A0A5K4F9L4_SCHMA Loading...

LITAF domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F9L4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 105 aa.

						>A0A5K4F9L4_SCHMA|A0A5K4F9L4
MQQSQTYKPQIPPSCPLVITDQPMSQVTFSDMPVTLHCPSCGLNTLTSLEYKSGLLTYLACCGICLVGGVLGCCLIPFCVNSCKDVKHVCPHCQRAVGTYHRLGN
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.8	Very low	39.9	Very low	243 Å²	243	135.1 Å²	135.1	100%	1.197	68%	0.68	S	S	*	*				0	107	0	-52	-165.9	-168	0	0	107	Q3	M1-Q3 PolarHBondContact O-N 2.63Å
2	Q	39.5	Very low	41	Very low	135 Å²	135	132.8 Å²	132.8	63%	0.631	68%	0.681	S	S	*	*			trans	-79.4	105.8	-173.3	-158.9	150.4	19.9	0	0	107.7	S4 Y51	Q2-S4 PolarHBondContact O-N 3.17Å; Q2-Y51 PolarHBondContact NE2-O 2.99Å
3	Q	39	Very low	41.5	Very low	134 Å²	134	130.8 Å²	130.8	63%	0.626	68%	0.683	S	S	*	*			trans	-72.5	94.1	-175.3	-165.2	169.4	83.9	0	0	108.4	M1 Q5	M1-Q3 PolarHBondContact O-N 2.63Å; Q3-Q5 VanDerWaalsContact C-N 3.31Å; Q3-Q5 PolarHBondContact O-N 2.81Å
4	S	44.4	Very low	41.5	Very low	94 Å²	94	130.3 Å²	130.3	66%	0.657	70%	0.696	S	S	*	*			trans	-59	101.1	155.5	50.3	0	0	0	0	106.3	Q2 T6	Q2-S4 PolarHBondContact O-N 3.17Å; S4-T6 VanDerWaalsContact C-N 3.28Å; S4-T6 PolarHBondContact O-N 2.79Å
5	Q	42.3	Very low	41.8	Very low	112 Å²	112	128.9 Å²	128.9	52%	0.523	70%	0.699	S	S	.	*			trans	-65	98.9	165.8	-85.3	-164.5	60.1	0	0	106.7	Q3 Y7	Q3-Q5 VanDerWaalsContact C-N 3.31Å; Q3-Q5 PolarHBondContact O-N 2.81Å; Q5-Y7 PolarHBondContact O-N 3.13Å
6	T	36.2	Very low	41.9	Very low	126 Å²	126	128.3 Å²	128.3	77%	0.773	70%	0.703	S	S	*	*			trans	-59.8	89.9	158.5	-78.1	0	0	0	0	106.5	S4 K8	S4-T6 VanDerWaalsContact C-N 3.28Å; S4-T6 PolarHBondContact O-N 2.79Å; T6-K8 PolarHBondContact O-N 2.96Å; T6-K8 VanDerWaalsContact O-N 3.13Å
7	Y	40.4	Very low	42.1	Very low	111 Å²	111	130.9 Å²	130.9	44%	0.435	72%	0.715	S	S	.	*			trans	-71.9	104.6	167	-177.9	-97.4	0	0	0	107.2	Q5 P33 L46	Q5-Y7 PolarHBondContact O-N 3.13Å; Y7-P33 HydrophobicContact CD1-CG 3.79Å; Y7-P33 HydrophobicContact CD2-CG 4.27Å; Y7-P33 HydrophobicContact CE1-CG 4.2Å; Y7-P33 HydrophobicContact CG-CG 3.81Å; Y7-L46 HydrophobicContact CD1-CD1 4.1Å; Y7-L46 HydrophobicContact CD1-CD2 3.76Å; Y7-L46 HydrophobicContact CE1-CD1 3.75Å; Y7-L46 HydrophobicContact CE1-CD2 4.29Å
8	K	35.6	Very low	42.6	Very low	162 Å²	162	129.9 Å²	129.9	70%	0.704	71%	0.714	S	S	*	*			trans	-65.7	128.1	172.6	-174.7	-178.7	167.2	-163.4	0	107.7	T6 Q10	T6-K8 PolarHBondContact O-N 2.96Å; T6-K8 VanDerWaalsContact O-N 3.13Å; K8-Q10 PolarHBondContact O-N 2.84Å
9	P	42.2	Very low	42.9	Very low	80 Å²	80	132.1 Å²	132.1	52%	0.519	72%	0.722	S	S	.	*			trans	-60	117.1	-176.6	24.7	-33.1	0	0	0	109.7	I11	P9-I11 VanDerWaalsContact C-N 3.34Å; P9-I11 HydrophobicContact CB-CG1 4.38Å; P9-I11 PolarHBondContact O-N 3.47Å
10	Q	36.9	Very low	43.1	Very low	147 Å²	147	129.8 Å²	129.8	69%	0.687	71%	0.712	S	S	*	*			trans	-78.3	94.6	159.3	-65.3	-79	-84.5	0	0	105.5	K8 P12	K8-Q10 PolarHBondContact O-N 2.84Å; Q10-P12 WeakPolarHBondContact O-CD 3.29Å
11	I	48.6	Very low	43.4	Very low	142 Å²	142	130.8 Å²	130.8	73%	0.728	72%	0.717	S	S	*	*			trans	-69.1	111.6	171.3	-60.4	148.7	0	0	0	105.7	P9	P9-I11 VanDerWaalsContact C-N 3.34Å; P9-I11 HydrophobicContact CB-CG1 4.38Å; P9-I11 PolarHBondContact O-N 3.47Å
12	P	53.5	Low	44	Very low	107 Å²	107	125.9 Å²	125.9	70%	0.695	69%	0.691	S	S	*	*			trans	-61.5	137.9	168.3	25.8	-31.4	0	0	0	108.4	Q10 S14	Q10-P12 WeakPolarHBondContact O-CD 3.29Å; P12-S14 PolarHBondContact O-N 3.11Å
13	P	46.8	Very low	44.6	Very low	108 Å²	108	124.5 Å²	124.5	70%	0.701	69%	0.694	S	S	*	*			trans	-62.7	138.1	-174.1	26.3	-32.9	0	0	0	110.2	C15	P13-C15 PolarHBondContact O-N 2.84Å; P13-C15 VanDerWaalsContact O-N 3.14Å; P13-C15 PolarHBondContact O-SG 3.46Å
14	S	42.4	Very low	45.2	Very low	123 Å²	123	127.3 Å²	127.3	86%	0.86	71%	0.709	S	S	*	*			trans	-18.1	103.2	167.4	48.5	0	0	0	0	115.3	P12	P12-S14 PolarHBondContact O-N 3.11Å
15	C	45.2	Very low	45.8	Very low	110 Å²	110	126.6 Å²	126.6	74%	0.743	70%	0.704	S	S	*	*			trans	-123.5	140.9	159.8	-60.8	0	0	0	0	107.1	P13	P13-C15 PolarHBondContact O-N 2.84Å; P13-C15 VanDerWaalsContact O-N 3.14Å; P13-C15 PolarHBondContact O-SG 3.46Å
16	P	44.3	Very low	46.7	Very low	119 Å²	119	130.1 Å²	130.1	77%	0.773	72%	0.721	S	S	*	*			trans	-60.8	147.7	-166.9	26.2	-33.4	0	0	0	111.8	V18	P16-V18 PolarHBondContact O-N 3.41Å
17	L	45.5	Very low	48.4	Very low	172 Å²	172	126.9 Å²	126.9	90%	0.901	70%	0.701	S	S	*	*			trans	-56.2	94.8	174.9	-72.6	167.8	0	0	0	110.2
18	V	50.1	Low	50.2	Low	114 Å²	114	127.1 Å²	127.1	69%	0.691	71%	0.714	S	S	*	*			trans	-85.8	108.2	161	-179.5	0	0	0	0	106.1	P16 T20	P16-V18 PolarHBondContact O-N 3.41Å; V18-T20 WeakPolarHBondContact CG1-OG1 3.27Å; V18-T20 PolarHBondContact O-N 3.41Å
19	I	49	Very low	52.4	Low	170 Å²	170	122 Å²	122	87%	0.872	69%	0.692	S	S	*	*			trans	-67.4	82.5	167.1	-58.2	167.5	0	0	0	106.1
20	T	47.1	Very low	54.3	Low	86 Å²	86	120.1 Å²	120.1	53%	0.528	68%	0.68	S	S	.	*			trans	-94.1	115.8	161.8	-70	0	0	0	0	106	V18 Q22	V18-T20 WeakPolarHBondContact CG1-OG1 3.27Å; V18-T20 PolarHBondContact O-N 3.41Å; T20-Q22 HydrophobicContact CG2-CG 3.73Å; T20-Q22 PolarHBondContact O-N 2.8Å
21	D	48.5	Very low	56.3	Low	152 Å²	152	115.7 Å²	115.7	81%	0.813	66%	0.662	S	S	*	*			trans	-56.3	85.7	157.4	-168.6	-113.2	0	0	0	107.1	P23	D21-P23 VanDerWaalsContact O-CD 3.27Å; D21-P23 WeakPolarHBondContact O-CD 3.48Å
22	Q	47.2	Very low	57.9	Low	139 Å²	139	114.9 Å²	114.9	65%	0.65	66%	0.656	S	S	*	*			trans	-75.7	112	176.6	-62.4	-171.3	-0.3	0	0	105.5	T20 M24	T20-Q22 HydrophobicContact CG2-CG 3.73Å; T20-Q22 PolarHBondContact O-N 2.8Å; Q22-M24 PolarHBondContact O-N 2.99Å
