A0A077ZKL1_TRITR Loading...

DUF5641 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZKL1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 124 aa.

						>A0A077ZKL1_TRITR|A0A077ZKL1
MTALCYVENLLNGRPLACASLETREVEVLTPHHLLTGRSQPNFPPDVMSHLSLDVESGRRTSGMSVGDVVVLVDSNTPRGSWPLGRISTVYSGKDGVVRSADEALALITTRRSVNKLLLLQAAD
					

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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	50.1	Low	55.3	Low	221 Å²	221	109.6 Å²	109.6	100%	1.089	59%	0.585	S	S	*	*				0	66.4	0	-173.9	172.1	159	0	0	106.9
2	T	56.1	Low	55.6	Low	98 Å²	98	104.4 Å²	104.4	60%	0.601	56%	0.558	S	S	*	*			trans	-129.7	-22.6	-155	-32.8	0	0	0	0	112.3	C5	T2-C5 PolarHBondContact O-SG 3.14Å; T2-C5 VanDerWaalsContact O-SG 3.37Å
3	A	53.9	Low	55.7	Low	75 Å²	75	100.9 Å²	100.9	62%	0.62	56%	0.561	S	S	*	*	H	α-helix	trans	-73.4	-36.3	177.3	0	0	0	0	0	113.1	V7	A3-V7 VanDerWaalsContact O-CG2 3.23Å; A3-V7 WeakPolarHBondContact O-CG2 3.19Å; A3-V7 PolarHBondContact O-N 3.1Å
4	L	55.2	Low	55.5	Low	143 Å²	143	104.4 Å²	104.4	75%	0.749	56%	0.561	S	S	*	*	H	α-helix	trans	-75.9	-34.7	-176.5	-70.1	176.7	0	0	0	113.1	V7 E8	L4-V7 PolarHBondContact O-N 2.94Å; L4-E8 VanDerWaalsContact O-CB 3.27Å; L4-E8 WeakPolarHBondContact O-CB 3.44Å; L4-E8 PolarHBondContact O-N 3.45Å
5	C	51.5	Low	55.2	Low	62 Å²	62	102.6 Å²	102.6	42%	0.419	56%	0.558	S	S	.	*	H	α-helix	trans	-71	-35.7	177.6	70.1	0	0	0	0	112.2	T2 E8 N9	T2-C5 PolarHBondContact O-SG 3.14Å; T2-C5 VanDerWaalsContact O-SG 3.37Å; C5-E8 PolarHBondContact O-N 2.72Å; C5-N9 WeakPolarHBondContact O-CB 3.37Å; C5-N9 PolarHBondContact O-N 3.35Å; C5-N9 PolarHBondContact O-ND2 3.21Å
6	Y	50.6	Low	55.2	Low	164 Å²	164	102.8 Å²	102.8	64%	0.643	56%	0.558	S	S	*	*	H	α-helix	trans	-64.2	-45.8	174.9	-176	-98.6	0	0	0	110.8	N9 L10	Y6-N9 PolarHBondContact O-N 2.8Å; Y6-L10 HydrophobicContact CE1-CD1 4.33Å; Y6-L10 VanDerWaalsContact O-CB 3.3Å; Y6-L10 WeakPolarHBondContact O-CB 3.31Å; Y6-L10 PolarHBondContact O-N 2.65Å
7	V	57.3	Low	55.1	Low	67 Å²	67	99.8 Å²	99.8	41%	0.406	55%	0.55	S	S	.	*	H	α-helix	trans	-65.5	-40.8	176.4	173.3	0	0	0	0	111.3	A3 L4 L10 L11	A3-V7 VanDerWaalsContact O-CG2 3.23Å; A3-V7 WeakPolarHBondContact O-CG2 3.19Å; A3-V7 PolarHBondContact O-N 3.1Å; L4-V7 PolarHBondContact O-N 2.94Å; V7-L10 PolarHBondContact O-N 2.92Å; V7-L11 HydrophobicContact CG1-CD1 3.62Å; V7-L11 HydrophobicContact CG1-CG 4.08Å; V7-L11 VanDerWaalsContact O-CB 3.32Å; V7-L11 WeakPolarHBondContact O-CB 3.36Å; V7-L11 VanDerWaalsContact O-CG 3.23Å; V7-L11 WeakPolarHBondContact O-CG 3.4Å; V7-L11 PolarHBondContact O-N 3.44Å
8	E	59.9	Low	54.4	Low	118 Å²	118	101.7 Å²	101.7	55%	0.551	57%	0.569	S	S	*	*	H	α-helix	trans	-62.7	-44.7	176.8	-176.5	176.2	-174.3	0	0	111.9	L4 C5 L10 L11 N12	L4-E8 VanDerWaalsContact O-CB 3.27Å; L4-E8 WeakPolarHBondContact O-CB 3.44Å; L4-E8 PolarHBondContact O-N 3.45Å; C5-E8 PolarHBondContact O-N 2.72Å; E8-L10 VanDerWaalsContact C-N 3.34Å; E8-L10 PolarHBondContact O-N 2.75Å; E8-L11 PolarHBondContact O-N 3.43Å; E8-N12 WeakPolarHBondContact CG-ND2 3.38Å; E8-N12 WeakPolarHBondContact O-CB 3.09Å; E8-N12 VanDerWaalsContact O-CG 3.25Å; E8-N12 PolarHBondContact O-N 3.45Å; E8-N12 PolarHBondContact O-ND2 3.07Å
9	N	56.1	Low	54.1	Low	91 Å²	91	100.6 Å²	100.6	49%	0.487	58%	0.575	S	S	.	*	H	α-helix	trans	-63.5	-40.3	174.6	-83.9	-35	0	0	0	111.9	C5 Y6 G13	C5-N9 WeakPolarHBondContact O-CB 3.37Å; C5-N9 PolarHBondContact O-N 3.35Å; C5-N9 PolarHBondContact O-ND2 3.21Å; Y6-N9 PolarHBondContact O-N 2.8Å; N9-G13 PolarHBondContact O-N 2.69Å
10	L	59	Low	53.3	Low	61 Å²	61	99.5 Å²	99.5	32%	0.319	57%	0.573	S	S	.	*	H	α-helix	trans	-66.9	-40	178.1	-160.1	99.9	0	0	0	112.2	Y6 V7 E8 R14	Y6-L10 HydrophobicContact CE1-CD1 4.33Å; Y6-L10 VanDerWaalsContact O-CB 3.3Å; Y6-L10 WeakPolarHBondContact O-CB 3.31Å; Y6-L10 PolarHBondContact O-N 2.65Å; V7-L10 PolarHBondContact O-N 2.92Å; E8-L10 VanDerWaalsContact C-N 3.34Å; E8-L10 PolarHBondContact O-N 2.75Å; L10-R14 VanDerWaalsContact O-CD 3.28Å; L10-R14 WeakPolarHBondContact O-CD 3.43Å; L10-R14 WeakPolarHBondContact O-CG 3.37Å
11	L	58.3	Low	53.3	Low	106 Å²	106	103.2 Å²	103.2	56%	0.555	59%	0.59	S	S	*	*	H	α-helix	trans	-73.1	-42.4	178.4	-71.8	174.3	0	0	0	111.2	V7 E8 P31	V7-L11 HydrophobicContact CG1-CD1 3.62Å; V7-L11 HydrophobicContact CG1-CG 4.08Å; V7-L11 VanDerWaalsContact O-CB 3.32Å; V7-L11 WeakPolarHBondContact O-CB 3.36Å; V7-L11 VanDerWaalsContact O-CG 3.23Å; V7-L11 WeakPolarHBondContact O-CG 3.4Å; V7-L11 PolarHBondContact O-N 3.44Å; E8-L11 PolarHBondContact O-N 3.43Å; L11-P31 WeakPolarHBondContact O-CG 3.13Å
12	N	59.4	Low	53.2	Low	47 Å²	47	100.3 Å²	100.3	25%	0.251	57%	0.574	S	S	.	*	H	α-helix	trans	-79.2	-24.7	-175	-70.1	-27.3	0	0	0	113.9	E8 H32	E8-N12 WeakPolarHBondContact CG-ND2 3.38Å; E8-N12 WeakPolarHBondContact O-CB 3.09Å; E8-N12 VanDerWaalsContact O-CG 3.25Å; E8-N12 PolarHBondContact O-N 3.45Å; E8-N12 PolarHBondContact O-ND2 3.07Å; N12-H32 WeakPolarHBondContact O-CB 3.33Å
13	G	57.2	Low	52.4	Low	59 Å²	59	100.4 Å²	100.4	61%	0.608	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-6.2	-179.8	0	0	0	0	0	115.4	N9	N9-G13 PolarHBondContact O-N 2.69Å
14	R	52.4	Low	52.4	Low	149 Å²	149	109.2 Å²	109.2	56%	0.562	59%	0.592	S	S	*	*	S	Bend	trans	-91.6	136.6	-175.4	-81.7	179.4	179.2	-153.8	0.2	112.5	L10 L16 P31	L10-R14 VanDerWaalsContact O-CD 3.28Å; L10-R14 WeakPolarHBondContact O-CD 3.43Å; L10-R14 WeakPolarHBondContact O-CG 3.37Å; R14-L16 PolarHBondContact O-N 3.43Å; R14-P31 WeakPolarHBondContact O-CD 3.35Å
15	P	51.7	Low	52.1	Low	78 Å²	78	111.3 Å²	111.3	51%	0.506	60%	0.598	S	S	.	*			trans	-45.7	129.5	163.7	-34.3	40.4	0	0	0	113.2	V28	P15-V28 HydrophobicContact CB-CG1 3.33Å; P15-V28 HydrophobicContact CG-CG1 3.74Å
16	L	54.2	Low	52.1	Low	106 Å²	106	113.3 Å²	113.3	56%	0.555	61%	0.608	S	S	*	*	S	Bend	trans	-79.5	-5.7	165.7	-72.2	175.7	0	0	0	112.8	R14 L29 P31 L34	R14-L16 PolarHBondContact O-N 3.43Å; L16-L29 WeakPolarHBondContact CB-O 3.42Å; L16-L29 PolarHBondContact N-O 3.05Å; L16-P31 HydrophobicContact CD1-CB 4.36Å; L16-P31 HydrophobicContact CD1-CG 3.89Å; L16-P31 HydrophobicContact CD2-CG 3.64Å; L16-P31 HydrophobicContact CG-CG 3.64Å; L16-L34 HydrophobicContact CD1-CD1 3.54Å; L16-L34 HydrophobicContact CD1-CG 4.44Å
17	A	53.4	Low	52.5	Low	52 Å²	52	111.1 Å²	111.1	43%	0.43	60%	0.604	S	S	.	*	S	Bend	trans	-115	129.6	-179.6	0	0	0	0	0	110.8	A19	A17-A19 PolarHBondContact O-N 3.24Å; A17-A19 VanDerWaalsContact O-N 3.14Å
