26	H	89	Confident	92.3	Very high	87 Å²	87	80.1 Å²	80.1	40%	0.403	47%	0.468	S	S	.	.			trans	-125.2	157.9	-176.7	-57.1	-50.9	0	0	0	111.7	Y19 N23 S46 S47	Y19-H26 AromaticContact CZ-CD2 3.99Å; Y19-H26 PolarHBondContact OH-CD2 3.46Å; Y19-H26 PolarHBondContact OH-NE2 2.9Å; N23-H26 PolarHBondContact O-CD2 2.71Å; H26-S46 CarbonylContact O-C 3.53Å; H26-S46 WeakPolarHBondContact O-CA 3.4Å; H26-S47 PolarHBondContact O-N 2.84Å
27	W	94.1	Very high	92	Very high	131 Å²	131	82 Å²	82	50%	0.496	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.1	177.8	-59	-90.6	0	0	0	109.8	N29 Y44	W27-N29 PolarHBondContact O-ND2 3Å; W27-Y44 HydrophobicContact CB-CD2 4.4Å; W27-Y44 HydrophobicContact CB-CG 4.41Å; W27-Y44 AromaticContact CD1-CD2 3.54Å; W27-Y44 AromaticContact CD1-CE2 3.53Å; W27-Y44 HydrophobicContact CG-CD2 4.35Å
28	W	95.8	Very high	91.8	Very high	63 Å²	63	84.7 Å²	84.7	24%	0.239	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	111.7	175.4	-63.6	95.9	0	0	0	108.8	V16 Y19 I21 Y44 I45 L72	V16-W28 HydrophobicContact CB-CH2 4.4Å; V16-W28 HydrophobicContact CG1-CH2 3.88Å; V16-W28 HydrophobicContact CG1-CZ2 4.49Å; V16-W28 HydrophobicContact CG2-CE3 4.42Å; V16-W28 HydrophobicContact CG2-CH2 3.67Å; V16-W28 HydrophobicContact CG2-CZ2 4.29Å; V16-W28 HydrophobicContact CG2-CZ3 3.74Å; Y19-W28 HydrophobicContact CD1-CZ2 4.26Å; I21-W28 HydrophobicContact CB-CZ2 4.2Å; I21-W28 HydrophobicContact CG2-CH2 4.48Å; I21-W28 HydrophobicContact CG2-CZ2 3.88Å; I21-W28 PolarHBondContact O-NE1 3.31Å; W28-Y44 CarbonylContact O-C 3.59Å; W28-Y44 WeakPolarHBondContact O-CA 3.36Å; W28-Y44 WeakPolarHBondContact O-CB 3.44Å; W28-I45 HydrophobicContact CB-CG2 4.09Å; W28-I45 PolarHBondContact N-O 3Å; W28-I45 PolarHBondContact O-N 3Å; W28-L72 HydrophobicContact CB-CD1 3.63Å; W28-L72 HydrophobicContact CB-CD2 4.07Å; W28-L72 HydrophobicContact CB-CG 4.5Å; W28-L72 HydrophobicContact CD2-CD1 3.51Å; W28-L72 HydrophobicContact CE3-CD1 3.64Å; W28-L72 HydrophobicContact CG-CD1 3.5Å; W28-L72 VanDerWaalsContact CG-CD1 3.5Å; W28-L72 HydrophobicContact CG-CD2 4.06Å; W28-L72 HydrophobicContact CG-CG 4.43Å; W28-L72 HydrophobicContact CZ3-CD1 4.48Å
29	N	96.6	Very high	91.8	Very high	89 Å²	89	85.5 Å²	85.5	48%	0.476	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	141.2	-173	-73.6	-88.7	0	0	0	111.5	W27 W41	W27-N29 PolarHBondContact O-ND2 3Å; N29-W41 PolarHBondContact OD1-NE1 2.81Å
30	W	96.6	Very high	91.9	Very high	34 Å²	34	84 Å²	84	13%	0.129	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	129	166.3	-68.7	94.5	0	0	0	109.2	L12 C14 I42 G43 L72 L74	L12-W30 HydrophobicContact CB-CH2 3.82Å; L12-W30 HydrophobicContact CB-CZ3 3.75Å; L12-W30 HydrophobicContact CD1-CE3 4.46Å; L12-W30 HydrophobicContact CD1-CZ3 3.98Å; C14-W30 HydrophobicContact CB-CH2 3.92Å; C14-W30 HydrophobicContact CB-CZ2 4.1Å; W30-I42 HydrophobicContact CB-CB 4.02Å; W30-I42 HydrophobicContact CB-CD1 4.42Å; W30-I42 HydrophobicContact CB-CG2 4.37Å; W30-I42 WeakPolarHBondContact O-CB 3.46Å; W30-I42 PolarHBondContact O-N 3.45Å; W30-G43 PolarHBondContact N-O 2.82Å; W30-L72 HydrophobicContact CZ2-CB 4.33Å; W30-L74 HydrophobicContact CB-CD2 4.09Å; W30-L74 HydrophobicContact CD2-CB 3.57Å; W30-L74 HydrophobicContact CD2-CD2 3.86Å; W30-L74 HydrophobicContact CD2-CG 4.26Å; W30-L74 HydrophobicContact CE3-CB 3.85Å; W30-L74 HydrophobicContact CE3-CD2 3.74Å; W30-L74 HydrophobicContact CE3-CG 4.44Å; W30-L74 HydrophobicContact CG-CB 4.08Å; W30-L74 HydrophobicContact CG-CD1 4.5Å; W30-L74 HydrophobicContact CG-CD2 4.02Å; W30-L74 HydrophobicContact CG-CG 4.43Å; W30-L74 HydrophobicContact CH2-CB 4.03Å; W30-L74 HydrophobicContact CZ2-CB 3.76Å; W30-L74 HydrophobicContact CZ3-CB 4.07Å; W30-L74 HydrophobicContact CZ3-CD2 4.45Å
