A0A5K4EZT2_SCHMA Loading...

ZP domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EZT2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 116 aa.

						>A0A5K4EZT2_SCHMA|A0A5K4EZT2
MQGLQAPSRGFCGLIKPGCSGNFHSDSFSTTSASIRQQLGNGLLKMELGEYSLTVLCELTNPNSTYEYSVRQFPSKIMPTFCTYKIQNNKVKLRLRKACGSEQWAGALAVKGLDQS
					

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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	36.5	Very low	39.1	Very low	246 Å²	246	128.5 Å²	128.5	100%	1.212	71%	0.706	S	S	*	*				0	109	0	-67.6	-171.6	-123.7	0	0	108.6	G3	M1-G3 PolarHBondContact O-N 3.3Å
2	Q	36.5	Very low	39.2	Very low	203 Å²	203	128.8 Å²	128.8	95%	0.949	72%	0.721	S	S	*	*			trans	-77.7	101	177.4	-79.9	171.3	-38	0	0	108.5
3	G	37.7	Very low	39.5	Very low	62 Å²	62	124.5 Å²	124.5	64%	0.639	72%	0.724	S	S	*	*			trans	-70.8	145.7	168.5	0	0	0	0	0	110.1	M1 Q5	M1-G3 PolarHBondContact O-N 3.3Å; G3-Q5 PolarHBondContact O-N 3.34Å
4	L	36.7	Very low	39.8	Very low	163 Å²	163	119.4 Å²	119.4	85%	0.853	69%	0.692	S	S	*	*			trans	-49.4	102.5	169.3	-78	157.5	0	0	0	109.4
5	Q	32.5	Very low	40.2	Very low	164 Å²	164	113.6 Å²	113.6	77%	0.766	66%	0.657	S	S	*	*			trans	-99.1	108.9	176.2	-170.4	171.1	1	0	0	107.4	G3	G3-Q5 PolarHBondContact O-N 3.34Å
6	A	44	Very low	41	Very low	45 Å²	45	117.5 Å²	117.5	37%	0.372	66%	0.664	S	S	.	*			trans	-59.5	142.7	172.4	0	0	0	0	0	109.9	S8 N89	A6-S8 PolarHBondContact O-N 3.04Å; A6-N89 HydrophobicContact CB-CB 4.31Å
7	P	35.3	Very low	41.7	Very low	91 Å²	91	118.6 Å²	118.6	59%	0.591	68%	0.677	S	S	*	*			trans	-55.4	131.1	-177.2	-6.8	6.8	0	0	0	111.8	R9	P7-R9 VanDerWaalsContact C-N 3.28Å; P7-R9 PolarHBondContact O-N 2.98Å
8	S	46	Very low	42.8	Very low	99 Å²	99	114.2 Å²	114.2	69%	0.692	66%	0.662	S	S	*	*	S	Bend	trans	-76.2	-6.7	-170.9	51.6	0	0	0	0	115	A6	A6-S8 PolarHBondContact O-N 3.04Å
9	R	40.3	Very low	44.7	Very low	238 Å²	238	109.6 Å²	109.6	90%	0.898	64%	0.636	S	S	*	*	S	Bend	trans	-116.6	91.9	-176.9	-64.3	-172	-175.2	-165.8	2.2	110.3	P7	P7-R9 VanDerWaalsContact C-N 3.28Å; P7-R9 PolarHBondContact O-N 2.98Å
10	G	41.6	Very low	46.8	Very low	58 Å²	58	108.2 Å²	108.2	60%	0.598	63%	0.633	S	S	*	*	S	Bend	trans	149.9	-22.9	170.3	0	0	0	0	0	115.9
11	F	43.3	Very low	48.9	Very low	45 Å²	45	104.1 Å²	104.1	20%	0.197	61%	0.614	C	S	.	*			trans	-101.7	-4.8	-169.1	-68	-84.2	0	0	0	116.1	G13 L14 N41 L59 N89	F11-G13 PolarHBondContact O-N 3.33Å; F11-L14 HydrophobicContact CD1-CB 4.34Å; F11-L14 HydrophobicContact CD1-CD1 3.49Å; F11-L14 VanDerWaalsContact CD1-CD1 3.49Å; F11-L14 HydrophobicContact CD1-CG 4.48Å; F11-L14 HydrophobicContact CE1-CD1 3.89Å; F11-L14 HydrophobicContact CG-CD1 4.26Å; F11-L14 PolarHBondContact O-N 3.13Å; F11-N41 WeakPolarHBondContact CE1-ND2 3.49Å; F11-L59 HydrophobicContact CE1-CD1 4.06Å; F11-L59 HydrophobicContact CZ-CD1 4.24Å; F11-N89 WeakPolarHBondContact CB-ND2 3.14Å; F11-N89 WeakPolarHBondContact CB-OD1 3.35Å
12	C	40.5	Very low	51.5	Low	131 Å²	131	96.6 Å²	96.6	89%	0.885	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-18.5	-176.1	-98.3	0	0	0	0	114.9
13	G	43	Very low	54.1	Low	73 Å²	73	87 Å²	87	75%	0.753	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-6	176	0	0	0	0	0	115.6	F11	F11-G13 PolarHBondContact O-N 3.33Å
14	L	43.7	Very low	56.5	Low	53 Å²	53	89.8 Å²	89.8	28%	0.277	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-16.4	-166.1	-69.8	175.7	0	0	0	114	F11 G40 N41	F11-L14 HydrophobicContact CD1-CB 4.34Å; F11-L14 HydrophobicContact CD1-CD1 3.49Å; F11-L14 VanDerWaalsContact CD1-CD1 3.49Å; F11-L14 HydrophobicContact CD1-CG 4.48Å; F11-L14 HydrophobicContact CE1-CD1 3.89Å; F11-L14 HydrophobicContact CG-CD1 4.26Å; F11-L14 PolarHBondContact O-N 3.13Å; L14-G40 WeakPolarHBondContact O-CA 3.34Å; L14-G40 PolarHBondContact O-N 2.8Å; L14-N41 HydrophobicContact CD1-CB 4.01Å; L14-N41 HydrophobicContact CD2-CB 3.9Å; L14-N41 HydrophobicContact CG-CB 4.39Å
15	I	46.2	Very low	58.9	Low	33 Å²	33	83.6 Å²	83.6	17%	0.169	50%	0.5	C	S	.	.	S	Bend	trans	-122.4	113.6	175	-48.9	179.1	0	0	0	105.6	L39 I86	I15-L39 HydrophobicContact CD1-CD2 4.24Å; I15-L39 HydrophobicContact CG1-CD2 4.22Å; I15-L39 HydrophobicContact CG2-CD2 4.28Å; I15-I86 HydrophobicContact CD1-CG2 3.81Å; I15-I86 HydrophobicContact CG2-CB 4.36Å; I15-I86 HydrophobicContact CG2-CG2 3.8Å
16	K	51.7	Low	60.9	Low	176 Å²	176	83 Å²	83	77%	0.765	50%	0.502	S	S	*	.			trans	-45.6	135	172.9	-75.8	-177.5	177.8	178.3	0	108.4	G18	K16-G18 PolarHBondContact O-N 3.13Å
17	P	53.3	Low	62.3	Low	137 Å²	137	84.2 Å²	84.2	89%	0.89	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	117.6	-176	9.7	-21.1	0	0	0	110.9
18	G	61.8	Low	64	Low	39 Å²	39	90.4 Å²	90.4	40%	0.402	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	57.4	163.9	0	0	0	0	0	116.7	K16 S20 I86	K16-G18 PolarHBondContact O-N 3.13Å; G18-S20 PolarHBondContact O-N 3.11Å; G18-I86 WeakPolarHBondContact CA-O 3.43Å
19	C	78.3	Confident	65.6	Low	27 Å²	27	87.3 Å²	87.3	18%	0.182	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.6	163.8	-60.4	0	0	0	0	109.8	Q37 K85 I86	C19-Q37 HydrophobicContact CB-CG 4.43Å; C19-K85 CarbonylContact O-C 3.53Å; C19-K85 WeakPolarHBondContact O-CA 3.22Å; C19-I86 HydrophobicContact CB-CB 4.44Å; C19-I86 HydrophobicContact CB-CD1 4.39Å; C19-I86 HydrophobicContact CB-CG1 4.49Å; C19-I86 PolarHBondContact O-N 3.46Å
20	S	87.3	Confident	67.5	Low	81 Å²	81	80.3 Å²	80.3	57%	0.566	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.1	150.8	172.4	57.4	0	0	0	0	110.6	G18 Y84	G18-S20 PolarHBondContact O-N 3.11Å; S20-Y84 WeakPolarHBondContact CA-O 3.47Å; S20-Y84 WeakPolarHBondContact CB-O 3.47Å
21	G	90.2	Very high	69.8	Low	22 Å²	22	80.9 Å²	80.9	23%	0.227	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170	-177.2	178.6	0	0	0	0	0	112.4	T83 Y84	G21-T83 VanDerWaalsContact O-CA 3.31Å; G21-T83 WeakPolarHBondContact O-CA 3.39Å; G21-T83 WeakPolarHBondContact O-CB 3.45Å; G21-Y84 PolarHBondContact N-O 3.04Å; G21-Y84 VanDerWaalsContact N-O 3.14Å; G21-Y84 VanDerWaalsContact O-CD1 3.24Å; G21-Y84 WeakPolarHBondContact O-CD1 3.46Å; G21-Y84 PolarHBondContact O-N 3.08Å
22	N	91	Very high	72.2	Confident	88 Å²	88	80.5 Å²	80.5	47%	0.471	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	156.3	177.2	-60.8	-2.9	0	0	0	109.2	H24 I35 T83	N22-H24 PolarHBondContact O-CD2 3.26Å; N22-H24 PolarHBondContact O-NE2 2.86Å; N22-I35 WeakPolarHBondContact O-CG2 3.43Å; N22-T83 WeakPolarHBondContact OD1-CG2 3.49Å
23	F	91.6	Very high	74.7	Confident	2 Å²	2	74.5 Å²	74.5	1%	0.009	44%	0.443	C	S	.	.			trans	-78.7	139.2	165.5	-77.9	-103	0	0	0	109.7	A33 I35 M46 L48 P79 C82 Y84 L93	F23-A33 HydrophobicContact CB-CB 3.67Å; F23-I35 HydrophobicContact CB-CG2 4.28Å; F23-I35 HydrophobicContact CD1-CG1 4.49Å; F23-I35 HydrophobicContact CD1-CG2 3.77Å; F23-I35 HydrophobicContact CD2-CG2 4.27Å; F23-I35 HydrophobicContact CE1-CG1 4.03Å; F23-I35 HydrophobicContact CE1-CG2 4.13Å; F23-I35 HydrophobicContact CG-CG2 3.85Å; F23-I35 HydrophobicContact CZ-CG1 4.24Å; F23-M46 HydrophobicContact CE1-CB 3.78Å; F23-M46 HydrophobicContact CZ-CB 3.98Å; F23-M46 HydrophobicContact CZ-CE 4.07Å; F23-M46 HydrophobicContact CZ-SD 4.37Å; F23-L48 HydrophobicContact CB-CD1 4.44Å; F23-L48 HydrophobicContact CD1-CB 4.35Å; F23-L48 HydrophobicContact CD1-CD1 3.6Å; F23-L48 HydrophobicContact CD1-CG 3.87Å; F23-L48 HydrophobicContact CD2-CD1 3.74Å; F23-L48 HydrophobicContact CE1-CB 4.45Å; F23-L48 HydrophobicContact CE1-CD1 3.63Å; F23-L48 HydrophobicContact CE1-CG 3.62Å; F23-L48 HydrophobicContact CE2-CD1 3.75Å; F23-L48 HydrophobicContact CG-CD1 3.66Å; F23-L48 HydrophobicContact CG-CG 4.43Å; F23-L48 HydrophobicContact CZ-CD1 3.69Å; F23-L48 HydrophobicContact CZ-CG 3.97Å; F23-P79 WeakPolarHBondContact CB-O 3.31Å; F23-C82 HydrophobicContact CD2-CB 3.92Å; F23-C82 HydrophobicContact CE2-CB 4.44Å; F23-C82 HydrophobicContact CG-CB 4.48Å; F23-C82 PolarHBondContact N-O 3.05Å; F23-C82 VanDerWaalsContact N-O 3.08Å; F23-Y84 HydrophobicContact CD2-CD1 4.49Å; F23-Y84 HydrophobicContact CE2-CD1 4.23Å; F23-L93 HydrophobicContact CE2-CD2 3.8Å; F23-L93 HydrophobicContact CZ-CD2 3.75Å