18	C	42.3	Very low	52.7	Low	133 Å²	133	110.3 Å²	110.3	90%	0.899	60%	0.599	S	S	*	*			trans	-62	110.4	157.3	-71.3	0	0	0	0	107.2	S20	C18-S20 VanDerWaalsContact C-N 3.33Å; C18-S20 PolarHBondContact O-N 2.94Å
19	A	48.9	Very low	52.6	Low	81 Å²	81	109.5 Å²	109.5	67%	0.669	60%	0.598	S	S	*	*			trans	-63.8	97.2	172.3	0	0	0	0	0	108.4	A17 L21	A17-A19 PolarHBondContact O-N 3.24Å; A17-A19 VanDerWaalsContact O-N 3.14Å; A19-L21 PolarHBondContact O-N 2.9Å
20	S	38.2	Very low	52.7	Low	78 Å²	78	106.2 Å²	106.2	55%	0.545	58%	0.581	S	S	.	*			trans	-56.8	132.8	161.1	179.8	0	0	0	0	107.4	C18 E22	C18-S20 VanDerWaalsContact C-N 3.33Å; C18-S20 PolarHBondContact O-N 2.94Å; S20-E22 PolarHBondContact O-N 2.84Å
21	L	53.6	Low	52.7	Low	178 Å²	178	104.9 Å²	104.9	93%	0.932	58%	0.576	S	S	*	*	S	Bend	trans	-64.2	9.5	-175.3	-120.9	89.9	0	0	0	114.2	A19	A19-L21 PolarHBondContact O-N 2.9Å
22	E	48.3	Very low	52.6	Low	160 Å²	160	101 Å²	101	75%	0.748	56%	0.555	S	S	*	*	S	Bend	trans	-128.4	39.7	-161.8	-64.8	-178.8	109.7	0	0	113	S20	S20-E22 PolarHBondContact O-N 2.84Å
23	T	39.5	Very low	52.8	Low	101 Å²	101	100 Å²	100	62%	0.62	55%	0.549	S	S	*	.			trans	-166.4	103.5	159.7	-4.5	0	0	0	0	110.9	E25	T23-E25 PolarHBondContact O-N 2.99Å
24	R	52.8	Low	53.1	Low	259 Å²	259	103.1 Å²	103.1	98%	0.977	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	16.5	-176.2	-82.1	-178.4	167.6	144.9	-2.6	115.3
25	E	49.1	Very low	53.6	Low	187 Å²	187	102.3 Å²	102.3	87%	0.874	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.6	18.1	-174.9	-66.6	-161.7	162.3	0	0	114.9	T23	T23-E25 PolarHBondContact O-N 2.99Å
26	V	52.8	Low	54	Low	104 Å²	104	100.7 Å²	100.7	63%	0.63	55%	0.546	S	S	*	.			trans	-101.8	100.8	175.1	-175	0	0	0	0	109.5	V28	V26-V28 PolarHBondContact O-N 3.41Å
27	E	59.2	Low	54.1	Low	118 Å²	118	99 Å²	99	55%	0.551	55%	0.554	S	S	*	*			trans	-58.2	121.5	168.3	-173.7	-179.8	176.5	0	0	109.3	L29 H33 S39	E27-L29 PolarHBondContact O-N 2.88Å; E27-H33 IonicContact OE1-CE1 3.66Å; E27-S39 WeakPolarHBondContact OE1-CB 3.42Å; E27-S39 PolarHBondContact OE1-OG 2.9Å
28	V	59.7	Low	54.1	Low	51 Å²	51	104.6 Å²	104.6	31%	0.309	56%	0.564	S	S	.	*			trans	-70.4	121.3	-170.4	174.8	0	0	0	0	110.5	P15 V26 T30 H33	P15-V28 HydrophobicContact CB-CG1 3.33Å; P15-V28 HydrophobicContact CG-CG1 3.74Å; V26-V28 PolarHBondContact O-N 3.41Å; V28-T30 PolarHBondContact O-N 3.4Å; V28-H33 PolarHBondContact O-CE1 2.9Å; V28-H33 PolarHBondContact O-ND1 2.78Å
29	L	57.9	Low	54.6	Low	101 Å²	101	101.3 Å²	101.3	53%	0.529	54%	0.542	S	S	.	.			trans	-68	114.6	170.7	-67	176.1	0	0	0	110.1	L16 E27 H33	L16-L29 WeakPolarHBondContact CB-O 3.42Å; L16-L29 PolarHBondContact N-O 3.05Å; E27-L29 PolarHBondContact O-N 2.88Å; L29-H33 WeakPolarHBondContact CA-ND1 3.45Å; L29-H33 HydrophobicContact CD2-CB 4.02Å
30	T	58	Low	54.8	Low	22 Å²	22	101.7 Å²	101.7	14%	0.135	53%	0.53	C	S	.	.			trans	-93	159.7	167.6	56.7	0	0	0	0	109.2	V28 H32 H33 L34	V28-T30 PolarHBondContact O-N 3.4Å; T30-H32 PolarHBondContact O-N 3.47Å; T30-H32 VanDerWaalsContact O-N 3.13Å; T30-H32 WeakPolarHBondContact OG1-CB 3.32Å; T30-H33 PolarHBondContact N-ND1 3.21Å; T30-H33 WeakPolarHBondContact O-CB 3.22Å; T30-H33 PolarHBondContact O-N 2.79Å; T30-H33 PolarHBondContact OG1-CD2 2.97Å; T30-H33 VanDerWaalsContact OG1-CD2 3.3Å; T30-H33 PolarHBondContact OG1-N 2.85Å; T30-L34 PolarHBondContact O-N 3.06Å
31	P	59.4	Low	55.5	Low	32 Å²	32	103.2 Å²	103.2	21%	0.208	54%	0.539	C	S	.	.	H	α-helix	trans	-55.7	-30.1	170.2	-25.5	37.9	0	0	0	111.3	L11 R14 L16 H33 L34 L35	L11-P31 WeakPolarHBondContact O-CG 3.13Å; R14-P31 WeakPolarHBondContact O-CD 3.35Å; L16-P31 HydrophobicContact CD1-CB 4.36Å; L16-P31 HydrophobicContact CD1-CG 3.89Å; L16-P31 HydrophobicContact CD2-CG 3.64Å; L16-P31 HydrophobicContact CG-CG 3.64Å; P31-H33 VanDerWaalsContact C-N 3.35Å; P31-H33 PolarHBondContact O-N 3.26Å; P31-L34 PolarHBondContact O-N 3.1Å; P31-L35 WeakPolarHBondContact O-CB 3.23Å; P31-L35 PolarHBondContact O-N 3.2Å
32	H	56.4	Low	55.2	Low	24 Å²	24	102 Å²	102	11%	0.111	53%	0.533	C	S	.	.	H	α-helix	trans	-58.3	-41.1	170.8	-178.5	-74.6	0	0	0	113	N12 T30 L34 L35 T36 Q40	N12-H32 WeakPolarHBondContact O-CB 3.33Å; T30-H32 PolarHBondContact O-N 3.47Å; T30-H32 VanDerWaalsContact O-N 3.13Å; T30-H32 WeakPolarHBondContact OG1-CB 3.32Å; H32-L34 VanDerWaalsContact C-N 3.32Å; H32-L34 PolarHBondContact O-N 3.07Å; H32-L35 PolarHBondContact O-N 3.35Å; H32-T36 PolarHBondContact CE1-OG1 3Å; H32-T36 VanDerWaalsContact CE1-OG1 3.28Å; H32-T36 PolarHBondContact ND1-OG1 2.8Å; H32-T36 WeakPolarHBondContact O-CB 3.41Å; H32-T36 PolarHBondContact O-N 2.66Å; H32-T36 PolarHBondContact O-OG1 3.22Å; H32-Q40 PolarHBondContact CD2-NE2 3.12Å; H32-Q40 WeakPolarHBondContact CE1-CG 3.29Å; H32-Q40 PolarHBondContact CE1-NE2 2.87Å; H32-Q40 VanDerWaalsContact CE1-NE2 3.32Å; H32-Q40 PolarHBondContact NE2-NE2 2.86Å
33	H	64.8	Low	55.3	Low	27 Å²	27	98.2 Å²	98.2	13%	0.125	51%	0.514	C	S	.	.	H	α-helix	trans	-61.1	-40.7	175	-66.6	171.2	0	0	0	111.9	E27 V28 L29 T30 P31 G37 R38	E27-H33 IonicContact OE1-CE1 3.66Å; V28-H33 PolarHBondContact O-CE1 2.9Å; V28-H33 PolarHBondContact O-ND1 2.78Å; L29-H33 WeakPolarHBondContact CA-ND1 3.45Å; L29-H33 HydrophobicContact CD2-CB 4.02Å; T30-H33 PolarHBondContact N-ND1 3.21Å; T30-H33 WeakPolarHBondContact O-CB 3.22Å; T30-H33 PolarHBondContact O-N 2.79Å; T30-H33 PolarHBondContact OG1-CD2 2.97Å; T30-H33 VanDerWaalsContact OG1-CD2 3.3Å; T30-H33 PolarHBondContact OG1-N 2.85Å; P31-H33 VanDerWaalsContact C-N 3.35Å; P31-H33 PolarHBondContact O-N 3.26Å; H33-G37 VanDerWaalsContact O-CA 3.31Å; H33-G37 WeakPolarHBondContact O-CA 3.49Å; H33-G37 PolarHBondContact O-N 3Å; H33-R38 PolarHBondContact CD2-O 2.85Å
34	L	62.4	Low	55.6	Low	125 Å²	125	96.9 Å²	96.9	65%	0.654	51%	0.507	S	S	*	.	H	α-helix	trans	-71.5	-35.5	177.9	-62.7	177.4	0	0	0	112.6	L16 T30 P31 H32	L16-L34 HydrophobicContact CD1-CD1 3.54Å; L16-L34 HydrophobicContact CD1-CG 4.44Å; T30-L34 PolarHBondContact O-N 3.06Å; P31-L34 PolarHBondContact O-N 3.1Å; H32-L34 VanDerWaalsContact C-N 3.32Å; H32-L34 PolarHBondContact O-N 3.07Å
35	L	63.2	Low	55.3	Low	131 Å²	131	90.1 Å²	90.1	69%	0.686	50%	0.497	S	S	*	.	H	α-helix	trans	-78.7	-29.8	-176.9	-169.3	63.6	0	0	0	113.1	P31 H32	P31-L35 WeakPolarHBondContact O-CB 3.23Å; P31-L35 PolarHBondContact O-N 3.2Å; H32-L35 PolarHBondContact O-N 3.35Å
36	T	59.3	Low	55.3	Low	44 Å²	44	87.5 Å²	87.5	27%	0.27	49%	0.489	S	S	.	.	H	α-helix	trans	-113.5	-12.9	-173.6	64.7	0	0	0	0	114.1	H32 R38	H32-T36 PolarHBondContact CE1-OG1 3Å; H32-T36 VanDerWaalsContact CE1-OG1 3.28Å; H32-T36 PolarHBondContact ND1-OG1 2.8Å; H32-T36 WeakPolarHBondContact O-CB 3.41Å; H32-T36 PolarHBondContact O-N 2.66Å; H32-T36 PolarHBondContact O-OG1 3.22Å; T36-R38 PolarHBondContact O-N 3.22Å