31	I	95.2	Very high	91.9	Very high	102 Å²	102	85.9 Å²	85.9	52%	0.523	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.8	178.2	60.8	176.7	0	0	0	108.8	E40	I31-E40 WeakPolarHBondContact CA-O 3.34Å
32	R	91.4	Very high	92	Very high	76 Å²	76	86.4 Å²	86.4	29%	0.287	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	157.4	169.8	62	-179.7	-170.8	177.6	3.4	111.2	E40 I42	R32-E40 HydrophobicContact CG-CB 4.11Å; R32-E40 IonicContact CZ-OE2 3.12Å; R32-E40 PolarHBondContact N-O 2.84Å; R32-E40 IonicContact NE-OE2 2.71Å; R32-E40 PolarHBondContact NE-OE2 2.82Å; R32-E40 IonicContact NH2-OE1 3.39Å; R32-E40 PolarHBondContact NH2-OE1 2.78Å; R32-E40 IonicContact NH2-OE2 2.7Å; R32-E40 PolarHBondContact NH2-OE2 3.07Å; R32-E40 PolarHBondContact O-N 2.99Å; R32-I42 HydrophobicContact CB-CD1 3.93Å; R32-I42 HydrophobicContact CB-CG1 4.46Å; R32-I42 HydrophobicContact CG-CD1 3.96Å; R32-I42 HydrophobicContact CG-CG1 4.03Å
33	Q	91.1	Very high	92.1	Very high	130 Å²	130	83.6 Å²	83.6	61%	0.607	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.7	124	168.6	-161.7	176.3	2.5	0	0	108.4	S37 L39	Q33-S37 WeakPolarHBondContact CG-O 3.28Å; Q33-S37 PolarHBondContact NE2-O 2.84Å; Q33-L39 HydrophobicContact CB-CD2 3.93Å; Q33-L39 HydrophobicContact CG-CD2 4.15Å
34	V	86.3	Confident	92.3	Very high	83 Å²	83	81.9 Å²	81.9	50%	0.503	43%	0.434	S	S	.	.			trans	-82.7	139.9	166.1	-177.5	0	0	0	0	107.3	G36 S37	V34-G36 PolarHBondContact O-N 2.9Å; V34-S37 WeakPolarHBondContact O-CA 3.42Å; V34-S37 VanDerWaalsContact O-CB 3.3Å; V34-S37 WeakPolarHBondContact O-CB 3.22Å; V34-S37 PolarHBondContact O-N 2.86Å
35	S	87.9	Confident	92.8	Very high	124 Å²	124	80.1 Å²	80.1	87%	0.867	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	129.3	-179.1	-169.1	0	0	0	0	111	S37	S35-S37 VanDerWaalsContact C-N 3.26Å; S35-S37 PolarHBondContact O-N 3.19Å
36	G	88.1	Confident	93.2	Very high	86 Å²	86	75.1 Å²	75.1	89%	0.887	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	2.9	-176.2	0	0	0	0	0	116	V34	V34-G36 PolarHBondContact O-N 2.9Å
37	S	88.9	Confident	93.5	Very high	61 Å²	61	71.7 Å²	71.7	43%	0.427	37%	0.373	S	S	.	.	S	Bend	trans	-110.8	166.1	-179.8	-60.8	0	0	0	0	113	Q33 V34 S35	Q33-S37 WeakPolarHBondContact CG-O 3.28Å; Q33-S37 PolarHBondContact NE2-O 2.84Å; V34-S37 WeakPolarHBondContact O-CA 3.42Å; V34-S37 VanDerWaalsContact O-CB 3.3Å; V34-S37 WeakPolarHBondContact O-CB 3.22Å; V34-S37 PolarHBondContact O-N 2.86Å; S35-S37 VanDerWaalsContact C-N 3.26Å; S35-S37 PolarHBondContact O-N 3.19Å
38	K	91.9	Very high	93.4	Very high	182 Å²	182	70 Å²	70	79%	0.791	38%	0.381	S	S	*	.			trans	-68.6	160.4	171.5	66.1	-178.6	179.7	-178	0	111.7	E40	K38-E40 PolarHBondContact O-N 2.99Å
39	L	93.8	Very high	93.4	Very high	110 Å²	110	68.3 Å²	68.3	58%	0.576	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.6	133.7	169.9	-64.9	174.2	0	0	0	110.1	Q33	Q33-L39 HydrophobicContact CB-CD2 3.93Å; Q33-L39 HydrophobicContact CG-CD2 4.15Å
40	E	93.2	Very high	93.3	Very high	56 Å²	56	67.2 Å²	67.2	26%	0.262	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126	175.1	-173.2	-176.8	-172.9	0	0	109.3	I31 R32 K38	I31-E40 WeakPolarHBondContact CA-O 3.34Å; R32-E40 HydrophobicContact CG-CB 4.11Å; R32-E40 IonicContact CZ-OE2 3.12Å; R32-E40 PolarHBondContact N-O 2.84Å; R32-E40 IonicContact NE-OE2 2.71Å; R32-E40 PolarHBondContact NE-OE2 2.82Å; R32-E40 IonicContact NH2-OE1 3.39Å; R32-E40 PolarHBondContact NH2-OE1 2.78Å; R32-E40 IonicContact NH2-OE2 2.7Å; R32-E40 PolarHBondContact NH2-OE2 3.07Å; R32-E40 PolarHBondContact O-N 2.99Å; K38-E40 PolarHBondContact O-N 2.99Å