23	P	52.5	Low	59.2	Low	107 Å²	107	111.1 Å²	111.1	70%	0.695	63%	0.632	S	S	*	*			trans	-55.8	118.3	179.3	24.1	-32.8	0	0	0	106.4	D21 S25	D21-P23 VanDerWaalsContact O-CD 3.27Å; D21-P23 WeakPolarHBondContact O-CD 3.48Å; P23-S25 VanDerWaalsContact O-CA 3.29Å; P23-S25 WeakPolarHBondContact O-CA 3.34Å; P23-S25 PolarHBondContact O-N 3.16Å
24	M	50.7	Low	60.9	Low	192 Å²	192	107.5 Å²	107.5	95%	0.946	61%	0.607	S	S	*	*			trans	-31	85.7	-169.6	-152.3	-174.4	-150.6	0	0	111.2	Q22 Q26	Q22-M24 PolarHBondContact O-N 2.99Å; M24-Q26 PolarHBondContact O-N 3.11Å
25	S	56	Low	62.9	Low	79 Å²	79	105.8 Å²	105.8	55%	0.552	59%	0.592	S	S	*	*			trans	-72.7	123.1	-169.9	55.8	0	0	0	0	104.6	P23 V27	P23-S25 VanDerWaalsContact O-CA 3.29Å; P23-S25 WeakPolarHBondContact O-CA 3.34Å; P23-S25 PolarHBondContact O-N 3.16Å; S25-V27 PolarHBondContact O-N 3.15Å
26	Q	63.2	Low	64.7	Low	186 Å²	186	101.1 Å²	101.1	87%	0.869	56%	0.56	S	S	*	*			trans	-52.5	106	-175.2	-69.5	179.2	-93.7	0	0	108.5	M24 T28	M24-Q26 PolarHBondContact O-N 3.11Å; Q26-T28 PolarHBondContact O-N 3.3Å; Q26-T28 PolarHBondContact O-OG1 3.37Å
27	V	71.8	Confident	66.7	Low	59 Å²	59	101.1 Å²	101.1	36%	0.358	55%	0.549	S	S	.	.			trans	-66.1	109.4	-177.8	179.2	0	0	0	0	106.5	S25 F29 V34 L36	S25-V27 PolarHBondContact O-N 3.15Å; V27-F29 HydrophobicContact CG1-CE1 4.24Å; V27-F29 HydrophobicContact CG1-CZ 4.38Å; V27-F29 PolarHBondContact O-N 3.36Å; V27-V34 HydrophobicContact CG1-CB 4.22Å; V27-V34 HydrophobicContact CG1-CG2 3.64Å; V27-L36 HydrophobicContact CG1-CB 4.22Å; V27-L36 HydrophobicContact CG1-CD2 3.91Å; V27-L36 HydrophobicContact CG2-CB 3.93Å
28	T	78.1	Confident	68.5	Low	115 Å²	115	93 Å²	93	71%	0.706	51%	0.507	S	S	*	.			trans	-82.2	105.6	176.8	-57.9	0	0	0	0	107.4	Q26	Q26-T28 PolarHBondContact O-N 3.3Å; Q26-T28 PolarHBondContact O-OG1 3.37Å
29	F	80.9	Confident	70.2	Confident	55 Å²	55	93 Å²	93	24%	0.241	51%	0.509	C	S	.	.			trans	-67.8	136.3	172.3	-60.7	-75.3	0	0	0	109.2	V27 V34 L36 H88 V97 Y100	V27-F29 HydrophobicContact CG1-CE1 4.24Å; V27-F29 HydrophobicContact CG1-CZ 4.38Å; V27-F29 PolarHBondContact O-N 3.36Å; F29-V34 HydrophobicContact CD1-CG2 4.19Å; F29-V34 HydrophobicContact CE1-CG2 4.38Å; F29-L36 HydrophobicContact CE1-CD2 3.62Å; F29-L36 HydrophobicContact CZ-CD2 4.03Å; F29-H88 HydrophobicContact CD1-CB 3.99Å; F29-H88 AromaticContact CD1-CD2 3.52Å; F29-H88 AromaticContact CD1-CE1 3.99Å; F29-H88 AromaticContact CD1-CG 3.56Å; F29-H88 AromaticContact CD1-ND1 3.88Å; F29-H88 AromaticContact CD1-NE2 3.79Å; F29-H88 HydrophobicContact CE1-CB 4.08Å; F29-V97 HydrophobicContact CE1-CG2 4.23Å; F29-V97 WeakPolarHBondContact CZ-O 3.27Å; F29-Y100 WeakPolarHBondContact O-CD2 3.31Å
30	S	81.5	Confident	72	Confident	40 Å²	40	87.6 Å²	87.6	28%	0.28	49%	0.486	S	S	.	.			trans	-142.1	-170.4	179.8	-160.8	0	0	0	0	108.9	M32 H88	S30-M32 PolarHBondContact O-N 3.27Å; S30-M32 VanDerWaalsContact O-N 3.15Å; S30-H88 PolarHBondContact O-CE1 3.4Å; S30-H88 PolarHBondContact O-NE2 3.39Å
31	D	79.5	Confident	74	Confident	55 Å²	55	85.6 Å²	85.6	29%	0.294	48%	0.476	S	S	.	.	S	Bend	trans	-72.3	6.8	171.2	68.7	-61	0	0	0	115	L49 Y51 V86	D31-L49 WeakPolarHBondContact O-CD1 3.11Å; D31-Y51 PolarHBondContact O-OH 3.15Å; D31-V86 HydrophobicContact CB-CG2 4.38Å
32	M	82.1	Confident	75.8	Confident	124 Å²	124	80.3 Å²	80.3	61%	0.611	46%	0.457	S	S	*	.	S	Bend	trans	-118.7	144	179.3	-63.6	-170.5	-175.6	0	0	111.1	S30 V34 H88	S30-M32 PolarHBondContact O-N 3.27Å; S30-M32 VanDerWaalsContact O-N 3.15Å; M32-V34 PolarHBondContact O-N 3.05Å; M32-H88 PolarHBondContact O-CE1 2.93Å; M32-H88 VanDerWaalsContact O-CE1 3.25Å
33	P	81.5	Confident	77.5	Confident	29 Å²	29	77.8 Å²	77.8	19%	0.188	45%	0.447	C	S	.	.			trans	-66	133.8	177.6	29.4	-34.1	0	0	0	109.7	Y7 L46 T47 L49	Y7-P33 HydrophobicContact CD1-CG 3.79Å; Y7-P33 HydrophobicContact CD2-CG 4.27Å; Y7-P33 HydrophobicContact CE1-CG 4.2Å; Y7-P33 HydrophobicContact CG-CG 3.81Å; P33-L46 HydrophobicContact CB-CD2 3.61Å; P33-L46 HydrophobicContact CB-CG 4.07Å; P33-L46 HydrophobicContact CG-CD2 4.1Å; P33-T47 WeakPolarHBondContact CB-O 3.43Å; P33-L49 HydrophobicContact CB-CD2 4.21Å; P33-L49 HydrophobicContact CB-CG 4.07Å
34	V	81.9	Confident	79.1	Confident	31 Å²	31	77.7 Å²	77.7	19%	0.188	44%	0.441	C	S	.	.			trans	-112	142	179.9	-64.9	0	0	0	0	109.9	V27 F29 M32 L36 T47	V27-V34 HydrophobicContact CG1-CB 4.22Å; V27-V34 HydrophobicContact CG1-CG2 3.64Å; F29-V34 HydrophobicContact CD1-CG2 4.19Å; F29-V34 HydrophobicContact CE1-CG2 4.38Å; M32-V34 PolarHBondContact O-N 3.05Å; V34-L36 HydrophobicContact CG2-CD2 4.05Å; V34-T47 PolarHBondContact N-OG1 2.98Å; V34-T47 WeakPolarHBondContact O-CG2 3.05Å; V34-T47 PolarHBondContact O-N 2.88Å; V34-T47 PolarHBondContact O-OG1 3.13Å
35	T	84.1	Confident	80.6	Confident	87 Å²	87	69.8 Å²	69.8	53%	0.534	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.5	170.4	-57.3	0	0	0	0	108
36	L	82.5	Confident	82	Confident	13 Å²	13	68.3 Å²	68.3	7%	0.068	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	160.3	177.7	69.1	86.2	0	0	0	111.2	V27 F29 V34 C38 T45 T47 V97	V27-L36 HydrophobicContact CG1-CB 4.22Å; V27-L36 HydrophobicContact CG1-CD2 3.91Å; V27-L36 HydrophobicContact CG2-CB 3.93Å; F29-L36 HydrophobicContact CE1-CD2 3.62Å; F29-L36 HydrophobicContact CZ-CD2 4.03Å; V34-L36 HydrophobicContact CG2-CD2 4.05Å; L36-C38 PolarHBondContact O-N 3.05Å; L36-T45 PolarHBondContact N-O 3.04Å; L36-T45 VanDerWaalsContact N-O 3.13Å; L36-T45 PolarHBondContact O-N 3.28Å; L36-T45 VanDerWaalsContact O-N 3.15Å; L36-T47 HydrophobicContact CD2-CG2 3.64Å; L36-T47 HydrophobicContact CG-CG2 3.86Å; L36-V97 HydrophobicContact CD1-CB 4.22Å; L36-V97 HydrophobicContact CD1-CG1 4.22Å; L36-V97 HydrophobicContact CD1-CG2 4.36Å; L36-V97 HydrophobicContact CD2-CB 4.28Å; L36-V97 HydrophobicContact CD2-CG2 3.83Å