37	G	56.8	Low	55.1	Low	71 Å²	71	85.6 Å²	85.6	73%	0.732	48%	0.478	S	S	*	.	S	Bend	trans	63.5	16.2	-176.3	0	0	0	0	0	113.7	H33	H33-G37 VanDerWaalsContact O-CA 3.31Å; H33-G37 WeakPolarHBondContact O-CA 3.49Å; H33-G37 PolarHBondContact O-N 3Å
38	R	54.1	Low	54.4	Low	169 Å²	169	83.4 Å²	83.4	64%	0.638	47%	0.468	S	S	*	.	S	Bend	trans	-127.9	133.5	-176	-65.8	-176.8	-176.5	-174.5	0.5	110.5	H33 T36	H33-R38 PolarHBondContact CD2-O 2.85Å; T36-R38 PolarHBondContact O-N 3.22Å
39	S	52.6	Low	53.5	Low	64 Å²	64	85.1 Å²	85.1	45%	0.448	48%	0.482	S	S	.	.			trans	-62.4	125	158.6	164	0	0	0	0	108	E27 P41	E27-S39 WeakPolarHBondContact OE1-CB 3.42Å; E27-S39 PolarHBondContact OE1-OG 2.9Å; S39-P41 VanDerWaalsContact O-CD 3.28Å; S39-P41 WeakPolarHBondContact O-CD 3.48Å
40	Q	53.6	Low	52.8	Low	89 Å²	89	84.9 Å²	84.9	42%	0.416	48%	0.478	S	S	.	.			trans	-70.3	119.9	172.5	-80.7	-169.1	-11.1	0	0	108.9	H32 N42	H32-Q40 PolarHBondContact CD2-NE2 3.12Å; H32-Q40 WeakPolarHBondContact CE1-CG 3.29Å; H32-Q40 PolarHBondContact CE1-NE2 2.87Å; H32-Q40 VanDerWaalsContact CE1-NE2 3.32Å; H32-Q40 PolarHBondContact NE2-NE2 2.86Å; Q40-N42 PolarHBondContact O-N 3.23Å
41	P	52	Low	52.1	Low	111 Å²	111	86 Å²	86	72%	0.721	48%	0.484	S	S	*	.			trans	-75.6	102.8	167.9	31.1	-28.8	0	0	0	108.1	S39	S39-P41 VanDerWaalsContact O-CD 3.28Å; S39-P41 WeakPolarHBondContact O-CD 3.48Å
42	N	48.1	Very low	51.2	Low	152 Å²	152	88.4 Å²	88.4	81%	0.813	50%	0.501	S	S	*	.			trans	63.4	59.7	149.7	-48.4	-25.2	0	0	0	117.4	Q40	Q40-N42 PolarHBondContact O-N 3.23Å
43	F	50.4	Low	50.8	Low	80 Å²	80	90 Å²	90	35%	0.351	51%	0.51	S	S	.	.			trans	-92.4	115	157.4	-161.4	-93.2	0	0	0	109.1	V47 M48 L51	F43-V47 HydrophobicContact CE1-CB 3.74Å; F43-V47 HydrophobicContact CE1-CG1 4.13Å; F43-V47 HydrophobicContact CE2-CB 4.46Å; F43-V47 HydrophobicContact CE2-CG1 4.12Å; F43-V47 HydrophobicContact CZ-CB 3.69Å; F43-V47 HydrophobicContact CZ-CG1 3.54Å; F43-M48 HydrophobicContact CD1-SD 4.47Å; F43-M48 HydrophobicContact CE1-CB 3.88Å; F43-M48 HydrophobicContact CE1-CG 4.39Å; F43-M48 HydrophobicContact CE1-SD 3.72Å; F43-M48 HydrophobicContact CZ-SD 3.93Å; F43-L51 HydrophobicContact CZ-CD1 4.38Å
44	P	45.9	Very low	49.6	Very low	73 Å²	73	92.6 Å²	92.6	47%	0.474	52%	0.524	S	S	.	.			trans	-63.3	127.1	175.3	-10	22.9	0	0	0	108.5	D46 V47	P44-D46 PolarHBondContact O-N 3.31Å; P44-V47 HydrophobicContact CB-CG2 3.86Å; P44-V47 HydrophobicContact CG-CG2 3.76Å; P44-V47 PolarHBondContact O-N 3.03Å
45	P	46.3	Very low	48.9	Very low	117 Å²	117	92.5 Å²	92.5	76%	0.76	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-54.8	-30.3	-176.8	-9.5	9.7	0	0	0	113	V47	P45-V47 VanDerWaalsContact C-N 3.29Å; P45-V47 PolarHBondContact O-N 3.2Å
46	D	48.5	Very low	47.7	Very low	132 Å²	132	93.7 Å²	93.7	71%	0.706	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-75.3	-10.1	-178.7	-75.4	-15.5	0	0	0	114.6	P44 S49	P44-D46 PolarHBondContact O-N 3.31Å; D46-S49 PolarHBondContact O-OG 3.5Å
47	V	49.2	Very low	46.7	Very low	65 Å²	65	95 Å²	95	39%	0.394	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-79.2	-23.8	179.5	177.2	0	0	0	0	111	F43 P44 P45 L51	F43-V47 HydrophobicContact CE1-CB 3.74Å; F43-V47 HydrophobicContact CE1-CG1 4.13Å; F43-V47 HydrophobicContact CE2-CB 4.46Å; F43-V47 HydrophobicContact CE2-CG1 4.12Å; F43-V47 HydrophobicContact CZ-CB 3.69Å; F43-V47 HydrophobicContact CZ-CG1 3.54Å; P44-V47 HydrophobicContact CB-CG2 3.86Å; P44-V47 HydrophobicContact CG-CG2 3.76Å; P44-V47 PolarHBondContact O-N 3.03Å; P45-V47 VanDerWaalsContact C-N 3.29Å; P45-V47 PolarHBondContact O-N 3.2Å; V47-L51 HydrophobicContact CG1-CD1 3.99Å; V47-L51 WeakPolarHBondContact O-CD1 2.99Å; V47-L51 VanDerWaalsContact O-CG 3.28Å; V47-L51 WeakPolarHBondContact O-CG 3.45Å
48	M	43	Very low	45.9	Very low	72 Å²	72	96 Å²	96	36%	0.355	55%	0.552	S	S	.	*	S	Bend	trans	-84.8	-25	-174.7	-144.8	113.3	-161.8	0	0	114.1	F43 H50 L51	F43-M48 HydrophobicContact CD1-SD 4.47Å; F43-M48 HydrophobicContact CE1-CB 3.88Å; F43-M48 HydrophobicContact CE1-CG 4.39Å; F43-M48 HydrophobicContact CE1-SD 3.72Å; F43-M48 HydrophobicContact CZ-SD 3.93Å; M48-H50 PolarHBondContact O-N 3.37Å; M48-L51 PolarHBondContact O-N 2.79Å
49	S	42.4	Very low	45.4	Very low	87 Å²	87	98 Å²	98	61%	0.608	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-24.7	-178.8	46.4	0	0	0	0	112.8	D46	D46-S49 PolarHBondContact O-OG 3.5Å
50	H	43.4	Very low	45.3	Very low	96 Å²	96	100.3 Å²	100.3	44%	0.444	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.3	0.5	-178.8	-64.1	-84	0	0	0	113.5	M48 S52 A123	M48-H50 PolarHBondContact O-N 3.37Å; H50-S52 PolarHBondContact O-N 3.49Å; H50-A123 HydrophobicContact CB-CB 3.82Å; H50-A123 WeakPolarHBondContact O-CB 3.49Å; H50-A123 PolarHBondContact O-N 2.72Å
51	L	43.2	Very low	45.3	Very low	46 Å²	46	97.9 Å²	97.9	24%	0.241	55%	0.55	C	S	.	*			trans	-97.1	88.8	-180	-69.2	175	0	0	0	110	F43 V47 M48 L53 L120	F43-L51 HydrophobicContact CZ-CD1 4.38Å; V47-L51 HydrophobicContact CG1-CD1 3.99Å; V47-L51 WeakPolarHBondContact O-CD1 2.99Å; V47-L51 VanDerWaalsContact O-CG 3.28Å; V47-L51 WeakPolarHBondContact O-CG 3.45Å; M48-L51 PolarHBondContact O-N 2.79Å; L51-L53 PolarHBondContact O-N 2.9Å; L51-L53 VanDerWaalsContact O-N 3.13Å; L51-L120 HydrophobicContact CD1-CD2 4.05Å; L51-L120 HydrophobicContact CD2-CB 4.42Å; L51-L120 HydrophobicContact CD2-CD2 3.67Å; L51-L120 HydrophobicContact CG-CD2 4.31Å
52	S	40.1	Very low	45.5	Very low	81 Å²	81	96.9 Å²	96.9	57%	0.566	55%	0.545	S	S	*	.			trans	-72.9	99.6	163.8	-68.9	0	0	0	0	108.6	H50 D54	H50-S52 PolarHBondContact O-N 3.49Å; S52-D54 PolarHBondContact O-N 2.98Å
53	L	46.7	Very low	46.7	Very low	59 Å²	59	91.7 Å²	91.7	31%	0.309	53%	0.528	S	S	.	.			trans	-74	100.6	164.1	-70.9	173	0	0	0	107.6	L51 V55 W82 L120	L51-L53 PolarHBondContact O-N 2.9Å; L51-L53 VanDerWaalsContact O-N 3.13Å; L53-V55 HydrophobicContact CB-CG2 4.12Å; L53-V55 PolarHBondContact O-N 2.86Å; L53-W82 HydrophobicContact CD1-CH2 4.37Å; L53-W82 HydrophobicContact CD1-CZ3 4.16Å; L53-L120 HydrophobicContact CD2-CD2 4.16Å
54	D	41.6	Very low	48.2	Very low	80 Å²	80	88.4 Å²	88.4	43%	0.428	51%	0.514	S	S	.	.			trans	-70.6	80.1	172.5	-72	-48.1	0	0	0	110.4	S52 E56 R60	S52-D54 PolarHBondContact O-N 2.98Å; D54-E56 PolarHBondContact O-N 2.88Å; D54-R60 IonicContact OD2-CZ 2.98Å; D54-R60 IonicContact OD2-NE 3.19Å; D54-R60 IonicContact OD2-NH1 2.66Å; D54-R60 PolarHBondContact OD2-NH1 3.44Å; D54-R60 IonicContact OD2-NH2 3.07Å