41	W	95.1	Very high	93.3	Very high	86 Å²	86	69.3 Å²	69.3	33%	0.326	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	132.1	173.7	178	78.1	0	0	0	110.5	N29 G43 Y44 D52 S53 N54	N29-W41 PolarHBondContact OD1-NE1 2.81Å; W41-G43 VanDerWaalsContact CE2-CA 3.47Å; W41-Y44 HydrophobicContact CH2-CD1 4.47Å; W41-Y44 AromaticContact CZ2-CD1 3.62Å; W41-Y44 HydrophobicContact CZ2-CD1 3.62Å; W41-Y44 HydrophobicContact CZ2-CE1 4.29Å; W41-Y44 HydrophobicContact CZ2-CG 4.45Å; W41-D52 HydrophobicContact CH2-CB 4.37Å; W41-S53 VanDerWaalsContact CZ3-C 3.49Å; W41-N54 HydrophobicContact CE3-CB 3.95Å; W41-N54 HydrophobicContact CZ3-CB 4.09Å; W41-N54 WeakPolarHBondContact O-CB 3.36Å; W41-N54 PolarHBondContact O-ND2 2.84Å
42	I	95.8	Very high	93.3	Very high	13 Å²	13	67.7 Å²	67.7	7%	0.067	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-47.3	179.9	-63	176.1	0	0	0	110.5	W30 R32 S53 N54 L57 I61 L74	W30-I42 HydrophobicContact CB-CB 4.02Å; W30-I42 HydrophobicContact CB-CD1 4.42Å; W30-I42 HydrophobicContact CB-CG2 4.37Å; W30-I42 WeakPolarHBondContact O-CB 3.46Å; W30-I42 PolarHBondContact O-N 3.45Å; R32-I42 HydrophobicContact CB-CD1 3.93Å; R32-I42 HydrophobicContact CB-CG1 4.46Å; R32-I42 HydrophobicContact CG-CD1 3.96Å; R32-I42 HydrophobicContact CG-CG1 4.03Å; I42-S53 WeakPolarHBondContact O-CA 3.3Å; I42-N54 PolarHBondContact O-N 2.84Å; I42-L57 HydrophobicContact CB-CD1 4.37Å; I42-L57 HydrophobicContact CG1-CD1 4.05Å; I42-L57 HydrophobicContact CG2-CD1 4.25Å; I42-I61 HydrophobicContact CG2-CD1 3.44Å; I42-I61 VanDerWaalsContact CG2-CD1 3.44Å; I42-I61 HydrophobicContact CG2-CG2 4.2Å; I42-I61 WeakPolarHBondContact O-CD1 3.43Å; I42-L74 HydrophobicContact CD1-CD2 3.92Å; I42-L74 HydrophobicContact CG2-CD1 3.99Å; I42-L74 HydrophobicContact CG2-CD2 4.32Å
43	G	96.9	Very high	93.6	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.2	172.7	-173.5	0	0	0	0	0	112.4	W30 W41 D52	W30-G43 PolarHBondContact N-O 2.82Å; W41-G43 VanDerWaalsContact CE2-CA 3.47Å; G43-D52 CarbonylContact C-O 3.43Å; G43-D52 WeakPolarHBondContact CA-O 3.48Å
44	Y	96.9	Very high	93.7	Very high	54 Å²	54	60.3 Å²	60.3	21%	0.212	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	162.9	173.1	73.1	-109.2	0	0	0	112.3	W27 W28 W41 T51 D52	W27-Y44 HydrophobicContact CB-CD2 4.4Å; W27-Y44 HydrophobicContact CB-CG 4.41Å; W27-Y44 AromaticContact CD1-CD2 3.54Å; W27-Y44 AromaticContact CD1-CE2 3.53Å; W27-Y44 HydrophobicContact CG-CD2 4.35Å; W28-Y44 CarbonylContact O-C 3.59Å; W28-Y44 WeakPolarHBondContact O-CA 3.36Å; W28-Y44 WeakPolarHBondContact O-CB 3.44Å; W41-Y44 HydrophobicContact CH2-CD1 4.47Å; W41-Y44 AromaticContact CZ2-CD1 3.62Å; W41-Y44 HydrophobicContact CZ2-CD1 3.62Å; W41-Y44 HydrophobicContact CZ2-CE1 4.29Å; W41-Y44 HydrophobicContact CZ2-CG 4.45Å; Y44-T51 VanDerWaalsContact O-CA 3.32Å; Y44-T51 WeakPolarHBondContact O-CA 3.43Å; Y44-D52 HydrophobicContact CD1-CB 4.13Å; Y44-D52 HydrophobicContact CE1-CB 3.46Å; Y44-D52 VanDerWaalsContact CE1-CB 3.46Å; Y44-D52 HydrophobicContact CE2-CB 4.25Å; Y44-D52 PolarHBondContact N-O 2.93Å; Y44-D52 PolarHBondContact O-N 3.44Å
45	I	97.3	Very high	94.1	Very high	6 Å²	6	61.6 Å²	61.6	3%	0.031	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	130.2	160.4	-172.5	162.9	0	0	0	109.9	W28 S50 T51 I63 R65 L72	W28-I45 HydrophobicContact CB-CG2 4.09Å; W28-I45 PolarHBondContact N-O 3Å; W28-I45 PolarHBondContact O-N 3Å; I45-S50 CarbonylContact C-O 3.55Å; I45-S50 WeakPolarHBondContact CA-O 3.38Å; I45-T51 HydrophobicContact CB-CG2 4.02Å; I45-T51 HydrophobicContact CD1-CG2 3.79Å; I45-T51 HydrophobicContact CG1-CG2 3.77Å; I45-I63 HydrophobicContact CB-CG2 3.83Å; I45-I63 HydrophobicContact CG2-CG2 3.89Å; I45-R65 HydrophobicContact CD1-CB 4.04Å; I45-R65 HydrophobicContact CD1-CG 3.77Å; I45-L72 HydrophobicContact CG2-CD2 3.5Å