37	H	86.4	Confident	83.1	Confident	119 Å²	119	59.5 Å²	59.5	55%	0.551	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81	108.8	173.9	-154.7	86.2	0	0	0	109.1	P39 G42 N44	H37-P39 WeakPolarHBondContact O-CD 3.33Å; H37-G42 PolarHBondContact CE1-O 2.76Å; H37-G42 PolarHBondContact NE2-O 2.8Å; H37-N44 WeakPolarHBondContact CA-OD1 3.39Å; H37-N44 PolarHBondContact N-OD1 2.85Å
38	C	85.1	Confident	83.8	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.007	35%	0.351	C	S	.	.			trans	-69.4	121.7	-171.6	-179.6	0	0	0	0	110.6	L36 S40 C41 G42 L43 T45 C90 C93	L36-C38 PolarHBondContact O-N 3.05Å; C38-S40 PolarHBondContact O-N 2.75Å; C38-S40 VanDerWaalsContact O-N 3.13Å; C38-C41 WeakPolarHBondContact CB-SG 3.42Å; C38-C41 PolarHBondContact O-N 3.25Å; C38-C41 VanDerWaalsContact SG-SG 3.61Å; C38-G42 WeakPolarHBondContact O-CA 3.46Å; C38-G42 PolarHBondContact O-N 2.84Å; C38-L43 PolarHBondContact N-O 2.77Å; C38-L43 VanDerWaalsContact N-O 3.15Å; C38-T45 HydrophobicContact CB-CG2 4.48Å; C38-C90 VanDerWaalsContact SG-SG 3.69Å; C38-C93 VanDerWaalsContact SG-SG 3.7Å
39	P	83.8	Confident	84.2	Confident	113 Å²	113	54.9 Å²	54.9	73%	0.734	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-14.3	-177.2	27.8	-35.8	0	0	0	113.5	H37	H37-P39 WeakPolarHBondContact O-CD 3.33Å
40	S	88	Confident	84.4	Confident	57 Å²	57	56.6 Å²	56.6	40%	0.399	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-31.5	179.2	-68.4	0	0	0	0	114.4	C38 R95	C38-S40 PolarHBondContact O-N 2.75Å; C38-S40 VanDerWaalsContact O-N 3.13Å; S40-R95 VanDerWaalsContact CB-CD 3.46Å; S40-R95 WeakPolarHBondContact OG-CD 3.46Å; S40-R95 PolarHBondContact OG-NH1 3.07Å; S40-R95 VanDerWaalsContact OG-NH1 3.11Å
41	C	89.1	Confident	84.5	Confident	45 Å²	45	56 Å²	56	30%	0.304	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-10.7	179.3	65.5	0	0	0	0	114.5	C38 L43 C93	C38-C41 WeakPolarHBondContact CB-SG 3.42Å; C38-C41 PolarHBondContact O-N 3.25Å; C38-C41 VanDerWaalsContact SG-SG 3.61Å; C41-L43 PolarHBondContact O-N 2.83Å; C41-L43 VanDerWaalsContact O-N 3.16Å; C41-C93 HydrophobicContact CB-CB 4.16Å
42	G	85	Confident	84.5	Confident	41 Å²	41	57.3 Å²	57.3	42%	0.423	33%	0.325	S	S	.	.			trans	65.7	11.2	-176.3	0	0	0	0	0	114	H37 C38	H37-G42 PolarHBondContact CE1-O 2.76Å; H37-G42 PolarHBondContact NE2-O 2.8Å; C38-G42 WeakPolarHBondContact O-CA 3.46Å; C38-G42 PolarHBondContact O-N 2.84Å
43	L	83.8	Confident	84.3	Confident	85 Å²	85	53.5 Å²	53.5	45%	0.445	31%	0.311	S	S	.	.			trans	-96.7	134.6	179.2	-146	74.6	0	0	0	109.7	C38 C41 T45	C38-L43 PolarHBondContact N-O 2.77Å; C38-L43 VanDerWaalsContact N-O 3.15Å; C41-L43 PolarHBondContact O-N 2.83Å; C41-L43 VanDerWaalsContact O-N 3.16Å; L43-T45 PolarHBondContact O-N 2.99Å
44	N	85.9	Confident	84.1	Confident	105 Å²	105	52.5 Å²	52.5	56%	0.561	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	109.5	174	-146.9	54.6	0	0	0	108.6	H37	H37-N44 WeakPolarHBondContact CA-OD1 3.39Å; H37-N44 PolarHBondContact N-OD1 2.85Å
45	T	82.8	Confident	83.9	Confident	26 Å²	26	56.4 Å²	56.4	16%	0.16	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	154.7	-171.9	-166.5	0	0	0	0	111.4	L36 C38 L43 C90 P91	L36-T45 PolarHBondContact N-O 3.04Å; L36-T45 VanDerWaalsContact N-O 3.13Å; L36-T45 PolarHBondContact O-N 3.28Å; L36-T45 VanDerWaalsContact O-N 3.15Å; C38-T45 HydrophobicContact CB-CG2 4.48Å; L43-T45 PolarHBondContact O-N 2.99Å; T45-C90 VanDerWaalsContact CG2-SG 3.58Å; T45-P91 HydrophobicContact CG2-CG 4.44Å; T45-P91 WeakPolarHBondContact OG1-CG 3.19Å
46	L	84.9	Confident	83.7	Confident	48 Å²	48	54.5 Å²	54.5	25%	0.251	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	124.2	175.7	-175.8	142.1	0	0	0	108.8	Y7 P33 P91	Y7-L46 HydrophobicContact CD1-CD1 4.1Å; Y7-L46 HydrophobicContact CD1-CD2 3.76Å; Y7-L46 HydrophobicContact CE1-CD1 3.75Å; Y7-L46 HydrophobicContact CE1-CD2 4.29Å; P33-L46 HydrophobicContact CB-CD2 3.61Å; P33-L46 HydrophobicContact CB-CG 4.07Å; P33-L46 HydrophobicContact CG-CD2 4.1Å; L46-P91 VanDerWaalsContact O-CD 3.23Å; L46-P91 WeakPolarHBondContact O-CD 3.35Å; L46-P91 WeakPolarHBondContact O-CG 3.32Å
47	T	86.5	Confident	83.6	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.006	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-67.4	138.9	-177.9	51.4	0	0	0	0	111.7	P33 V34 L36 H88 V97	P33-T47 WeakPolarHBondContact CB-O 3.43Å; V34-T47 PolarHBondContact N-OG1 2.98Å; V34-T47 WeakPolarHBondContact O-CG2 3.05Å; V34-T47 PolarHBondContact O-N 2.88Å; V34-T47 PolarHBondContact O-OG1 3.13Å; L36-T47 HydrophobicContact CD2-CG2 3.64Å; L36-T47 HydrophobicContact CG-CG2 3.86Å; T47-H88 HydrophobicContact CG2-CB 4.18Å; T47-H88 PolarHBondContact OG1-ND1 3.45Å; T47-V97 HydrophobicContact CG2-CG2 3.41Å; T47-V97 VanDerWaalsContact CG2-CG2 3.41Å
48	S	87.1	Confident	83.3	Confident	59 Å²	59	54.8 Å²	54.8	41%	0.413	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	137.2	170.7	-162.9	0	0	0	0	109.6	H88 V89	S48-H88 CarbonylContact O-C 3.53Å; S48-H88 WeakPolarHBondContact O-CA 3.33Å; S48-V89 PolarHBondContact N-O 2.91Å; S48-V89 PolarHBondContact O-N 3.02Å
