A0A3Q0KQ03_SCHMA Loading...

DDE_Tnp_1_7 domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KQ03, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 150 aa.

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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	56.9	Low	72.3	Confident	208 Å²	208	98 Å²	98	100%	1.025	48%	0.475	S	S	*	.				0	-45.6	0	-78.9	180	142.1	0	0	112.6	Q3 L4 F5	M1-Q3 PolarHBondContact O-N 3.14Å; M1-L4 WeakPolarHBondContact O-CB 3.45Å; M1-L4 PolarHBondContact O-N 3.45Å; M1-L4 VanDerWaalsContact O-N 3.14Å; M1-F5 PolarHBondContact O-N 3.31Å
2	V	60.3	Low	73.6	Confident	67 Å²	67	92.3 Å²	92.3	41%	0.406	45%	0.448	S	S	.	.	H	α-helix	trans	-53.6	-47.1	180	-179.1	0	0	0	0	114.3	L4 F5 Y6 Y150	V2-L4 VanDerWaalsContact C-N 3.27Å; V2-L4 PolarHBondContact O-N 3.35Å; V2-F5 WeakPolarHBondContact O-CB 2.92Å; V2-F5 PolarHBondContact O-N 3.3Å; V2-Y6 HydrophobicContact CG1-CD2 4.06Å; V2-Y6 HydrophobicContact CG1-CE2 3.64Å; V2-Y6 VanDerWaalsContact O-CD2 3.25Å; V2-Y6 WeakPolarHBondContact O-CD2 3.48Å; V2-Y6 PolarHBondContact O-N 3.45Å; V2-Y150 WeakPolarHBondContact CB-O 3.19Å; V2-Y150 WeakPolarHBondContact CG1-O 3.41Å; V2-Y150 WeakPolarHBondContact CG2-O 3.42Å
3	Q	65.4	Low	75	Confident	136 Å²	136	88.5 Å²	88.5	64%	0.636	44%	0.435	S	S	*	.	H	α-helix	trans	-64.5	-29.9	-179.4	-74.1	-173.3	-34.5	0	0	113.3	M1 Y6 Y7	M1-Q3 PolarHBondContact O-N 3.14Å; Q3-Y6 PolarHBondContact O-N 3.35Å; Q3-Y7 WeakPolarHBondContact O-CB 3.25Å; Q3-Y7 PolarHBondContact O-N 3.03Å
4	L	72.1	Confident	76.1	Confident	105 Å²	105	82.4 Å²	82.4	55%	0.55	41%	0.406	S	S	.	.	H	α-helix	trans	-66.9	-41.9	176.8	-69.8	167.8	0	0	0	110.9	M1 V2 Y6 Y7 E8	M1-L4 WeakPolarHBondContact O-CB 3.45Å; M1-L4 PolarHBondContact O-N 3.45Å; M1-L4 VanDerWaalsContact O-N 3.14Å; V2-L4 VanDerWaalsContact C-N 3.27Å; V2-L4 PolarHBondContact O-N 3.35Å; L4-Y6 VanDerWaalsContact C-N 3.32Å; L4-Y6 PolarHBondContact O-N 3.26Å; L4-Y7 WeakPolarHBondContact O-CB 3.5Å; L4-Y7 PolarHBondContact O-N 3.17Å; L4-Y7 VanDerWaalsContact O-N 3.1Å; L4-E8 WeakPolarHBondContact O-CB 3.44Å; L4-E8 WeakPolarHBondContact O-CG 3.34Å; L4-E8 PolarHBondContact O-N 3Å
5	F	73.1	Confident	77	Confident	117 Å²	117	85.3 Å²	85.3	51%	0.513	41%	0.41	S	S	.	.	H	α-helix	trans	-57.2	-45	176.1	174.2	-95.4	0	0	0	112.1	M1 V2 Y7 N9	M1-F5 PolarHBondContact O-N 3.31Å; V2-F5 WeakPolarHBondContact O-CB 2.92Å; V2-F5 PolarHBondContact O-N 3.3Å; F5-Y7 VanDerWaalsContact C-N 3.34Å; F5-N9 WeakPolarHBondContact CD2-ND2 3.18Å; F5-N9 WeakPolarHBondContact CE2-ND2 2.95Å; F5-N9 VanDerWaalsContact CZ-ND2 3.31Å; F5-N9 WeakPolarHBondContact CZ-ND2 3.36Å; F5-N9 WeakPolarHBondContact O-CB 2.91Å; F5-N9 PolarHBondContact O-N 3.44Å; F5-N9 VanDerWaalsContact O-N 3.08Å; F5-N9 PolarHBondContact O-ND2 3.1Å
6	Y	73.6	Confident	77.7	Confident	22 Å²	22	84.5 Å²	84.5	9%	0.086	41%	0.406	C	S	.	.	H	α-helix	trans	-70.9	-31.6	177.6	-68.3	-70.4	0	0	0	112.9	V2 Q3 L4 R10 L122 R147 E148	V2-Y6 HydrophobicContact CG1-CD2 4.06Å; V2-Y6 HydrophobicContact CG1-CE2 3.64Å; V2-Y6 VanDerWaalsContact O-CD2 3.25Å; V2-Y6 WeakPolarHBondContact O-CD2 3.48Å; V2-Y6 PolarHBondContact O-N 3.45Å; Q3-Y6 PolarHBondContact O-N 3.35Å; L4-Y6 VanDerWaalsContact C-N 3.32Å; L4-Y6 PolarHBondContact O-N 3.26Å; Y6-R10 PolarHBondContact O-N 3.29Å; Y6-L122 HydrophobicContact CD1-CD1 3.88Å; Y6-L122 HydrophobicContact CE1-CD1 3.98Å; Y6-R147 HydrophobicContact CD1-CG 3.75Å; Y6-R147 HydrophobicContact CD2-CG 4.3Å; Y6-R147 HydrophobicContact CE1-CB 4.02Å; Y6-R147 HydrophobicContact CE1-CG 3.57Å; Y6-R147 HydrophobicContact CE2-CB 4.2Å; Y6-R147 HydrophobicContact CE2-CG 4.12Å; Y6-R147 HydrophobicContact CG-CG 4.12Å; Y6-E148 PolarHBondContact OH-O 2.95Å
7	Y	76.4	Confident	78.3	Confident	145 Å²	145	80.2 Å²	80.2	57%	0.569	39%	0.385	S	S	*	.	H	α-helix	trans	-66.6	-46.4	174.9	-173.8	-95.3	0	0	0	111.3	Q3 L4 F5 N9 R10 F117	Q3-Y7 WeakPolarHBondContact O-CB 3.25Å; Q3-Y7 PolarHBondContact O-N 3.03Å; L4-Y7 WeakPolarHBondContact O-CB 3.5Å; L4-Y7 PolarHBondContact O-N 3.17Å; L4-Y7 VanDerWaalsContact O-N 3.1Å; F5-Y7 VanDerWaalsContact C-N 3.34Å; Y7-N9 VanDerWaalsContact C-N 3.29Å; Y7-N9 PolarHBondContact O-N 3.13Å; Y7-R10 WeakPolarHBondContact O-CB 3.4Å; Y7-R10 PolarHBondContact O-N 3.07Å; Y7-R10 VanDerWaalsContact O-N 3.12Å; Y7-F117 HydrophobicContact CD2-CE2 4.37Å; Y7-F117 HydrophobicContact CD2-CZ 4.13Å
8	E	76.5	Confident	78.8	Confident	139 Å²	139	76.6 Å²	76.6	65%	0.65	37%	0.368	S	S	*	.	H	α-helix	trans	-64.1	-33.8	177.5	-71.9	171.4	-179.1	0	0	112.6	L4 R10	L4-E8 WeakPolarHBondContact O-CB 3.44Å; L4-E8 WeakPolarHBondContact O-CG 3.34Å; L4-E8 PolarHBondContact O-N 3Å; E8-R10 VanDerWaalsContact C-N 3.3Å
9	N	74.4	Confident	79.2	Confident	36 Å²	36	81.9 Å²	81.9	19%	0.193	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	7.5	176.9	-70.9	-68.5	0	0	0	113.5	F5 Y7 I12	F5-N9 WeakPolarHBondContact CD2-ND2 3.18Å; F5-N9 WeakPolarHBondContact CE2-ND2 2.95Å; F5-N9 VanDerWaalsContact CZ-ND2 3.31Å; F5-N9 WeakPolarHBondContact CZ-ND2 3.36Å; F5-N9 WeakPolarHBondContact O-CB 2.91Å; F5-N9 PolarHBondContact O-N 3.44Å; F5-N9 VanDerWaalsContact O-N 3.08Å; F5-N9 PolarHBondContact O-ND2 3.1Å; Y7-N9 VanDerWaalsContact C-N 3.29Å; Y7-N9 PolarHBondContact O-N 3.13Å; N9-I12 HydrophobicContact CB-CD1 3.89Å; N9-I12 VanDerWaalsContact O-CG1 3.25Å; N9-I12 WeakPolarHBondContact O-CG1 3.48Å
10	R	82	Confident	79.4	Confident	70 Å²	70	82.6 Å²	82.6	26%	0.264	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	136.2	174.4	-170.6	175.8	174.7	-171	-6.1	109.9	Y6 Y7 E8 I12 I112 D114	Y6-R10 PolarHBondContact O-N 3.29Å; Y7-R10 WeakPolarHBondContact O-CB 3.4Å; Y7-R10 PolarHBondContact O-N 3.07Å; Y7-R10 VanDerWaalsContact O-N 3.12Å; E8-R10 VanDerWaalsContact C-N 3.3Å; R10-I12 PolarHBondContact O-N 3.12Å; R10-I112 HydrophobicContact CG-CG1 4.26Å; R10-I112 PolarHBondContact NE-O 2.84Å; R10-I112 PolarHBondContact NH2-O 3.03Å; R10-D114 IonicContact CZ-OD1 2.74Å; R10-D114 IonicContact NH1-OD1 2.66Å; R10-D114 PolarHBondContact NH1-OD1 2.84Å; R10-D114 IonicContact NH2-OD1 2.89Å; R10-D114 PolarHBondContact NH2-OD1 3.37Å