24	H	88.7	Confident	77.1	Confident	120 Å²	120	72.9 Å²	72.9	56%	0.556	42%	0.42	S	S	*	.	B	Isolated β-bridge	trans	-120.5	146.1	-178.7	-63.3	-81	0	0	0	109.7	N22 A33 S34	N22-H24 PolarHBondContact O-CD2 3.26Å; N22-H24 PolarHBondContact O-NE2 2.86Å; H24-A33 CarbonylContact O-C 3.47Å; H24-A33 VanDerWaalsContact O-CA 3.26Å; H24-A33 WeakPolarHBondContact O-CA 3.41Å; H24-A33 WeakPolarHBondContact O-CB 3.4Å; H24-S34 PolarHBondContact N-O 2.99Å; H24-S34 VanDerWaalsContact N-O 3.17Å; H24-S34 PolarHBondContact O-N 3.45Å
25	S	86.1	Confident	79.4	Confident	34 Å²	34	71 Å²	71	24%	0.238	41%	0.41	C	S	.	.			trans	-101.5	136.2	172.1	-172.8	0	0	0	0	109.6	S27 S29 S32	S25-S27 VanDerWaalsContact C-N 3.35Å; S25-S27 WeakPolarHBondContact CB-O 3.3Å; S25-S27 PolarHBondContact OG-O 2.75Å; S25-S29 WeakPolarHBondContact CB-O 3.49Å; S25-S29 PolarHBondContact OG-O 3.33Å; S25-S32 VanDerWaalsContact CB-O 3.27Å; S25-S32 WeakPolarHBondContact CB-O 3.38Å; S25-S32 PolarHBondContact OG-O 2.91Å
26	D	76.2	Confident	81.6	Confident	150 Å²	150	77.9 Å²	77.9	80%	0.802	43%	0.434	S	S	*	.	S	Bend	trans	-77.9	-24.7	-179.3	-61.4	-34.1	0	0	0	112.4
27	S	71.8	Confident	83.4	Confident	72 Å²	72	71.4 Å²	71.4	50%	0.503	41%	0.407	S	S	.	.	S	Bend	trans	-118.7	149.4	174.1	47.9	0	0	0	0	107.3	S25 S29	S25-S27 VanDerWaalsContact C-N 3.35Å; S25-S27 WeakPolarHBondContact CB-O 3.3Å; S25-S27 PolarHBondContact OG-O 2.75Å; S27-S29 WeakPolarHBondContact O-CA 3.13Å; S27-S29 WeakPolarHBondContact O-CB 3.45Å; S27-S29 PolarHBondContact O-N 3.33Å
28	F	72.4	Confident	85	Confident	220 Å²	220	70.9 Å²	70.9	97%	0.965	39%	0.392	S	S	*	.	S	Bend	trans	-52.5	1.5	178.4	-59.7	-87.7	0	0	0	115.5
29	S	77.8	Confident	86.1	Confident	35 Å²	35	69.7 Å²	69.7	25%	0.245	38%	0.376	C	S	.	.			trans	-41.6	131.8	156.1	-177.9	0	0	0	0	113.1	S25 S27 T31 S32	S25-S29 WeakPolarHBondContact CB-O 3.49Å; S25-S29 PolarHBondContact OG-O 3.33Å; S27-S29 WeakPolarHBondContact O-CA 3.13Å; S27-S29 WeakPolarHBondContact O-CB 3.45Å; S27-S29 PolarHBondContact O-N 3.33Å; S29-T31 PolarHBondContact OG-N 3.17Å; S29-T31 VanDerWaalsContact OG-N 3.15Å; S29-T31 PolarHBondContact OG-OG1 2.74Å; S29-S32 PolarHBondContact OG-OG 2.97Å
30	T	80.8	Confident	86.4	Confident	91 Å²	91	71.5 Å²	71.5	56%	0.558	40%	0.4	S	S	*	.	S	Bend	trans	-104.6	-0.2	168.3	54.7	0	0	0	0	111.7	P79	T30-P79 WeakPolarHBondContact O-CD 3.34Å
31	T	89.6	Confident	86.3	Confident	69 Å²	69	68.2 Å²	68.2	42%	0.423	38%	0.376	S	S	.	.	S	Bend	trans	-91.6	-14.3	-172.9	66.5	0	0	0	0	113	S29 E50	S29-T31 PolarHBondContact OG-N 3.17Å; S29-T31 VanDerWaalsContact OG-N 3.15Å; S29-T31 PolarHBondContact OG-OG1 2.74Å; T31-E50 HydrophobicContact CG2-CG 4.42Å; T31-E50 VanDerWaalsContact O-CG 3.26Å; T31-E50 WeakPolarHBondContact O-CG 3.46Å; T31-E50 PolarHBondContact O-N 3.28Å
32	S	93.3	Very high	86.3	Confident	38 Å²	38	67.4 Å²	67.4	27%	0.266	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	146.7	178.5	56.6	0	0	0	0	109.9	S25 S29 L48	S25-S32 VanDerWaalsContact CB-O 3.27Å; S25-S32 WeakPolarHBondContact CB-O 3.38Å; S25-S32 PolarHBondContact OG-O 2.91Å; S29-S32 PolarHBondContact OG-OG 2.97Å; S32-L48 CarbonylContact C-O 3.58Å; S32-L48 VanDerWaalsContact CA-O 3.22Å; S32-L48 WeakPolarHBondContact CA-O 3.32Å
33	A	94.2	Very high	86.3	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.033	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	146.2	169.9	0	0	0	0	0	109.9	F23 H24 L48 P79 T80	F23-A33 HydrophobicContact CB-CB 3.67Å; H24-A33 CarbonylContact O-C 3.47Å; H24-A33 VanDerWaalsContact O-CA 3.26Å; H24-A33 WeakPolarHBondContact O-CA 3.41Å; H24-A33 WeakPolarHBondContact O-CB 3.4Å; A33-L48 PolarHBondContact N-O 2.94Å; A33-L48 PolarHBondContact O-N 2.76Å; A33-P79 HydrophobicContact CB-CB 3.54Å; A33-T80 HydrophobicContact CB-CG2 4.01Å
34	S	94.1	Very high	86.3	Confident	39 Å²	39	64 Å²	64	27%	0.273	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	163.7	-177.6	78.3	0	0	0	0	111.7	H24 M46	H24-S34 PolarHBondContact N-O 2.99Å; H24-S34 VanDerWaalsContact N-O 3.17Å; H24-S34 PolarHBondContact O-N 3.45Å; S34-M46 CarbonylContact C-O 3.58Å; S34-M46 WeakPolarHBondContact CA-O 3.18Å; S34-M46 WeakPolarHBondContact CB-O 3.15Å
35	I	92.1	Very high	86.6	Confident	13 Å²	13	61.5 Å²	61.5	7%	0.067	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	150.8	166.6	65.9	95.9	0	0	0	109.2	N22 F23 Q37 K45 M46 Y84	N22-I35 WeakPolarHBondContact O-CG2 3.43Å; F23-I35 HydrophobicContact CB-CG2 4.28Å; F23-I35 HydrophobicContact CD1-CG1 4.49Å; F23-I35 HydrophobicContact CD1-CG2 3.77Å; F23-I35 HydrophobicContact CD2-CG2 4.27Å; F23-I35 HydrophobicContact CE1-CG1 4.03Å; F23-I35 HydrophobicContact CE1-CG2 4.13Å; F23-I35 HydrophobicContact CG-CG2 3.85Å; F23-I35 HydrophobicContact CZ-CG1 4.24Å; I35-Q37 HydrophobicContact CD1-CB 4.12Å; I35-K45 WeakPolarHBondContact O-CA 3.38Å; I35-M46 HydrophobicContact CD1-CB 4.25Å; I35-M46 HydrophobicContact CD1-CE 3.38Å; I35-M46 HydrophobicContact CD1-CG 4.21Å; I35-M46 HydrophobicContact CG1-CB 3.88Å; I35-M46 HydrophobicContact CG1-CE 3.64Å; I35-M46 HydrophobicContact CG1-CG 4.35Å; I35-M46 PolarHBondContact N-O 3.15Å; I35-M46 PolarHBondContact O-N 2.77Å; I35-Y84 HydrophobicContact CB-CD1 4.47Å; I35-Y84 HydrophobicContact CB-CE1 4.06Å; I35-Y84 HydrophobicContact CD1-CE1 4.34Å; I35-Y84 HydrophobicContact CD1-CE2 4.5Å; I35-Y84 HydrophobicContact CG1-CD1 4.21Å; I35-Y84 HydrophobicContact CG1-CE1 4.17Å; I35-Y84 HydrophobicContact CG2-CD1 3.96Å; I35-Y84 HydrophobicContact CG2-CE1 3.7Å
36	R	91.3	Very high	87	Confident	179 Å²	179	60 Å²	60	68%	0.675	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	113.8	168.9	-177.1	176.7	177.1	154	2.3	108.4	L43 L44 K45	R36-L43 HydrophobicContact CG-CD1 3.4Å; R36-L43 VanDerWaalsContact CG-CD1 3.4Å; R36-L43 HydrophobicContact CG-CD2 4.29Å; R36-L43 HydrophobicContact CG-CG 4.23Å; R36-L44 CarbonylContact C-O 3.52Å; R36-L44 WeakPolarHBondContact CA-O 3.35Å; R36-K45 HydrophobicContact CG-CG 4.38Å
37	Q	89.1	Confident	87.9	Confident	40 Å²	40	58.3 Å²	58.3	19%	0.187	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.3	-179.4	-179.7	57.9	62.1	0	0	110.3	C19 I35 L39 L43 L44 Y84 I86	C19-Q37 HydrophobicContact CB-CG 4.43Å; I35-Q37 HydrophobicContact CD1-CB 4.12Å; Q37-L39 HydrophobicContact CG-CD2 4.31Å; Q37-L39 PolarHBondContact O-N 2.8Å; Q37-L43 WeakPolarHBondContact O-CD1 3.41Å; Q37-L44 HydrophobicContact CB-CB 4.39Å; Q37-L44 PolarHBondContact N-O 2.83Å; Q37-L44 PolarHBondContact O-N 3.47Å; Q37-Y84 PolarHBondContact OE1-OH 2.83Å; Q37-I86 HydrophobicContact CB-CD1 4.31Å; Q37-I86 HydrophobicContact CG-CD1 3.68Å
38	Q	87.5	Confident	89	Confident	126 Å²	126	54.9 Å²	54.9	59%	0.589	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	128.4	171.8	-163.3	65.9	18.9	0	0	109.8	G42	Q38-G42 PolarHBondContact NE2-O 2.85Å