49	L	86.1	Confident	83.3	Confident	19 Å²	19	59.1 Å²	59.1	10%	0.099	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	121.3	-179.5	-59.5	-170.6	0	0	0	111.4	D31 P33 Y51 V86 H88	D31-L49 WeakPolarHBondContact O-CD1 3.11Å; P33-L49 HydrophobicContact CB-CD2 4.21Å; P33-L49 HydrophobicContact CB-CG 4.07Å; L49-Y51 HydrophobicContact CB-CE2 4.05Å; L49-Y51 HydrophobicContact CD1-CE2 4.47Å; L49-V86 HydrophobicContact CB-CG1 3.98Å; L49-V86 HydrophobicContact CD1-CG1 4.03Å; L49-V86 HydrophobicContact CD2-CG1 3.64Å; L49-V86 HydrophobicContact CG-CG1 4.09Å; L49-H88 WeakPolarHBondContact CD2-CE1 3.32Å; L49-H88 VanDerWaalsContact CD2-ND1 3.34Å; L49-H88 WeakPolarHBondContact CD2-ND1 3.17Å
50	E	85.8	Confident	83.2	Confident	90 Å²	90	55.1 Å²	55.1	42%	0.421	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	111.8	170.8	-73.1	-153.9	116.2	0	0	110.9	K52 K87 V89	E50-K52 PolarHBondContact O-N 2.98Å; E50-K52 IonicContact OE2-NZ 2.93Å; E50-K52 PolarHBondContact OE2-NZ 3.25Å; E50-K87 HydrophobicContact CB-CB 4.03Å; E50-K87 PolarHBondContact N-O 3.17Å; E50-K87 PolarHBondContact O-N 2.93Å; E50-V89 HydrophobicContact CG-CG2 4.12Å
51	Y	82.1	Confident	82.9	Confident	27 Å²	27	53.8 Å²	53.8	11%	0.106	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	114.1	177.8	-63.4	-90.6	0	0	0	111.5	Q2 D31 L49 N81 K84 D85 V86	Q2-Y51 PolarHBondContact NE2-O 2.99Å; D31-Y51 PolarHBondContact O-OH 3.15Å; L49-Y51 HydrophobicContact CB-CE2 4.05Å; L49-Y51 HydrophobicContact CD1-CE2 4.47Å; Y51-N81 HydrophobicContact CD1-CB 4.46Å; Y51-K84 HydrophobicContact CD1-CB 4.42Å; Y51-D85 CarbonylContact C-O 3.55Å; Y51-D85 WeakPolarHBondContact CA-O 3.46Å; Y51-V86 HydrophobicContact CD1-CG2 3.69Å; Y51-V86 HydrophobicContact CE1-CG1 4.44Å; Y51-V86 HydrophobicContact CE1-CG2 3.53Å
52	K	81	Confident	82.7	Confident	84 Å²	84	54.9 Å²	54.9	37%	0.365	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136.1	174.8	-72.9	-167	170.6	68.9	0	110.8	E50 G54 K84 D85 K87	E50-K52 PolarHBondContact O-N 2.98Å; E50-K52 IonicContact OE2-NZ 2.93Å; E50-K52 PolarHBondContact OE2-NZ 3.25Å; K52-G54 PolarHBondContact O-N 3.44Å; K52-K84 CarbonylContact O-C 3.57Å; K52-K84 WeakPolarHBondContact O-CA 3.33Å; K52-K84 WeakPolarHBondContact O-CB 3.4Å; K52-D85 PolarHBondContact N-O 3.32Å; K52-D85 PolarHBondContact O-N 3.48Å; K52-K87 HydrophobicContact CD-CD 3.81Å; K52-K87 HydrophobicContact CG-CD 4.44Å
53	S	77.8	Confident	82.7	Confident	43 Å²	43	54.5 Å²	54.5	30%	0.301	30%	0.301	S	S	.	.			trans	-66.7	104.1	176.5	43.3	0	0	0	0	110
54	G	76	Confident	82.7	Confident	9 Å²	9	52.7 Å²	52.7	9%	0.093	29%	0.291	C	S	.	.			trans	-87	-175.7	176.6	0	0	0	0	0	113	K52 L56 T57 Y58 D85	K52-G54 PolarHBondContact O-N 3.44Å; G54-L56 PolarHBondContact O-N 3.11Å; G54-T57 WeakPolarHBondContact O-CB 3.47Å; G54-T57 PolarHBondContact O-N 3.41Å; G54-Y58 WeakPolarHBondContact O-CD2 3.45Å; G54-Y58 PolarHBondContact O-N 3.14Å; G54-D85 WeakPolarHBondContact CA-OD2 3.31Å
55	L	79.2	Confident	82.6	Confident	113 Å²	113	50.1 Å²	50.1	59%	0.592	28%	0.281	S	S	*	.	H	α-helix	trans	-53.3	-38.2	178	-176.2	61.7	0	0	0	112.2	T57 Y58 L59 L103	L55-T57 VanDerWaalsContact C-N 3.32Å; L55-T57 PolarHBondContact O-N 2.93Å; L55-Y58 WeakPolarHBondContact O-CB 3.45Å; L55-Y58 PolarHBondContact O-N 3.19Å; L55-Y58 VanDerWaalsContact O-N 3.11Å; L55-L59 HydrophobicContact CD1-CG 4.32Å; L55-L59 HydrophobicContact CD2-CD1 4.48Å; L55-L59 HydrophobicContact CG-CD1 4.04Å; L55-L59 HydrophobicContact CG-CG 4.14Å; L55-L59 WeakPolarHBondContact O-CG 3.5Å; L55-L59 PolarHBondContact O-N 2.83Å; L55-L103 HydrophobicContact CD2-CD2 4.19Å; L55-L103 HydrophobicContact CG-CD2 4.49Å
56	L	79.1	Confident	82.6	Confident	46 Å²	46	55.7 Å²	55.7	24%	0.241	31%	0.309	C	S	.	.	H	α-helix	trans	-58.5	-40.9	177.4	-179.8	62.3	0	0	0	112.8	G54 Y58 L59 A60 C83 R102	G54-L56 PolarHBondContact O-N 3.11Å; L56-Y58 VanDerWaalsContact C-N 3.31Å; L56-Y58 PolarHBondContact O-N 3.18Å; L56-L59 PolarHBondContact O-N 2.91Å; L56-A60 WeakPolarHBondContact O-CB 3.12Å; L56-A60 PolarHBondContact O-N 2.85Å; L56-C83 HydrophobicContact CD2-CB 4.2Å; L56-C83 HydrophobicContact CG-CB 4.11Å; L56-R102 HydrophobicContact CD2-CB 4.05Å
57	T	79.7	Confident	82.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-42.4	176.6	-55.8	0	0	0	0	110.5	G54 L55 C61 F78 C83	G54-T57 WeakPolarHBondContact O-CB 3.47Å; G54-T57 PolarHBondContact O-N 3.41Å; L55-T57 VanDerWaalsContact C-N 3.32Å; L55-T57 PolarHBondContact O-N 2.93Å; T57-C61 VanDerWaalsContact O-CB 3.3Å; T57-C61 WeakPolarHBondContact O-CB 3.35Å; T57-C61 PolarHBondContact O-N 3.44Å; T57-F78 HydrophobicContact CG2-CD1 4.24Å; T57-F78 HydrophobicContact CG2-CD2 4.17Å; T57-F78 HydrophobicContact CG2-CE1 4.18Å; T57-F78 HydrophobicContact CG2-CE2 4.12Å; T57-F78 HydrophobicContact CG2-CG 4.24Å; T57-F78 HydrophobicContact CG2-CZ 4.12Å; T57-C83 PolarHBondContact N-O 3.36Å; T57-C83 PolarHBondContact OG1-O 3.02Å
58	Y	81	Confident	81.8	Confident	138 Å²	138	62 Å²	62	54%	0.541	36%	0.359	S	S	.	.	H	α-helix	trans	-68.4	-42.6	177.3	-74.3	-82	0	0	0	112.6	G54 L55 L56 C61 C62	G54-Y58 WeakPolarHBondContact O-CD2 3.45Å; G54-Y58 PolarHBondContact O-N 3.14Å; L55-Y58 WeakPolarHBondContact O-CB 3.45Å; L55-Y58 PolarHBondContact O-N 3.19Å; L55-Y58 VanDerWaalsContact O-N 3.11Å; L56-Y58 VanDerWaalsContact C-N 3.31Å; L56-Y58 PolarHBondContact O-N 3.18Å; Y58-C61 WeakPolarHBondContact O-CB 3.41Å; Y58-C61 PolarHBondContact O-N 3.03Å; Y58-C62 VanDerWaalsContact O-CB 3.32Å; Y58-C62 WeakPolarHBondContact O-CB 3.34Å; Y58-C62 PolarHBondContact O-N 2.83Å