11	G	84.8	Confident	79.7	Confident	33 Å²	33	80.9 Å²	80.9	34%	0.34	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	5.7	-179.4	0	0	0	0	0	115.6	T110	G11-T110 WeakPolarHBondContact CA-OG1 3.5Å; G11-T110 PolarHBondContact N-O 3.47Å
12	I	88.3	Confident	81.1	Confident	29 Å²	29	73.9 Å²	73.9	15%	0.149	36%	0.361	C	S	.	.			trans	-66.9	145.5	171.5	67.5	-178.9	0	0	0	110.1	N9 R10 C14 H16 L17 T110	N9-I12 HydrophobicContact CB-CD1 3.89Å; N9-I12 VanDerWaalsContact O-CG1 3.25Å; N9-I12 WeakPolarHBondContact O-CG1 3.48Å; R10-I12 PolarHBondContact O-N 3.12Å; I12-C14 PolarHBondContact O-N 3.12Å; I12-H16 HydrophobicContact CD1-CB 4.43Å; I12-L17 HydrophobicContact CD1-CD2 3.66Å; I12-L17 HydrophobicContact CD1-CG 4.16Å; I12-T110 HydrophobicContact CG1-CG2 4.1Å; I12-T110 PolarHBondContact N-OG1 3.4Å; I12-T110 WeakPolarHBondContact O-CB 3.32Å; I12-T110 VanDerWaalsContact O-CG2 3.29Å; I12-T110 WeakPolarHBondContact O-CG2 3.5Å; I12-T110 PolarHBondContact O-OG1 2.92Å
13	P	91	Very high	82.5	Confident	43 Å²	43	74.3 Å²	74.3	28%	0.279	36%	0.355	S	S	.	.			trans	-53.4	132.2	174.8	-30.7	37.9	0	0	0	112.2	R15 H16	P13-R15 HydrophobicContact CB-CG 3.68Å; P13-R15 PolarHBondContact O-N 2.66Å; P13-H16 WeakPolarHBondContact O-CA 3.48Å; P13-H16 WeakPolarHBondContact O-CB 3.25Å; P13-H16 PolarHBondContact O-N 2.74Å
14	C	90.9	Very high	83.9	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.02	35%	0.353	C	S	.	.	H	α-helix	trans	-53.7	-30.5	179	-69.3	0	0	0	0	112.5	I12 H16 L17 L18 F77 G82 M84 L108	I12-C14 PolarHBondContact O-N 3.12Å; C14-H16 PolarHBondContact O-N 2.94Å; C14-L17 WeakPolarHBondContact O-CB 3.18Å; C14-L17 PolarHBondContact O-N 3.46Å; C14-L18 PolarHBondContact O-N 2.79Å; C14-F77 HydrophobicContact CB-CD1 4.27Å; C14-F77 HydrophobicContact CB-CE1 4.05Å; C14-G82 VanDerWaalsContact CB-O 3.31Å; C14-G82 WeakPolarHBondContact CB-O 3.48Å; C14-G82 PolarHBondContact N-O 3.16Å; C14-M84 HydrophobicContact CB-CB 3.78Å; C14-L108 PolarHBondContact SG-O 3.45Å
15	R	89.2	Confident	84.9	Confident	126 Å²	126	69.7 Å²	69.7	48%	0.475	33%	0.329	S	S	.	.	H	α-helix	trans	-57.7	-27.6	172.7	67.6	-179	-174	179.3	-0	113.5	P13 R19 F77	P13-R15 HydrophobicContact CB-CG 3.68Å; P13-R15 PolarHBondContact O-N 2.66Å; R15-R19 WeakPolarHBondContact O-CG 3.41Å; R15-R19 PolarHBondContact O-N 3.5Å; R15-F77 HydrophobicContact CB-CD1 3.97Å; R15-F77 HydrophobicContact CB-CD2 4.41Å; R15-F77 HydrophobicContact CB-CE1 3.95Å; R15-F77 HydrophobicContact CB-CE2 4.4Å; R15-F77 HydrophobicContact CB-CG 4.22Å; R15-F77 HydrophobicContact CB-CZ 4.18Å
16	H	88.8	Confident	86	Confident	73 Å²	73	67.6 Å²	67.6	34%	0.338	32%	0.322	S	S	.	.	H	α-helix	trans	-71.1	-40.7	178.3	-168.1	76.7	0	0	0	110.9	I12 P13 C14 L18 R19 N20	I12-H16 HydrophobicContact CD1-CB 4.43Å; P13-H16 WeakPolarHBondContact O-CA 3.48Å; P13-H16 WeakPolarHBondContact O-CB 3.25Å; P13-H16 PolarHBondContact O-N 2.74Å; C14-H16 PolarHBondContact O-N 2.94Å; H16-L18 VanDerWaalsContact C-N 3.26Å; H16-L18 PolarHBondContact O-N 3.08Å; H16-R19 WeakPolarHBondContact O-CA 3.39Å; H16-R19 WeakPolarHBondContact O-CB 3.31Å; H16-R19 PolarHBondContact O-N 3.04Å; H16-N20 PolarHBondContact CD2-ND2 2.74Å; H16-N20 PolarHBondContact NE2-ND2 3.25Å; H16-N20 PolarHBondContact NE2-OD1 3.36Å; H16-N20 PolarHBondContact O-N 2.98Å; H16-N20 PolarHBondContact O-OD1 3.3Å
17	L	87.1	Confident	87	Confident	11 Å²	11	66.6 Å²	66.6	6%	0.058	32%	0.318	C	S	.	.	H	α-helix	trans	-56	-42.2	173.1	-62	176.7	0	0	0	111.9	I12 C14 R19 N20 I22 F25 T110 L123	I12-L17 HydrophobicContact CD1-CD2 3.66Å; I12-L17 HydrophobicContact CD1-CG 4.16Å; C14-L17 WeakPolarHBondContact O-CB 3.18Å; C14-L17 PolarHBondContact O-N 3.46Å; L17-R19 VanDerWaalsContact C-N 3.34Å; L17-R19 PolarHBondContact O-N 2.96Å; L17-N20 PolarHBondContact O-N 3.2Å; L17-I22 HydrophobicContact CB-CD1 4.3Å; L17-I22 HydrophobicContact CD2-CD1 4.09Å; L17-I22 WeakPolarHBondContact O-CB 3.38Å; L17-I22 PolarHBondContact O-N 2.67Å; L17-F25 HydrophobicContact CB-CZ 4.21Å; L17-F25 HydrophobicContact CD1-CE1 4.33Å; L17-F25 HydrophobicContact CD1-CZ 4.41Å; L17-T110 HydrophobicContact CD1-CG2 3.75Å; L17-T110 HydrophobicContact CG-CG2 4.42Å; L17-L123 HydrophobicContact CD1-CD1 4.28Å; L17-L123 HydrophobicContact CD1-CD2 3.77Å; L17-L123 HydrophobicContact CD1-CG 4.29Å
18	L	87.9	Confident	87.8	Confident	15 Å²	15	61.4 Å²	61.4	8%	0.079	30%	0.299	C	S	.	.	H	α-helix	trans	-68.3	-31.1	176.3	-61.4	-178.3	0	0	0	113.4	C14 H16 I22 R23 F25 F48 F77	C14-L18 PolarHBondContact O-N 2.79Å; H16-L18 VanDerWaalsContact C-N 3.26Å; H16-L18 PolarHBondContact O-N 3.08Å; L18-I22 WeakPolarHBondContact CD2-O 3.15Å; L18-R23 PolarHBondContact O-NH1 3.1Å; L18-R23 PolarHBondContact O-NH2 3.41Å; L18-R23 VanDerWaalsContact O-NH2 3.08Å; L18-F25 HydrophobicContact CD2-CE2 3.71Å; L18-F25 HydrophobicContact CD2-CZ 4.29Å; L18-F48 HydrophobicContact CD1-CD1 3.7Å; L18-F48 HydrophobicContact CD1-CE1 3.86Å; L18-F48 HydrophobicContact CD1-CG 4.36Å; L18-F48 HydrophobicContact CD2-CB 4.01Å; L18-F48 HydrophobicContact CD2-CD1 3.74Å; L18-F48 HydrophobicContact CD2-CD2 3.79Å; L18-F48 HydrophobicContact CD2-CE1 4.12Å; L18-F48 HydrophobicContact CD2-CE2 4.19Å; L18-F48 HydrophobicContact CD2-CG 3.55Å; L18-F48 HydrophobicContact CD2-CZ 4.34Å; L18-F48 HydrophobicContact CG-CD1 4.41Å; L18-F77 HydrophobicContact CD1-CE1 4.3Å; L18-F77 HydrophobicContact CD1-CZ 3.6Å
19	R	85.9	Confident	88.6	Confident	179 Å²	179	55 Å²	55	68%	0.675	27%	0.269	S	S	*	.	H	α-helix	trans	-72.3	-37.4	175.1	-74.2	175.8	-177.8	-167.9	-0.4	111.3	R15 H16 L17 G21	R15-R19 WeakPolarHBondContact O-CG 3.41Å; R15-R19 PolarHBondContact O-N 3.5Å; H16-R19 WeakPolarHBondContact O-CA 3.39Å; H16-R19 WeakPolarHBondContact O-CB 3.31Å; H16-R19 PolarHBondContact O-N 3.04Å; L17-R19 VanDerWaalsContact C-N 3.34Å; L17-R19 PolarHBondContact O-N 2.96Å; R19-G21 PolarHBondContact O-N 2.93Å; R19-G21 VanDerWaalsContact O-N 3.11Å
20	N	84.3	Confident	89.3	Confident	95 Å²	95	57.3 Å²	57.3	51%	0.508	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	2.2	178.5	-65.8	0.9	0	0	0	113.4	H16 L17	H16-N20 PolarHBondContact CD2-ND2 2.74Å; H16-N20 PolarHBondContact NE2-ND2 3.25Å; H16-N20 PolarHBondContact NE2-OD1 3.36Å; H16-N20 PolarHBondContact O-N 2.98Å; H16-N20 PolarHBondContact O-OD1 3.3Å; L17-N20 PolarHBondContact O-N 3.2Å