39	L	85.1	Confident	90.1	Very high	13 Å²	13	45 Å²	45	7%	0.068	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	159.1	170.4	-51	179.8	0	0	0	108.4	I15 Q37 N41 G42 L44 L59 I86	I15-L39 HydrophobicContact CD1-CD2 4.24Å; I15-L39 HydrophobicContact CG1-CD2 4.22Å; I15-L39 HydrophobicContact CG2-CD2 4.28Å; Q37-L39 HydrophobicContact CG-CD2 4.31Å; Q37-L39 PolarHBondContact O-N 2.8Å; L39-N41 PolarHBondContact O-N 2.79Å; L39-G42 WeakPolarHBondContact CA-O 3.06Å; L39-G42 PolarHBondContact N-O 3.23Å; L39-G42 PolarHBondContact O-N 2.88Å; L39-G42 VanDerWaalsContact O-O 3.05Å; L39-L44 HydrophobicContact CD1-CB 4.19Å; L39-L44 HydrophobicContact CD2-CB 4.37Å; L39-L44 HydrophobicContact CG-CB 4.3Å; L39-L59 HydrophobicContact CD1-CD2 4.2Å; L39-I86 HydrophobicContact CD2-CD1 4.07Å
40	G	83.5	Confident	90.8	Very high	66 Å²	66	45.5 Å²	45.5	68%	0.68	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.3	178.3	0	0	0	0	0	113.6	L14	L14-G40 WeakPolarHBondContact O-CA 3.34Å; L14-G40 PolarHBondContact O-N 2.8Å
41	N	85.7	Confident	91.4	Very high	11 Å²	11	45.7 Å²	45.7	6%	0.059	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.4	31.3	176.9	72.8	-42	0	0	0	112.4	F11 L14 L39 L59 T60	F11-N41 WeakPolarHBondContact CE1-ND2 3.49Å; L14-N41 HydrophobicContact CD1-CB 4.01Å; L14-N41 HydrophobicContact CD2-CB 3.9Å; L14-N41 HydrophobicContact CG-CB 4.39Å; L39-N41 PolarHBondContact O-N 2.79Å; N41-L59 CarbonylContact O-C 3.6Å; N41-L59 VanDerWaalsContact O-CA 3.3Å; N41-L59 WeakPolarHBondContact O-CA 3.24Å; N41-T60 PolarHBondContact O-N 3.01Å; N41-T60 PolarHBondContact O-OG1 2.84Å
42	G	90.1	Very high	91.6	Very high	6 Å²	6	44.4 Å²	44.4	6%	0.062	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.9	-154.4	-177.7	0	0	0	0	0	115.2	Q38 L39 E58	Q38-G42 PolarHBondContact NE2-O 2.85Å; L39-G42 WeakPolarHBondContact CA-O 3.06Å; L39-G42 PolarHBondContact N-O 3.23Å; L39-G42 PolarHBondContact O-N 2.88Å; L39-G42 VanDerWaalsContact O-O 3.05Å; G42-E58 CarbonylContact C-O 3.59Å; G42-E58 WeakPolarHBondContact CA-O 3.37Å
43	L	91.2	Very high	91.6	Very high	13 Å²	13	43.1 Å²	43.1	7%	0.068	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	131.2	-173.7	-177.7	61.5	0	0	0	110.7	R36 Q37 K45 C57 E58	R36-L43 HydrophobicContact CG-CD1 3.4Å; R36-L43 VanDerWaalsContact CG-CD1 3.4Å; R36-L43 HydrophobicContact CG-CD2 4.29Å; R36-L43 HydrophobicContact CG-CG 4.23Å; Q37-L43 WeakPolarHBondContact O-CD1 3.41Å; L43-K45 HydrophobicContact CD2-CD 4.41Å; L43-K45 HydrophobicContact CD2-CG 4.22Å; L43-K45 HydrophobicContact CG-CG 4.18Å; L43-C57 CarbonylContact O-C 3.4Å; L43-C57 WeakPolarHBondContact O-CA 3.49Å; L43-E58 PolarHBondContact N-O 3.34Å; L43-E58 PolarHBondContact O-N 3.44Å
44	L	92.1	Very high	91.6	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.026	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.2	168.9	179.8	70.3	0	0	0	108.8	R36 Q37 L39 M46 V55 L56 C57 I86 V91	R36-L44 CarbonylContact C-O 3.52Å; R36-L44 WeakPolarHBondContact CA-O 3.35Å; Q37-L44 HydrophobicContact CB-CB 4.39Å; Q37-L44 PolarHBondContact N-O 2.83Å; Q37-L44 PolarHBondContact O-N 3.47Å; L39-L44 HydrophobicContact CD1-CB 4.19Å; L39-L44 HydrophobicContact CD2-CB 4.37Å; L39-L44 HydrophobicContact CG-CB 4.3Å; L44-M46 HydrophobicContact CD1-CG 4.36Å; L44-M46 HydrophobicContact CD2-CE 3.96Å; L44-M46 HydrophobicContact CD2-SD 4.34Å; L44-M46 HydrophobicContact CG-CG 4.24Å; L44-V55 HydrophobicContact CD1-CG1 3.72Å; L44-L56 CarbonylContact C-O 3.42Å; L44-L56 WeakPolarHBondContact CA-O 3.39Å; L44-C57 HydrophobicContact CD1-CB 4.05Å; L44-I86 HydrophobicContact CD2-CD1 3.58Å; L44-I86 HydrophobicContact CD2-CG1 4.3Å; L44-V91 HydrophobicContact CD1-CG2 4.35Å; L44-V91 HydrophobicContact CD2-CG1 4.5Å; L44-V91 HydrophobicContact CD2-CG2 3.54Å
45	K	94	Very high	91.6	Very high	68 Å²	68	44.6 Å²	44.6	30%	0.296	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	137.8	168.7	-57.6	175.4	-171	142.8	0	108.3	I35 R36 L43 V55 L56 E58	I35-K45 WeakPolarHBondContact O-CA 3.38Å; R36-K45 HydrophobicContact CG-CG 4.38Å; L43-K45 HydrophobicContact CD2-CD 4.41Å; L43-K45 HydrophobicContact CD2-CG 4.22Å; L43-K45 HydrophobicContact CG-CG 4.18Å; K45-V55 WeakPolarHBondContact O-CA 3.33Å; K45-L56 HydrophobicContact CB-CB 4.35Å; K45-L56 HydrophobicContact CD-CD2 4.26Å; K45-L56 PolarHBondContact N-O 3.17Å; K45-L56 PolarHBondContact O-N 3.35Å; K45-E58 WeakPolarHBondContact CE-OE2 3.31Å; K45-E58 IonicContact NZ-OE2 2.64Å; K45-E58 PolarHBondContact NZ-OE2 3.02Å
46	M	94.7	Very high	91.7	Very high	3 Å²	3	45.9 Å²	45.9	2%	0.015	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	139.4	170.1	-57.2	-175.3	-80.4	0	0	109.6	F23 S34 I35 L44 L53 T54 V55 Y84 V91 L93	F23-M46 HydrophobicContact CE1-CB 3.78Å; F23-M46 HydrophobicContact CZ-CB 3.98Å; F23-M46 HydrophobicContact CZ-CE 4.07Å; F23-M46 HydrophobicContact CZ-SD 4.37Å; S34-M46 CarbonylContact C-O 3.58Å; S34-M46 WeakPolarHBondContact CA-O 3.18Å; S34-M46 WeakPolarHBondContact CB-O 3.15Å; I35-M46 HydrophobicContact CD1-CB 4.25Å; I35-M46 HydrophobicContact CD1-CE 3.38Å; I35-M46 HydrophobicContact CD1-CG 4.21Å; I35-M46 HydrophobicContact CG1-CB 3.88Å; I35-M46 HydrophobicContact CG1-CE 3.64Å; I35-M46 HydrophobicContact CG1-CG 4.35Å; I35-M46 PolarHBondContact N-O 3.15Å; I35-M46 PolarHBondContact O-N 2.77Å; L44-M46 HydrophobicContact CD1-CG 4.36Å; L44-M46 HydrophobicContact CD2-CE 3.96Å; L44-M46 HydrophobicContact CD2-SD 4.34Å; L44-M46 HydrophobicContact CG-CG 4.24Å; M46-L53 HydrophobicContact CB-CD1 4.44Å; M46-T54 CarbonylContact C-O 3.55Å; M46-T54 VanDerWaalsContact CA-O 3.25Å; M46-T54 WeakPolarHBondContact CA-O 3.18Å; M46-V55 HydrophobicContact CG-CB 4.34Å; M46-V55 HydrophobicContact CG-CG1 4.02Å; M46-V55 HydrophobicContact CG-CG2 3.99Å; M46-V55 HydrophobicContact SD-CG1 4.46Å; M46-V55 HydrophobicContact SD-CG2 4.16Å; M46-Y84 HydrophobicContact CE-CD1 4.46Å; M46-Y84 HydrophobicContact CE-CD2 4.05Å; M46-Y84 HydrophobicContact CE-CG 3.83Å; M46-V91 HydrophobicContact CE-CG1 3.72Å; M46-V91 HydrophobicContact SD-CG1 3.54Å; M46-V91 VanDerWaalsContact SD-CG1 3.54Å; M46-L93 HydrophobicContact CE-CD2 3.93Å; M46-L93 HydrophobicContact SD-CD1 4.44Å; M46-L93 HydrophobicContact SD-CD2 3.78Å; M46-L93 HydrophobicContact SD-CG 4.5Å
47	E	95.1	Very high	91.8	Very high	114 Å²	114	38.6 Å²	38.6	53%	0.533	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.9	177	-172.6	177.9	167.6	0	0	108.6	L53 T54	E47-L53 CarbonylContact O-C 3.38Å; E47-L53 VanDerWaalsContact O-CA 3.29Å; E47-L53 WeakPolarHBondContact O-CA 3.23Å; E47-T54 PolarHBondContact N-O 2.73Å; E47-T54 PolarHBondContact O-N 2.86Å