59	L	83.6	Confident	81.1	Confident	92 Å²	92	59.8 Å²	59.8	48%	0.482	35%	0.345	S	S	.	.	H	α-helix	trans	-63.3	-44	177.5	-72.1	178.7	0	0	0	111.6	L55 L56 C62 G63 L103	L55-L59 HydrophobicContact CD1-CG 4.32Å; L55-L59 HydrophobicContact CD2-CD1 4.48Å; L55-L59 HydrophobicContact CG-CD1 4.04Å; L55-L59 HydrophobicContact CG-CG 4.14Å; L55-L59 WeakPolarHBondContact O-CG 3.5Å; L55-L59 PolarHBondContact O-N 2.83Å; L56-L59 PolarHBondContact O-N 2.91Å; L59-C62 PolarHBondContact O-N 3.47Å; L59-G63 PolarHBondContact O-N 2.88Å; L59-L103 HydrophobicContact CD1-CD2 4.22Å
60	A	83	Confident	80.2	Confident	29 Å²	29	64.3 Å²	64.3	24%	0.24	37%	0.374	C	S	.	.	H	α-helix	trans	-65	-40.8	176.6	0	0	0	0	0	111.6	L56 G63 I64 P77	L56-A60 WeakPolarHBondContact O-CB 3.12Å; L56-A60 PolarHBondContact O-N 2.85Å; A60-G63 PolarHBondContact O-N 3.12Å; A60-I64 WeakPolarHBondContact O-CD1 3.3Å; A60-I64 VanDerWaalsContact O-CG1 3.29Å; A60-I64 WeakPolarHBondContact O-CG1 3.36Å; A60-I64 PolarHBondContact O-N 3.15Å; A60-P77 HydrophobicContact CB-CB 3.54Å; A60-P77 HydrophobicContact CB-CG 4.34Å
61	C	81.8	Confident	79.3	Confident	29 Å²	29	68.5 Å²	68.5	20%	0.196	40%	0.398	C	S	.	.	H	α-helix	trans	-58.9	-49.4	172.3	-175.4	0	0	0	0	111.6	T57 Y58 I64 C65 P77 F78	T57-C61 VanDerWaalsContact O-CB 3.3Å; T57-C61 WeakPolarHBondContact O-CB 3.35Å; T57-C61 PolarHBondContact O-N 3.44Å; Y58-C61 WeakPolarHBondContact O-CB 3.41Å; Y58-C61 PolarHBondContact O-N 3.03Å; C61-I64 PolarHBondContact O-N 3.29Å; C61-C65 VanDerWaalsContact O-CB 3.32Å; C61-C65 WeakPolarHBondContact O-CB 3.48Å; C61-C65 PolarHBondContact O-N 3.49Å; C61-C65 PolarHBondContact O-SG 2.83Å; C61-P77 HydrophobicContact CB-CG 3.92Å; C61-F78 HydrophobicContact CB-CE2 4.35Å
62	C	83.9	Confident	78.5	Confident	68 Å²	68	69.2 Å²	69.2	46%	0.459	41%	0.413	S	S	.	.	H	α-helix	trans	-60.2	-48.5	178	-171.2	0	0	0	0	111.5	Y58 L59 I64 C65 L66	Y58-C62 VanDerWaalsContact O-CB 3.32Å; Y58-C62 WeakPolarHBondContact O-CB 3.34Å; Y58-C62 PolarHBondContact O-N 2.83Å; L59-C62 PolarHBondContact O-N 3.47Å; C62-I64 PolarHBondContact O-N 2.78Å; C62-C65 CarbonylContact O-C 3.6Å; C62-C65 PolarHBondContact O-N 2.81Å; C62-C65 VanDerWaalsContact O-N 3.17Å; C62-L66 VanDerWaalsContact O-CG 3.31Å; C62-L66 WeakPolarHBondContact O-CG 3.19Å; C62-L66 PolarHBondContact O-N 3.34Å
63	G	85.1	Confident	77.8	Confident	33 Å²	33	67.9 Å²	67.9	34%	0.34	41%	0.414	S	S	.	.	H	α-helix	trans	-58.7	-44.5	178.4	0	0	0	0	0	112.7	L59 A60 L66 V67	L59-G63 PolarHBondContact O-N 2.88Å; A60-G63 PolarHBondContact O-N 3.12Å; G63-L66 PolarHBondContact O-N 3.4Å; G63-V67 VanDerWaalsContact O-CG2 3.27Å; G63-V67 WeakPolarHBondContact O-CG2 3.23Å; G63-V67 PolarHBondContact O-N 3.5Å; G63-V67 VanDerWaalsContact O-N 3.1Å
64	I	84.1	Confident	77.3	Confident	48 Å²	48	66.7 Å²	66.7	25%	0.246	41%	0.406	C	S	.	.	H	α-helix	trans	-66.5	-40.2	177	-67.5	163.6	0	0	0	111.2	A60 C61 C62 L66 V67 G69 C73 P77	A60-I64 WeakPolarHBondContact O-CD1 3.3Å; A60-I64 VanDerWaalsContact O-CG1 3.29Å; A60-I64 WeakPolarHBondContact O-CG1 3.36Å; A60-I64 PolarHBondContact O-N 3.15Å; C61-I64 PolarHBondContact O-N 3.29Å; C62-I64 PolarHBondContact O-N 2.78Å; I64-L66 VanDerWaalsContact C-N 3.33Å; I64-L66 PolarHBondContact O-N 3.46Å; I64-V67 PolarHBondContact O-N 2.87Å; I64-G69 WeakPolarHBondContact O-CA 3.37Å; I64-G69 PolarHBondContact O-N 3.46Å; I64-C73 VanDerWaalsContact CG2-C 3.49Å; I64-C73 HydrophobicContact CG2-CB 3.48Å; I64-C73 VanDerWaalsContact CG2-CB 3.48Å; I64-P77 HydrophobicContact CD1-CB 4.47Å; I64-P77 HydrophobicContact CD1-CG 3.88Å
65	C	83.3	Confident	76.8	Confident	51 Å²	51	71.7 Å²	71.7	35%	0.345	43%	0.43	S	S	.	.	H	α-helix	trans	-65	-36.3	176.9	-80.1	0	0	0	0	111.7	C61 C62 G68 C74	C61-C65 VanDerWaalsContact O-CB 3.32Å; C61-C65 WeakPolarHBondContact O-CB 3.48Å; C61-C65 PolarHBondContact O-N 3.49Å; C61-C65 PolarHBondContact O-SG 2.83Å; C62-C65 CarbonylContact O-C 3.6Å; C62-C65 PolarHBondContact O-N 2.81Å; C62-C65 VanDerWaalsContact O-N 3.17Å; C65-G68 PolarHBondContact O-N 3.06Å; C65-C74 WeakPolarHBondContact CA-SG 3.42Å; C65-C74 WeakPolarHBondContact CB-SG 3.39Å; C65-C74 PolarHBondContact N-SG 3.12Å; C65-C74 WeakPolarHBondContact SG-CB 3.41Å; C65-C74 CovalentContact SG-SG 2.07Å; C65-C74 PolarHBondContact SG-SG 3.33Å
66	L	83.6	Confident	76.5	Confident	142 Å²	142	70.9 Å²	70.9	74%	0.743	43%	0.425	S	S	*	.	H	α-helix	trans	-69.2	-33	175.8	-71.8	175.9	0	0	0	113.5	C62 G63 I64 G68	C62-L66 VanDerWaalsContact O-CG 3.31Å; C62-L66 WeakPolarHBondContact O-CG 3.19Å; C62-L66 PolarHBondContact O-N 3.34Å; G63-L66 PolarHBondContact O-N 3.4Å; I64-L66 VanDerWaalsContact C-N 3.33Å; I64-L66 PolarHBondContact O-N 3.46Å; L66-G68 PolarHBondContact O-N 3.03Å
67	V	82.2	Confident	75.8	Confident	131 Å²	131	69 Å²	69	79%	0.794	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	4.6	179.2	180	0	0	0	0	112.2	G63 I64	G63-V67 VanDerWaalsContact O-CG2 3.27Å; G63-V67 WeakPolarHBondContact O-CG2 3.23Å; G63-V67 PolarHBondContact O-N 3.5Å; G63-V67 VanDerWaalsContact O-N 3.1Å; I64-V67 PolarHBondContact O-N 2.87Å
68	G	72.5	Confident	75.2	Confident	51 Å²	51	73 Å²	73	53%	0.526	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.7	12.8	178.3	0	0	0	0	0	114.3	C65 L66 V70	C65-G68 PolarHBondContact O-N 3.06Å; L66-G68 PolarHBondContact O-N 3.03Å; G68-V70 PolarHBondContact O-N 2.82Å
69	G	71.8	Confident	74.4	Confident	12 Å²	12	70.9 Å²	70.9	12%	0.124	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	30.6	179.5	0	0	0	0	0	115.7	I64 L71 C73 C74	I64-G69 WeakPolarHBondContact O-CA 3.37Å; I64-G69 PolarHBondContact O-N 3.46Å; G69-L71 VanDerWaalsContact C-N 3.28Å; G69-L71 PolarHBondContact O-N 2.85Å; G69-C73 WeakPolarHBondContact O-CB 3.4Å; G69-C73 PolarHBondContact O-N 2.92Å; G69-C74 PolarHBondContact O-N 3.08Å; G69-C74 PolarHBondContact O-SG 3.12Å