46	S	95.8	Very high	94.3	Very high	4 Å²	4	59 Å²	59	3%	0.028	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	167.5	179.7	72.5	0	0	0	0	111.9	H26 S48 G49 S50 R65	H26-S46 CarbonylContact O-C 3.53Å; H26-S46 WeakPolarHBondContact O-CA 3.4Å; S46-S48 PolarHBondContact O-N 3.44Å; S46-S48 PolarHBondContact OG-N 2.98Å; S46-S48 PolarHBondContact OG-OG 2.73Å; S46-G49 PolarHBondContact O-N 2.73Å; S46-G49 PolarHBondContact OG-N 2.83Å; S46-G49 VanDerWaalsContact OG-N 3.16Å; S46-S50 PolarHBondContact N-O 2.97Å; S46-S50 WeakPolarHBondContact OG-CB 3.21Å; S46-S50 PolarHBondContact OG-N 2.83Å; S46-S50 PolarHBondContact OG-O 3.09Å; S46-R65 PolarHBondContact O-NH1 2.59Å
47	S	94.1	Very high	94.4	Very high	15 Å²	15	55 Å²	55	11%	0.105	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.4	169.5	58.9	0	0	0	0	113.3	G24 H26 R65	G24-S47 VanDerWaalsContact O-CB 3.3Å; G24-S47 WeakPolarHBondContact O-CB 3.49Å; G24-S47 PolarHBondContact O-OG 2.84Å; H26-S47 PolarHBondContact O-N 2.84Å; S47-R65 VanDerWaalsContact O-CZ 3.3Å; S47-R65 PolarHBondContact O-NH1 2.97Å; S47-R65 PolarHBondContact O-NH2 3.19Å
48	S	93.8	Very high	94.4	Very high	95 Å²	95	58.2 Å²	58.2	66%	0.664	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-11.2	171	58.9	0	0	0	0	114.2	S46 R65	S46-S48 PolarHBondContact O-N 3.44Å; S46-S48 PolarHBondContact OG-N 2.98Å; S46-S48 PolarHBondContact OG-OG 2.73Å; S48-R65 PolarHBondContact O-NH2 2.99Å
49	G	94.2	Very high	94.4	Very high	29 Å²	29	54.9 Å²	54.9	30%	0.299	32%	0.32	S	S	.	.			trans	92.2	5.3	-179.7	0	0	0	0	0	114.3	S46 R65	S46-G49 PolarHBondContact O-N 2.73Å; S46-G49 PolarHBondContact OG-N 2.83Å; S46-G49 VanDerWaalsContact OG-N 3.16Å; G49-R65 VanDerWaalsContact CA-CZ 3.45Å; G49-R65 VanDerWaalsContact N-NH2 3.2Å
50	S	95.1	Very high	94.4	Very high	65 Å²	65	52.6 Å²	52.6	46%	0.455	30%	0.304	S	S	.	.			trans	-66.1	136.2	169.9	-175.2	0	0	0	0	109.9	I45 S46	I45-S50 CarbonylContact C-O 3.55Å; I45-S50 WeakPolarHBondContact CA-O 3.38Å; S46-S50 PolarHBondContact N-O 2.97Å; S46-S50 WeakPolarHBondContact OG-CB 3.21Å; S46-S50 PolarHBondContact OG-N 2.83Å; S46-S50 PolarHBondContact OG-O 3.09Å
51	T	96.3	Very high	94.5	Very high	78 Å²	78	50.9 Å²	50.9	48%	0.479	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140	-178.4	57.3	0	0	0	0	110.6	Y44 I45	Y44-T51 VanDerWaalsContact O-CA 3.32Å; Y44-T51 WeakPolarHBondContact O-CA 3.43Å; I45-T51 HydrophobicContact CB-CG2 4.02Å; I45-T51 HydrophobicContact CD1-CG2 3.79Å; I45-T51 HydrophobicContact CG1-CG2 3.77Å
52	D	96.4	Very high	94.5	Very high	69 Å²	69	48.9 Å²	48.9	37%	0.369	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	158.9	163.6	-160.9	8.5	0	0	0	109.9	W41 G43 Y44	W41-D52 HydrophobicContact CH2-CB 4.37Å; G43-D52 CarbonylContact C-O 3.43Å; G43-D52 WeakPolarHBondContact CA-O 3.48Å; Y44-D52 HydrophobicContact CD1-CB 4.13Å; Y44-D52 HydrophobicContact CE1-CB 3.46Å; Y44-D52 VanDerWaalsContact CE1-CB 3.46Å; Y44-D52 HydrophobicContact CE2-CB 4.25Å; Y44-D52 PolarHBondContact N-O 2.93Å; Y44-D52 PolarHBondContact O-N 3.44Å
53	S	96.1	Very high	94.6	Very high	17 Å²	17	49.2 Å²	49.2	12%	0.119	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	149.3	-168.9	53.1	0	0	0	0	110.9	W41 I42 P55 K58	W41-S53 VanDerWaalsContact CZ3-C 3.49Å; I42-S53 WeakPolarHBondContact O-CA 3.3Å; S53-P55 WeakPolarHBondContact O-CD 3.42Å; S53-K58 WeakPolarHBondContact OG-CD 3.39Å; S53-K58 VanDerWaalsContact OG-CG 3.28Å; S53-K58 WeakPolarHBondContact OG-CG 3.49Å
54	N	94.6	Very high	94.6	Very high	34 Å²	34	52.4 Å²	52.4	18%	0.182	32%	0.317	C	S	.	.			trans	-57.3	121.8	172.6	-172.9	-24.4	0	0	0	109.8	W41 I42 S56 L57 K58	W41-N54 HydrophobicContact CE3-CB 3.95Å; W41-N54 HydrophobicContact CZ3-CB 4.09Å; W41-N54 WeakPolarHBondContact O-CB 3.36Å; W41-N54 PolarHBondContact O-ND2 2.84Å; I42-N54 PolarHBondContact O-N 2.84Å; N54-S56 PolarHBondContact O-N 3.12Å; N54-S56 PolarHBondContact OD1-N 2.99Å; N54-S56 PolarHBondContact OD1-OG 2.82Å; N54-L57 HydrophobicContact CB-CB 4.5Å; N54-L57 HydrophobicContact CB-CD1 4.49Å; N54-L57 HydrophobicContact CB-CG 4.49Å; N54-L57 PolarHBondContact O-N 2.95Å; N54-K58 PolarHBondContact O-N 3.35Å