48	L	95.1	Very high	92	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.5	174.3	-73.2	175	0	0	0	108.8	F23 S32 A33 S52 L53 F73 I77 P79 C82 L95	F23-L48 HydrophobicContact CB-CD1 4.44Å; F23-L48 HydrophobicContact CD1-CB 4.35Å; F23-L48 HydrophobicContact CD1-CD1 3.6Å; F23-L48 HydrophobicContact CD1-CG 3.87Å; F23-L48 HydrophobicContact CD2-CD1 3.74Å; F23-L48 HydrophobicContact CE1-CB 4.45Å; F23-L48 HydrophobicContact CE1-CD1 3.63Å; F23-L48 HydrophobicContact CE1-CG 3.62Å; F23-L48 HydrophobicContact CE2-CD1 3.75Å; F23-L48 HydrophobicContact CG-CD1 3.66Å; F23-L48 HydrophobicContact CG-CG 4.43Å; F23-L48 HydrophobicContact CZ-CD1 3.69Å; F23-L48 HydrophobicContact CZ-CG 3.97Å; S32-L48 CarbonylContact C-O 3.58Å; S32-L48 VanDerWaalsContact CA-O 3.22Å; S32-L48 WeakPolarHBondContact CA-O 3.32Å; A33-L48 PolarHBondContact N-O 2.94Å; A33-L48 PolarHBondContact O-N 2.76Å; L48-S52 WeakPolarHBondContact CA-O 3.48Å; L48-L53 HydrophobicContact CD2-CB 3.89Å; L48-L53 HydrophobicContact CD2-CD1 3.6Å; L48-L53 HydrophobicContact CD2-CG 4.29Å; L48-L53 HydrophobicContact CG-CD1 4.3Å; L48-F73 HydrophobicContact CD2-CE2 4.31Å; L48-F73 HydrophobicContact CD2-CZ 4.27Å; L48-I77 HydrophobicContact CB-CD1 4.38Å; L48-I77 HydrophobicContact CD1-CD1 4.28Å; L48-I77 HydrophobicContact CD2-CD1 3.97Å; L48-I77 HydrophobicContact CG-CD1 4.46Å; L48-P79 HydrophobicContact CB-CB 3.92Å; L48-P79 HydrophobicContact CB-CG 4.37Å; L48-C82 HydrophobicContact CD1-CB 3.41Å; L48-C82 VanDerWaalsContact CD1-CB 3.41Å; L48-L95 HydrophobicContact CD1-CD2 4.1Å; L48-L95 HydrophobicContact CD2-CD2 3.83Å
49	G	94.7	Very high	92.2	Very high	12 Å²	12	34.7 Å²	34.7	12%	0.124	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	174.8	156.9	0	0	0	0	0	110.5	Y51 S52 I77	G49-Y51 PolarHBondContact O-N 2.75Å; G49-Y51 VanDerWaalsContact O-N 3.08Å; G49-S52 PolarHBondContact N-O 2.78Å; G49-S52 PolarHBondContact O-N 2.86Å; G49-I77 WeakPolarHBondContact O-CD1 3.34Å; G49-I77 WeakPolarHBondContact O-CG1 3.44Å
50	E	93.5	Very high	92.3	Very high	45 Å²	45	37.6 Å²	37.6	21%	0.21	21%	0.214	C	C	.	.	S	Bend	trans	-58.6	-23.6	177.4	-57.7	-163.3	127.7	0	0	113.8	T31 K76 I77	T31-E50 HydrophobicContact CG2-CG 4.42Å; T31-E50 VanDerWaalsContact O-CG 3.26Å; T31-E50 WeakPolarHBondContact O-CG 3.46Å; T31-E50 PolarHBondContact O-N 3.28Å; E50-K76 HydrophobicContact CB-CG 4.06Å; E50-K76 CarbonylContact O-C 3.52Å; E50-K76 WeakPolarHBondContact O-CA 3.49Å; E50-K76 WeakPolarHBondContact OE1-CE 3.17Å; E50-K76 IonicContact OE1-NZ 2.72Å; E50-K76 PolarHBondContact OE1-NZ 2.77Å; E50-K76 VanDerWaalsContact OE2-CE 3.29Å; E50-K76 WeakPolarHBondContact OE2-CE 3.33Å; E50-K76 IonicContact OE2-NZ 2.73Å; E50-K76 PolarHBondContact OE2-NZ 2.82Å; E50-I77 WeakPolarHBondContact O-CG1 3.29Å; E50-I77 PolarHBondContact O-N 2.84Å
51	Y	92.6	Very high	92.3	Very high	95 Å²	95	40.9 Å²	40.9	37%	0.373	22%	0.216	S	C	.	.	S	Bend	trans	-132.5	4.1	179.9	-63.1	-83.5	0	0	0	113.2	G49 Q72 F73 K76	G49-Y51 PolarHBondContact O-N 2.75Å; G49-Y51 VanDerWaalsContact O-N 3.08Å; Y51-Q72 CarbonylContact O-C 3.51Å; Y51-Q72 WeakPolarHBondContact O-CA 3.28Å; Y51-F73 WeakPolarHBondContact O-CD2 3.25Å; Y51-F73 PolarHBondContact O-N 2.99Å; Y51-K76 HydrophobicContact CD1-CB 4.46Å; Y51-K76 VanDerWaalsContact CE1-CA 3.47Å; Y51-K76 HydrophobicContact CE1-CB 3.67Å; Y51-K76 HydrophobicContact CE1-CG 4.36Å; Y51-K76 VanDerWaalsContact CE1-N 3.26Å; Y51-K76 HydrophobicContact CE2-CB 4.35Å; Y51-K76 HydrophobicContact CE2-CD 4.31Å; Y51-K76 HydrophobicContact CE2-CG 4.19Å
52	S	93.8	Very high	92.3	Very high	42 Å²	42	44.7 Å²	44.7	29%	0.294	24%	0.241	S	C	.	.			trans	-137.4	159.5	-169.8	59.9	0	0	0	0	112.2	L48 G49 V70 F73	L48-S52 WeakPolarHBondContact CA-O 3.48Å; G49-S52 PolarHBondContact N-O 2.78Å; G49-S52 PolarHBondContact O-N 2.86Å; S52-V70 CarbonylContact C-O 3.52Å; S52-V70 WeakPolarHBondContact CA-O 3.35Å; S52-V70 VanDerWaalsContact CB-O 3.3Å; S52-V70 WeakPolarHBondContact CB-O 3.34Å; S52-F73 WeakPolarHBondContact O-CE2 3.29Å
53	L	94.2	Very high	92.3	Very high	11 Å²	11	50.7 Å²	50.7	6%	0.058	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	134.1	171.8	164.5	70.5	0	0	0	108.3	M46 E47 L48 V55 S69 V70 F73 L93	M46-L53 HydrophobicContact CB-CD1 4.44Å; E47-L53 CarbonylContact O-C 3.38Å; E47-L53 VanDerWaalsContact O-CA 3.29Å; E47-L53 WeakPolarHBondContact O-CA 3.23Å; L48-L53 HydrophobicContact CD2-CB 3.89Å; L48-L53 HydrophobicContact CD2-CD1 3.6Å; L48-L53 HydrophobicContact CD2-CG 4.29Å; L48-L53 HydrophobicContact CG-CD1 4.3Å; L53-V55 HydrophobicContact CD1-CG2 3.74Å; L53-V55 HydrophobicContact CD2-CG2 3.96Å; L53-V55 HydrophobicContact CG-CG2 3.82Å; L53-S69 CarbonylContact O-C 3.48Å; L53-S69 WeakPolarHBondContact O-CA 3.18Å; L53-V70 HydrophobicContact CB-CB 4.25Å; L53-V70 HydrophobicContact CB-CG2 4.48Å; L53-V70 HydrophobicContact CD2-CG2 4.42Å; L53-V70 PolarHBondContact N-O 2.85Å; L53-V70 PolarHBondContact O-N 3.49Å; L53-F73 HydrophobicContact CB-CE1 4.34Å; L53-F73 HydrophobicContact CB-CE2 4.43Å; L53-F73 HydrophobicContact CB-CZ 3.63Å; L53-L93 HydrophobicContact CD1-CD1 3.81Å; L53-L93 HydrophobicContact CD2-CD1 3.36Å; L53-L93 HydrophobicContact CG-CD1 4.25Å
54	T	94.6	Very high	92.4	Very high	52 Å²	52	51.7 Å²	51.7	32%	0.319	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.1	165.2	-57.7	0	0	0	0	108.2	M46 E47 Y68	M46-T54 CarbonylContact C-O 3.55Å; M46-T54 VanDerWaalsContact CA-O 3.25Å; M46-T54 WeakPolarHBondContact CA-O 3.18Å; E47-T54 PolarHBondContact N-O 2.73Å; E47-T54 PolarHBondContact O-N 2.86Å; T54-Y68 CarbonylContact C-O 3.58Å
55	V	93.9	Very high	92.5	Very high	23 Å²	23	56 Å²	56	14%	0.139	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.9	176.5	-178.8	0	0	0	0	107.4	L44 K45 M46 L53 E67 Y68	L44-V55 HydrophobicContact CD1-CG1 3.72Å; K45-V55 WeakPolarHBondContact O-CA 3.33Å; M46-V55 HydrophobicContact CG-CB 4.34Å; M46-V55 HydrophobicContact CG-CG1 4.02Å; M46-V55 HydrophobicContact CG-CG2 3.99Å; M46-V55 HydrophobicContact SD-CG1 4.46Å; M46-V55 HydrophobicContact SD-CG2 4.16Å; L53-V55 HydrophobicContact CD1-CG2 3.74Å; L53-V55 HydrophobicContact CD2-CG2 3.96Å; L53-V55 HydrophobicContact CG-CG2 3.82Å; V55-E67 CarbonylContact O-C 3.51Å; V55-E67 VanDerWaalsContact O-CA 3.32Å; V55-E67 WeakPolarHBondContact O-CA 3.16Å; V55-Y68 HydrophobicContact CG2-CD1 4.49Å; V55-Y68 PolarHBondContact N-O 3.5Å; V55-Y68 PolarHBondContact O-N 2.71Å
56	L	94.6	Very high	92.4	Very high	40 Å²	40	59.3 Å²	59.3	21%	0.209	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.2	173.2	-175.5	72.7	0	0	0	108.8	L44 K45 E58 T65 Y66 E67	L44-L56 CarbonylContact C-O 3.42Å; L44-L56 WeakPolarHBondContact CA-O 3.39Å; K45-L56 HydrophobicContact CB-CB 4.35Å; K45-L56 HydrophobicContact CD-CD2 4.26Å; K45-L56 PolarHBondContact N-O 3.17Å; K45-L56 PolarHBondContact O-N 3.35Å; L56-E58 HydrophobicContact CD2-CG 4.04Å; L56-E58 HydrophobicContact CG-CG 4.05Å; L56-T65 HydrophobicContact CD1-CG2 3.47Å; L56-T65 VanDerWaalsContact CD1-CG2 3.47Å; L56-T65 HydrophobicContact CG-CG2 4.41Å; L56-Y66 CarbonylContact C-O 3.5Å; L56-Y66 WeakPolarHBondContact CA-O 3.3Å; L56-E67 HydrophobicContact CD1-CB 4.26Å; L56-E67 HydrophobicContact CD1-CG 4.49Å
57	C	92.9	Very high	92.3	Very high	25 Å²	25	66 Å²	66	17%	0.169	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	110.6	175.4	-171.4	0	0	0	0	109	L43 L44 T65 Y66	L43-C57 CarbonylContact O-C 3.4Å; L43-C57 WeakPolarHBondContact O-CA 3.49Å; L44-C57 HydrophobicContact CD1-CB 4.05Å; C57-T65 CarbonylContact O-C 3.54Å; C57-T65 WeakPolarHBondContact O-CA 3.5Å; C57-Y66 PolarHBondContact N-O 2.82Å; C57-Y66 PolarHBondContact O-N 2.95Å
58	E	92.7	Very high	92.1	Very high	66 Å²	66	64.1 Å²	64.1	31%	0.308	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	109.5	179.3	-59.7	174.5	106.1	0	0	107.8	G42 L43 K45 L56 T65	G42-E58 CarbonylContact C-O 3.59Å; G42-E58 WeakPolarHBondContact CA-O 3.37Å; L43-E58 PolarHBondContact N-O 3.34Å; L43-E58 PolarHBondContact O-N 3.44Å; K45-E58 WeakPolarHBondContact CE-OE2 3.31Å; K45-E58 IonicContact NZ-OE2 2.64Å; K45-E58 PolarHBondContact NZ-OE2 3.02Å; L56-E58 HydrophobicContact CD2-CG 4.04Å; L56-E58 HydrophobicContact CG-CG 4.05Å; E58-T65 HydrophobicContact CG-CG2 4.21Å