21	G	84.7	Confident	89.7	Confident	46 Å²	46	56.3 Å²	56.3	47%	0.474	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.3	-3.3	171.4	0	0	0	0	0	114.6	R19 R23	R19-G21 PolarHBondContact O-N 2.93Å; R19-G21 VanDerWaalsContact O-N 3.11Å; G21-R23 WeakPolarHBondContact O-CG 3.4Å; G21-R23 PolarHBondContact O-N 3.39Å; G21-R23 VanDerWaalsContact O-N 3.15Å
22	I	86.4	Confident	89.7	Confident	61 Å²	61	56.3 Å²	56.3	31%	0.313	28%	0.28	S	S	.	.			trans	-67.8	116.5	172.5	-56.1	173.5	0	0	0	108.2	L17 L18 F25	L17-I22 HydrophobicContact CB-CD1 4.3Å; L17-I22 HydrophobicContact CD2-CD1 4.09Å; L17-I22 WeakPolarHBondContact O-CB 3.38Å; L17-I22 PolarHBondContact O-N 2.67Å; L18-I22 WeakPolarHBondContact CD2-O 3.15Å; I22-F25 HydrophobicContact CB-CE1 4.47Å; I22-F25 HydrophobicContact CB-CZ 4.08Å; I22-F25 HydrophobicContact CG2-CD1 4.12Å; I22-F25 HydrophobicContact CG2-CD2 4.45Å; I22-F25 HydrophobicContact CG2-CE1 3.51Å; I22-F25 HydrophobicContact CG2-CE2 3.9Å; I22-F25 HydrophobicContact CG2-CZ 3.4Å
23	R	90.3	Very high	89.3	Confident	77 Å²	77	64.3 Å²	64.3	29%	0.291	32%	0.317	S	S	.	.			trans	-117	-10.6	-178.3	-62.6	-57.9	176.2	-176.3	-10.1	113.8	L18 G21 I47 F48	L18-R23 PolarHBondContact O-NH1 3.1Å; L18-R23 PolarHBondContact O-NH2 3.41Å; L18-R23 VanDerWaalsContact O-NH2 3.08Å; G21-R23 WeakPolarHBondContact O-CG 3.4Å; G21-R23 PolarHBondContact O-N 3.39Å; G21-R23 VanDerWaalsContact O-N 3.15Å; R23-I47 WeakPolarHBondContact O-CA 3.28Å; R23-F48 PolarHBondContact O-N 3.11Å
24	K	93.7	Very high	88.5	Confident	138 Å²	138	69.7 Å²	69.7	60%	0.6	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	134.3	-178.1	-62.8	-177.5	-175.7	173.8	0	108.6	L45 L46 I47	K24-L45 HydrophobicContact CB-CD1 4.4Å; K24-L46 VanDerWaalsContact CA-O 3.25Å; K24-L46 WeakPolarHBondContact CA-O 3.25Å; K24-I47 HydrophobicContact CG-CG1 4.42Å
25	F	94.4	Very high	87.6	Confident	6 Å²	6	71 Å²	71	3%	0.026	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.4	169.8	-60.6	-89	0	0	0	108.5	L17 L18 I22 L46 F48 L122 L123 V145	L17-F25 HydrophobicContact CB-CZ 4.21Å; L17-F25 HydrophobicContact CD1-CE1 4.33Å; L17-F25 HydrophobicContact CD1-CZ 4.41Å; L18-F25 HydrophobicContact CD2-CE2 3.71Å; L18-F25 HydrophobicContact CD2-CZ 4.29Å; I22-F25 HydrophobicContact CB-CE1 4.47Å; I22-F25 HydrophobicContact CB-CZ 4.08Å; I22-F25 HydrophobicContact CG2-CD1 4.12Å; I22-F25 HydrophobicContact CG2-CD2 4.45Å; I22-F25 HydrophobicContact CG2-CE1 3.51Å; I22-F25 HydrophobicContact CG2-CE2 3.9Å; I22-F25 HydrophobicContact CG2-CZ 3.4Å; F25-L46 HydrophobicContact CB-CB 4.31Å; F25-L46 HydrophobicContact CB-CD1 4.3Å; F25-L46 PolarHBondContact N-O 2.82Å; F25-L46 PolarHBondContact O-N 3.38Å; F25-F48 AromaticContact CD2-CD2 3.95Å; F25-F48 HydrophobicContact CD2-CD2 3.95Å; F25-F48 AromaticContact CD2-CE2 3.53Å; F25-F48 HydrophobicContact CD2-CE2 3.53Å; F25-F48 HydrophobicContact CE2-CD2 4.03Å; F25-F48 AromaticContact CE2-CE2 3.77Å; F25-F48 HydrophobicContact CE2-CE2 3.77Å; F25-L122 HydrophobicContact CE1-CD2 4.49Å; F25-L123 HydrophobicContact CD1-CD1 3.85Å; F25-L123 HydrophobicContact CE1-CD1 3.73Å; F25-L123 HydrophobicContact CZ-CD1 4.37Å; F25-V145 HydrophobicContact CB-CG1 4.46Å; F25-V145 HydrophobicContact CB-CG2 4.16Å; F25-V145 HydrophobicContact CD1-CG1 4.15Å; F25-V145 HydrophobicContact CD1-CG2 4.46Å
26	I	94.8	Very high	86.6	Confident	73 Å²	73	69.9 Å²	69.9	37%	0.374	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	103.3	169.1	-59	173.2	0	0	0	106.5	K43 L45	I26-K43 HydrophobicContact CG2-CD 4.46Å; I26-L45 HydrophobicContact CG1-CD1 4.13Å
27	V	95.4	Very high	85.6	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.3	177.1	-172.8	0	0	0	0	108	L29 K43 W44 L46 L106 L108 A143 Y144 V145	V27-L29 HydrophobicContact CG1-CD2 3.81Å; V27-K43 CarbonylContact O-C 3.53Å; V27-K43 WeakPolarHBondContact O-CA 3.22Å; V27-W44 HydrophobicContact CB-CB 4.22Å; V27-W44 PolarHBondContact N-O 3.37Å; V27-W44 PolarHBondContact O-N 3.16Å; V27-L46 HydrophobicContact CG2-CD1 3.54Å; V27-L46 HydrophobicContact CG2-CG 3.84Å; V27-L106 HydrophobicContact CG1-CD1 4.45Å; V27-L106 HydrophobicContact CG2-CD2 4.3Å; V27-L108 HydrophobicContact CG2-CD1 4.12Å; V27-A143 HydrophobicContact CG1-CB 3.83Å; V27-Y144 CarbonylContact C-O 3.48Å; V27-Y144 WeakPolarHBondContact CA-O 3.16Å; V27-V145 HydrophobicContact CB-CG2 4.39Å; V27-V145 HydrophobicContact CG2-CG2 3.83Å
28	Q	93.8	Very high	84.3	Confident	37 Å²	37	77.2 Å²	77.2	17%	0.173	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.3	171.4	-62.3	-174.8	0.8	0	0	108.1	K43 A143 Y144 K146	Q28-K43 HydrophobicContact CG-CG 4.48Å; Q28-A143 WeakPolarHBondContact O-CA 3.3Å; Q28-Y144 HydrophobicContact CB-CD1 4.36Å; Q28-Y144 HydrophobicContact CB-CD2 4.03Å; Q28-Y144 HydrophobicContact CB-CE1 3.91Å; Q28-Y144 HydrophobicContact CB-CE2 3.55Å; Q28-Y144 HydrophobicContact CB-CG 4.43Å; Q28-Y144 HydrophobicContact CG-CE2 4.11Å; Q28-Y144 PolarHBondContact N-O 3.44Å; Q28-Y144 PolarHBondContact O-N 2.75Å; Q28-Y144 PolarHBondContact OE1-OH 3.02Å; Q28-K146 VanDerWaalsContact OE1-CE 3.23Å
29	L	92.6	Very high	82.9	Confident	4 Å²	4	78.1 Å²	78.1	2%	0.021	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	119.7	-178.3	-58.7	-177.2	0	0	0	109.9	V27 S42 W44 V127 H141 Y142 A143	V27-L29 HydrophobicContact CG1-CD2 3.81Å; L29-S42 VanDerWaalsContact CB-O 3.27Å; L29-S42 WeakPolarHBondContact CB-O 3.45Å; L29-S42 WeakPolarHBondContact CD1-OG 3.47Å; L29-S42 PolarHBondContact N-O 3.41Å; L29-W44 VanDerWaalsContact CD1-CD1 3.49Å; L29-W44 HydrophobicContact CD1-CD2 3.78Å; L29-W44 VanDerWaalsContact CD1-CE2 3.43Å; L29-W44 HydrophobicContact CD1-CG 3.83Å; L29-W44 HydrophobicContact CD1-CZ2 3.96Å; L29-V127 HydrophobicContact CD1-CG2 4.15Å; L29-V127 HydrophobicContact CD2-CG2 3.5Å; L29-V127 VanDerWaalsContact CD2-CG2 3.5Å; L29-H141 HydrophobicContact CB-CB 3.93Å; L29-H141 HydrophobicContact CD2-CB 4.28Å; L29-Y142 WeakPolarHBondContact CA-O 3.29Å; L29-A143 HydrophobicContact CD2-CB 3.49Å; L29-A143 VanDerWaalsContact CD2-CB 3.49Å