55	V	46.1	Very low	50.2	Low	124 Å²	124	88 Å²	88	75%	0.752	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	11.7	175	175.4	0	0	0	0	111.4	L53	L53-V55 HydrophobicContact CB-CG2 4.12Å; L53-V55 PolarHBondContact O-N 2.86Å
56	E	39.6	Very low	52.4	Low	156 Å²	156	86.8 Å²	86.8	73%	0.729	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	17.5	-171.6	-162.6	121.5	-178.2	0	0	115.1	D54	D54-E56 PolarHBondContact O-N 2.88Å
57	S	36.9	Very low	54.3	Low	71 Å²	71	82.4 Å²	82.4	50%	0.497	49%	0.489	S	S	.	.			trans	-167.4	122.9	166.8	-109.7	0	0	0	0	114.1	R59	S57-R59 PolarHBondContact O-N 2.8Å
58	G	40.9	Very low	56.2	Low	92 Å²	92	81.4 Å²	81.4	95%	0.948	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	44.7	160.4	0	0	0	0	0	113.6
59	R	42.7	Very low	58.3	Low	210 Å²	210	81.1 Å²	81.1	79%	0.792	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.1	-0.3	-173.2	-106.6	-179.1	169.1	171.2	-3.1	114.2	S57	S57-R59 PolarHBondContact O-N 2.8Å
60	R	50.9	Low	60.4	Low	113 Å²	113	77 Å²	77	43%	0.426	46%	0.455	S	S	.	.			trans	-100.1	6.9	-175.4	-54.9	-171.8	97.3	-138.8	1.8	115.6	D54 S62 Q121	D54-R60 IonicContact OD2-CZ 2.98Å; D54-R60 IonicContact OD2-NE 3.19Å; D54-R60 IonicContact OD2-NH1 2.66Å; D54-R60 PolarHBondContact OD2-NH1 3.44Å; D54-R60 IonicContact OD2-NH2 3.07Å; R60-S62 PolarHBondContact O-N 2.81Å; R60-Q121 VanDerWaalsContact CZ-OE1 3.23Å
61	T	53.4	Low	62.3	Low	39 Å²	39	72.6 Å²	72.6	24%	0.239	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-73.2	-11.5	171.2	62.4	0	0	0	0	113.2	G63 V114	T61-G63 PolarHBondContact O-N 2.89Å; T61-V114 HydrophobicContact CG2-CB 3.75Å; T61-V114 HydrophobicContact CG2-CG2 3.68Å
62	S	56	Low	64.3	Low	89 Å²	89	71 Å²	71	62%	0.622	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-72.6	0.1	-179.3	-85.1	0	0	0	0	115.1	R60	R60-S62 PolarHBondContact O-N 2.81Å
63	G	74.3	Confident	66.2	Low	44 Å²	44	70.3 Å²	70.3	45%	0.454	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-116.5	-1	-177.4	0	0	0	0	0	116.1	T61 S65	T61-G63 PolarHBondContact O-N 2.89Å; G63-S65 PolarHBondContact O-N 3.46Å; G63-S65 PolarHBondContact O-OG 3.36Å
64	M	82	Confident	67.4	Low	10 Å²	10	69.2 Å²	69.2	5%	0.049	41%	0.413	C	S	.	.			trans	-65.6	122.3	-172.2	-72	165.3	83.2	0	0	111.4	V70 I87 V98 A101 V114 L117	M64-V70 HydrophobicContact CE-CG1 4.23Å; M64-I87 HydrophobicContact CB-CD1 3.78Å; M64-I87 HydrophobicContact CE-CD1 3.58Å; M64-I87 HydrophobicContact CG-CD1 4.05Å; M64-V98 HydrophobicContact CB-CG1 4.46Å; M64-A101 HydrophobicContact CE-CB 4.34Å; M64-V114 HydrophobicContact CE-CB 4.34Å; M64-V114 HydrophobicContact CE-CG1 3.96Å; M64-V114 HydrophobicContact SD-CB 3.68Å; M64-V114 HydrophobicContact SD-CG1 3.44Å; M64-V114 WeakPolarHBondContact SD-CG1 3.03Å; M64-L117 HydrophobicContact CE-CB 3.52Å; M64-L117 HydrophobicContact CE-CD1 3.47Å; M64-L117 VanDerWaalsContact CE-CD1 3.47Å; M64-L117 HydrophobicContact CE-CG 4.13Å
65	S	86.9	Confident	68.9	Low	64 Å²	64	70.8 Å²	70.8	45%	0.448	43%	0.43	S	S	.	.			trans	-124.6	156.7	-177.3	-60.8	0	0	0	0	110.6	G63 G67 D68 I87	G63-S65 PolarHBondContact O-N 3.46Å; G63-S65 PolarHBondContact O-OG 3.36Å; S65-G67 PolarHBondContact O-N 2.93Å; S65-D68 PolarHBondContact N-OD2 3.25Å; S65-D68 WeakPolarHBondContact O-CB 3.44Å; S65-D68 PolarHBondContact O-N 2.61Å; S65-I87 WeakPolarHBondContact O-CB 3.45Å
66	V	91.9	Very high	70.3	Confident	92 Å²	92	71 Å²	71	56%	0.558	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	129.2	173.3	178.2	0	0	0	0	109	S88 V90	V66-S88 WeakPolarHBondContact CG1-O 3.23Å; V66-V90 HydrophobicContact CG2-CG1 4.43Å; V66-V90 HydrophobicContact CG2-CG2 4.26Å
67	G	90	Very high	71.6	Confident	40 Å²	40	65.1 Å²	65.1	41%	0.412	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.3	-18.1	-176.9	0	0	0	0	0	114.6	S65 R86 I87	S65-G67 PolarHBondContact O-N 2.93Å; G67-R86 WeakPolarHBondContact O-CG 3.48Å; G67-I87 PolarHBondContact N-O 3.43Å
68	D	87.6	Confident	73.1	Confident	45 Å²	45	65.1 Å²	65.1	24%	0.241	40%	0.4	C	S	.	.			trans	-64.6	142.3	178.3	-71.8	-16.8	0	0	0	112	S65 R86 I87 L119	S65-D68 PolarHBondContact N-OD2 3.25Å; S65-D68 WeakPolarHBondContact O-CB 3.44Å; S65-D68 PolarHBondContact O-N 2.61Å; D68-R86 CarbonylContact O-C 3.44Å; D68-R86 WeakPolarHBondContact O-CA 3.13Å; D68-I87 HydrophobicContact CB-CD1 4.05Å; D68-I87 HydrophobicContact CB-CG1 4.33Å; D68-I87 PolarHBondContact O-N 3.25Å; D68-L119 HydrophobicContact CB-CD1 3.56Å
69	V	87.5	Confident	74.2	Confident	65 Å²	65	71.6 Å²	71.6	39%	0.394	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	129.6	172.2	-176.3	0	0	0	0	108.7	G85 L120	V69-G85 WeakPolarHBondContact CA-O 3.45Å; V69-L120 HydrophobicContact CB-CB 4.49Å; V69-L120 HydrophobicContact CG1-CB 4.43Å; V69-L120 HydrophobicContact CG1-CD1 3.9Å; V69-L120 PolarHBondContact O-N 2.82Å
70	V	86.1	Confident	75.3	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.006	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.8	-177.6	-65.4	0	0	0	0	111.2	M64 L84 G85 I87 E103 L117 L118 L119	M64-V70 HydrophobicContact CE-CG1 4.23Å; V70-L84 WeakPolarHBondContact O-CA 3.43Å; V70-G85 WeakPolarHBondContact CG2-O 3.34Å; V70-G85 PolarHBondContact N-O 2.94Å; V70-G85 PolarHBondContact O-N 2.7Å; V70-I87 HydrophobicContact CG1-CD1 3.82Å; V70-I87 HydrophobicContact CG1-CG1 3.88Å; V70-I87 HydrophobicContact CG2-CG1 4.19Å; V70-E103 HydrophobicContact CG2-CB 4.29Å; V70-L117 HydrophobicContact CB-CB 4.4Å; V70-L117 HydrophobicContact CG2-CD2 4.02Å; V70-L118 CarbonylContact C-O 3.48Å; V70-L118 WeakPolarHBondContact CA-O 3.3Å; V70-L118 WeakPolarHBondContact CB-O 3.34Å; V70-L119 HydrophobicContact CG1-CD1 4.45Å
71	V	85	Confident	76.2	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.024	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	129.2	162.3	-178.1	0	0	0	0	108.1	V73 W82 L84 L117 L118 L120	V71-V73 PolarHBondContact O-N 3.28Å; V71-W82 HydrophobicContact CG1-CB 4.36Å; V71-W82 HydrophobicContact CG1-CE3 3.71Å; V71-W82 HydrophobicContact CG1-CZ3 4.47Å; V71-L84 HydrophobicContact CB-CD2 4.48Å; V71-L84 HydrophobicContact CG2-CD2 3.75Å; V71-L117 WeakPolarHBondContact O-CA 3.16Å; V71-L118 HydrophobicContact CB-CB 4.26Å; V71-L118 PolarHBondContact N-O 3.45Å; V71-L118 PolarHBondContact O-N 3.39Å; V71-L120 HydrophobicContact CG2-CD1 3.5Å; V71-L120 VanDerWaalsContact CG2-CD1 3.5Å; V71-L120 HydrophobicContact CG2-CD2 3.81Å; V71-L120 HydrophobicContact CG2-CG 3.66Å