59	L	91.7	Very high	92	Very high	19 Å²	19	66 Å²	66	10%	0.099	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	140.5	177.2	-57.7	-174.7	0	0	0	110.5	F11 L39 N41 N63 S64 Y66	F11-L59 HydrophobicContact CE1-CD1 4.06Å; F11-L59 HydrophobicContact CZ-CD1 4.24Å; L39-L59 HydrophobicContact CD1-CD2 4.2Å; N41-L59 CarbonylContact O-C 3.6Å; N41-L59 VanDerWaalsContact O-CA 3.3Å; N41-L59 WeakPolarHBondContact O-CA 3.24Å; L59-N63 VanDerWaalsContact O-CA 3.31Å; L59-N63 WeakPolarHBondContact O-CA 3.25Å; L59-S64 PolarHBondContact N-O 3.14Å; L59-S64 PolarHBondContact O-N 2.78Å; L59-S64 VanDerWaalsContact O-N 3.11Å; L59-Y66 HydrophobicContact CD1-CD2 4.45Å; L59-Y66 HydrophobicContact CD1-CE2 3.85Å; L59-Y66 HydrophobicContact CG-CE2 4.31Å
60	T	88	Confident	91.8	Very high	74 Å²	74	65.5 Å²	65.5	45%	0.454	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	122.5	168.3	56.4	0	0	0	0	107.5	N41	N41-T60 PolarHBondContact O-N 3.01Å; N41-T60 PolarHBondContact O-OG1 2.84Å
61	N	83.7	Confident	91.5	Very high	135 Å²	135	71.1 Å²	71.1	72%	0.722	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	85.9	-176.2	-47.8	-48.5	0	0	0	116.3
62	P	85.8	Confident	91.4	Very high	90 Å²	90	72.6 Å²	72.6	58%	0.584	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	cis	-70.4	155.1	-10	31.2	-34.9	0	0	0	110.8	S64	P62-S64 PolarHBondContact O-N 2.83Å; P62-S64 VanDerWaalsContact O-N 3.13Å
63	N	90.6	Very high	91.3	Very high	132 Å²	132	70.8 Å²	70.8	71%	0.706	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	115.5	172.9	-69.4	-9	0	0	0	108.7	L59	L59-N63 VanDerWaalsContact O-CA 3.31Å; L59-N63 WeakPolarHBondContact O-CA 3.25Å
64	S	92.1	Very high	91.1	Very high	34 Å²	34	73 Å²	73	24%	0.238	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	132.4	-178.7	-63.6	0	0	0	0	109.7	L59 P62	L59-S64 PolarHBondContact N-O 3.14Å; L59-S64 PolarHBondContact O-N 2.78Å; L59-S64 VanDerWaalsContact O-N 3.11Å; P62-S64 PolarHBondContact O-N 2.83Å; P62-S64 VanDerWaalsContact O-N 3.13Å
65	T	93.9	Very high	90.9	Very high	96 Å²	96	71.2 Å²	71.2	59%	0.589	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.6	125	175.4	-59.4	0	0	0	0	108.5	L56 C57 E58	L56-T65 HydrophobicContact CD1-CG2 3.47Å; L56-T65 VanDerWaalsContact CD1-CG2 3.47Å; L56-T65 HydrophobicContact CG-CG2 4.41Å; C57-T65 CarbonylContact O-C 3.54Å; C57-T65 WeakPolarHBondContact O-CA 3.5Å; E58-T65 HydrophobicContact CG-CG2 4.21Å
66	Y	92.4	Very high	90.8	Very high	138 Å²	138	73.3 Å²	73.3	54%	0.541	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	131.3	175.3	-57.6	-89.6	0	0	0	108.7	L56 C57 L59	L56-Y66 CarbonylContact C-O 3.5Å; L56-Y66 WeakPolarHBondContact CA-O 3.3Å; C57-Y66 PolarHBondContact N-O 2.82Å; C57-Y66 PolarHBondContact O-N 2.95Å; L59-Y66 HydrophobicContact CD1-CD2 4.45Å; L59-Y66 HydrophobicContact CD1-CE2 3.85Å; L59-Y66 HydrophobicContact CG-CE2 4.31Å
67	E	93.6	Very high	90.8	Very high	143 Å²	143	71.4 Å²	71.4	67%	0.668	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	141.2	176.3	-171.1	174.8	178.1	0	0	109.8	V55 L56	V55-E67 CarbonylContact O-C 3.51Å; V55-E67 VanDerWaalsContact O-CA 3.32Å; V55-E67 WeakPolarHBondContact O-CA 3.16Å; L56-E67 HydrophobicContact CD1-CB 4.26Å; L56-E67 HydrophobicContact CD1-CG 4.49Å
68	Y	90.8	Very high	90.9	Very high	75 Å²	75	73 Å²	73	29%	0.294	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	124	175	179	-88.1	0	0	0	109.4	T54 V55 V70 Q115	T54-Y68 CarbonylContact C-O 3.58Å; V55-Y68 HydrophobicContact CG2-CD1 4.49Å; V55-Y68 PolarHBondContact N-O 3.5Å; V55-Y68 PolarHBondContact O-N 2.71Å; Y68-V70 HydrophobicContact CE1-CG2 3.58Å; Y68-Q115 VanDerWaalsContact CZ-NE2 3.3Å
69	S	91.6	Very high	91	Very high	38 Å²	38	69.8 Å²	69.8	27%	0.266	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.6	179.4	63.7	0	0	0	0	112	L53 Q115	L53-S69 CarbonylContact O-C 3.48Å; L53-S69 WeakPolarHBondContact O-CA 3.18Å; S69-Q115 WeakPolarHBondContact O-CG 3.33Å; S69-Q115 PolarHBondContact O-NE2 2.61Å
70	V	91.2	Very high	91	Very high	3 Å²	3	70.8 Å²	70.8	2%	0.018	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	117.2	162.3	-177.6	0	0	0	0	106.8	S52 L53 Y68 F73 L113	S52-V70 CarbonylContact C-O 3.52Å; S52-V70 WeakPolarHBondContact CA-O 3.35Å; S52-V70 VanDerWaalsContact CB-O 3.3Å; S52-V70 WeakPolarHBondContact CB-O 3.34Å; L53-V70 HydrophobicContact CB-CB 4.25Å; L53-V70 HydrophobicContact CB-CG2 4.48Å; L53-V70 HydrophobicContact CD2-CG2 4.42Å; L53-V70 PolarHBondContact N-O 2.85Å; L53-V70 PolarHBondContact O-N 3.49Å; Y68-V70 HydrophobicContact CE1-CG2 3.58Å; V70-F73 HydrophobicContact CB-CE1 4.04Å; V70-F73 HydrophobicContact CG1-CD1 3.77Å; V70-F73 HydrophobicContact CG1-CE1 3.76Å; V70-F73 HydrophobicContact CG2-CE1 4.4Å; V70-L113 HydrophobicContact CG2-CB 4.38Å
71	R	88	Confident	91.2	Very high	163 Å²	163	73.7 Å²	73.7	62%	0.615	37%	0.368	S	S	*	.			trans	-79.4	-33.5	-178	-63.8	-165.9	-176.6	151.4	-4.9	113.1	S116	R71-S116 VanDerWaalsContact CD-O 3.25Å; R71-S116 WeakPolarHBondContact CD-O 3.38Å; R71-S116 PolarHBondContact NE-O 3.25Å; R71-S116 PolarHBondContact NH1-O 3.15Å; R71-S116 PolarHBondContact NH1-OXT 2.72Å
72	Q	90	Very high	91.7	Very high	126 Å²	126	67.2 Å²	67.2	59%	0.589	33%	0.334	S	S	*	.			trans	-145.2	107.9	-173.9	-173.9	63.4	47.7	0	0	111.6	Y51	Y51-Q72 CarbonylContact O-C 3.51Å; Y51-Q72 WeakPolarHBondContact O-CA 3.28Å
73	F	90.9	Very high	92.1	Very high	3 Å²	3	65 Å²	65	1%	0.013	32%	0.319	C	S	.	.			trans	-68.4	154.3	166.1	-66.8	-46.3	0	0	0	110.8	L48 Y51 S52 L53 V70 S75 I77 L95 W104 L113	L48-F73 HydrophobicContact CD2-CE2 4.31Å; L48-F73 HydrophobicContact CD2-CZ 4.27Å; Y51-F73 WeakPolarHBondContact O-CD2 3.25Å; Y51-F73 PolarHBondContact O-N 2.99Å; S52-F73 WeakPolarHBondContact O-CE2 3.29Å; L53-F73 HydrophobicContact CB-CE1 4.34Å; L53-F73 HydrophobicContact CB-CE2 4.43Å; L53-F73 HydrophobicContact CB-CZ 3.63Å; V70-F73 HydrophobicContact CB-CE1 4.04Å; V70-F73 HydrophobicContact CG1-CD1 3.77Å; V70-F73 HydrophobicContact CG1-CE1 3.76Å; V70-F73 HydrophobicContact CG2-CE1 4.4Å; F73-S75 WeakPolarHBondContact CB-O 3.37Å; F73-S75 PolarHBondContact O-N 2.92Å; F73-S75 VanDerWaalsContact O-N 3.12Å; F73-I77 HydrophobicContact CD2-CD1 4.11Å; F73-I77 HydrophobicContact CD2-CG1 4.11Å; F73-I77 HydrophobicContact CD2-CG2 4.14Å; F73-I77 HydrophobicContact CE2-CD1 3.62Å; F73-I77 HydrophobicContact CE2-CG1 4.13Å; F73-L95 HydrophobicContact CD1-CD1 4.25Å; F73-L95 HydrophobicContact CE1-CD1 3.61Å; F73-L95 HydrophobicContact CE2-CD1 4.14Å; F73-L95 HydrophobicContact CZ-CD1 3.53Å; F73-W104 HydrophobicContact CB-CH2 3.7Å; F73-W104 HydrophobicContact CB-CZ2 3.87Å; F73-W104 AromaticContact CD1-CH2 3.87Å; F73-W104 HydrophobicContact CD1-CH2 3.87Å; F73-W104 HydrophobicContact CD1-CZ3 4.13Å; F73-W104 HydrophobicContact CD2-CH2 4.26Å; F73-W104 AromaticContact CG-CH2 3.69Å; F73-W104 HydrophobicContact CG-CH2 3.69Å; F73-W104 HydrophobicContact CG-CZ2 4.34Å; F73-W104 HydrophobicContact CG-CZ3 4.4Å; F73-L113 HydrophobicContact CD1-CD2 4.24Å; F73-L113 HydrophobicContact CE1-CD2 4.41Å
74	P	89.5	Confident	92.2	Very high	58 Å²	58	59.8 Å²	59.8	38%	0.377	29%	0.289	S	S	.	.	S	Bend	trans	-57.5	-27.7	176.5	-25.8	34.4	0	0	0	114	W104 A107 L108	P74-W104 HydrophobicContact CB-CD2 4.24Å; P74-W104 HydrophobicContact CB-CG 4Å; P74-W104 HydrophobicContact CG-CB 4.41Å; P74-W104 HydrophobicContact CG-CD2 3.98Å; P74-W104 HydrophobicContact CG-CE3 4.34Å; P74-W104 HydrophobicContact CG-CG 4Å; P74-A107 HydrophobicContact CB-CB 3.68Å; P74-A107 HydrophobicContact CG-CB 3.83Å; P74-L108 HydrophobicContact CG-CD2 4.19Å