30	E	89.8	Confident	81.7	Confident	85 Å²	85	73.2 Å²	73.2	40%	0.397	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.2	171.8	-79.2	170.3	-164	0	0	108.6	C32 H141 Y142 Y144	E30-C32 PolarHBondContact O-N 2.63Å; E30-H141 CarbonylContact O-C 3.55Å; E30-H141 WeakPolarHBondContact O-CA 3.33Å; E30-H141 VanDerWaalsContact O-CB 3.3Å; E30-H141 WeakPolarHBondContact O-CB 3.11Å; E30-Y142 PolarHBondContact N-O 3.14Å; E30-Y142 PolarHBondContact O-N 3.09Å; E30-Y144 VanDerWaalsContact CD-CE1 3.44Å; E30-Y144 HydrophobicContact CG-CE1 3.83Å; E30-Y144 WeakPolarHBondContact OE1-CE1 3.45Å; E30-Y144 VanDerWaalsContact OE1-CZ 3.24Å; E30-Y144 PolarHBondContact OE1-OH 3.13Å
31	A	88.8	Confident	80.9	Confident	49 Å²	49	75.7 Å²	75.7	41%	0.405	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	135.2	179.7	0	0	0	0	0	110.4
32	C	86.5	Confident	80.6	Confident	33 Å²	33	73.9 Å²	73.9	22%	0.223	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-66	146.1	169.2	-62.8	0	0	0	0	109.5	E30 N34 W35 T140	E30-C32 PolarHBondContact O-N 2.63Å; C32-N34 PolarHBondContact O-N 2.51Å; C32-W35 VanDerWaalsContact O-CB 3.26Å; C32-W35 WeakPolarHBondContact O-CB 3.33Å; C32-W35 PolarHBondContact O-N 3.03Å; C32-T140 PolarHBondContact N-O 2.83Å
33	E	78.5	Confident	80.8	Confident	197 Å²	197	75.5 Å²	75.5	92%	0.921	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-33.1	-178.4	-63.9	-178.1	168	0	0	113.3	W35	E33-W35 VanDerWaalsContact C-N 3.26Å; E33-W35 PolarHBondContact O-N 3.26Å
34	N	74.6	Confident	81	Confident	155 Å²	155	72 Å²	72	83%	0.829	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-1	-179.7	-63.5	-22.6	0	0	0	114	C32 P36	C32-N34 PolarHBondContact O-N 2.51Å; N34-P36 VanDerWaalsContact O-CD 3.27Å; N34-P36 WeakPolarHBondContact O-CD 3.37Å
35	W	73.1	Confident	81.1	Confident	32 Å²	32	67.2 Å²	67.2	12%	0.121	36%	0.359	C	S	.	.			trans	-79.4	112	-176.8	-171.6	-116.2	0	0	0	110.5	C32 E33 Y37 E138 T140	C32-W35 VanDerWaalsContact O-CB 3.26Å; C32-W35 WeakPolarHBondContact O-CB 3.33Å; C32-W35 PolarHBondContact O-N 3.03Å; E33-W35 VanDerWaalsContact C-N 3.26Å; E33-W35 PolarHBondContact O-N 3.26Å; W35-Y37 HydrophobicContact CD2-CD2 4.36Å; W35-Y37 AromaticContact CE2-CD2 3.81Å; W35-Y37 AromaticContact CH2-CD2 3.92Å; W35-Y37 HydrophobicContact CH2-CD2 3.92Å; W35-Y37 HydrophobicContact CH2-CE2 4.26Å; W35-Y37 AromaticContact CZ2-CD2 3.6Å; W35-Y37 HydrophobicContact CZ2-CD2 3.6Å; W35-Y37 HydrophobicContact CZ2-CE2 4.36Å; W35-Y37 HydrophobicContact CZ2-CG 4.4Å; W35-Y37 HydrophobicContact CZ3-CD2 4.43Å; W35-Y37 PolarHBondContact O-N 3.3Å; W35-E138 WeakPolarHBondContact CZ3-OE2 3.19Å; W35-T140 HydrophobicContact CD2-CG2 4.06Å; W35-T140 HydrophobicContact CE3-CG2 3.55Å; W35-T140 HydrophobicContact CH2-CG2 3.5Å; W35-T140 VanDerWaalsContact CH2-CG2 3.5Å; W35-T140 HydrophobicContact CZ2-CG2 3.97Å; W35-T140 HydrophobicContact CZ3-CG2 3.27Å
36	P	66.8	Low	81.2	Confident	101 Å²	101	67 Å²	67	66%	0.656	36%	0.358	S	S	*	.			trans	-79.5	-5.7	-167.9	32	-35.2	0	0	0	113.7	N34	N34-P36 VanDerWaalsContact O-CD 3.27Å; N34-P36 WeakPolarHBondContact O-CD 3.37Å
37	Y	67.5	Low	81.2	Confident	111 Å²	111	66 Å²	66	44%	0.435	35%	0.353	S	S	.	.	S	Bend	trans	-103.1	146.5	-177.4	-59.1	-79.6	0	0	0	110.3	W35 S39 Q99	W35-Y37 HydrophobicContact CD2-CD2 4.36Å; W35-Y37 AromaticContact CE2-CD2 3.81Å; W35-Y37 AromaticContact CH2-CD2 3.92Å; W35-Y37 HydrophobicContact CH2-CD2 3.92Å; W35-Y37 HydrophobicContact CH2-CE2 4.26Å; W35-Y37 AromaticContact CZ2-CD2 3.6Å; W35-Y37 HydrophobicContact CZ2-CD2 3.6Å; W35-Y37 HydrophobicContact CZ2-CE2 4.36Å; W35-Y37 HydrophobicContact CZ2-CG 4.4Å; W35-Y37 HydrophobicContact CZ3-CD2 4.43Å; W35-Y37 PolarHBondContact O-N 3.3Å; Y37-S39 VanDerWaalsContact C-N 3.35Å; Y37-S39 PolarHBondContact O-N 3.46Å; Y37-Q99 HydrophobicContact CE1-CG 4.45Å; Y37-Q99 HydrophobicContact CE2-CG 4.18Å; Y37-Q99 VanDerWaalsContact CZ-NE2 3.33Å
38	P	59.6	Low	81.2	Confident	127 Å²	127	66.4 Å²	66.4	83%	0.825	36%	0.355	S	S	*	.			trans	-60.7	100.8	172.9	25.7	-33.1	0	0	0	108.6	S40	P38-S40 PolarHBondContact O-N 3.16Å
39	S	60.5	Low	80.9	Confident	34 Å²	34	68 Å²	68	24%	0.238	36%	0.364	C	S	.	.			trans	-89.8	102.9	167.9	172	0	0	0	0	106.7	Y37 H141	Y37-S39 VanDerWaalsContact C-N 3.35Å; Y37-S39 PolarHBondContact O-N 3.46Å; S39-H141 WeakPolarHBondContact CB-NE2 3.12Å; S39-H141 PolarHBondContact OG-CD2 2.69Å; S39-H141 VanDerWaalsContact OG-CD2 3.31Å; S39-H141 PolarHBondContact OG-NE2 2.88Å
40	S	58.8	Low	80.3	Confident	76 Å²	76	76.7 Å²	76.7	53%	0.531	40%	0.397	S	S	.	.			trans	-65.3	137.5	163.6	-43.4	0	0	0	0	107.9	P38 S42 S63	P38-S40 PolarHBondContact O-N 3.16Å; S40-S42 PolarHBondContact O-N 3.15Å; S40-S63 WeakPolarHBondContact CB-OG 3.38Å
41	E	68.1	Low	80	Confident	147 Å²	147	81.1 Å²	81.1	69%	0.687	42%	0.415	S	S	*	.			trans	-41.4	104.3	173.7	-71.9	-177.4	-174.9	0	0	110.5	S63	E41-S63 VanDerWaalsContact C-OG 3.3Å; E41-S63 PolarHBondContact N-OG 3.21Å; E41-S63 VanDerWaalsContact N-OG 3.14Å; E41-S63 WeakPolarHBondContact O-CB 3.46Å; E41-S63 PolarHBondContact O-OG 3.03Å
42	S	79.4	Confident	79.9	Confident	8 Å²	8	82.9 Å²	82.9	6%	0.056	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	135.4	-175.2	62.3	0	0	0	0	109	L29 S40 M61	L29-S42 VanDerWaalsContact CB-O 3.27Å; L29-S42 WeakPolarHBondContact CB-O 3.45Å; L29-S42 WeakPolarHBondContact CD1-OG 3.47Å; L29-S42 PolarHBondContact N-O 3.41Å; S40-S42 PolarHBondContact O-N 3.15Å; S42-M61 WeakPolarHBondContact CA-O 3.15Å
43	K	91	Very high	79.8	Confident	96 Å²	96	89 Å²	89	42%	0.417	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	127.1	175.5	-69.9	179.8	-176.4	172.7	0	107.8	I26 V27 Q28 M61	I26-K43 HydrophobicContact CG2-CD 4.46Å; V27-K43 CarbonylContact O-C 3.53Å; V27-K43 WeakPolarHBondContact O-CA 3.22Å; Q28-K43 HydrophobicContact CG-CG 4.48Å; K43-M61 HydrophobicContact CB-CB 4.45Å; K43-M61 HydrophobicContact CB-CE 3.73Å; K43-M61 PolarHBondContact N-O 3.28Å; K43-M61 WeakPolarHBondContact O-CA 3.43Å; K43-M61 WeakPolarHBondContact O-CB 3.43Å; K43-M61 PolarHBondContact O-N 3.18Å