72	L	83.1	Confident	77.4	Confident	12 Å²	12	64.6 Å²	64.6	6%	0.063	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.8	164	164.4	67.5	0	0	0	111.1	D74 P83 L105 R112 K116 L117	L72-D74 HydrophobicContact CD1-CB 4.17Å; L72-D74 HydrophobicContact CD2-CB 4.46Å; L72-D74 HydrophobicContact CG-CB 4.33Å; L72-P83 HydrophobicContact CB-CB 4.27Å; L72-P83 HydrophobicContact CB-CG 3.88Å; L72-P83 HydrophobicContact CD2-CB 4.28Å; L72-P83 HydrophobicContact CD2-CG 3.81Å; L72-P83 HydrophobicContact CG-CG 4.1Å; L72-P83 PolarHBondContact N-O 2.49Å; L72-L105 HydrophobicContact CD2-CD1 4.39Å; L72-R112 VanDerWaalsContact CD1-NH1 3.28Å; L72-K116 HydrophobicContact CD1-CB 4.49Å; L72-L117 HydrophobicContact CD1-CD2 4.46Å
73	V	80.5	Confident	78.6	Confident	66 Å²	66	61.9 Å²	61.9	40%	0.4	37%	0.365	S	S	.	.			trans	-105.5	98.5	167.6	-174.3	0	0	0	0	108.7	V71 K116 L118	V71-V73 PolarHBondContact O-N 3.28Å; V73-K116 PolarHBondContact N-O 2.86Å; V73-K116 WeakPolarHBondContact O-CA 3.32Å; V73-K116 VanDerWaalsContact O-CB 3.29Å; V73-K116 WeakPolarHBondContact O-CB 3.28Å; V73-L118 HydrophobicContact CG2-CD1 3.47Å; V73-L118 VanDerWaalsContact CG2-CD1 3.47Å; V73-L118 HydrophobicContact CG2-CG 3.63Å
74	D	73.5	Confident	79.1	Confident	37 Å²	37	63.9 Å²	63.9	20%	0.198	37%	0.365	C	S	.	.			trans	-117.8	148.2	169.6	-168.5	37.2	0	0	0	110.1	L72 N76 T77 K116	L72-D74 HydrophobicContact CD1-CB 4.17Å; L72-D74 HydrophobicContact CD2-CB 4.46Å; L72-D74 HydrophobicContact CG-CB 4.33Å; D74-N76 PolarHBondContact O-N 3.17Å; D74-N76 WeakPolarHBondContact OD2-CB 3.37Å; D74-N76 PolarHBondContact OD2-ND2 3.13Å; D74-T77 PolarHBondContact N-OG1 3.2Å; D74-T77 VanDerWaalsContact O-CB 3.3Å; D74-T77 WeakPolarHBondContact O-CB 3.48Å; D74-T77 PolarHBondContact O-N 3.2Å; D74-T77 PolarHBondContact O-OG1 2.98Å; D74-K116 IonicContact OD1-NZ 3.84Å; D74-K116 PolarHBondContact OD1-NZ 3.03Å
75	S	72.2	Confident	79.5	Confident	112 Å²	112	63.8 Å²	63.8	78%	0.783	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.9	178.1	54.7	0	0	0	0	112.9
76	N	74.4	Confident	79.7	Confident	130 Å²	130	68.4 Å²	68.4	70%	0.695	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-5	176.3	-51.5	-57.2	0	0	0	112.9	D74 P78	D74-N76 PolarHBondContact O-N 3.17Å; D74-N76 WeakPolarHBondContact OD2-CB 3.37Å; D74-N76 PolarHBondContact OD2-ND2 3.13Å; N76-P78 WeakPolarHBondContact O-CD 3.43Å
77	T	68.2	Low	79.7	Confident	32 Å²	32	64.1 Å²	64.1	20%	0.196	35%	0.347	C	S	.	.	S	Bend	trans	-67.3	119.5	174.6	-60.9	0	0	0	0	108	D74 R79 S81 P83	D74-T77 PolarHBondContact N-OG1 3.2Å; D74-T77 VanDerWaalsContact O-CB 3.3Å; D74-T77 WeakPolarHBondContact O-CB 3.48Å; D74-T77 PolarHBondContact O-N 3.2Å; D74-T77 PolarHBondContact O-OG1 2.98Å; T77-R79 PolarHBondContact O-N 2.93Å; T77-S81 WeakPolarHBondContact CG2-O 3.46Å; T77-P83 HydrophobicContact CG2-CG 3.8Å
78	P	68.5	Low	79.9	Confident	70 Å²	70	64.5 Å²	64.5	46%	0.455	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-60.1	141.2	179.9	21.9	-29.2	0	0	0	110	N76 G80 S81	N76-P78 WeakPolarHBondContact O-CD 3.43Å; P78-G80 PolarHBondContact O-N 3.32Å; P78-S81 VanDerWaalsContact O-CB 3.23Å; P78-S81 WeakPolarHBondContact O-CB 3.3Å; P78-S81 PolarHBondContact O-N 3.37Å
79	R	63.3	Low	80.1	Confident	229 Å²	229	65 Å²	65	86%	0.864	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	134.9	176.3	-76	-174.4	-101.8	-93.7	2.3	110.2	T77 S81	T77-R79 PolarHBondContact O-N 2.93Å; R79-S81 VanDerWaalsContact C-N 3.3Å
80	G	66.7	Low	80.4	Confident	35 Å²	35	64.1 Å²	64.1	36%	0.361	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	-7.2	-175.5	0	0	0	0	0	115	P78	P78-G80 PolarHBondContact O-N 3.32Å
81	S	69.3	Low	80.7	Confident	54 Å²	54	67.7 Å²	67.7	38%	0.378	36%	0.357	S	S	.	.			trans	-91.6	126.4	170.5	-171.2	0	0	0	0	110.4	T77 P78 R79 P83	T77-S81 WeakPolarHBondContact CG2-O 3.46Å; P78-S81 VanDerWaalsContact O-CB 3.23Å; P78-S81 WeakPolarHBondContact O-CB 3.3Å; P78-S81 PolarHBondContact O-N 3.37Å; R79-S81 VanDerWaalsContact C-N 3.3Å; S81-P83 VanDerWaalsContact O-CD 3.26Å; S81-P83 WeakPolarHBondContact O-CD 3.38Å
82	W	77.6	Confident	81	Confident	126 Å²	126	71.2 Å²	71.2	48%	0.477	38%	0.382	S	S	.	.			trans	-119.5	72.9	177.5	-58.3	92.1	0	0	0	108.6	L53 V71 L84	L53-W82 HydrophobicContact CD1-CH2 4.37Å; L53-W82 HydrophobicContact CD1-CZ3 4.16Å; V71-W82 HydrophobicContact CG1-CB 4.36Å; V71-W82 HydrophobicContact CG1-CE3 3.71Å; V71-W82 HydrophobicContact CG1-CZ3 4.47Å; W82-L84 WeakPolarHBondContact O-CD2 3.44Å; W82-L84 WeakPolarHBondContact O-CG 3.18Å; W82-L84 PolarHBondContact O-N 3.05Å
83	P	81.6	Confident	81.2	Confident	31 Å²	31	71.9 Å²	71.9	20%	0.201	39%	0.392	C	S	.	.			trans	-60.6	111.9	-177.8	16.3	-22.5	0	0	0	109.7	L72 T77 S81 L105	L72-P83 HydrophobicContact CB-CB 4.27Å; L72-P83 HydrophobicContact CB-CG 3.88Å; L72-P83 HydrophobicContact CD2-CB 4.28Å; L72-P83 HydrophobicContact CD2-CG 3.81Å; L72-P83 HydrophobicContact CG-CG 4.1Å; L72-P83 PolarHBondContact N-O 2.49Å; T77-P83 HydrophobicContact CG2-CG 3.8Å; S81-P83 VanDerWaalsContact O-CD 3.26Å; S81-P83 WeakPolarHBondContact O-CD 3.38Å; P83-L105 HydrophobicContact CB-CD2 4.33Å
84	L	86.3	Confident	81.6	Confident	87 Å²	87	79.5 Å²	79.5	46%	0.455	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	140.1	177.5	-55.8	-171.8	0	0	0	109.8	V70 V71 W82 L105 L120	V70-L84 WeakPolarHBondContact O-CA 3.43Å; V71-L84 HydrophobicContact CB-CD2 4.48Å; V71-L84 HydrophobicContact CG2-CD2 3.75Å; W82-L84 WeakPolarHBondContact O-CD2 3.44Å; W82-L84 WeakPolarHBondContact O-CG 3.18Å; W82-L84 PolarHBondContact O-N 3.05Å; L84-L105 WeakPolarHBondContact O-CD2 3.28Å; L84-L120 HydrophobicContact CD1-CD1 4.46Å; L84-L120 HydrophobicContact CD2-CD1 3.38Å; L84-L120 HydrophobicContact CG-CD1 4.48Å
85	G	88.7	Confident	82.3	Confident	7 Å²	7	82.3 Å²	82.3	7%	0.072	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	160.8	172.3	0	0	0	0	0	111.1	V69 V70 A104	V69-G85 WeakPolarHBondContact CA-O 3.45Å; V70-G85 WeakPolarHBondContact CG2-O 3.34Å; V70-G85 PolarHBondContact N-O 2.94Å; V70-G85 PolarHBondContact O-N 2.7Å; G85-A104 CarbonylContact C-O 3.58Å; G85-A104 WeakPolarHBondContact CA-O 3.02Å
86	R	92.4	Very high	82.9	Confident	161 Å²	161	79.6 Å²	79.6	61%	0.608	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	133.7	170.9	-172.9	169.4	60.8	-169.1	-2	109.6	G67 D68 S88 A104	G67-R86 WeakPolarHBondContact O-CG 3.48Å; D68-R86 CarbonylContact O-C 3.44Å; D68-R86 WeakPolarHBondContact O-CA 3.13Å; R86-S88 PolarHBondContact O-N 3.41Å; R86-A104 PolarHBondContact N-O 3Å; R86-A104 PolarHBondContact O-N 3.38Å