75	S	91	Very high	92.2	Very high	14 Å²	14	62.6 Å²	62.6	10%	0.098	30%	0.297	C	S	.	.	S	Bend	trans	-152	172.6	173.1	80	0	0	0	0	111.2	F73 S101 W104	F73-S75 WeakPolarHBondContact CB-O 3.37Å; F73-S75 PolarHBondContact O-N 2.92Å; F73-S75 VanDerWaalsContact O-N 3.12Å; S75-S101 WeakPolarHBondContact OG-CB 3.44Å; S75-S101 PolarHBondContact OG-OG 2.74Å; S75-S101 VanDerWaalsContact OG-OG 3.08Å; S75-W104 WeakPolarHBondContact O-CZ2 3.46Å; S75-W104 PolarHBondContact OG-NE1 2.76Å
76	K	92.6	Very high	91.8	Very high	68 Å²	68	58.2 Å²	58.2	30%	0.296	27%	0.27	S	S	.	.			trans	-60.9	137.4	177.9	-168	165.4	165.4	148.6	0	112.2	E50 Y51 A98 S101	E50-K76 HydrophobicContact CB-CG 4.06Å; E50-K76 CarbonylContact O-C 3.52Å; E50-K76 WeakPolarHBondContact O-CA 3.49Å; E50-K76 WeakPolarHBondContact OE1-CE 3.17Å; E50-K76 IonicContact OE1-NZ 2.72Å; E50-K76 PolarHBondContact OE1-NZ 2.77Å; E50-K76 VanDerWaalsContact OE2-CE 3.29Å; E50-K76 WeakPolarHBondContact OE2-CE 3.33Å; E50-K76 IonicContact OE2-NZ 2.73Å; E50-K76 PolarHBondContact OE2-NZ 2.82Å; Y51-K76 HydrophobicContact CD1-CB 4.46Å; Y51-K76 VanDerWaalsContact CE1-CA 3.47Å; Y51-K76 HydrophobicContact CE1-CB 3.67Å; Y51-K76 HydrophobicContact CE1-CG 4.36Å; Y51-K76 VanDerWaalsContact CE1-N 3.26Å; Y51-K76 HydrophobicContact CE2-CB 4.35Å; Y51-K76 HydrophobicContact CE2-CD 4.31Å; Y51-K76 HydrophobicContact CE2-CG 4.19Å; K76-A98 HydrophobicContact CB-CB 3.96Å; K76-A98 HydrophobicContact CD-CB 4.31Å; K76-A98 HydrophobicContact CG-CB 3.88Å; K76-A98 PolarHBondContact O-N 3.18Å; K76-S101 PolarHBondContact O-OG 3.48Å
77	I	93.9	Very high	91.4	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-110.3	170.9	169.1	64.9	158.8	0	0	0	111.2	L48 G49 E50 F73 P79 L95 R96 W104	L48-I77 HydrophobicContact CB-CD1 4.38Å; L48-I77 HydrophobicContact CD1-CD1 4.28Å; L48-I77 HydrophobicContact CD2-CD1 3.97Å; L48-I77 HydrophobicContact CG-CD1 4.46Å; G49-I77 WeakPolarHBondContact O-CD1 3.34Å; G49-I77 WeakPolarHBondContact O-CG1 3.44Å; E50-I77 WeakPolarHBondContact O-CG1 3.29Å; E50-I77 PolarHBondContact O-N 2.84Å; F73-I77 HydrophobicContact CD2-CD1 4.11Å; F73-I77 HydrophobicContact CD2-CG1 4.11Å; F73-I77 HydrophobicContact CD2-CG2 4.14Å; F73-I77 HydrophobicContact CE2-CD1 3.62Å; F73-I77 HydrophobicContact CE2-CG1 4.13Å; I77-P79 HydrophobicContact CG1-CG 4.46Å; I77-P79 WeakPolarHBondContact O-CD 3.21Å; I77-L95 HydrophobicContact CD1-CD2 4.2Å; I77-L95 HydrophobicContact CG2-CB 4.25Å; I77-R96 CarbonylContact C-O 3.46Å; I77-R96 VanDerWaalsContact CA-O 3.25Å; I77-R96 WeakPolarHBondContact CA-O 3.37Å; I77-R96 WeakPolarHBondContact CB-O 3.35Å; I77-W104 HydrophobicContact CG2-CH2 3.62Å; I77-W104 HydrophobicContact CG2-CZ2 3.65Å
78	M	94.5	Very high	90.9	Very high	57 Å²	57	54.3 Å²	54.3	28%	0.281	26%	0.261	S	S	.	.			trans	-110.5	93.8	170.6	-58.5	-173.1	-64.4	0	0	108.2	T80 F81 C82 R96 A98	M78-T80 VanDerWaalsContact C-N 3.33Å; M78-T80 PolarHBondContact O-N 2.82Å; M78-F81 HydrophobicContact CB-CB 4.23Å; M78-F81 HydrophobicContact CB-CD2 3.81Å; M78-F81 HydrophobicContact CB-CG 4.41Å; M78-F81 HydrophobicContact CE-CB 4.5Å; M78-F81 HydrophobicContact CE-CD2 4.37Å; M78-F81 HydrophobicContact CE-CG 4.38Å; M78-F81 PolarHBondContact O-N 2.86Å; M78-F81 HydrophobicContact SD-CD2 4.39Å; M78-C82 PolarHBondContact O-N 3.17Å; M78-C82 PolarHBondContact O-SG 3.24Å; M78-R96 HydrophobicContact CE-CG 3.44Å; M78-R96 VanDerWaalsContact CE-CG 3.44Å; M78-R96 PolarHBondContact N-O 2.79Å; M78-A98 HydrophobicContact CG-CB 4.08Å
79	P	94.6	Very high	90.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-49.4	-47.4	-172.1	-33.9	38.4	0	0	0	114.3	F23 T30 A33 L48 I77 F81 C82	F23-P79 WeakPolarHBondContact CB-O 3.31Å; T30-P79 WeakPolarHBondContact O-CD 3.34Å; A33-P79 HydrophobicContact CB-CB 3.54Å; L48-P79 HydrophobicContact CB-CB 3.92Å; L48-P79 HydrophobicContact CB-CG 4.37Å; I77-P79 HydrophobicContact CG1-CG 4.46Å; I77-P79 WeakPolarHBondContact O-CD 3.21Å; P79-F81 PolarHBondContact O-N 3.32Å; P79-F81 VanDerWaalsContact O-N 3.16Å; P79-C82 VanDerWaalsContact O-CB 3.29Å; P79-C82 WeakPolarHBondContact O-CB 3.42Å; P79-C82 PolarHBondContact O-N 3.26Å
80	T	92.7	Very high	89.9	Confident	40 Å²	40	57.2 Å²	57.2	25%	0.245	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-68.4	-13.6	-177.6	54.6	0	0	0	0	114.8	A33 M78	A33-T80 HydrophobicContact CB-CG2 4.01Å; M78-T80 VanDerWaalsContact C-N 3.33Å; M78-T80 PolarHBondContact O-N 2.82Å
81	F	92.6	Very high	89.8	Confident	134 Å²	134	59.8 Å²	59.8	59%	0.588	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-101.3	1.4	175.6	-66.8	-93.9	0	0	0	112.7	M78 P79 R96	M78-F81 HydrophobicContact CB-CB 4.23Å; M78-F81 HydrophobicContact CB-CD2 3.81Å; M78-F81 HydrophobicContact CB-CG 4.41Å; M78-F81 HydrophobicContact CE-CB 4.5Å; M78-F81 HydrophobicContact CE-CD2 4.37Å; M78-F81 HydrophobicContact CE-CG 4.38Å; M78-F81 PolarHBondContact O-N 2.86Å; M78-F81 HydrophobicContact SD-CD2 4.39Å; P79-F81 PolarHBondContact O-N 3.32Å; P79-F81 VanDerWaalsContact O-N 3.16Å; F81-R96 HydrophobicContact CB-CB 3.89Å; F81-R96 HydrophobicContact CB-CG 3.83Å
82	C	94	Very high	89.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.282	C	S	.	.			trans	-80	153.7	175	-61	0	0	0	0	110.4	F23 L48 M78 P79 R94 L95 R96	F23-C82 HydrophobicContact CD2-CB 3.92Å; F23-C82 HydrophobicContact CE2-CB 4.44Å; F23-C82 HydrophobicContact CG-CB 4.48Å; F23-C82 PolarHBondContact N-O 3.05Å; F23-C82 VanDerWaalsContact N-O 3.08Å; L48-C82 HydrophobicContact CD1-CB 3.41Å; L48-C82 VanDerWaalsContact CD1-CB 3.41Å; M78-C82 PolarHBondContact O-N 3.17Å; M78-C82 PolarHBondContact O-SG 3.24Å; P79-C82 VanDerWaalsContact O-CB 3.29Å; P79-C82 WeakPolarHBondContact O-CB 3.42Å; P79-C82 PolarHBondContact O-N 3.26Å; C82-R94 WeakPolarHBondContact CA-O 3.46Å; C82-L95 HydrophobicContact CB-CD2 4.42Å; C82-R96 PolarHBondContact SG-N 2.77Å
83	T	94.2	Very high	90	Very high	44 Å²	44	53.8 Å²	53.8	27%	0.27	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	158.9	177.2	68.8	0	0	0	0	111.3	G21 N22 R94	G21-T83 VanDerWaalsContact O-CA 3.31Å; G21-T83 WeakPolarHBondContact O-CA 3.39Å; G21-T83 WeakPolarHBondContact O-CB 3.45Å; N22-T83 WeakPolarHBondContact OD1-CG2 3.49Å; T83-R94 PolarHBondContact N-O 2.91Å; T83-R94 PolarHBondContact O-N 3.08Å
84	Y	92.1	Very high	90.1	Very high	22 Å²	22	63 Å²	63	9%	0.086	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	155.8	175.5	73.5	-83.6	0	0	0	111.2	S20 G21 F23 I35 Q37 M46 I86 K92	S20-Y84 WeakPolarHBondContact CA-O 3.47Å; S20-Y84 WeakPolarHBondContact CB-O 3.47Å; G21-Y84 PolarHBondContact N-O 3.04Å; G21-Y84 VanDerWaalsContact N-O 3.14Å; G21-Y84 VanDerWaalsContact O-CD1 3.24Å; G21-Y84 WeakPolarHBondContact O-CD1 3.46Å; G21-Y84 PolarHBondContact O-N 3.08Å; F23-Y84 HydrophobicContact CD2-CD1 4.49Å; F23-Y84 HydrophobicContact CE2-CD1 4.23Å; I35-Y84 HydrophobicContact CB-CD1 4.47Å; I35-Y84 HydrophobicContact CB-CE1 4.06Å; I35-Y84 HydrophobicContact CD1-CE1 4.34Å; I35-Y84 HydrophobicContact CD1-CE2 4.5Å; I35-Y84 HydrophobicContact CG1-CD1 4.21Å; I35-Y84 HydrophobicContact CG1-CE1 4.17Å; I35-Y84 HydrophobicContact CG2-CD1 3.96Å; I35-Y84 HydrophobicContact CG2-CE1 3.7Å; Q37-Y84 PolarHBondContact OE1-OH 2.83Å; M46-Y84 HydrophobicContact CE-CD1 4.46Å; M46-Y84 HydrophobicContact CE-CD2 4.05Å; M46-Y84 HydrophobicContact CE-CG 3.83Å; Y84-I86 HydrophobicContact CD2-CG1 4.08Å; Y84-I86 HydrophobicContact CE2-CD1 4.37Å; Y84-I86 HydrophobicContact CE2-CG1 4.27Å; Y84-K92 CarbonylContact C-O 3.56Å; Y84-K92 WeakPolarHBondContact CA-O 3.35Å