44	W	94	Very high	80.4	Confident	3 Å²	3	83.9 Å²	83.9	1%	0.011	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125	172.9	-72.5	20.2	0	0	0	109.1	V27 L29 V58 I59 F90 F104 L106 V127	V27-W44 HydrophobicContact CB-CB 4.22Å; V27-W44 PolarHBondContact N-O 3.37Å; V27-W44 PolarHBondContact O-N 3.16Å; L29-W44 VanDerWaalsContact CD1-CD1 3.49Å; L29-W44 HydrophobicContact CD1-CD2 3.78Å; L29-W44 VanDerWaalsContact CD1-CE2 3.43Å; L29-W44 HydrophobicContact CD1-CG 3.83Å; L29-W44 HydrophobicContact CD1-CZ2 3.96Å; W44-V58 HydrophobicContact CD2-CG1 4.36Å; W44-V58 HydrophobicContact CE3-CG1 3.89Å; W44-V58 HydrophobicContact CZ3-CG1 4.47Å; W44-I59 CarbonylContact C-O 3.59Å; W44-I59 WeakPolarHBondContact CA-O 3.4Å; W44-F90 AromaticContact CH2-CE2 3.95Å; W44-F90 HydrophobicContact CH2-CE2 3.95Å; W44-F90 AromaticContact CZ2-CE2 3.88Å; W44-F90 HydrophobicContact CZ2-CE2 3.88Å; W44-F90 HydrophobicContact CZ3-CE2 4.41Å; W44-F104 HydrophobicContact CH2-CB 3.87Å; W44-F104 AromaticContact CH2-CD2 3.9Å; W44-F104 HydrophobicContact CH2-CD2 3.9Å; W44-F104 AromaticContact CH2-CG 3.84Å; W44-F104 HydrophobicContact CH2-CG 3.84Å; W44-F104 HydrophobicContact CZ3-CB 4.42Å; W44-F104 AromaticContact CZ3-CD2 3.58Å; W44-F104 HydrophobicContact CZ3-CD2 3.58Å; W44-F104 AromaticContact CZ3-CE2 3.97Å; W44-F104 HydrophobicContact CZ3-CE2 3.97Å; W44-F104 HydrophobicContact CZ3-CG 4.01Å; W44-L106 HydrophobicContact CE3-CD2 4.25Å; W44-L106 HydrophobicContact CZ3-CB 4.27Å; W44-V127 HydrophobicContact CH2-CG1 3.62Å; W44-V127 HydrophobicContact CH2-CG2 4.23Å; W44-V127 HydrophobicContact CZ2-CG1 4.18Å; W44-V127 HydrophobicContact CZ3-CG1 4.26Å; W44-V127 HydrophobicContact CZ3-CG2 4.18Å
45	L	95	Very high	81.4	Confident	38 Å²	38	82.3 Å²	82.3	20%	0.199	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	117	171.2	174.7	62.5	0	0	0	108.7	K24 I26 I47 I59 M61	K24-L45 HydrophobicContact CB-CD1 4.4Å; I26-L45 HydrophobicContact CG1-CD1 4.13Å; L45-I47 HydrophobicContact CD1-CG1 4.31Å; L45-I47 HydrophobicContact CD2-CD1 3.97Å; L45-I47 HydrophobicContact CD2-CG1 4.23Å; L45-I47 HydrophobicContact CG-CD1 4.17Å; L45-I47 HydrophobicContact CG-CG1 3.91Å; L45-I59 HydrophobicContact CB-CB 4.25Å; L45-I59 HydrophobicContact CD2-CD1 4.31Å; L45-I59 PolarHBondContact N-O 2.89Å; L45-I59 PolarHBondContact O-N 3.02Å; L45-M61 HydrophobicContact CB-CE 4Å
46	L	96.5	Very high	82.4	Confident	0 Å²	0	81 Å²	81	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.7	173.7	-53.2	178.1	0	0	0	109	K24 F25 V27 F48 K57 V58 I86 L106 L108	K24-L46 VanDerWaalsContact CA-O 3.25Å; K24-L46 WeakPolarHBondContact CA-O 3.25Å; F25-L46 HydrophobicContact CB-CB 4.31Å; F25-L46 HydrophobicContact CB-CD1 4.3Å; F25-L46 PolarHBondContact N-O 2.82Å; F25-L46 PolarHBondContact O-N 3.38Å; V27-L46 HydrophobicContact CG2-CD1 3.54Å; V27-L46 HydrophobicContact CG2-CG 3.84Å; L46-F48 HydrophobicContact CB-CD2 4.4Å; L46-F48 HydrophobicContact CB-CE2 3.69Å; L46-F48 HydrophobicContact CB-CZ 4.46Å; L46-F48 HydrophobicContact CD1-CE2 4.28Å; L46-F48 HydrophobicContact CD1-CZ 4.49Å; L46-K57 WeakPolarHBondContact CA-O 3.41Å; L46-V58 HydrophobicContact CD2-CB 4.33Å; L46-V58 HydrophobicContact CD2-CG1 3.92Å; L46-V58 HydrophobicContact CD2-CG2 3.88Å; L46-I86 HydrophobicContact CD1-CD1 3.48Å; L46-I86 VanDerWaalsContact CD1-CD1 3.48Å; L46-I86 HydrophobicContact CD2-CD1 3.97Å; L46-I86 HydrophobicContact CG-CD1 4.29Å; L46-L106 HydrophobicContact CD1-CD2 3.88Å; L46-L106 HydrophobicContact CD2-CD2 4.1Å; L46-L106 HydrophobicContact CG-CD2 4.49Å; L46-L108 HydrophobicContact CD1-CD1 3.89Å
47	I	95.6	Very high	83.8	Confident	52 Å²	52	80 Å²	80	27%	0.267	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	112.5	177.6	-54.3	168.9	0	0	0	108.8	R23 K24 L45 C56 K57 I59	R23-I47 WeakPolarHBondContact O-CA 3.28Å; K24-I47 HydrophobicContact CG-CG1 4.42Å; L45-I47 HydrophobicContact CD1-CG1 4.31Å; L45-I47 HydrophobicContact CD2-CD1 3.97Å; L45-I47 HydrophobicContact CD2-CG1 4.23Å; L45-I47 HydrophobicContact CG-CD1 4.17Å; L45-I47 HydrophobicContact CG-CG1 3.91Å; I47-C56 CarbonylContact O-C 3.48Å; I47-C56 VanDerWaalsContact O-CA 3.32Å; I47-C56 WeakPolarHBondContact O-CA 3.49Å; I47-C56 WeakPolarHBondContact O-CB 3.45Å; I47-K57 HydrophobicContact CB-CB 4.23Å; I47-K57 HydrophobicContact CD1-CD 4.49Å; I47-K57 PolarHBondContact N-O 3.21Å; I47-K57 PolarHBondContact O-N 2.79Å; I47-I59 HydrophobicContact CD1-CD1 4Å
48	F	94.3	Very high	85.2	Confident	9 Å²	9	74.7 Å²	74.7	4%	0.039	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.4	-179.1	-67.9	-98.3	0	0	0	110.6	L18 R23 F25 L46 C56 V75 M84 I86	L18-F48 HydrophobicContact CD1-CD1 3.7Å; L18-F48 HydrophobicContact CD1-CE1 3.86Å; L18-F48 HydrophobicContact CD1-CG 4.36Å; L18-F48 HydrophobicContact CD2-CB 4.01Å; L18-F48 HydrophobicContact CD2-CD1 3.74Å; L18-F48 HydrophobicContact CD2-CD2 3.79Å; L18-F48 HydrophobicContact CD2-CE1 4.12Å; L18-F48 HydrophobicContact CD2-CE2 4.19Å; L18-F48 HydrophobicContact CD2-CG 3.55Å; L18-F48 HydrophobicContact CD2-CZ 4.34Å; L18-F48 HydrophobicContact CG-CD1 4.41Å; R23-F48 PolarHBondContact O-N 3.11Å; F25-F48 AromaticContact CD2-CD2 3.95Å; F25-F48 HydrophobicContact CD2-CD2 3.95Å; F25-F48 AromaticContact CD2-CE2 3.53Å; F25-F48 HydrophobicContact CD2-CE2 3.53Å; F25-F48 HydrophobicContact CE2-CD2 4.03Å; F25-F48 AromaticContact CE2-CE2 3.77Å; F25-F48 HydrophobicContact CE2-CE2 3.77Å; L46-F48 HydrophobicContact CB-CD2 4.4Å; L46-F48 HydrophobicContact CB-CE2 3.69Å; L46-F48 HydrophobicContact CB-CZ 4.46Å; L46-F48 HydrophobicContact CD1-CE2 4.28Å; L46-F48 HydrophobicContact CD1-CZ 4.49Å; F48-C56 HydrophobicContact CD1-CB 3.82Å; F48-C56 HydrophobicContact CD2-CB 4.4Å; F48-C56 HydrophobicContact CE1-CB 3.94Å; F48-C56 HydrophobicContact CE2-CB 4.46Å; F48-C56 HydrophobicContact CG-CB 4.08Å; F48-C56 HydrophobicContact CZ-CB 4.25Å; F48-V75 HydrophobicContact CD1-CG2 4.28Å; F48-V75 HydrophobicContact CE1-CB 4.47Å; F48-V75 HydrophobicContact CE1-CG1 3.98Å; F48-V75 HydrophobicContact CE1-CG2 3.69Å; F48-M84 HydrophobicContact CE1-SD 3.68Å; F48-M84 HydrophobicContact CZ-CE 3.9Å; F48-M84 HydrophobicContact CZ-SD 3.48Å; F48-M84 WeakPolarHBondContact CZ-SD 3.25Å; F48-I86 HydrophobicContact CZ-CD1 3.8Å
49	N	87.7	Confident	86.8	Confident	70 Å²	70	69.3 Å²	69.3	37%	0.374	33%	0.326	S	S	.	.			trans	-83.2	138.4	176	-169	-28.5	0	0	0	110.2	F51 I52	N49-F51 VanDerWaalsContact C-N 3.3Å; N49-F51 PolarHBondContact O-N 3.36Å; N49-F51 WeakPolarHBondContact OD1-CD2 3.38Å; N49-F51 PolarHBondContact OD1-N 2.9Å; N49-I52 HydrophobicContact CB-CB 4.16Å; N49-I52 HydrophobicContact CB-CG1 4.49Å