55	P	94.4	Very high	94.5	Very high	110 Å²	110	53 Å²	53	71%	0.714	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-32	-177.6	-29.1	35.6	0	0	0	114.2	S53 L57	S53-P55 WeakPolarHBondContact O-CD 3.42Å; P55-L57 PolarHBondContact O-N 2.9Å
56	S	90.9	Very high	94.5	Very high	69 Å²	69	54.5 Å²	54.5	48%	0.483	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-20.8	178.4	70.3	0	0	0	0	113.9	N54	N54-S56 PolarHBondContact O-N 3.12Å; N54-S56 PolarHBondContact OD1-N 2.99Å; N54-S56 PolarHBondContact OD1-OG 2.82Å
57	L	90.4	Very high	94.4	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.016	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-13.8	-177.2	-58.7	-179.2	0	0	0	112.6	I42 N54 P55 S59 R60 I61	I42-L57 HydrophobicContact CB-CD1 4.37Å; I42-L57 HydrophobicContact CG1-CD1 4.05Å; I42-L57 HydrophobicContact CG2-CD1 4.25Å; N54-L57 HydrophobicContact CB-CB 4.5Å; N54-L57 HydrophobicContact CB-CD1 4.49Å; N54-L57 HydrophobicContact CB-CG 4.49Å; N54-L57 PolarHBondContact O-N 2.95Å; P55-L57 PolarHBondContact O-N 2.9Å; L57-S59 VanDerWaalsContact C-N 3.27Å; L57-S59 PolarHBondContact O-N 3.07Å; L57-S59 VanDerWaalsContact O-N 3.12Å; L57-R60 VanDerWaalsContact CD2-NH2 3.28Å; L57-R60 WeakPolarHBondContact O-CA 3.48Å; L57-R60 PolarHBondContact O-N 2.84Å; L57-I61 HydrophobicContact CB-CD1 4.44Å; L57-I61 HydrophobicContact CB-CG2 4.08Å; L57-I61 PolarHBondContact O-N 3.19Å; L57-I61 VanDerWaalsContact O-N 3.09Å
58	K	90.3	Very high	94.5	Very high	127 Å²	127	62.2 Å²	62.2	55%	0.552	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-36.5	-170.6	-173.9	164.3	-170.5	171.7	0	114.5	S53 N54 R60	S53-K58 WeakPolarHBondContact OG-CD 3.39Å; S53-K58 VanDerWaalsContact OG-CG 3.28Å; S53-K58 WeakPolarHBondContact OG-CG 3.49Å; N54-K58 PolarHBondContact O-N 3.35Å; K58-R60 VanDerWaalsContact C-N 3.28Å; K58-R60 PolarHBondContact O-N 3.2Å
59	S	92.1	Very high	94.6	Very high	112 Å²	112	63.9 Å²	63.9	78%	0.783	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-16	178.1	59.3	0	0	0	0	114.1	L57	L57-S59 VanDerWaalsContact C-N 3.27Å; L57-S59 PolarHBondContact O-N 3.07Å; L57-S59 VanDerWaalsContact O-N 3.12Å
60	R	92.5	Very high	94.7	Very high	62 Å²	62	63.9 Å²	63.9	23%	0.234	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-13.4	-174.3	-63.2	-169.8	-67.9	170.4	-5.7	113.5	L57 K58 L76 N77 T80	L57-R60 VanDerWaalsContact CD2-NH2 3.28Å; L57-R60 WeakPolarHBondContact O-CA 3.48Å; L57-R60 PolarHBondContact O-N 2.84Å; K58-R60 VanDerWaalsContact C-N 3.28Å; K58-R60 PolarHBondContact O-N 3.2Å; R60-L76 HydrophobicContact CB-CD1 4.22Å; R60-N77 WeakPolarHBondContact O-CB 3.39Å; R60-N77 PolarHBondContact O-N 3.16Å; R60-T80 PolarHBondContact NH1-OG1 2.78Å
61	I	94.6	Very high	94.8	Very high	20 Å²	20	62.8 Å²	62.8	10%	0.103	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	152.2	-176.4	70.2	170.5	0	0	0	112.5	I42 L57 I63 L74 Q75 L76	I42-I61 HydrophobicContact CG2-CD1 3.44Å; I42-I61 VanDerWaalsContact CG2-CD1 3.44Å; I42-I61 HydrophobicContact CG2-CG2 4.2Å; I42-I61 WeakPolarHBondContact O-CD1 3.43Å; L57-I61 HydrophobicContact CB-CD1 4.44Å; L57-I61 HydrophobicContact CB-CG2 4.08Å; L57-I61 PolarHBondContact O-N 3.19Å; L57-I61 VanDerWaalsContact O-N 3.09Å; I61-I63 HydrophobicContact CD1-CD1 4.1Å; I61-I63 HydrophobicContact CD1-CG1 4.37Å; I61-L74 HydrophobicContact CB-CD1 4.16Å; I61-L74 HydrophobicContact CG2-CD1 4.41Å; I61-Q75 CarbonylContact C-O 3.58Å; I61-Q75 VanDerWaalsContact CA-O 3.22Å; I61-Q75 WeakPolarHBondContact CA-O 3.32Å; I61-L76 HydrophobicContact CG2-CD1 3.55Å