70	V	66.7	Low	73.6	Confident	114 Å²	114	69.2 Å²	69.2	69%	0.691	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-17.1	-178.6	-88	0	0	0	0	113.8	G68 G72	G68-V70 PolarHBondContact O-N 2.82Å; V70-G72 PolarHBondContact O-N 3.48Å
71	L	67.3	Low	72.7	Confident	178 Å²	178	70.5 Å²	70.5	93%	0.932	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	32.3	177.4	-69.2	170	0	0	0	113.9	G69	G69-L71 VanDerWaalsContact C-N 3.28Å; G69-L71 PolarHBondContact O-N 2.85Å
72	G	65	Low	72	Confident	42 Å²	42	72.7 Å²	72.7	43%	0.433	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.6	-7.6	174.2	0	0	0	0	0	116	V70 C74 L75	V70-G72 PolarHBondContact O-N 3.48Å; G72-C74 VanDerWaalsContact C-N 3.3Å; G72-C74 PolarHBondContact O-N 3.06Å; G72-L75 PolarHBondContact O-N 3.13Å
73	C	68.2	Low	71.1	Confident	57 Å²	57	70.6 Å²	70.6	39%	0.385	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-70.6	-25.2	178.5	-58.6	0	0	0	0	112.7	I64 G69 L75 I76	I64-C73 VanDerWaalsContact CG2-C 3.49Å; I64-C73 HydrophobicContact CG2-CB 3.48Å; I64-C73 VanDerWaalsContact CG2-CB 3.48Å; G69-C73 WeakPolarHBondContact O-CB 3.4Å; G69-C73 PolarHBondContact O-N 2.92Å; C73-L75 PolarHBondContact O-N 3.07Å; C73-I76 HydrophobicContact CB-CD1 4.01Å; C73-I76 WeakPolarHBondContact O-CB 3.04Å; C73-I76 VanDerWaalsContact O-CG1 3.27Å; C73-I76 WeakPolarHBondContact O-CG1 3.14Å; C73-I76 PolarHBondContact O-N 3.22Å
74	C	65.5	Low	70.6	Confident	18 Å²	18	69.5 Å²	69.5	12%	0.122	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-64.6	-9.3	175.5	-59.7	0	0	0	0	113.5	C65 G69 G72 P77	C65-C74 WeakPolarHBondContact CA-SG 3.42Å; C65-C74 WeakPolarHBondContact CB-SG 3.39Å; C65-C74 PolarHBondContact N-SG 3.12Å; C65-C74 WeakPolarHBondContact SG-CB 3.41Å; C65-C74 CovalentContact SG-SG 2.07Å; C65-C74 PolarHBondContact SG-SG 3.33Å; G69-C74 PolarHBondContact O-N 3.08Å; G69-C74 PolarHBondContact O-SG 3.12Å; G72-C74 VanDerWaalsContact C-N 3.3Å; G72-C74 PolarHBondContact O-N 3.06Å; C74-P77 VanDerWaalsContact O-CD 3.32Å; C74-P77 WeakPolarHBondContact O-CD 3.37Å; C74-P77 WeakPolarHBondContact O-CG 3.33Å
75	L	66.5	Low	70.5	Confident	114 Å²	114	68.2 Å²	68.2	60%	0.597	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-81.5	-22.5	170	-83.3	88.3	0	0	0	113.9	G72 C73 P77 F78 C79	G72-L75 PolarHBondContact O-N 3.13Å; C73-L75 PolarHBondContact O-N 3.07Å; L75-P77 VanDerWaalsContact C-CD 3.49Å; L75-F78 CarbonylContact O-C 3.58Å; L75-F78 WeakPolarHBondContact O-CA 3.16Å; L75-F78 WeakPolarHBondContact O-CB 3.37Å; L75-F78 PolarHBondContact O-N 2.97Å; L75-C79 PolarHBondContact O-N 3.44Å; L75-C79 PolarHBondContact O-SG 3.02Å
76	I	72.5	Confident	70.5	Confident	96 Å²	96	65.8 Å²	65.8	49%	0.492	40%	0.398	S	S	.	.	H	α-helix	trans	-52	-49.3	178.1	-58.4	169.1	0	0	0	111.9	C73 F78 C79 V80	C73-I76 HydrophobicContact CB-CD1 4.01Å; C73-I76 WeakPolarHBondContact O-CB 3.04Å; C73-I76 VanDerWaalsContact O-CG1 3.27Å; C73-I76 WeakPolarHBondContact O-CG1 3.14Å; C73-I76 PolarHBondContact O-N 3.22Å; I76-F78 PolarHBondContact O-N 2.07Å; I76-C79 WeakPolarHBondContact O-CB 3.28Å; I76-C79 PolarHBondContact O-N 3.22Å; I76-V80 HydrophobicContact CG2-CG2 4.17Å; I76-V80 VanDerWaalsContact O-CG2 3.31Å; I76-V80 WeakPolarHBondContact O-CG2 2.84Å; I76-V80 PolarHBondContact O-N 3.27Å
77	P	65.4	Low	70.7	Confident	5 Å²	5	62.4 Å²	62.4	3%	0.032	38%	0.378	C	S	.	.	H	α-helix	trans	-69	-23	-179.6	26.9	-35	0	0	0	112.8	A60 C61 I64 C74 L75	A60-P77 HydrophobicContact CB-CB 3.54Å; A60-P77 HydrophobicContact CB-CG 4.34Å; C61-P77 HydrophobicContact CB-CG 3.92Å; I64-P77 HydrophobicContact CD1-CB 4.47Å; I64-P77 HydrophobicContact CD1-CG 3.88Å; C74-P77 VanDerWaalsContact O-CD 3.32Å; C74-P77 WeakPolarHBondContact O-CD 3.37Å; C74-P77 WeakPolarHBondContact O-CG 3.33Å; L75-P77 VanDerWaalsContact C-CD 3.49Å
78	F	66.2	Low	71	Confident	84 Å²	84	56.2 Å²	56.2	37%	0.368	34%	0.34	S	S	.	.	H	α-helix	trans	-76.3	-31.8	171.7	-91.5	-87	0	0	0	112.8	T57 C61 L75 I76 K84	T57-F78 HydrophobicContact CG2-CD1 4.24Å; T57-F78 HydrophobicContact CG2-CD2 4.17Å; T57-F78 HydrophobicContact CG2-CE1 4.18Å; T57-F78 HydrophobicContact CG2-CE2 4.12Å; T57-F78 HydrophobicContact CG2-CG 4.24Å; T57-F78 HydrophobicContact CG2-CZ 4.12Å; C61-F78 HydrophobicContact CB-CE2 4.35Å; L75-F78 CarbonylContact O-C 3.58Å; L75-F78 WeakPolarHBondContact O-CA 3.16Å; L75-F78 WeakPolarHBondContact O-CB 3.37Å; L75-F78 PolarHBondContact O-N 2.97Å; I76-F78 PolarHBondContact O-N 2.07Å; F78-K84 VanDerWaalsContact O-CE 3.23Å; F78-K84 WeakPolarHBondContact O-CE 3.32Å; F78-K84 PolarHBondContact O-NZ 3.27Å
79	C	64.7	Low	71.8	Confident	95 Å²	95	54.8 Å²	54.8	64%	0.642	32%	0.321	S	S	*	.	H	α-helix	trans	-77.2	-30	175.4	-73.1	0	0	0	0	112.7	L75 I76 N81	L75-C79 PolarHBondContact O-N 3.44Å; L75-C79 PolarHBondContact O-SG 3.02Å; I76-C79 WeakPolarHBondContact O-CB 3.28Å; I76-C79 PolarHBondContact O-N 3.22Å; C79-N81 PolarHBondContact O-N 3.25Å; C79-N81 VanDerWaalsContact O-N 3.16Å
80	V	66.9	Low	72.7	Confident	57 Å²	57	54.2 Å²	54.2	35%	0.345	32%	0.315	S	S	.	.			trans	-81	100.7	-179.9	178.8	0	0	0	0	109.5	I76 S82 C83	I76-V80 HydrophobicContact CG2-CG2 4.17Å; I76-V80 VanDerWaalsContact O-CG2 3.31Å; I76-V80 WeakPolarHBondContact O-CG2 2.84Å; I76-V80 PolarHBondContact O-N 3.27Å; V80-S82 PolarHBondContact O-N 2.99Å; V80-S82 VanDerWaalsContact O-N 3.12Å; V80-C83 PolarHBondContact O-N 2.89Å
81	N	64	Low	73.6	Confident	56 Å²	56	52.2 Å²	52.2	30%	0.299	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-59	-21.3	173.7	-69.7	-50.6	0	0	0	112.9	Y51 C79 C83 K84	Y51-N81 HydrophobicContact CD1-CB 4.46Å; C79-N81 PolarHBondContact O-N 3.25Å; C79-N81 VanDerWaalsContact O-N 3.16Å; N81-C83 PolarHBondContact O-N 3.35Å; N81-C83 VanDerWaalsContact O-N 3.12Å; N81-K84 PolarHBondContact O-N 3.1Å; N81-K84 VanDerWaalsContact O-N 3.08Å