50	R	81.1	Confident	88.3	Confident	187 Å²	187	68.7 Å²	68.7	71%	0.706	32%	0.319	S	S	*	.	S	Bend	trans	-64.4	-35.1	174.8	-174.4	176.8	-178.2	173	1	112.3
51	F	83.7	Confident	89.7	Confident	179 Å²	179	67.3 Å²	67.3	79%	0.785	31%	0.305	S	S	*	.	S	Bend	trans	-86.1	-32.2	-175.5	-57.5	-72.1	0	0	0	112.4	N49	N49-F51 VanDerWaalsContact C-N 3.3Å; N49-F51 PolarHBondContact O-N 3.36Å; N49-F51 WeakPolarHBondContact OD1-CD2 3.38Å; N49-F51 PolarHBondContact OD1-N 2.9Å
52	I	86.4	Confident	90.4	Very high	85 Å²	85	62.2 Å²	62.2	44%	0.436	28%	0.284	S	S	.	.			trans	-110.4	85.7	-175	-46.7	176.7	0	0	0	109.6	N49 N54 W55	N49-I52 HydrophobicContact CB-CB 4.16Å; N49-I52 HydrophobicContact CB-CG1 4.49Å; I52-N54 VanDerWaalsContact C-N 3.32Å; I52-N54 PolarHBondContact O-N 3.08Å; I52-W55 HydrophobicContact CG2-CB 3.62Å; I52-W55 HydrophobicContact CG2-CG 3.8Å; I52-W55 PolarHBondContact O-N 3.37Å; I52-W55 VanDerWaalsContact O-O 3.04Å
53	K	84	Confident	89.9	Confident	162 Å²	162	65.1 Å²	65.1	70%	0.704	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.9	-168.6	-63.9	-179.8	-177.6	173.6	0	115.1
54	N	91	Very high	88.9	Confident	89 Å²	89	63.6 Å²	63.6	48%	0.476	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	10.1	-175.6	-60.3	-4.2	0	0	0	112.7	I52 H74 V75	I52-N54 VanDerWaalsContact C-N 3.32Å; I52-N54 PolarHBondContact O-N 3.08Å; N54-H74 CarbonylContact O-C 3.55Å; N54-H74 WeakPolarHBondContact O-CA 3.49Å; N54-H74 PolarHBondContact O-CD2 3.49Å; N54-V75 PolarHBondContact O-N 2.55Å
55	W	94.8	Very high	87.5	Confident	122 Å²	122	65.5 Å²	65.5	46%	0.462	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139.4	-178.3	-59.4	89	0	0	0	110.5	I52 I72 G73 H74	I52-W55 HydrophobicContact CG2-CB 3.62Å; I52-W55 HydrophobicContact CG2-CG 3.8Å; I52-W55 PolarHBondContact O-N 3.37Å; I52-W55 VanDerWaalsContact O-O 3.04Å; W55-I72 HydrophobicContact CB-CG2 4.22Å; W55-I72 HydrophobicContact CD2-CG2 4.31Å; W55-I72 HydrophobicContact CE3-CG2 3.54Å; W55-I72 HydrophobicContact CZ3-CG2 4.2Å; W55-G73 CarbonylContact C-O 3.58Å; W55-G73 VanDerWaalsContact CA-O 3.29Å; W55-G73 WeakPolarHBondContact CA-O 3.48Å; W55-H74 AromaticContact CE2-CD2 3.91Å; W55-H74 HydrophobicContact CE3-CB 3.96Å; W55-H74 HydrophobicContact CH2-CB 4.24Å; W55-H74 AromaticContact CZ2-CD2 3.94Å; W55-H74 HydrophobicContact CZ3-CB 3.81Å
56	C	95.2	Very high	86.3	Confident	4 Å²	4	69.6 Å²	69.6	3%	0.027	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	154.5	174.2	68.2	0	0	0	0	110.3	I47 F48 I72 G73 V75 I86	I47-C56 CarbonylContact O-C 3.48Å; I47-C56 VanDerWaalsContact O-CA 3.32Å; I47-C56 WeakPolarHBondContact O-CA 3.49Å; I47-C56 WeakPolarHBondContact O-CB 3.45Å; F48-C56 HydrophobicContact CD1-CB 3.82Å; F48-C56 HydrophobicContact CD2-CB 4.4Å; F48-C56 HydrophobicContact CE1-CB 3.94Å; F48-C56 HydrophobicContact CE2-CB 4.46Å; F48-C56 HydrophobicContact CG-CB 4.08Å; F48-C56 HydrophobicContact CZ-CB 4.25Å; C56-I72 CarbonylContact O-C 3.56Å; C56-I72 WeakPolarHBondContact O-CA 3.48Å; C56-G73 PolarHBondContact N-O 2.78Å; C56-G73 PolarHBondContact O-N 2.8Å; C56-V75 HydrophobicContact CB-CG2 3.94Å; C56-I86 VanDerWaalsContact SG-CG2 3.53Å
57	K	96.3	Very high	85.5	Confident	80 Å²	80	75 Å²	75	35%	0.348	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	130.1	167.4	-172.8	-179.2	-178.1	-176	0	107.8	L46 I47 I59 E70	L46-K57 WeakPolarHBondContact CA-O 3.41Å; I47-K57 HydrophobicContact CB-CB 4.23Å; I47-K57 HydrophobicContact CD1-CD 4.49Å; I47-K57 PolarHBondContact N-O 3.21Å; I47-K57 PolarHBondContact O-N 2.79Å; K57-I59 HydrophobicContact CD-CD1 4.07Å; K57-I59 HydrophobicContact CD-CG1 4.22Å; K57-I59 HydrophobicContact CG-CD1 4.46Å; K57-I59 HydrophobicContact CG-CG1 4.11Å; K57-E70 WeakPolarHBondContact CE-OE1 3.3Å; K57-E70 WeakPolarHBondContact CE-OE2 3.08Å; K57-E70 IonicContact NZ-OE1 3.47Å; K57-E70 PolarHBondContact NZ-OE1 3.46Å; K57-E70 IonicContact NZ-OE2 2.73Å; K57-E70 PolarHBondContact NZ-OE2 2.8Å
58	V	96.1	Very high	85.1	Confident	0 Å²	0	80.6 Å²	80.6	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.7	176.9	-174.3	0	0	0	0	107.7	W44 L46 E70 T71 I86 F90 F104	W44-V58 HydrophobicContact CD2-CG1 4.36Å; W44-V58 HydrophobicContact CE3-CG1 3.89Å; W44-V58 HydrophobicContact CZ3-CG1 4.47Å; L46-V58 HydrophobicContact CD2-CB 4.33Å; L46-V58 HydrophobicContact CD2-CG1 3.92Å; L46-V58 HydrophobicContact CD2-CG2 3.88Å; V58-E70 WeakPolarHBondContact O-CA 3.35Å; V58-T71 HydrophobicContact CB-CG2 3.91Å; V58-T71 PolarHBondContact N-O 2.79Å; V58-T71 PolarHBondContact O-N 2.99Å; V58-I86 HydrophobicContact CG2-CG2 3.97Å; V58-F90 HydrophobicContact CB-CZ 4.46Å; V58-F90 HydrophobicContact CG1-CZ 3.76Å; V58-F104 HydrophobicContact CB-CZ 4.24Å; V58-F104 HydrophobicContact CG1-CZ 4.16Å; V58-F104 HydrophobicContact CG2-CE2 4.45Å; V58-F104 HydrophobicContact CG2-CZ 4.01Å
59	I	93.7	Very high	84.9	Confident	14 Å²	14	81.5 Å²	81.5	7%	0.072	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	111.9	179.8	-55.1	175.8	0	0	0	107.9	W44 L45 I47 K57 M61 Y69 E70	W44-I59 CarbonylContact C-O 3.59Å; W44-I59 WeakPolarHBondContact CA-O 3.4Å; L45-I59 HydrophobicContact CB-CB 4.25Å; L45-I59 HydrophobicContact CD2-CD1 4.31Å; L45-I59 PolarHBondContact N-O 2.89Å; L45-I59 PolarHBondContact O-N 3.02Å; I47-I59 HydrophobicContact CD1-CD1 4Å; K57-I59 HydrophobicContact CD-CD1 4.07Å; K57-I59 HydrophobicContact CD-CG1 4.22Å; K57-I59 HydrophobicContact CG-CD1 4.46Å; K57-I59 HydrophobicContact CG-CG1 4.11Å; I59-M61 HydrophobicContact CG2-CG 4.22Å; I59-Y69 CarbonylContact C-O 3.52Å; I59-Y69 WeakPolarHBondContact CA-O 3.4Å; I59-E70 HydrophobicContact CG1-CG 4.11Å; I59-E70 HydrophobicContact CG2-CG 4.3Å
60	Q	91.1	Very high	85.1	Confident	22 Å²	22	83.1 Å²	83.1	10%	0.103	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	123.6	172.2	175.4	175	24.2	0	0	109.4	R68 Y69 F90	Q60-R68 VanDerWaalsContact O-CA 3.32Å; Q60-R68 WeakPolarHBondContact O-CA 3.39Å; Q60-Y69 PolarHBondContact N-O 3Å; Q60-Y69 PolarHBondContact O-N 2.79Å; Q60-F90 HydrophobicContact CB-CE1 3.82Å; Q60-F90 HydrophobicContact CB-CE2 4.41Å; Q60-F90 HydrophobicContact CB-CZ 3.71Å