85	K	91.4	Very high	90.3	Very high	92 Å²	92	62.4 Å²	62.4	40%	0.4	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	129.2	169.3	-176.3	175.3	-173.9	178.3	0	109.7	C19 K92	C19-K85 CarbonylContact O-C 3.53Å; C19-K85 WeakPolarHBondContact O-CA 3.22Å; K85-K92 PolarHBondContact N-O 3.44Å; K85-K92 PolarHBondContact O-N 2.91Å
86	I	86.7	Confident	90.4	Very high	4 Å²	4	68.9 Å²	68.9	2%	0.021	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	116	173.5	-46.9	-179.2	0	0	0	108.1	I15 G18 C19 Q37 L39 L44 Y84 K90 V91	I15-I86 HydrophobicContact CD1-CG2 3.81Å; I15-I86 HydrophobicContact CG2-CB 4.36Å; I15-I86 HydrophobicContact CG2-CG2 3.8Å; G18-I86 WeakPolarHBondContact CA-O 3.43Å; C19-I86 HydrophobicContact CB-CB 4.44Å; C19-I86 HydrophobicContact CB-CD1 4.39Å; C19-I86 HydrophobicContact CB-CG1 4.49Å; C19-I86 PolarHBondContact O-N 3.46Å; Q37-I86 HydrophobicContact CB-CD1 4.31Å; Q37-I86 HydrophobicContact CG-CD1 3.68Å; L39-I86 HydrophobicContact CD2-CD1 4.07Å; L44-I86 HydrophobicContact CD2-CD1 3.58Å; L44-I86 HydrophobicContact CD2-CG1 4.3Å; Y84-I86 HydrophobicContact CD2-CG1 4.08Å; Y84-I86 HydrophobicContact CE2-CD1 4.37Å; Y84-I86 HydrophobicContact CE2-CG1 4.27Å; I86-K90 WeakPolarHBondContact CA-O 3.25Å; I86-V91 HydrophobicContact CG1-CG2 4.44Å
87	Q	84.5	Confident	90.4	Very high	68 Å²	68	69 Å²	69	32%	0.318	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	134.1	-178.1	-174	-178.3	11.3	0	0	109.9	N89 K90	Q87-N89 VanDerWaalsContact C-N 3.3Å; Q87-N89 PolarHBondContact O-N 3.19Å; Q87-K90 PolarHBondContact N-O 2.72Å; Q87-K90 WeakPolarHBondContact O-CB 3.33Å; Q87-K90 PolarHBondContact O-N 3.12Å
88	N	82.3	Confident	90.3	Very high	131 Å²	131	69.8 Å²	69.8	70%	0.701	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	47	177	-56.4	-12.6	0	0	0	112.4	K90	N88-K90 PolarHBondContact O-N 3.43Å; N88-K90 VanDerWaalsContact O-N 3.13Å
89	N	77	Confident	90	Very high	54 Å²	54	73.4 Å²	73.4	29%	0.289	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	21.4	-177.3	-49.9	-36.4	0	0	0	114.4	A6 F11 Q87	A6-N89 HydrophobicContact CB-CB 4.31Å; F11-N89 WeakPolarHBondContact CB-ND2 3.14Å; F11-N89 WeakPolarHBondContact CB-OD1 3.35Å; Q87-N89 VanDerWaalsContact C-N 3.3Å; Q87-N89 PolarHBondContact O-N 3.19Å
90	K	84.7	Confident	89.7	Confident	121 Å²	121	77 Å²	77	53%	0.526	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	135.6	175.4	-64.4	-176.2	178.8	-174.3	0	110.1	I86 Q87 N88	I86-K90 WeakPolarHBondContact CA-O 3.25Å; Q87-K90 PolarHBondContact N-O 2.72Å; Q87-K90 WeakPolarHBondContact O-CB 3.33Å; Q87-K90 PolarHBondContact O-N 3.12Å; N88-K90 PolarHBondContact O-N 3.43Å; N88-K90 VanDerWaalsContact O-N 3.13Å
91	V	87.9	Confident	89.3	Confident	57 Å²	57	76.2 Å²	76.2	35%	0.345	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	120.2	165	-176.7	0	0	0	0	107.8	L44 M46 I86 L93	L44-V91 HydrophobicContact CD1-CG2 4.35Å; L44-V91 HydrophobicContact CD2-CG1 4.5Å; L44-V91 HydrophobicContact CD2-CG2 3.54Å; M46-V91 HydrophobicContact CE-CG1 3.72Å; M46-V91 HydrophobicContact SD-CG1 3.54Å; M46-V91 VanDerWaalsContact SD-CG1 3.54Å; I86-V91 HydrophobicContact CG1-CG2 4.44Å; V91-L93 HydrophobicContact CG1-CD2 4.09Å; V91-L93 HydrophobicContact CG1-CG 4.27Å
92	K	90.6	Very high	88.8	Confident	109 Å²	109	76.9 Å²	76.9	47%	0.474	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.5	173	-63.1	-178.2	-179.8	177.5	0	108	Y84 K85	Y84-K92 CarbonylContact C-O 3.56Å; Y84-K92 WeakPolarHBondContact CA-O 3.35Å; K85-K92 PolarHBondContact N-O 3.44Å; K85-K92 PolarHBondContact O-N 2.91Å
93	L	92.5	Very high	88.4	Confident	54 Å²	54	84.5 Å²	84.5	28%	0.283	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	136.3	175.9	-63.6	177.1	0	0	0	110	F23 M46 L53 V91 L95	F23-L93 HydrophobicContact CE2-CD2 3.8Å; F23-L93 HydrophobicContact CZ-CD2 3.75Å; M46-L93 HydrophobicContact CE-CD2 3.93Å; M46-L93 HydrophobicContact SD-CD1 4.44Å; M46-L93 HydrophobicContact SD-CD2 3.78Å; M46-L93 HydrophobicContact SD-CG 4.5Å; L53-L93 HydrophobicContact CD1-CD1 3.81Å; L53-L93 HydrophobicContact CD2-CD1 3.36Å; L53-L93 HydrophobicContact CG-CD1 4.25Å; V91-L93 HydrophobicContact CG1-CD2 4.09Å; V91-L93 HydrophobicContact CG1-CG 4.27Å; L93-L95 HydrophobicContact CB-CD2 4.22Å
94	R	93.2	Very high	88	Confident	197 Å²	197	84.1 Å²	84.1	74%	0.743	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.7	101.3	166.2	-174	179.5	-177.1	174.3	0.6	107.9	C82 T83	C82-R94 WeakPolarHBondContact CA-O 3.46Å; T83-R94 PolarHBondContact N-O 2.91Å; T83-R94 PolarHBondContact O-N 3.08Å
95	L	93.5	Very high	87.6	Confident	45 Å²	45	86.3 Å²	86.3	24%	0.236	44%	0.444	C	S	.	.			trans	-84.1	128.1	179.2	-56.4	-179.8	0	0	0	110.1	L48 F73 I77 C82 L93 W104	L48-L95 HydrophobicContact CD1-CD2 4.1Å; L48-L95 HydrophobicContact CD2-CD2 3.83Å; F73-L95 HydrophobicContact CD1-CD1 4.25Å; F73-L95 HydrophobicContact CE1-CD1 3.61Å; F73-L95 HydrophobicContact CE2-CD1 4.14Å; F73-L95 HydrophobicContact CZ-CD1 3.53Å; I77-L95 HydrophobicContact CD1-CD2 4.2Å; I77-L95 HydrophobicContact CG2-CB 4.25Å; C82-L95 HydrophobicContact CB-CD2 4.42Å; L93-L95 HydrophobicContact CB-CD2 4.22Å; L95-W104 HydrophobicContact CB-CH2 4.44Å; L95-W104 HydrophobicContact CD1-CH2 3.91Å; L95-W104 HydrophobicContact CD1-CZ3 3.8Å
96	R	93.3	Very high	87.3	Confident	149 Å²	149	84.3 Å²	84.3	56%	0.562	45%	0.449	S	S	*	.			trans	-94.9	109.8	176.8	-176.3	65.8	175.1	150.9	-0.6	109.1	I77 M78 F81 C82	I77-R96 CarbonylContact C-O 3.46Å; I77-R96 VanDerWaalsContact CA-O 3.25Å; I77-R96 WeakPolarHBondContact CA-O 3.37Å; I77-R96 WeakPolarHBondContact CB-O 3.35Å; M78-R96 HydrophobicContact CE-CG 3.44Å; M78-R96 VanDerWaalsContact CE-CG 3.44Å; M78-R96 PolarHBondContact N-O 2.79Å; F81-R96 HydrophobicContact CB-CB 3.89Å; F81-R96 HydrophobicContact CB-CG 3.83Å; C82-R96 PolarHBondContact SG-N 2.77Å
97	K	91.7	Very high	87.1	Confident	70 Å²	70	85.8 Å²	85.8	30%	0.304	46%	0.462	S	S	.	.	B	Isolated β-bridge	trans	-61.1	145.6	174.1	-60.6	-166.9	-64.6	156.8	0	111.7	S101 E102 W104	K97-S101 PolarHBondContact NZ-O 3.08Å; K97-E102 PolarHBondContact NZ-O 2.79Å; K97-W104 HydrophobicContact CD-CG 4.44Å; K97-W104 HydrophobicContact CG-CZ2 4.32Å
98	A	91.9	Very high	86.9	Confident	17 Å²	17	85.5 Å²	85.5	14%	0.14	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-67.6	160	168.4	0	0	0	0	0	111.1	K76 M78 S101	K76-A98 HydrophobicContact CB-CB 3.96Å; K76-A98 HydrophobicContact CD-CB 4.31Å; K76-A98 HydrophobicContact CG-CB 3.88Å; K76-A98 PolarHBondContact O-N 3.18Å; M78-A98 HydrophobicContact CG-CB 4.08Å; A98-S101 WeakPolarHBondContact O-CB 3.41Å; A98-S101 PolarHBondContact O-N 3.03Å; A98-S101 PolarHBondContact O-OG 2.8Å
99	C	88.8	Confident	87	Confident	134 Å²	134	83.4 Å²	83.4	91%	0.905	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	142.5	174.3	-164	0	0	0	0	110.5	S101	C99-S101 VanDerWaalsContact C-N 3.25Å; C99-S101 PolarHBondContact O-N 2.9Å
100	G	87.6	Confident	87.3	Confident	74 Å²	74	86.7 Å²	86.7	76%	0.763	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	4.2	-177.4	0	0	0	0	0	115.4