82	S	65.9	Low	74.6	Confident	75 Å²	75	49.8 Å²	49.8	52%	0.524	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-66.2	-6.4	173.9	-57.4	0	0	0	0	114.4	V80 R102	V80-S82 PolarHBondContact O-N 2.99Å; V80-S82 VanDerWaalsContact O-N 3.12Å; S82-R102 WeakPolarHBondContact O-CD 3.27Å; S82-R102 PolarHBondContact O-NE 3.18Å; S82-R102 VanDerWaalsContact O-NE 3.12Å
83	C	66.1	Low	75.8	Confident	23 Å²	23	49.8 Å²	49.8	16%	0.155	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-102	-2	173.5	-61.7	0	0	0	0	113.3	L56 T57 V80 N81	L56-C83 HydrophobicContact CD2-CB 4.2Å; L56-C83 HydrophobicContact CG-CB 4.11Å; T57-C83 PolarHBondContact N-O 3.36Å; T57-C83 PolarHBondContact OG1-O 3.02Å; V80-C83 PolarHBondContact O-N 2.89Å; N81-C83 PolarHBondContact O-N 3.35Å; N81-C83 VanDerWaalsContact O-N 3.12Å
84	K	75.3	Confident	76.8	Confident	11 Å²	11	54.9 Å²	54.9	5%	0.048	30%	0.299	C	S	.	.	S	Bend	trans	-97.7	143.6	-177.4	-62.3	178.8	-167.2	-75.9	0	110	Y51 K52 F78 N81 R102	Y51-K84 HydrophobicContact CD1-CB 4.42Å; K52-K84 CarbonylContact O-C 3.57Å; K52-K84 WeakPolarHBondContact O-CA 3.33Å; K52-K84 WeakPolarHBondContact O-CB 3.4Å; F78-K84 VanDerWaalsContact O-CE 3.23Å; F78-K84 WeakPolarHBondContact O-CE 3.32Å; F78-K84 PolarHBondContact O-NZ 3.27Å; N81-K84 PolarHBondContact O-N 3.1Å; N81-K84 VanDerWaalsContact O-N 3.08Å; K84-R102 VanDerWaalsContact O-CD 3.28Å; K84-R102 WeakPolarHBondContact O-CD 3.33Å; K84-R102 PolarHBondContact O-NE 3.41Å
85	D	81.7	Confident	77.9	Confident	21 Å²	21	61.3 Å²	61.3	11%	0.112	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	149.1	172	-61.5	-40.5	0	0	0	109.5	Y51 K52 G54 H101 R102	Y51-D85 CarbonylContact C-O 3.55Å; Y51-D85 WeakPolarHBondContact CA-O 3.46Å; K52-D85 PolarHBondContact N-O 3.32Å; K52-D85 PolarHBondContact O-N 3.48Å; G54-D85 WeakPolarHBondContact CA-OD2 3.31Å; D85-H101 WeakPolarHBondContact OD1-CA 3.3Å; D85-H101 IonicContact OD1-ND1 3.83Å; D85-H101 IonicContact OD2-ND1 3.61Å; D85-R102 PolarHBondContact OD1-N 2.83Å
86	V	83.4	Confident	78.9	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	110.9	-173.2	-175.2	0	0	0	0	109.1	D31 L49 Y51 T99 Y100	D31-V86 HydrophobicContact CB-CG2 4.38Å; L49-V86 HydrophobicContact CB-CG1 3.98Å; L49-V86 HydrophobicContact CD1-CG1 4.03Å; L49-V86 HydrophobicContact CD2-CG1 3.64Å; L49-V86 HydrophobicContact CG-CG1 4.09Å; Y51-V86 HydrophobicContact CD1-CG2 3.69Å; Y51-V86 HydrophobicContact CE1-CG1 4.44Å; Y51-V86 HydrophobicContact CE1-CG2 3.53Å; V86-T99 CarbonylContact O-C 3.55Å; V86-T99 WeakPolarHBondContact O-CA 3.5Å; V86-Y100 HydrophobicContact CB-CD1 4.35Å; V86-Y100 HydrophobicContact CG2-CD1 4.29Å; V86-Y100 PolarHBondContact N-O 3.39Å; V86-Y100 PolarHBondContact O-N 3.41Å
87	K	88	Confident	79.6	Confident	71 Å²	71	56 Å²	56	31%	0.309	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	124.7	174.7	-67.5	-170.3	175.5	-173.4	0	109.6	E50 K52 T99	E50-K87 HydrophobicContact CB-CB 4.03Å; E50-K87 PolarHBondContact N-O 3.17Å; E50-K87 PolarHBondContact O-N 2.93Å; K52-K87 HydrophobicContact CD-CD 3.81Å; K52-K87 HydrophobicContact CG-CD 4.44Å; K87-T99 HydrophobicContact CG-CG2 3.74Å
88	H	87.5	Confident	80.6	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.3	174.7	-68.3	-106.5	0	0	0	109.2	F29 S30 M32 T47 S48 L49 A96 V97 G98	F29-H88 HydrophobicContact CD1-CB 3.99Å; F29-H88 AromaticContact CD1-CD2 3.52Å; F29-H88 AromaticContact CD1-CE1 3.99Å; F29-H88 AromaticContact CD1-CG 3.56Å; F29-H88 AromaticContact CD1-ND1 3.88Å; F29-H88 AromaticContact CD1-NE2 3.79Å; F29-H88 HydrophobicContact CE1-CB 4.08Å; S30-H88 PolarHBondContact O-CE1 3.4Å; S30-H88 PolarHBondContact O-NE2 3.39Å; M32-H88 PolarHBondContact O-CE1 2.93Å; M32-H88 VanDerWaalsContact O-CE1 3.25Å; T47-H88 HydrophobicContact CG2-CB 4.18Å; T47-H88 PolarHBondContact OG1-ND1 3.45Å; S48-H88 CarbonylContact O-C 3.53Å; S48-H88 WeakPolarHBondContact O-CA 3.33Å; L49-H88 WeakPolarHBondContact CD2-CE1 3.32Å; L49-H88 VanDerWaalsContact CD2-ND1 3.34Å; L49-H88 WeakPolarHBondContact CD2-ND1 3.17Å; H88-A96 CarbonylContact O-C 3.59Å; H88-A96 WeakPolarHBondContact O-CA 3.35Å; H88-V97 HydrophobicContact CB-CG2 3.76Å; H88-V97 WeakPolarHBondContact O-CG2 3.29Å; H88-V97 PolarHBondContact O-N 3.3Å; H88-G98 WeakPolarHBondContact CB-O 3.44Å; H88-G98 PolarHBondContact N-O 3.28Å
89	V	90.1	Very high	81.5	Confident	21 Å²	21	54.8 Å²	54.8	13%	0.127	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.4	-177.8	-176.8	0	0	0	0	109.6	S48 E50 Q94	S48-V89 PolarHBondContact N-O 2.91Å; S48-V89 PolarHBondContact O-N 3.02Å; E50-V89 HydrophobicContact CG-CG2 4.12Å; V89-Q94 WeakPolarHBondContact CG1-O 3.42Å
90	C	89	Confident	82.4	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.29	C	S	.	.			trans	-70.4	122.5	174.8	175.2	0	0	0	0	110.1	C38 T45 H92 C93 Q94 R95 V97	C38-C90 VanDerWaalsContact SG-SG 3.69Å; T45-C90 VanDerWaalsContact CG2-SG 3.58Å; C90-H92 PolarHBondContact O-N 3.05Å; C90-C93 VanDerWaalsContact CB-SG 3.51Å; C90-C93 PolarHBondContact SG-SG 2.9Å; C90-Q94 WeakPolarHBondContact O-CA 3.23Å; C90-Q94 PolarHBondContact O-N 3.16Å; C90-R95 PolarHBondContact N-O 3.3Å; C90-V97 HydrophobicContact CB-CG1 4.21Å
91	P	87.2	Confident	83.1	Confident	72 Å²	72	54.8 Å²	54.8	47%	0.468	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.8	-179.5	28.7	-36.1	0	0	0	113.3	T45 L46	T45-P91 HydrophobicContact CG2-CG 4.44Å; T45-P91 WeakPolarHBondContact OG1-CG 3.19Å; L46-P91 VanDerWaalsContact O-CD 3.23Å; L46-P91 WeakPolarHBondContact O-CD 3.35Å; L46-P91 WeakPolarHBondContact O-CG 3.32Å