61	M	89	Confident	85.8	Confident	46 Å²	46	75.4 Å²	75.4	23%	0.227	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	125	175.6	-57.8	178.7	-70.7	0	0	109.1	S42 K43 L45 I59	S42-M61 WeakPolarHBondContact CA-O 3.15Å; K43-M61 HydrophobicContact CB-CB 4.45Å; K43-M61 HydrophobicContact CB-CE 3.73Å; K43-M61 PolarHBondContact N-O 3.28Å; K43-M61 WeakPolarHBondContact O-CA 3.43Å; K43-M61 WeakPolarHBondContact O-CB 3.43Å; K43-M61 PolarHBondContact O-N 3.18Å; L45-M61 HydrophobicContact CB-CE 4Å; I59-M61 HydrophobicContact CG2-CG 4.22Å
62	T	81.6	Confident	86.4	Confident	40 Å²	40	72 Å²	72	25%	0.245	38%	0.375	C	S	.	.			trans	-79.3	151.4	173.8	52.5	0	0	0	0	110.8	G64 G65 K67	T62-G64 PolarHBondContact O-N 2.76Å; T62-G64 VanDerWaalsContact O-N 3.16Å; T62-G65 PolarHBondContact O-N 2.98Å; T62-K67 HydrophobicContact CG2-CB 4.12Å; T62-K67 PolarHBondContact N-O 3.48Å; T62-K67 PolarHBondContact OG1-N 3.48Å; T62-K67 PolarHBondContact OG1-O 3.01Å
63	S	69.9	Low	86.8	Confident	70 Å²	70	67.9 Å²	67.9	49%	0.49	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.9	-174.6	-26.7	0	0	0	0	113.4	S40 E41 G65	S40-S63 WeakPolarHBondContact CB-OG 3.38Å; E41-S63 VanDerWaalsContact C-OG 3.3Å; E41-S63 PolarHBondContact N-OG 3.21Å; E41-S63 VanDerWaalsContact N-OG 3.14Å; E41-S63 WeakPolarHBondContact O-CB 3.46Å; E41-S63 PolarHBondContact O-OG 3.03Å; S63-G65 VanDerWaalsContact C-N 3.27Å; S63-G65 PolarHBondContact O-N 3.19Å
64	G	68.9	Low	87.5	Confident	63 Å²	63	63 Å²	63	65%	0.649	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-2	175	0	0	0	0	0	114.9	T62 T66	T62-G64 PolarHBondContact O-N 2.76Å; T62-G64 VanDerWaalsContact O-N 3.16Å; G64-T66 PolarHBondContact O-N 2.9Å
65	G	64.7	Low	87.7	Confident	44 Å²	44	58.9 Å²	58.9	45%	0.454	31%	0.312	S	S	.	.	S	Bend	trans	68.1	-7.8	179.8	0	0	0	0	0	115.8	T62 S63	T62-G65 PolarHBondContact O-N 2.98Å; S63-G65 VanDerWaalsContact C-N 3.27Å; S63-G65 PolarHBondContact O-N 3.19Å
66	T	70.8	Confident	87.7	Confident	124 Å²	124	55.9 Å²	55.9	76%	0.761	31%	0.307	S	S	*	.	S	Bend	trans	-75.9	-33	-171.5	51.9	0	0	0	0	113.5	G64	G64-T66 PolarHBondContact O-N 2.9Å
67	K	80.7	Confident	87.6	Confident	112 Å²	112	58.8 Å²	58.8	49%	0.487	32%	0.319	S	S	.	.			trans	-117.9	126.9	-178.4	-65.8	178	179	179.5	0	110.7	T62 Y69	T62-K67 HydrophobicContact CG2-CB 4.12Å; T62-K67 PolarHBondContact N-O 3.48Å; T62-K67 PolarHBondContact OG1-N 3.48Å; T62-K67 PolarHBondContact OG1-O 3.01Å; K67-Y69 HydrophobicContact CB-CE2 4.25Å
68	R	86.4	Confident	87.3	Confident	170 Å²	170	57.1 Å²	57.1	64%	0.642	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.5	172.3	-62.6	-178.5	-175.1	173	0.8	108.9	Q60	Q60-R68 VanDerWaalsContact O-CA 3.32Å; Q60-R68 WeakPolarHBondContact O-CA 3.39Å
69	Y	90	Very high	86.7	Confident	29 Å²	29	67.2 Å²	67.2	11%	0.114	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129.4	174.6	-58.3	-65.5	0	0	0	109.1	I59 Q60 K67 F90 Q92 D93	I59-Y69 CarbonylContact C-O 3.52Å; I59-Y69 WeakPolarHBondContact CA-O 3.4Å; Q60-Y69 PolarHBondContact N-O 3Å; Q60-Y69 PolarHBondContact O-N 2.79Å; K67-Y69 HydrophobicContact CB-CE2 4.25Å; Y69-F90 WeakPolarHBondContact O-CE1 3.48Å; Y69-Q92 HydrophobicContact CD1-CB 3.7Å; Y69-Q92 HydrophobicContact CE1-CB 4.09Å; Y69-Q92 WeakPolarHBondContact CE1-O 3.31Å; Y69-D93 HydrophobicContact CD2-CB 4.19Å; Y69-D93 HydrophobicContact CE2-CB 4.44Å; Y69-D93 HydrophobicContact CG-CB 4.34Å
70	E	92.5	Very high	85.8	Confident	104 Å²	104	74.4 Å²	74.4	49%	0.486	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	143.6	-179.1	-54.3	-163.1	150.1	0	0	110.9	K57 V58 I59	K57-E70 WeakPolarHBondContact CE-OE1 3.3Å; K57-E70 WeakPolarHBondContact CE-OE2 3.08Å; K57-E70 IonicContact NZ-OE1 3.47Å; K57-E70 PolarHBondContact NZ-OE1 3.46Å; K57-E70 IonicContact NZ-OE2 2.73Å; K57-E70 PolarHBondContact NZ-OE2 2.8Å; V58-E70 WeakPolarHBondContact O-CA 3.35Å; I59-E70 HydrophobicContact CG1-CG 4.11Å; I59-E70 HydrophobicContact CG2-CG 4.3Å
71	T	95.1	Very high	85.1	Confident	24 Å²	24	78.7 Å²	78.7	15%	0.147	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	169.9	171.5	-175	0	0	0	0	110.2	V58 K89 F90 F104	V58-T71 HydrophobicContact CB-CG2 3.91Å; V58-T71 PolarHBondContact N-O 2.79Å; V58-T71 PolarHBondContact O-N 2.99Å; T71-K89 WeakPolarHBondContact CB-O 3.44Å; T71-K89 PolarHBondContact OG1-O 2.85Å; T71-F90 HydrophobicContact CG2-CD1 3.64Å; T71-F90 HydrophobicContact CG2-CD2 4.44Å; T71-F90 HydrophobicContact CG2-CE1 3.4Å; T71-F90 HydrophobicContact CG2-CE2 4.25Å; T71-F90 HydrophobicContact CG2-CG 4.18Å; T71-F90 HydrophobicContact CG2-CZ 3.75Å; T71-F104 HydrophobicContact CG2-CE1 3.63Å; T71-F104 HydrophobicContact CG2-CZ 4.01Å
72	I	95.5	Very high	84.9	Confident	107 Å²	107	76.7 Å²	76.7	55%	0.549	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	133.8	167	-56.1	174.7	0	0	0	107.5	W55 C56	W55-I72 HydrophobicContact CB-CG2 4.22Å; W55-I72 HydrophobicContact CD2-CG2 4.31Å; W55-I72 HydrophobicContact CE3-CG2 3.54Å; W55-I72 HydrophobicContact CZ3-CG2 4.2Å; C56-I72 CarbonylContact O-C 3.56Å; C56-I72 WeakPolarHBondContact O-CA 3.48Å
73	G	96.6	Very high	85.5	Confident	0 Å²	0	75 Å²	75	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.6	173.7	0	0	0	0	0	111	W55 C56 T87	W55-G73 CarbonylContact C-O 3.58Å; W55-G73 VanDerWaalsContact CA-O 3.29Å; W55-G73 WeakPolarHBondContact CA-O 3.48Å; C56-G73 PolarHBondContact N-O 2.78Å; C56-G73 PolarHBondContact O-N 2.8Å; G73-T87 CarbonylContact C-O 3.33Å; G73-T87 VanDerWaalsContact CA-O 3.26Å; G73-T87 WeakPolarHBondContact CA-O 3.28Å
74	H	96.7	Very high	86.7	Confident	60 Å²	60	71.8 Å²	71.8	28%	0.278	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126	170.5	180	-101.6	0	0	0	109.6	N54 W55 T76 I86 T87	N54-H74 CarbonylContact O-C 3.55Å; N54-H74 WeakPolarHBondContact O-CA 3.49Å; N54-H74 PolarHBondContact O-CD2 3.49Å; W55-H74 AromaticContact CE2-CD2 3.91Å; W55-H74 HydrophobicContact CE3-CB 3.96Å; W55-H74 HydrophobicContact CH2-CB 4.24Å; W55-H74 AromaticContact CZ2-CD2 3.94Å; W55-H74 HydrophobicContact CZ3-CB 3.81Å; H74-T76 WeakPolarHBondContact CE1-CG2 3.36Å; H74-I86 WeakPolarHBondContact O-CA 3.13Å; H74-T87 PolarHBondContact N-O 2.88Å; H74-T87 PolarHBondContact O-N 2.91Å; H74-T87 PolarHBondContact O-OG1 3.1Å