87	I	92.2	Very high	83.4	Confident	2 Å²	2	75.7 Å²	75.7	1%	0.01	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	121.7	176	-61.3	-172.6	0	0	0	109.1	M64 S65 G67 D68 V70 V90 A101	M64-I87 HydrophobicContact CB-CD1 3.78Å; M64-I87 HydrophobicContact CE-CD1 3.58Å; M64-I87 HydrophobicContact CG-CD1 4.05Å; S65-I87 WeakPolarHBondContact O-CB 3.45Å; G67-I87 PolarHBondContact N-O 3.43Å; D68-I87 HydrophobicContact CB-CD1 4.05Å; D68-I87 HydrophobicContact CB-CG1 4.33Å; D68-I87 PolarHBondContact O-N 3.25Å; V70-I87 HydrophobicContact CG1-CD1 3.82Å; V70-I87 HydrophobicContact CG1-CG1 3.88Å; V70-I87 HydrophobicContact CG2-CG1 4.19Å; I87-V90 HydrophobicContact CG2-CG1 3.57Å; I87-A101 HydrophobicContact CD1-CB 4.32Å; I87-A101 HydrophobicContact CG1-CB 4.49Å; I87-A101 HydrophobicContact CG2-CB 4.09Å
88	S	92.9	Very high	84.3	Confident	49 Å²	49	74.9 Å²	74.9	34%	0.343	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-31.3	175.5	60.6	0	0	0	0	112.5	V66 R86 D102	V66-S88 WeakPolarHBondContact CG1-O 3.23Å; R86-S88 PolarHBondContact O-N 3.41Å; S88-D102 PolarHBondContact N-O 3.39Å; S88-D102 WeakPolarHBondContact OG-CB 3.48Å; S88-D102 PolarHBondContact OG-O 2.99Å; S88-D102 VanDerWaalsContact OG-O 3.12Å
89	T	92.9	Very high	85.3	Confident	55 Å²	55	77.4 Å²	77.4	34%	0.337	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	143.2	179.6	-56.1	0	0	0	0	110.1	Y91 A101 D102	T89-Y91 HydrophobicContact CG2-CE1 4.19Å; T89-Y91 HydrophobicContact CG2-CE2 3.8Å; T89-Y91 WeakPolarHBondContact CG2-OH 3.26Å; T89-A101 CarbonylContact O-C 3.59Å; T89-A101 VanDerWaalsContact O-CA 3.23Å; T89-A101 WeakPolarHBondContact O-CA 3.31Å; T89-D102 PolarHBondContact N-O 3.3Å; T89-D102 PolarHBondContact O-N 2.97Å
90	V	93	Very high	86.5	Confident	47 Å²	47	67.9 Å²	67.9	29%	0.285	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	142.7	178.3	-67.1	0	0	0	0	110.6	V66 I87 V98 A101	V66-V90 HydrophobicContact CG2-CG1 4.43Å; V66-V90 HydrophobicContact CG2-CG2 4.26Å; I87-V90 HydrophobicContact CG2-CG1 3.57Å; V90-V98 HydrophobicContact CB-CG1 4.04Å; V90-V98 HydrophobicContact CB-CG2 4.35Å; V90-V98 HydrophobicContact CG1-CG1 4.31Å; V90-A101 HydrophobicContact CG1-CB 4.43Å
91	Y	93	Very high	87.7	Confident	75 Å²	75	66.2 Å²	66.2	29%	0.294	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	105.8	179.3	-58	-88.3	0	0	0	109.5	T89 R99 S100 D102 R111	T89-Y91 HydrophobicContact CG2-CE1 4.19Å; T89-Y91 HydrophobicContact CG2-CE2 3.8Å; T89-Y91 WeakPolarHBondContact CG2-OH 3.26Å; Y91-R99 PolarHBondContact O-N 3.21Å; Y91-S100 WeakPolarHBondContact CB-OG 3.47Å; Y91-S100 PolarHBondContact N-O 3.46Å; Y91-D102 HydrophobicContact CE2-CB 4.46Å; Y91-D102 WeakPolarHBondContact CE2-OD1 3.29Å; Y91-D102 WeakPolarHBondContact CE2-OD2 3.39Å; Y91-D102 PolarHBondContact OH-OD2 3.25Å; Y91-R111 VanDerWaalsContact CE2-CZ 3.45Å; Y91-R111 PolarHBondContact OH-NH2 3.47Å
92	S	90.4	Very high	88.8	Confident	79 Å²	79	64.7 Å²	64.7	55%	0.552	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	149.8	175.5	53.2	0	0	0	0	112	V97	S92-V97 CarbonylContact C-O 3.58Å; S92-V97 VanDerWaalsContact CA-O 3.31Å; S92-V97 WeakPolarHBondContact CA-O 3.46Å
93	G	86.8	Confident	89.3	Confident	26 Å²	26	58.8 Å²	58.8	27%	0.268	32%	0.317	S	S	.	.			trans	-80.8	-178.7	168.7	0	0	0	0	0	112.2	D95 G96 V97	G93-D95 PolarHBondContact O-N 3.33Å; G93-D95 VanDerWaalsContact O-N 3.1Å; G93-G96 PolarHBondContact O-N 3.37Å; G93-V97 PolarHBondContact N-O 2.94Å
94	K	89.2	Confident	89.6	Confident	226 Å²	226	58.9 Å²	58.9	98%	0.983	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-20.1	178	-66.7	-178.5	177.5	-179.7	0	114	G96	K94-G96 VanDerWaalsContact C-N 3.34Å
95	D	88.1	Confident	89.5	Confident	95 Å²	95	56.3 Å²	56.3	51%	0.508	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1.3	176.4	58.2	-5.7	0	0	0	113.5	G93 V97 R99	G93-D95 PolarHBondContact O-N 3.33Å; G93-D95 VanDerWaalsContact O-N 3.1Å; D95-V97 VanDerWaalsContact C-N 3.27Å; D95-V97 HydrophobicContact CB-CG2 4.43Å; D95-V97 PolarHBondContact O-N 2.91Å; D95-V97 PolarHBondContact OD1-N 3.45Å; D95-V97 VanDerWaalsContact OD1-N 3.14Å; D95-R99 IonicContact OD1-CZ 2.61Å; D95-R99 IonicContact OD1-NH1 2.72Å; D95-R99 PolarHBondContact OD1-NH1 2.87Å; D95-R99 IonicContact OD1-NH2 3.95Å; D95-R99 IonicContact OD2-CZ 3.45Å; D95-R99 IonicContact OD2-NH1 3.35Å; D95-R99 PolarHBondContact OD2-NH1 3.2Å; D95-R99 IonicContact OD2-NH2 2.8Å; D95-R99 PolarHBondContact OD2-NH2 3.13Å
96	G	84.8	Confident	88.9	Confident	55 Å²	55	60.8 Å²	60.8	57%	0.567	34%	0.344	S	S	*	.	S	Bend	trans	80.8	-0.9	-177	0	0	0	0	0	114.5	G93 K94	G93-G96 PolarHBondContact O-N 3.37Å; K94-G96 VanDerWaalsContact C-N 3.34Å
97	V	85.4	Confident	88.2	Confident	48 Å²	48	61.2 Å²	61.2	29%	0.291	36%	0.357	S	S	.	.			trans	-85.5	124.9	-176.9	-178.3	0	0	0	0	110.7	S92 G93 D95 R99	S92-V97 CarbonylContact C-O 3.58Å; S92-V97 VanDerWaalsContact CA-O 3.31Å; S92-V97 WeakPolarHBondContact CA-O 3.46Å; G93-V97 PolarHBondContact N-O 2.94Å; D95-V97 VanDerWaalsContact C-N 3.27Å; D95-V97 HydrophobicContact CB-CG2 4.43Å; D95-V97 PolarHBondContact O-N 2.91Å; D95-V97 PolarHBondContact OD1-N 3.45Å; D95-V97 VanDerWaalsContact OD1-N 3.14Å; V97-R99 PolarHBondContact O-N 3.41Å; V97-R99 PolarHBondContact O-NH1 3.35Å
98	V	88.2	Confident	87.7	Confident	16 Å²	16	65.8 Å²	65.8	10%	0.097	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	122.5	174.9	-174.3	0	0	0	0	109.8	M64 V90 V114	M64-V98 HydrophobicContact CB-CG1 4.46Å; V90-V98 HydrophobicContact CB-CG1 4.04Å; V90-V98 HydrophobicContact CB-CG2 4.35Å; V90-V98 HydrophobicContact CG1-CG1 4.31Å; V98-V114 HydrophobicContact CB-CG1 4.42Å; V98-V114 HydrophobicContact CG1-CG1 3.79Å
99	R	87.6	Confident	87.6	Confident	123 Å²	123	67.7 Å²	67.7	46%	0.464	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-24.1	-179.2	-72	178.6	175.1	75.9	-4.2	113.2	Y91 D95 V97 S113 V114	Y91-R99 PolarHBondContact O-N 3.21Å; D95-R99 IonicContact OD1-CZ 2.61Å; D95-R99 IonicContact OD1-NH1 2.72Å; D95-R99 PolarHBondContact OD1-NH1 2.87Å; D95-R99 IonicContact OD1-NH2 3.95Å; D95-R99 IonicContact OD2-CZ 3.45Å; D95-R99 IonicContact OD2-NH1 3.35Å; D95-R99 PolarHBondContact OD2-NH1 3.2Å; D95-R99 IonicContact OD2-NH2 2.8Å; D95-R99 PolarHBondContact OD2-NH2 3.13Å; V97-R99 PolarHBondContact O-N 3.41Å; V97-R99 PolarHBondContact O-NH1 3.35Å; R99-S113 WeakPolarHBondContact O-CA 3.35Å; R99-S113 PolarHBondContact O-OG 2.85Å; R99-V114 PolarHBondContact O-N 3.47Å