92	H	88.1	Confident	83.6	Confident	128 Å²	128	55 Å²	55	59%	0.593	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-45.9	-178.5	-170.8	-77.6	0	0	0	112.9	C90	C90-H92 PolarHBondContact O-N 3.05Å
93	C	89.8	Confident	83.8	Confident	42 Å²	42	55.3 Å²	55.3	28%	0.284	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-2.8	-179.6	66	0	0	0	0	114	C38 C41 C90 R95	C38-C93 VanDerWaalsContact SG-SG 3.7Å; C41-C93 HydrophobicContact CB-CB 4.16Å; C90-C93 VanDerWaalsContact CB-SG 3.51Å; C90-C93 PolarHBondContact SG-SG 2.9Å; C93-R95 PolarHBondContact O-N 3.47Å
94	Q	88.8	Confident	83.4	Confident	164 Å²	164	58 Å²	58	77%	0.766	32%	0.315	S	S	*	.			trans	56.7	18.3	-177.9	-60.4	-175.7	-31.5	0	0	114.7	V89 C90	V89-Q94 WeakPolarHBondContact CG1-O 3.42Å; C90-Q94 WeakPolarHBondContact O-CA 3.23Å; C90-Q94 PolarHBondContact O-N 3.16Å
95	R	88.9	Confident	81.9	Confident	153 Å²	153	66.7 Å²	66.7	58%	0.577	36%	0.362	S	S	*	.			trans	-87.7	140.6	174.4	-73.2	-175.8	176.4	-166.6	0.9	111.7	S40 C90 C93 V97	S40-R95 VanDerWaalsContact CB-CD 3.46Å; S40-R95 WeakPolarHBondContact OG-CD 3.46Å; S40-R95 PolarHBondContact OG-NH1 3.07Å; S40-R95 VanDerWaalsContact OG-NH1 3.11Å; C90-R95 PolarHBondContact N-O 3.3Å; C93-R95 PolarHBondContact O-N 3.47Å; R95-V97 PolarHBondContact O-N 3.01Å
96	A	87.9	Confident	82	Confident	69 Å²	69	69 Å²	69	57%	0.57	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	127.8	171.3	0	0	0	0	0	109.9	H88	H88-A96 CarbonylContact O-C 3.59Å; H88-A96 WeakPolarHBondContact O-CA 3.35Å
97	V	87.3	Confident	81.9	Confident	30 Å²	30	72.6 Å²	72.6	18%	0.182	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-20.5	-180	-67.2	0	0	0	0	112.2	F29 L36 T47 H88 C90 R95	F29-V97 HydrophobicContact CE1-CG2 4.23Å; F29-V97 WeakPolarHBondContact CZ-O 3.27Å; L36-V97 HydrophobicContact CD1-CB 4.22Å; L36-V97 HydrophobicContact CD1-CG1 4.22Å; L36-V97 HydrophobicContact CD1-CG2 4.36Å; L36-V97 HydrophobicContact CD2-CB 4.28Å; L36-V97 HydrophobicContact CD2-CG2 3.83Å; T47-V97 HydrophobicContact CG2-CG2 3.41Å; T47-V97 VanDerWaalsContact CG2-CG2 3.41Å; H88-V97 HydrophobicContact CB-CG2 3.76Å; H88-V97 WeakPolarHBondContact O-CG2 3.29Å; H88-V97 PolarHBondContact O-N 3.3Å; C90-V97 HydrophobicContact CB-CG1 4.21Å; R95-V97 PolarHBondContact O-N 3.01Å
98	G	85.2	Confident	81.5	Confident	14 Å²	14	72.7 Å²	72.7	14%	0.144	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	160	175.7	0	0	0	0	0	111.5	H88	H88-G98 WeakPolarHBondContact CB-O 3.44Å; H88-G98 PolarHBondContact N-O 3.28Å
99	T	84.7	Confident	81.2	Confident	49 Å²	49	77 Å²	77	30%	0.301	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125.6	170.5	-55.7	0	0	0	0	108.3	V86 K87 H101	V86-T99 CarbonylContact O-C 3.55Å; V86-T99 WeakPolarHBondContact O-CA 3.5Å; K87-T99 HydrophobicContact CG-CG2 3.74Å; T99-H101 VanDerWaalsContact CG2-CE1 3.47Å; T99-H101 WeakPolarHBondContact CG2-CE1 3.29Å; T99-H101 WeakPolarHBondContact CG2-NE2 3.47Å
100	Y	84.1	Confident	80.6	Confident	74 Å²	74	80.5 Å²	80.5	29%	0.29	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	104.6	171.2	175.9	-111.4	0	0	0	108.6	F29 V86 R102	F29-Y100 WeakPolarHBondContact O-CD2 3.31Å; V86-Y100 HydrophobicContact CB-CD1 4.35Å; V86-Y100 HydrophobicContact CG2-CD1 4.29Å; V86-Y100 PolarHBondContact N-O 3.39Å; V86-Y100 PolarHBondContact O-N 3.41Å; Y100-R102 HydrophobicContact CD1-CG 4.24Å; Y100-R102 HydrophobicContact CE1-CG 3.81Å
101	H	81.9	Confident	80.1	Confident	78 Å²	78	85.9 Å²	85.9	36%	0.361	47%	0.47	S	S	.	.			trans	-84.8	122.8	172	-64.2	-73.6	0	0	0	108.8	D85 T99 L103 N105	D85-H101 WeakPolarHBondContact OD1-CA 3.3Å; D85-H101 IonicContact OD1-ND1 3.83Å; D85-H101 IonicContact OD2-ND1 3.61Å; T99-H101 VanDerWaalsContact CG2-CE1 3.47Å; T99-H101 WeakPolarHBondContact CG2-CE1 3.29Å; T99-H101 WeakPolarHBondContact CG2-NE2 3.47Å; H101-L103 PolarHBondContact O-N 3Å; H101-N105 PolarHBondContact CD2-OXT 3.06Å; H101-N105 VanDerWaalsContact CD2-OXT 3.3Å
102	R	74.4	Confident	79.6	Confident	59 Å²	59	86.9 Å²	86.9	22%	0.223	47%	0.47	C	S	.	.	S	Bend	trans	-72.7	-23.7	178.2	-64.9	-171.8	-179.7	-94.5	5	112.2	L56 S82 K84 D85 Y100	L56-R102 HydrophobicContact CD2-CB 4.05Å; S82-R102 WeakPolarHBondContact O-CD 3.27Å; S82-R102 PolarHBondContact O-NE 3.18Å; S82-R102 VanDerWaalsContact O-NE 3.12Å; K84-R102 VanDerWaalsContact O-CD 3.28Å; K84-R102 WeakPolarHBondContact O-CD 3.33Å; K84-R102 PolarHBondContact O-NE 3.41Å; D85-R102 PolarHBondContact OD1-N 2.83Å; Y100-R102 HydrophobicContact CD1-CG 4.24Å; Y100-R102 HydrophobicContact CE1-CG 3.81Å
103	L	70.4	Confident	78.9	Confident	83 Å²	83	83.7 Å²	83.7	44%	0.435	46%	0.461	S	S	.	.	S	Bend	trans	-109.7	108	172.8	-154.9	70.6	0	0	0	106.8	L55 L59 H101 N105	L55-L103 HydrophobicContact CD2-CD2 4.19Å; L55-L103 HydrophobicContact CG-CD2 4.49Å; L59-L103 HydrophobicContact CD1-CD2 4.22Å; H101-L103 PolarHBondContact O-N 3Å; L103-N105 PolarHBondContact O-N 3.49Å
104	G	57.2	Low	78	Confident	80 Å²	80	87.2 Å²	87.2	83%	0.825	48%	0.476	S	S	*	.			trans	-58.3	107.6	-166.3	0	0	0	0	0	114
105	N	45.1	Very low	77	Confident	193 Å²	193	80.2 Å²	80.2	100%	1.032	45%	0.449	S	S	*	.			trans	-152.8	0	156.5	-161.6	99.9	0	0	0	108.1	H101 L103	H101-N105 PolarHBondContact CD2-OXT 3.06Å; H101-N105 VanDerWaalsContact CD2-OXT 3.3Å; L103-N105 PolarHBondContact O-N 3.49Å

Retrieved 105 of 105 residues in 27.8 ms (Link to these results)

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