62	S	95.9	Very high	94.9	Very high	44 Å²	44	59.2 Å²	59.2	31%	0.308	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	127.4	165.4	178.8	0	0	0	0	108.9	L74 Q75	S62-L74 WeakPolarHBondContact O-CA 3.4Å; S62-Q75 PolarHBondContact N-O 2.92Å; S62-Q75 PolarHBondContact O-N 2.7Å
63	I	97.3	Very high	94.9	Very high	20 Å²	20	58 Å²	58	10%	0.103	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	121.7	178	-59.2	173.4	0	0	0	107.3	I45 I61 F73 L74	I45-I63 HydrophobicContact CB-CG2 3.83Å; I45-I63 HydrophobicContact CG2-CG2 3.89Å; I61-I63 HydrophobicContact CD1-CD1 4.1Å; I61-I63 HydrophobicContact CD1-CG1 4.37Å; I63-F73 WeakPolarHBondContact CA-O 3.46Å; I63-L74 HydrophobicContact CD1-CD1 4.42Å; I63-L74 HydrophobicContact CG1-CD1 3.74Å
64	T	96.9	Very high	94.9	Very high	67 Å²	67	57.6 Å²	57.6	41%	0.411	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	172.7	-178	61.3	0	0	0	0	111.1	F73	T64-F73 PolarHBondContact N-O 2.97Å; T64-F73 PolarHBondContact O-N 3.01Å
65	R	95.9	Very high	95	Very high	66 Å²	66	59.8 Å²	59.8	25%	0.249	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.5	179.3	67.8	-176.4	-175.4	164.1	7.7	111.7	I21 I45 S46 S47 S48 G49 T67 Q71 L72	I21-R65 HydrophobicContact CD1-CB 4.13Å; I45-R65 HydrophobicContact CD1-CB 4.04Å; I45-R65 HydrophobicContact CD1-CG 3.77Å; S46-R65 PolarHBondContact O-NH1 2.59Å; S47-R65 VanDerWaalsContact O-CZ 3.3Å; S47-R65 PolarHBondContact O-NH1 2.97Å; S47-R65 PolarHBondContact O-NH2 3.19Å; S48-R65 PolarHBondContact O-NH2 2.99Å; G49-R65 VanDerWaalsContact CA-CZ 3.45Å; G49-R65 VanDerWaalsContact N-NH2 3.2Å; R65-T67 HydrophobicContact CG-CG2 4.33Å; R65-Q71 CarbonylContact C-O 3.55Å; R65-Q71 VanDerWaalsContact CA-O 3.3Å; R65-Q71 WeakPolarHBondContact CA-O 3.28Å; R65-L72 HydrophobicContact CB-CD2 3.88Å
66	D	96	Very high	94.9	Very high	39 Å²	39	56.3 Å²	56.3	21%	0.209	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	104	168	-176.9	-17.9	0	0	0	107.8	S68 K69 N70 Q71 F73	D66-S68 VanDerWaalsContact C-N 3.29Å; D66-S68 WeakPolarHBondContact OD1-CB 3.43Å; D66-S68 PolarHBondContact OD1-N 3.33Å; D66-S68 PolarHBondContact OD1-OG 3.17Å; D66-K69 HydrophobicContact CB-CB 4.38Å; D66-K69 PolarHBondContact O-N 3.25Å; D66-K69 PolarHBondContact OD1-N 3.1Å; D66-K69 WeakPolarHBondContact OD2-CD 3.16Å; D66-K69 WeakPolarHBondContact OD2-CE 3.44Å; D66-K69 WeakPolarHBondContact OD2-CG 3.32Å; D66-K69 IonicContact OD2-NZ 3.53Å; D66-N70 PolarHBondContact O-N 3.03Å; D66-Q71 PolarHBondContact N-O 3.05Å; D66-Q71 PolarHBondContact O-N 2.81Å; D66-F73 HydrophobicContact CB-CE2 3.77Å; D66-F73 HydrophobicContact CB-CZ 4.4Å
67	T	94.9	Very high	94.8	Very high	79 Å²	79	55.5 Å²	55.5	49%	0.485	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-23.5	-177.6	57.6	0	0	0	0	112.3	I21 T22 R65 K69	I21-T67 HydrophobicContact CD1-CG2 4.48Å; T22-T67 HydrophobicContact CG2-CG2 3.35Å; R65-T67 HydrophobicContact CG-CG2 4.33Å; T67-K69 VanDerWaalsContact C-N 3.32Å
68	S	95.3	Very high	94.5	Very high	102 Å²	102	58.5 Å²	58.5	71%	0.713	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-31.7	176.6	75.5	0	0	0	0	111.8	D66	D66-S68 VanDerWaalsContact C-N 3.29Å; D66-S68 WeakPolarHBondContact OD1-CB 3.43Å; D66-S68 PolarHBondContact OD1-N 3.33Å; D66-S68 PolarHBondContact OD1-OG 3.17Å
69	K	96.8	Very high	94	Very high	129 Å²	129	53.7 Å²	53.7	56%	0.561	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-3.5	178	-62.4	-178.3	-168.9	156.5	0	113.8	D66 T67 Q71	D66-K69 HydrophobicContact CB-CB 4.38Å; D66-K69 PolarHBondContact O-N 3.25Å; D66-K69 PolarHBondContact OD1-N 3.1Å; D66-K69 WeakPolarHBondContact OD2-CD 3.16Å; D66-K69 WeakPolarHBondContact OD2-CE 3.44Å; D66-K69 WeakPolarHBondContact OD2-CG 3.32Å; D66-K69 IonicContact OD2-NZ 3.53Å; T67-K69 VanDerWaalsContact C-N 3.32Å; K69-Q71 VanDerWaalsContact C-N 3.31Å; K69-Q71 HydrophobicContact CB-CB 4.36Å; K69-Q71 HydrophobicContact CB-CG 4.06Å; K69-Q71 PolarHBondContact O-N 3.2Å