100	S	90.5	Very high	87.3	Confident	28 Å²	28	67.3 Å²	67.3	20%	0.196	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	154.3	172.6	53.2	0	0	0	0	111	Y91 R112	Y91-S100 WeakPolarHBondContact CB-OG 3.47Å; Y91-S100 PolarHBondContact N-O 3.46Å; S100-R112 CarbonylContact C-O 3.59Å; S100-R112 WeakPolarHBondContact CA-O 3.47Å; S100-R112 WeakPolarHBondContact CB-O 3.23Å
101	A	91.2	Very high	87.3	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	151.8	173.2	0	0	0	0	0	109.2	M64 I87 T89 V90 R111 R112 L117	M64-A101 HydrophobicContact CE-CB 4.34Å; I87-A101 HydrophobicContact CD1-CB 4.32Å; I87-A101 HydrophobicContact CG1-CB 4.49Å; I87-A101 HydrophobicContact CG2-CB 4.09Å; T89-A101 CarbonylContact O-C 3.59Å; T89-A101 VanDerWaalsContact O-CA 3.23Å; T89-A101 WeakPolarHBondContact O-CA 3.31Å; V90-A101 HydrophobicContact CG1-CB 4.43Å; A101-R111 WeakPolarHBondContact O-CA 3.43Å; A101-R112 PolarHBondContact N-O 3.49Å; A101-R112 PolarHBondContact O-N 2.84Å; A101-L117 HydrophobicContact CB-CD1 4Å
102	D	91.8	Very high	87.1	Confident	23 Å²	23	69.9 Å²	69.9	12%	0.123	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	121	162.1	-64.7	-19.6	0	0	0	106.8	S88 T89 Y91 T109 T110 R111	S88-D102 PolarHBondContact N-O 3.39Å; S88-D102 WeakPolarHBondContact OG-CB 3.48Å; S88-D102 PolarHBondContact OG-O 2.99Å; S88-D102 VanDerWaalsContact OG-O 3.12Å; T89-D102 PolarHBondContact N-O 3.3Å; T89-D102 PolarHBondContact O-N 2.97Å; Y91-D102 HydrophobicContact CE2-CB 4.46Å; Y91-D102 WeakPolarHBondContact CE2-OD1 3.29Å; Y91-D102 WeakPolarHBondContact CE2-OD2 3.39Å; Y91-D102 PolarHBondContact OH-OD2 3.25Å; D102-T109 HydrophobicContact CB-CG2 4.02Å; D102-T110 CarbonylContact C-O 3.53Å; D102-T110 WeakPolarHBondContact CA-O 3.27Å; D102-R111 WeakPolarHBondContact OD1-CB 3.45Å; D102-R111 WeakPolarHBondContact OD1-CG 3.45Å; D102-R111 IonicContact OD1-CZ 3.58Å; D102-R111 IonicContact OD1-NE 3.44Å; D102-R111 PolarHBondContact OD1-NE 2.85Å; D102-R111 IonicContact OD1-NH2 3.58Å; D102-R111 PolarHBondContact OD1-NH2 3.22Å; D102-R111 IonicContact OD2-NH2 3.54Å; D102-R111 PolarHBondContact OD2-NH2 3.03Å
103	E	88	Confident	87	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	126.9	176.3	71.1	-68.8	160	0	0	110.6	V70 L105 T109 T110 R112 L117	V70-E103 HydrophobicContact CG2-CB 4.29Å; E103-L105 PolarHBondContact O-N 3.24Å; E103-T109 VanDerWaalsContact O-CA 3.32Å; E103-T109 WeakPolarHBondContact O-CA 3.28Å; E103-T110 PolarHBondContact N-O 3.28Å; E103-T110 PolarHBondContact O-N 2.81Å; E103-T110 WeakPolarHBondContact OE1-CB 3.21Å; E103-T110 VanDerWaalsContact OE1-O 3.06Å; E103-R112 WeakPolarHBondContact OE1-CD 3.23Å; E103-R112 WeakPolarHBondContact OE1-CG 3.32Å; E103-R112 IonicContact OE1-CZ 2.69Å; E103-R112 IonicContact OE1-NE 2.78Å; E103-R112 PolarHBondContact OE1-NE 2.94Å; E103-R112 IonicContact OE1-NH1 3.92Å; E103-R112 PolarHBondContact OE1-NH1 3.23Å; E103-R112 IonicContact OE1-NH2 3.45Å; E103-R112 WeakPolarHBondContact OE2-CB 3.21Å; E103-R112 PolarHBondContact OE2-N 3.4Å; E103-L117 HydrophobicContact CG-CD2 4.15Å
104	A	87.5	Confident	86.9	Confident	34 Å²	34	67.6 Å²	67.6	28%	0.281	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	102.4	171.9	0	0	0	0	0	108.6	G85 R86	G85-A104 CarbonylContact C-O 3.58Å; G85-A104 WeakPolarHBondContact CA-O 3.02Å; R86-A104 PolarHBondContact N-O 3Å; R86-A104 PolarHBondContact O-N 3.38Å
105	L	84	Confident	86.6	Confident	33 Å²	33	63.2 Å²	63.2	17%	0.173	36%	0.359	C	S	.	.			trans	-76.8	175.9	163.6	-62	176.7	0	0	0	109.5	L72 P83 L84 E103 L107 I108	L72-L105 HydrophobicContact CD2-CD1 4.39Å; P83-L105 HydrophobicContact CB-CD2 4.33Å; L84-L105 WeakPolarHBondContact O-CD2 3.28Å; E103-L105 PolarHBondContact O-N 3.24Å; L105-L107 PolarHBondContact O-N 3.05Å; L105-I108 WeakPolarHBondContact CA-O 3.08Å; L105-I108 HydrophobicContact CB-CG1 4.19Å; L105-I108 WeakPolarHBondContact CB-O 3.37Å; L105-I108 HydrophobicContact CD1-CD1 4.35Å; L105-I108 HydrophobicContact CD1-CG1 4.15Å; L105-I108 PolarHBondContact N-O 3.18Å
106	A	77.5	Confident	86.4	Confident	101 Å²	101	62.9 Å²	62.9	84%	0.835	35%	0.353	S	S	*	.	S	Bend	trans	-48.6	-36	-175.6	0	0	0	0	0	115.1
107	L	76.4	Confident	86.4	Confident	169 Å²	169	60.7 Å²	60.7	89%	0.885	33%	0.328	S	S	*	.	S	Bend	trans	-130	-12.2	-175.3	-63.4	175.9	0	0	0	114.5	L105	L105-L107 PolarHBondContact O-N 3.05Å
108	I	83.6	Confident	86.3	Confident	99 Å²	99	61.5 Å²	61.5	51%	0.508	33%	0.33	S	S	.	.			trans	-139.4	142.8	-173.1	61.8	172.8	0	0	0	110.2	L105	L105-I108 WeakPolarHBondContact CA-O 3.08Å; L105-I108 HydrophobicContact CB-CG1 4.19Å; L105-I108 WeakPolarHBondContact CB-O 3.37Å; L105-I108 HydrophobicContact CD1-CD1 4.35Å; L105-I108 HydrophobicContact CD1-CG1 4.15Å; L105-I108 PolarHBondContact N-O 3.18Å
109	T	89	Confident	86.1	Confident	88 Å²	88	62.8 Å²	62.8	54%	0.54	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.5	164.9	-56.1	0	0	0	0	107.8	D102 E103	D102-T109 HydrophobicContact CB-CG2 4.02Å; E103-T109 VanDerWaalsContact O-CA 3.32Å; E103-T109 WeakPolarHBondContact O-CA 3.28Å
110	T	88	Confident	85.8	Confident	48 Å²	48	58.4 Å²	58.4	29%	0.294	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.5	176	-61.4	0	0	0	0	108.6	D102 E103 R112	D102-T110 CarbonylContact C-O 3.53Å; D102-T110 WeakPolarHBondContact CA-O 3.27Å; E103-T110 PolarHBondContact N-O 3.28Å; E103-T110 PolarHBondContact O-N 2.81Å; E103-T110 WeakPolarHBondContact OE1-CB 3.21Å; E103-T110 VanDerWaalsContact OE1-O 3.06Å; T110-R112 HydrophobicContact CG2-CG 4.19Å
111	R	91.6	Very high	85	Confident	136 Å²	136	61 Å²	61	51%	0.513	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	128.1	169.4	-176	168.4	-63.6	172.6	12	109.6	Y91 A101 D102	Y91-R111 VanDerWaalsContact CE2-CZ 3.45Å; Y91-R111 PolarHBondContact OH-NH2 3.47Å; A101-R111 WeakPolarHBondContact O-CA 3.43Å; D102-R111 WeakPolarHBondContact OD1-CB 3.45Å; D102-R111 WeakPolarHBondContact OD1-CG 3.45Å; D102-R111 IonicContact OD1-CZ 3.58Å; D102-R111 IonicContact OD1-NE 3.44Å; D102-R111 PolarHBondContact OD1-NE 2.85Å; D102-R111 IonicContact OD1-NH2 3.58Å; D102-R111 PolarHBondContact OD1-NH2 3.22Å; D102-R111 IonicContact OD2-NH2 3.54Å; D102-R111 PolarHBondContact OD2-NH2 3.03Å