101	S	85.2	Confident	86.8	Confident	25 Å²	25	88.4 Å²	88.4	18%	0.175	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-77.7	131.2	178.4	-78.7	0	0	0	0	113.9	S75 K76 K97 A98 C99	S75-S101 WeakPolarHBondContact OG-CB 3.44Å; S75-S101 PolarHBondContact OG-OG 2.74Å; S75-S101 VanDerWaalsContact OG-OG 3.08Å; K76-S101 PolarHBondContact O-OG 3.48Å; K97-S101 PolarHBondContact NZ-O 3.08Å; A98-S101 WeakPolarHBondContact O-CB 3.41Å; A98-S101 PolarHBondContact O-N 3.03Å; A98-S101 PolarHBondContact O-OG 2.8Å; C99-S101 VanDerWaalsContact C-N 3.25Å; C99-S101 PolarHBondContact O-N 2.9Å
102	E	81.6	Confident	86.2	Confident	148 Å²	148	87.3 Å²	87.3	69%	0.692	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-57.7	162.6	177.2	-64.9	-56.9	146.4	0	0	114.6	K97	K97-E102 PolarHBondContact NZ-O 2.79Å
103	Q	85.3	Confident	85.4	Confident	160 Å²	160	85.6 Å²	85.6	75%	0.748	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-69.9	134.9	173	-65.4	-168.1	9.7	0	0	111.2
104	W	86.8	Confident	83.8	Confident	35 Å²	35	89.3 Å²	89.3	13%	0.133	51%	0.509	C	S	.	.	H	α-helix	trans	-85.3	-12.7	-179.2	-69.6	11.5	0	0	0	113.3	F73 P74 S75 I77 L95 K97 G106 A107 L108	F73-W104 HydrophobicContact CB-CH2 3.7Å; F73-W104 HydrophobicContact CB-CZ2 3.87Å; F73-W104 AromaticContact CD1-CH2 3.87Å; F73-W104 HydrophobicContact CD1-CH2 3.87Å; F73-W104 HydrophobicContact CD1-CZ3 4.13Å; F73-W104 HydrophobicContact CD2-CH2 4.26Å; F73-W104 AromaticContact CG-CH2 3.69Å; F73-W104 HydrophobicContact CG-CH2 3.69Å; F73-W104 HydrophobicContact CG-CZ2 4.34Å; F73-W104 HydrophobicContact CG-CZ3 4.4Å; P74-W104 HydrophobicContact CB-CD2 4.24Å; P74-W104 HydrophobicContact CB-CG 4Å; P74-W104 HydrophobicContact CG-CB 4.41Å; P74-W104 HydrophobicContact CG-CD2 3.98Å; P74-W104 HydrophobicContact CG-CE3 4.34Å; P74-W104 HydrophobicContact CG-CG 4Å; S75-W104 WeakPolarHBondContact O-CZ2 3.46Å; S75-W104 PolarHBondContact OG-NE1 2.76Å; I77-W104 HydrophobicContact CG2-CH2 3.62Å; I77-W104 HydrophobicContact CG2-CZ2 3.65Å; L95-W104 HydrophobicContact CB-CH2 4.44Å; L95-W104 HydrophobicContact CD1-CH2 3.91Å; L95-W104 HydrophobicContact CD1-CZ3 3.8Å; K97-W104 HydrophobicContact CD-CG 4.44Å; K97-W104 HydrophobicContact CG-CZ2 4.32Å; W104-G106 PolarHBondContact O-N 2.83Å; W104-A107 PolarHBondContact O-N 3.16Å; W104-L108 HydrophobicContact CB-CD1 3.85Å; W104-L108 HydrophobicContact CB-CG 4.04Å; W104-L108 HydrophobicContact CE3-CD1 4.27Å; W104-L108 WeakPolarHBondContact O-CB 3.26Å; W104-L108 VanDerWaalsContact O-CG 3.28Å; W104-L108 WeakPolarHBondContact O-CG 3.19Å; W104-L108 PolarHBondContact O-N 3.02Å
105	A	84.4	Confident	81.9	Confident	68 Å²	68	84.1 Å²	84.1	56%	0.562	49%	0.493	S	S	*	.	H	α-helix	trans	-54.7	-49.6	-173.2	0	0	0	0	0	112.4	A109	A105-A109 VanDerWaalsContact O-CB 3.23Å; A105-A109 WeakPolarHBondContact O-CB 2.92Å; A105-A109 PolarHBondContact O-N 3.23Å
106	G	83.8	Confident	79.3	Confident	50 Å²	50	88.5 Å²	88.5	52%	0.515	53%	0.527	S	S	.	.	H	α-helix	trans	-65.9	-45.7	177	0	0	0	0	0	112.8	W104 L108 A109 V110	W104-G106 PolarHBondContact O-N 2.83Å; G106-L108 PolarHBondContact O-N 2.77Å; G106-A109 PolarHBondContact O-N 3.2Å; G106-V110 WeakPolarHBondContact O-CG2 3.29Å; G106-V110 PolarHBondContact O-N 2.64Å; G106-V110 VanDerWaalsContact O-N 3.17Å
107	A	82	Confident	78.6	Confident	35 Å²	35	85.5 Å²	85.5	29%	0.289	53%	0.525	S	S	.	.	H	α-helix	trans	-62.8	-44.5	-179.2	0	0	0	0	0	112.6	P74 W104 V110 K111	P74-A107 HydrophobicContact CB-CB 3.68Å; P74-A107 HydrophobicContact CG-CB 3.83Å; W104-A107 PolarHBondContact O-N 3.16Å; A107-V110 PolarHBondContact O-N 2.92Å; A107-K111 WeakPolarHBondContact O-CB 3.26Å; A107-K111 PolarHBondContact O-N 3.41Å
108	L	82.1	Confident	77.9	Confident	62 Å²	62	86.3 Å²	86.3	33%	0.325	54%	0.537	S	S	.	.	H	α-helix	trans	-70.8	-33.5	178.4	-66.4	177	0	0	0	112.2	P74 W104 G106 V110 G112 L113	P74-L108 HydrophobicContact CG-CD2 4.19Å; W104-L108 HydrophobicContact CB-CD1 3.85Å; W104-L108 HydrophobicContact CB-CG 4.04Å; W104-L108 HydrophobicContact CE3-CD1 4.27Å; W104-L108 WeakPolarHBondContact O-CB 3.26Å; W104-L108 VanDerWaalsContact O-CG 3.28Å; W104-L108 WeakPolarHBondContact O-CG 3.19Å; W104-L108 PolarHBondContact O-N 3.02Å; G106-L108 PolarHBondContact O-N 2.77Å; L108-V110 VanDerWaalsContact C-N 3.25Å; L108-V110 PolarHBondContact O-N 3.15Å; L108-G112 WeakPolarHBondContact CD2-O 3.46Å; L108-G112 WeakPolarHBondContact O-CA 3.27Å; L108-G112 PolarHBondContact O-N 2.93Å; L108-L113 HydrophobicContact CD2-CD2 3.59Å; L108-L113 HydrophobicContact CD2-CG 3.84Å
109	A	82.8	Confident	77.1	Confident	87 Å²	87	90.1 Å²	90.1	72%	0.719	56%	0.559	S	S	*	*	H	α-helix	trans	-64.8	-32.7	174.9	0	0	0	0	0	112.1	A105 G106	A105-A109 VanDerWaalsContact O-CB 3.23Å; A105-A109 WeakPolarHBondContact O-CB 2.92Å; A105-A109 PolarHBondContact O-N 3.23Å; G106-A109 PolarHBondContact O-N 3.2Å
110	V	82.8	Confident	76.4	Confident	124 Å²	124	87.5 Å²	87.5	75%	0.752	54%	0.539	S	S	*	.	H	α-helix	trans	-90.1	-47.4	-177.5	176.8	0	0	0	0	112.4	G106 A107 L108	G106-V110 WeakPolarHBondContact O-CG2 3.29Å; G106-V110 PolarHBondContact O-N 2.64Å; G106-V110 VanDerWaalsContact O-N 3.17Å; A107-V110 PolarHBondContact O-N 2.92Å; L108-V110 VanDerWaalsContact C-N 3.25Å; L108-V110 PolarHBondContact O-N 3.15Å
111	K	75.9	Confident	75.7	Confident	156 Å²	156	88.4 Å²	88.4	68%	0.678	53%	0.525	S	S	*	.	H	α-helix	trans	-108.1	-6.3	-171	-60.2	-176.4	178.6	-177.6	0	113.6	A107 D114	A107-K111 WeakPolarHBondContact O-CB 3.26Å; A107-K111 PolarHBondContact O-N 3.41Å; K111-D114 WeakPolarHBondContact O-CB 3.1Å; K111-D114 PolarHBondContact O-N 3.16Å
112	G	75.4	Confident	75.1	Confident	34 Å²	34	92.6 Å²	92.6	35%	0.351	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	-151.4	-166.6	0	0	0	0	0	111.8	L108 D114	L108-G112 WeakPolarHBondContact CD2-O 3.46Å; L108-G112 WeakPolarHBondContact O-CA 3.27Å; L108-G112 PolarHBondContact O-N 2.93Å; G112-D114 VanDerWaalsContact C-N 3.32Å
113	L	72.7	Confident	74.6	Confident	74 Å²	74	88.6 Å²	88.6	39%	0.387	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	19	166.2	-75	170.2	0	0	0	111.5	V70 F73 L108 Q115	V70-L113 HydrophobicContact CG2-CB 4.38Å; F73-L113 HydrophobicContact CD1-CD2 4.24Å; F73-L113 HydrophobicContact CE1-CD2 4.41Å; L108-L113 HydrophobicContact CD2-CD2 3.59Å; L108-L113 HydrophobicContact CD2-CG 3.84Å; L113-Q115 PolarHBondContact O-N 2.63Å
114	D	59.8	Low	73.8	Confident	131 Å²	131	83.2 Å²	83.2	70%	0.701	52%	0.522	S	S	*	.			trans	-62.3	105.2	-166.7	-90.4	-18.5	0	0	0	113.5	K111 G112 S116	K111-D114 WeakPolarHBondContact O-CB 3.1Å; K111-D114 PolarHBondContact O-N 3.16Å; G112-D114 VanDerWaalsContact C-N 3.32Å; D114-S116 PolarHBondContact O-N 3.36Å
115	Q	52.7	Low	72.7	Confident	88 Å²	88	87.2 Å²	87.2	41%	0.411	55%	0.554	S	S	.	*				23.4	77	97.2	-48.9	-155.7	-31.8	0	0	117.7	Y68 S69 L113	Y68-Q115 VanDerWaalsContact CZ-NE2 3.3Å; S69-Q115 WeakPolarHBondContact O-CG 3.33Å; S69-Q115 PolarHBondContact O-NE2 2.61Å; L113-Q115 PolarHBondContact O-N 2.63Å
116	S	38.6	Very low	71.7	Confident	137 Å²	137	88.9 Å²	88.9	96%	0.958	55%	0.553	S	S	*	*			trans	-109	0	145.3	45.8	0	0	0	0	109.6	R71 D114	R71-S116 VanDerWaalsContact CD-O 3.25Å; R71-S116 WeakPolarHBondContact CD-O 3.38Å; R71-S116 PolarHBondContact NE-O 3.25Å; R71-S116 PolarHBondContact NH1-O 3.15Å; R71-S116 PolarHBondContact NH1-OXT 2.72Å; D114-S116 PolarHBondContact O-N 3.36Å

Retrieved 116 of 116 residues in 175.6 ms (Link to these results)

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