70	N	96.5	Very high	93.2	Very high	30 Å²	30	52.6 Å²	52.6	16%	0.16	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	43.9	-176	-153.2	44.3	0	0	0	112.8	V16 Y19 S20 I21 D66	V16-N70 PolarHBondContact N-O 3.35Å; V16-N70 PolarHBondContact O-ND2 3.06Å; Y19-N70 PolarHBondContact O-ND2 3.28Å; S20-N70 WeakPolarHBondContact CA-OD1 3.09Å; I21-N70 WeakPolarHBondContact CG1-OD1 3.34Å; I21-N70 WeakPolarHBondContact CG2-OD1 3.44Å; I21-N70 PolarHBondContact N-OD1 2.89Å; D66-N70 PolarHBondContact O-N 3.03Å
71	Q	97.5	Very high	91.8	Very high	41 Å²	41	58.5 Å²	58.5	19%	0.192	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	148.6	-173.7	-75.1	178.7	-28.5	0	0	112.7	T13 C14 T15 I21 R65 D66 K69 F73	T13-Q71 HydrophobicContact CG2-CB 4.45Å; T13-Q71 HydrophobicContact CG2-CG 4.29Å; C14-Q71 CarbonylContact O-C 3.49Å; C14-Q71 WeakPolarHBondContact O-CA 3.4Å; T15-Q71 HydrophobicContact CG2-CG 4.07Å; T15-Q71 PolarHBondContact OG1-NE2 3.21Å; I21-Q71 WeakPolarHBondContact CD1-O 3.43Å; R65-Q71 CarbonylContact C-O 3.55Å; R65-Q71 VanDerWaalsContact CA-O 3.3Å; R65-Q71 WeakPolarHBondContact CA-O 3.28Å; D66-Q71 PolarHBondContact N-O 3.05Å; D66-Q71 PolarHBondContact O-N 2.81Å; K69-Q71 VanDerWaalsContact C-N 3.31Å; K69-Q71 HydrophobicContact CB-CB 4.36Å; K69-Q71 HydrophobicContact CB-CG 4.06Å; K69-Q71 PolarHBondContact O-N 3.2Å; Q71-F73 HydrophobicContact CB-CE2 3.87Å; Q71-F73 HydrophobicContact CB-CZ 3.71Å
72	L	97	Very high	91.6	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.016	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142.4	174.8	-58	153.5	0	0	0	108.5	T13 C14 V16 I21 W28 W30 I45 R65	T13-L72 WeakPolarHBondContact CA-O 3.33Å; C14-L72 HydrophobicContact CB-CB 4.22Å; C14-L72 PolarHBondContact N-O 3.35Å; C14-L72 PolarHBondContact O-N 2.99Å; V16-L72 HydrophobicContact CG2-CD1 4.41Å; I21-L72 HydrophobicContact CD1-CD2 4.14Å; I21-L72 HydrophobicContact CD1-CG 4.33Å; I21-L72 HydrophobicContact CG2-CD1 4.29Å; I21-L72 HydrophobicContact CG2-CG 4.38Å; W28-L72 HydrophobicContact CB-CD1 3.63Å; W28-L72 HydrophobicContact CB-CD2 4.07Å; W28-L72 HydrophobicContact CB-CG 4.5Å; W28-L72 HydrophobicContact CD2-CD1 3.51Å; W28-L72 HydrophobicContact CE3-CD1 3.64Å; W28-L72 HydrophobicContact CG-CD1 3.5Å; W28-L72 VanDerWaalsContact CG-CD1 3.5Å; W28-L72 HydrophobicContact CG-CD2 4.06Å; W28-L72 HydrophobicContact CG-CG 4.43Å; W28-L72 HydrophobicContact CZ3-CD1 4.48Å; W30-L72 HydrophobicContact CZ2-CB 4.33Å; I45-L72 HydrophobicContact CG2-CD2 3.5Å; R65-L72 HydrophobicContact CB-CD2 3.88Å
73	F	97.2	Very high	91.4	Very high	44 Å²	44	61.3 Å²	61.3	19%	0.193	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.7	-178	-52.9	-88.7	0	0	0	110.9	L12 T13 I63 T64 D66 Q71	L12-F73 VanDerWaalsContact O-CA 3.28Å; L12-F73 WeakPolarHBondContact O-CA 3.48Å; T13-F73 HydrophobicContact CG2-CD1 3.98Å; T13-F73 HydrophobicContact CG2-CE1 3.57Å; T13-F73 HydrophobicContact CG2-CZ 4.3Å; T13-F73 WeakPolarHBondContact OG1-CD1 3.38Å; I63-F73 WeakPolarHBondContact CA-O 3.46Å; T64-F73 PolarHBondContact N-O 2.97Å; T64-F73 PolarHBondContact O-N 3.01Å; D66-F73 HydrophobicContact CB-CE2 3.77Å; D66-F73 HydrophobicContact CB-CZ 4.4Å; Q71-F73 HydrophobicContact CB-CE2 3.87Å; Q71-F73 HydrophobicContact CB-CZ 3.71Å