112	R	89.4	Confident	83.7	Confident	39 Å²	39	65.2 Å²	65.2	15%	0.147	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	155.3	173.5	-67.9	179.3	-172.7	127.9	-4.3	112.7	L72 S100 A101 E103 T110 L117	L72-R112 VanDerWaalsContact CD1-NH1 3.28Å; S100-R112 CarbonylContact C-O 3.59Å; S100-R112 WeakPolarHBondContact CA-O 3.47Å; S100-R112 WeakPolarHBondContact CB-O 3.23Å; A101-R112 PolarHBondContact N-O 3.49Å; A101-R112 PolarHBondContact O-N 2.84Å; E103-R112 WeakPolarHBondContact OE1-CD 3.23Å; E103-R112 WeakPolarHBondContact OE1-CG 3.32Å; E103-R112 IonicContact OE1-CZ 2.69Å; E103-R112 IonicContact OE1-NE 2.78Å; E103-R112 PolarHBondContact OE1-NE 2.94Å; E103-R112 IonicContact OE1-NH1 3.92Å; E103-R112 PolarHBondContact OE1-NH1 3.23Å; E103-R112 IonicContact OE1-NH2 3.45Å; E103-R112 WeakPolarHBondContact OE2-CB 3.21Å; E103-R112 PolarHBondContact OE2-N 3.4Å; T110-R112 HydrophobicContact CG2-CG 4.19Å; R112-L117 HydrophobicContact CB-CD1 4.33Å; R112-L117 HydrophobicContact CB-CD2 4.38Å; R112-L117 HydrophobicContact CB-CG 4.34Å
113	S	87.7	Confident	82.1	Confident	50 Å²	50	65.9 Å²	65.9	35%	0.35	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	142.4	167.4	177.9	0	0	0	0	109.1	R99 N115 K116	R99-S113 WeakPolarHBondContact O-CA 3.35Å; R99-S113 PolarHBondContact O-OG 2.85Å; S113-N115 PolarHBondContact O-N 3.23Å; S113-N115 PolarHBondContact OG-N 3.31Å; S113-K116 WeakPolarHBondContact O-CB 3.16Å; S113-K116 PolarHBondContact O-N 2.97Å
114	V	86.2	Confident	80	Confident	7 Å²	7	76.6 Å²	76.6	4%	0.042	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-55.5	-24.1	174.7	-63.9	0	0	0	0	113.2	T61 M64 V98 R99 K116 L117	T61-V114 HydrophobicContact CG2-CB 3.75Å; T61-V114 HydrophobicContact CG2-CG2 3.68Å; M64-V114 HydrophobicContact CE-CB 4.34Å; M64-V114 HydrophobicContact CE-CG1 3.96Å; M64-V114 HydrophobicContact SD-CB 3.68Å; M64-V114 HydrophobicContact SD-CG1 3.44Å; M64-V114 WeakPolarHBondContact SD-CG1 3.03Å; V98-V114 HydrophobicContact CB-CG1 4.42Å; V98-V114 HydrophobicContact CG1-CG1 3.79Å; R99-V114 PolarHBondContact O-N 3.47Å; V114-K116 PolarHBondContact O-N 3.14Å; V114-L117 PolarHBondContact O-N 3.41Å; V114-L117 VanDerWaalsContact O-N 3.1Å; V114-L117 VanDerWaalsContact O-O 3.05Å
115	N	82.6	Confident	79.7	Confident	135 Å²	135	78.8 Å²	78.8	72%	0.722	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-67	-15.9	175.3	-65.6	-25.9	0	0	0	113.6	S113	S113-N115 PolarHBondContact O-N 3.23Å; S113-N115 PolarHBondContact OG-N 3.31Å
116	K	84.1	Confident	79.4	Confident	88 Å²	88	81.2 Å²	81.2	38%	0.383	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-101.8	7.8	176.1	-66.5	-162.3	174.1	-163.1	0	112.6	L72 V73 D74 S113 V114	L72-K116 HydrophobicContact CD1-CB 4.49Å; V73-K116 PolarHBondContact N-O 2.86Å; V73-K116 WeakPolarHBondContact O-CA 3.32Å; V73-K116 VanDerWaalsContact O-CB 3.29Å; V73-K116 WeakPolarHBondContact O-CB 3.28Å; D74-K116 IonicContact OD1-NZ 3.84Å; D74-K116 PolarHBondContact OD1-NZ 3.03Å; S113-K116 WeakPolarHBondContact O-CB 3.16Å; S113-K116 PolarHBondContact O-N 2.97Å; V114-K116 PolarHBondContact O-N 3.14Å
117	L	84.6	Confident	79.5	Confident	8 Å²	8	80.1 Å²	80.1	4%	0.042	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.7	-174.7	-61.4	175.6	0	0	0	108.9	M64 V70 V71 L72 A101 E103 R112 V114	M64-L117 HydrophobicContact CE-CB 3.52Å; M64-L117 HydrophobicContact CE-CD1 3.47Å; M64-L117 VanDerWaalsContact CE-CD1 3.47Å; M64-L117 HydrophobicContact CE-CG 4.13Å; V70-L117 HydrophobicContact CB-CB 4.4Å; V70-L117 HydrophobicContact CG2-CD2 4.02Å; V71-L117 WeakPolarHBondContact O-CA 3.16Å; L72-L117 HydrophobicContact CD1-CD2 4.46Å; A101-L117 HydrophobicContact CB-CD1 4Å; E103-L117 HydrophobicContact CG-CD2 4.15Å; R112-L117 HydrophobicContact CB-CD1 4.33Å; R112-L117 HydrophobicContact CB-CD2 4.38Å; R112-L117 HydrophobicContact CB-CG 4.34Å; V114-L117 PolarHBondContact O-N 3.41Å; V114-L117 VanDerWaalsContact O-N 3.1Å; V114-L117 VanDerWaalsContact O-O 3.05Å
118	L	84	Confident	79.7	Confident	65 Å²	65	74.8 Å²	74.8	34%	0.34	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	125.9	172.4	-66.3	173.9	0	0	0	109	V70 V71 V73 L120	V70-L118 CarbonylContact C-O 3.48Å; V70-L118 WeakPolarHBondContact CA-O 3.3Å; V70-L118 WeakPolarHBondContact CB-O 3.34Å; V71-L118 HydrophobicContact CB-CB 4.26Å; V71-L118 PolarHBondContact N-O 3.45Å; V71-L118 PolarHBondContact O-N 3.39Å; V73-L118 HydrophobicContact CG2-CD1 3.47Å; V73-L118 VanDerWaalsContact CG2-CD1 3.47Å; V73-L118 HydrophobicContact CG2-CG 3.63Å; L118-L120 PolarHBondContact O-N 2.8Å
119	L	83.5	Confident	79.5	Confident	44 Å²	44	73.3 Å²	73.3	23%	0.23	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	127.7	174.9	-175.5	66.1	0	0	0	110	D68 V70 Q121	D68-L119 HydrophobicContact CB-CD1 3.56Å; V70-L119 HydrophobicContact CG1-CD1 4.45Å; L119-Q121 HydrophobicContact CD2-CG 3.95Å; L119-Q121 HydrophobicContact CG-CG 4.08Å
120	L	81.4	Confident	78.9	Confident	30 Å²	30	72.3 Å²	72.3	16%	0.157	39%	0.39	C	S	.	.			trans	-92.5	114	168.1	-74.3	163.4	0	0	0	108.6	L51 L53 V69 V71 L84 L118	L51-L120 HydrophobicContact CD1-CD2 4.05Å; L51-L120 HydrophobicContact CD2-CB 4.42Å; L51-L120 HydrophobicContact CD2-CD2 3.67Å; L51-L120 HydrophobicContact CG-CD2 4.31Å; L53-L120 HydrophobicContact CD2-CD2 4.16Å; V69-L120 HydrophobicContact CB-CB 4.49Å; V69-L120 HydrophobicContact CG1-CB 4.43Å; V69-L120 HydrophobicContact CG1-CD1 3.9Å; V69-L120 PolarHBondContact O-N 2.82Å; V71-L120 HydrophobicContact CG2-CD1 3.5Å; V71-L120 VanDerWaalsContact CG2-CD1 3.5Å; V71-L120 HydrophobicContact CG2-CD2 3.81Å; V71-L120 HydrophobicContact CG2-CG 3.66Å; L84-L120 HydrophobicContact CD1-CD1 4.46Å; L84-L120 HydrophobicContact CD2-CD1 3.38Å; L84-L120 HydrophobicContact CG-CD1 4.48Å; L118-L120 PolarHBondContact O-N 2.8Å
121	Q	72.7	Confident	78.2	Confident	84 Å²	84	74.1 Å²	74.1	39%	0.393	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-99.2	137.9	168.6	-57.4	-168	-88.4	0	0	108.2	R60 L119	R60-Q121 VanDerWaalsContact CZ-OE1 3.23Å; L119-Q121 HydrophobicContact CD2-CG 3.95Å; L119-Q121 HydrophobicContact CG-CG 4.08Å
122	A	64.2	Low	77.2	Confident	87 Å²	87	69.3 Å²	69.3	72%	0.719	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-67.4	135.2	165.5	0	0	0	0	0	108.3
123	A	58.6	Low	76.2	Confident	38 Å²	38	71.8 Å²	71.8	31%	0.314	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-75.8	126.1	161.4	0	0	0	0	0	108.4	H50	H50-A123 HydrophobicContact CB-CB 3.82Å; H50-A123 WeakPolarHBondContact O-CB 3.49Å; H50-A123 PolarHBondContact O-N 2.72Å
124	D	44.4	Very low	75.1	Confident	226 Å²	226	73.8 Å²	73.8	100%	1.209	41%	0.414	S	S	*	.			trans	-59.8	0	168.9	-68.2	-43.2	0	0	0	112.5

Retrieved 124 of 124 residues in 68.5 ms (Link to these results)

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