74	L	96.8	Very high	91.1	Very high	8 Å²	8	63.6 Å²	63.6	4%	0.042	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	116.4	166	172.2	70.4	0	0	0	108.2	S11 L12 W30 I42 I61 S62 I63	S11-L74 CarbonylContact C-O 3.55Å; S11-L74 WeakPolarHBondContact CA-O 3.3Å; L12-L74 HydrophobicContact CB-CB 4.4Å; L12-L74 HydrophobicContact CD1-CD2 4.28Å; L12-L74 PolarHBondContact N-O 2.83Å; L12-L74 PolarHBondContact O-N 2.86Å; W30-L74 HydrophobicContact CB-CD2 4.09Å; W30-L74 HydrophobicContact CD2-CB 3.57Å; W30-L74 HydrophobicContact CD2-CD2 3.86Å; W30-L74 HydrophobicContact CD2-CG 4.26Å; W30-L74 HydrophobicContact CE3-CB 3.85Å; W30-L74 HydrophobicContact CE3-CD2 3.74Å; W30-L74 HydrophobicContact CE3-CG 4.44Å; W30-L74 HydrophobicContact CG-CB 4.08Å; W30-L74 HydrophobicContact CG-CD1 4.5Å; W30-L74 HydrophobicContact CG-CD2 4.02Å; W30-L74 HydrophobicContact CG-CG 4.43Å; W30-L74 HydrophobicContact CH2-CB 4.03Å; W30-L74 HydrophobicContact CZ2-CB 3.76Å; W30-L74 HydrophobicContact CZ3-CB 4.07Å; W30-L74 HydrophobicContact CZ3-CD2 4.45Å; I42-L74 HydrophobicContact CD1-CD2 3.92Å; I42-L74 HydrophobicContact CG2-CD1 3.99Å; I42-L74 HydrophobicContact CG2-CD2 4.32Å; I61-L74 HydrophobicContact CB-CD1 4.16Å; I61-L74 HydrophobicContact CG2-CD1 4.41Å; S62-L74 WeakPolarHBondContact O-CA 3.4Å; I63-L74 HydrophobicContact CD1-CD1 4.42Å; I63-L74 HydrophobicContact CG1-CD1 3.74Å
75	Q	95	Very high	90.8	Very high	80 Å²	80	63.4 Å²	63.4	37%	0.374	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	127.4	169.5	-169.9	176.5	27.5	0	0	108.7	T9 V10 I61 S62	T9-Q75 HydrophobicContact CG2-CG 3.51Å; V10-Q75 CarbonylContact O-C 3.55Å; V10-Q75 WeakPolarHBondContact O-CA 3.36Å; I61-Q75 CarbonylContact C-O 3.58Å; I61-Q75 VanDerWaalsContact CA-O 3.22Å; I61-Q75 WeakPolarHBondContact CA-O 3.32Å; S62-Q75 PolarHBondContact N-O 2.92Å; S62-Q75 PolarHBondContact O-N 2.7Å
76	L	92.1	Very high	90.4	Very high	37 Å²	37	63.3 Å²	63.3	19%	0.194	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	114.1	173.8	177	65.5	0	0	0	108.2	T9 V10 R60 I61 V79	T9-L76 WeakPolarHBondContact CA-O 3.28Å; V10-L76 PolarHBondContact N-O 3.1Å; V10-L76 PolarHBondContact O-N 2.98Å; R60-L76 HydrophobicContact CB-CD1 4.22Å; I61-L76 HydrophobicContact CG2-CD1 3.55Å; L76-V79 HydrophobicContact CD2-CG2 3.89Å; L76-V79 HydrophobicContact CG-CG2 4.04Å
77	N	90.3	Very high	90.1	Very high	53 Å²	53	64.9 Å²	64.9	28%	0.283	37%	0.368	S	S	.	.			trans	-87.4	146.8	177.1	-62.7	-41	0	0	0	110.5	T9 R60	T9-N77 WeakPolarHBondContact CG2-OD1 3.38Å; T9-N77 PolarHBondContact OG1-OD1 2.94Å; R60-N77 WeakPolarHBondContact O-CB 3.39Å; R60-N77 PolarHBondContact O-N 3.16Å
78	S	83.8	Confident	89.7	Confident	65 Å²	65	63.9 Å²	63.9	46%	0.455	36%	0.36	S	S	.	.	S	Bend	trans	51.6	60.8	176.4	-57.7	0	0	0	0	112.2	Q8 T80	Q8-S78 PolarHBondContact O-N 2.7Å; S78-T80 PolarHBondContact O-N 3.26Å; S78-T80 VanDerWaalsContact O-N 3.13Å
79	V	79.2	Confident	89.3	Confident	27 Å²	27	60.9 Å²	60.9	16%	0.164	33%	0.332	C	S	.	.			trans	-56.1	121.3	176.8	177.7	0	0	0	0	109	V4 P6 S7 Q8 V10 L76	V4-V79 HydrophobicContact CG2-CB 4.5Å; V4-V79 HydrophobicContact CG2-CG1 4.22Å; V4-V79 HydrophobicContact CG2-CG2 4.47Å; P6-V79 CarbonylContact C-O 3.52Å; P6-V79 VanDerWaalsContact CA-O 3.28Å; P6-V79 WeakPolarHBondContact CA-O 3.3Å; S7-V79 PolarHBondContact N-O 3.44Å; Q8-V79 WeakPolarHBondContact O-CG2 3.44Å; Q8-V79 PolarHBondContact O-N 2.93Å; Q8-V79 VanDerWaalsContact O-N 3.07Å; V10-V79 HydrophobicContact CB-CG2 4.21Å; V10-V79 HydrophobicContact CG2-CG2 3.75Å; L76-V79 HydrophobicContact CD2-CG2 3.89Å; L76-V79 HydrophobicContact CG-CG2 4.04Å
80	T	76.5	Confident	88.7	Confident	88 Å²	88	55.3 Å²	55.3	54%	0.54	31%	0.313	S	S	.	.			trans	-91.6	147.9	173.6	51.2	0	0	0	0	109.2	R60 S78	R60-T80 PolarHBondContact NH1-OG1 2.78Å; S78-T80 PolarHBondContact O-N 3.26Å; S78-T80 VanDerWaalsContact O-N 3.13Å
81	T	62	Low	87.9	Confident	187 Å²	187	57.5 Å²	57.5	100%	1.147	33%	0.327	S	S	*	.			trans	-59.9	0	174.6	-17.5	0	0	0	0	112.2

Retrieved 81 of 81 residues in 16.3 ms (Link to these results)

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