75	V	95.8	Very high	88	Confident	2 Å²	2	72 Å²	72	1%	0.012	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	124.8	-173.9	-174.3	0	0	0	0	109.5	F48 N54 C56 F77 M84 F85 I86	F48-V75 HydrophobicContact CD1-CG2 4.28Å; F48-V75 HydrophobicContact CE1-CB 4.47Å; F48-V75 HydrophobicContact CE1-CG1 3.98Å; F48-V75 HydrophobicContact CE1-CG2 3.69Å; N54-V75 PolarHBondContact O-N 2.55Å; C56-V75 HydrophobicContact CB-CG2 3.94Å; V75-F77 HydrophobicContact CG1-CE1 4.35Å; V75-F77 HydrophobicContact CG1-CE2 3.77Å; V75-F77 HydrophobicContact CG1-CZ 3.6Å; V75-M84 HydrophobicContact CG1-CG 3.78Å; V75-M84 HydrophobicContact CG1-SD 3.85Å; V75-F85 CarbonylContact C-O 3.58Å; V75-F85 VanDerWaalsContact CA-O 3.32Å; V75-F85 WeakPolarHBondContact CA-O 3.43Å; V75-I86 HydrophobicContact CG2-CG1 4.37Å
76	T	94.7	Very high	89.5	Confident	59 Å²	59	69.9 Å²	69.9	36%	0.362	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	154.5	171.1	53.7	0	0	0	0	110.5	H74 M84 F85	H74-T76 WeakPolarHBondContact CE1-CG2 3.36Å; T76-M84 WeakPolarHBondContact O-CA 3.36Å; T76-F85 PolarHBondContact N-O 3.42Å; T76-F85 PolarHBondContact O-N 2.78Å; T76-F85 WeakPolarHBondContact OG1-CB 3.48Å
77	F	92.9	Very high	90.7	Very high	64 Å²	64	66.2 Å²	66.2	28%	0.281	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.9	177.8	-60.7	-82.6	0	0	0	109.9	C14 R15 L18 V75 S83 M84	C14-F77 HydrophobicContact CB-CD1 4.27Å; C14-F77 HydrophobicContact CB-CE1 4.05Å; R15-F77 HydrophobicContact CB-CD1 3.97Å; R15-F77 HydrophobicContact CB-CD2 4.41Å; R15-F77 HydrophobicContact CB-CE1 3.95Å; R15-F77 HydrophobicContact CB-CE2 4.4Å; R15-F77 HydrophobicContact CB-CG 4.22Å; R15-F77 HydrophobicContact CB-CZ 4.18Å; L18-F77 HydrophobicContact CD1-CE1 4.3Å; L18-F77 HydrophobicContact CD1-CZ 3.6Å; V75-F77 HydrophobicContact CG1-CE1 4.35Å; V75-F77 HydrophobicContact CG1-CE2 3.77Å; V75-F77 HydrophobicContact CG1-CZ 3.6Å; F77-S83 CarbonylContact C-O 3.56Å; F77-S83 VanDerWaalsContact CA-O 3.25Å; F77-S83 WeakPolarHBondContact CA-O 3.45Å; F77-M84 HydrophobicContact CD1-CB 4Å; F77-M84 HydrophobicContact CD1-CG 4.26Å; F77-M84 HydrophobicContact CE1-CB 3.82Å; F77-M84 HydrophobicContact CE1-CG 3.75Å; F77-M84 HydrophobicContact CE1-SD 3.91Å; F77-M84 HydrophobicContact CZ-CG 4.29Å; F77-M84 HydrophobicContact CZ-SD 4.19Å
78	T	90.9	Very high	91.4	Very high	45 Å²	45	61.6 Å²	61.6	28%	0.276	30%	0.299	S	S	.	.			trans	-70.1	148.4	169.3	60.9	0	0	0	0	110	G82 S83 F85	T78-G82 WeakPolarHBondContact O-CA 3.38Å; T78-G82 PolarHBondContact OG1-N 3.47Å; T78-S83 PolarHBondContact N-O 3.03Å; T78-S83 PolarHBondContact OG1-N 3.23Å; T78-F85 HydrophobicContact CG2-CD2 4.13Å; T78-F85 HydrophobicContact CG2-CE2 3.51Å
79	K	82.4	Confident	91.8	Very high	212 Å²	212	58 Å²	58	92%	0.922	29%	0.288	S	S	*	.	S	Bend	trans	-72.7	-36.6	-179.5	-68.7	-176.6	179.8	178.8	0	112.6
80	L	76.3	Confident	91.7	Very high	166 Å²	166	56.6 Å²	56.6	87%	0.869	28%	0.282	S	S	*	.	S	Bend	trans	-87.2	-70.3	-171.6	-74	142.6	0	0	0	111.3	G82	L80-G82 VanDerWaalsContact C-N 3.31Å; L80-G82 PolarHBondContact O-N 2.8Å
81	E	76.3	Confident	91.3	Very high	112 Å²	112	58.9 Å²	58.9	52%	0.523	29%	0.291	S	S	.	.	S	Bend	trans	-74.7	-20.2	-177	-60.9	-57.1	132.3	0	0	113.7	S83	E81-S83 WeakPolarHBondContact CB-OG 3.26Å; E81-S83 PolarHBondContact O-N 3.03Å
82	G	84.3	Confident	90.7	Very high	3 Å²	3	64 Å²	64	3%	0.031	31%	0.313	C	S	.	.			trans	67.4	14.7	-173.7	0	0	0	0	0	114.3	C14 T78 L80	C14-G82 VanDerWaalsContact CB-O 3.31Å; C14-G82 WeakPolarHBondContact CB-O 3.48Å; C14-G82 PolarHBondContact N-O 3.16Å; T78-G82 WeakPolarHBondContact O-CA 3.38Å; T78-G82 PolarHBondContact OG1-N 3.47Å; L80-G82 VanDerWaalsContact C-N 3.31Å; L80-G82 PolarHBondContact O-N 2.8Å
83	S	93.6	Very high	89.9	Confident	5 Å²	5	59.1 Å²	59.1	4%	0.035	29%	0.288	C	S	.	.			trans	-57.3	156.1	169	-36.5	0	0	0	0	111	F77 T78 E81 T109	F77-S83 CarbonylContact C-O 3.56Å; F77-S83 VanDerWaalsContact CA-O 3.25Å; F77-S83 WeakPolarHBondContact CA-O 3.45Å; T78-S83 PolarHBondContact N-O 3.03Å; T78-S83 PolarHBondContact OG1-N 3.23Å; E81-S83 WeakPolarHBondContact CB-OG 3.26Å; E81-S83 PolarHBondContact O-N 3.03Å; S83-T109 PolarHBondContact OG-OG1 2.89Å
84	M	95.2	Very high	88.8	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.015	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	134.6	-175.5	-180	174	56.7	0	0	110.3	C14 F48 V75 T76 F77 I86 F107 L108	C14-M84 HydrophobicContact CB-CB 3.78Å; F48-M84 HydrophobicContact CE1-SD 3.68Å; F48-M84 HydrophobicContact CZ-CE 3.9Å; F48-M84 HydrophobicContact CZ-SD 3.48Å; F48-M84 WeakPolarHBondContact CZ-SD 3.25Å; V75-M84 HydrophobicContact CG1-CG 3.78Å; V75-M84 HydrophobicContact CG1-SD 3.85Å; T76-M84 WeakPolarHBondContact O-CA 3.36Å; F77-M84 HydrophobicContact CD1-CB 4Å; F77-M84 HydrophobicContact CD1-CG 4.26Å; F77-M84 HydrophobicContact CE1-CB 3.82Å; F77-M84 HydrophobicContact CE1-CG 3.75Å; F77-M84 HydrophobicContact CE1-SD 3.91Å; F77-M84 HydrophobicContact CZ-CG 4.29Å; F77-M84 HydrophobicContact CZ-SD 4.19Å; M84-I86 HydrophobicContact CE-CD1 4.01Å; M84-I86 HydrophobicContact CG-CD1 4.49Å; M84-I86 HydrophobicContact CG-CG1 4.05Å; M84-I86 HydrophobicContact SD-CD1 4.11Å; M84-I86 HydrophobicContact SD-CG1 4.26Å; M84-F107 CarbonylContact O-C 3.52Å; M84-F107 WeakPolarHBondContact O-CA 3.41Å; M84-L108 HydrophobicContact CE-CB 4.12Å; M84-L108 HydrophobicContact CE-CD1 3.79Å; M84-L108 PolarHBondContact N-O 2.89Å; M84-L108 PolarHBondContact O-N 3.41Å
85	F	96.1	Very high	87.7	Confident	66 Å²	66	61.2 Å²	61.2	29%	0.289	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	136.9	168.4	-69.3	-89.3	0	0	0	109.6	V75 T76 T78 L106 F107	V75-F85 CarbonylContact C-O 3.58Å; V75-F85 VanDerWaalsContact CA-O 3.32Å; V75-F85 WeakPolarHBondContact CA-O 3.43Å; T76-F85 PolarHBondContact N-O 3.42Å; T76-F85 PolarHBondContact O-N 2.78Å; T76-F85 WeakPolarHBondContact OG1-CB 3.48Å; T78-F85 HydrophobicContact CG2-CD2 4.13Å; T78-F85 HydrophobicContact CG2-CE2 3.51Å; F85-L106 CarbonylContact C-O 3.49Å; F85-L106 VanDerWaalsContact CA-O 3.29Å; F85-L106 WeakPolarHBondContact CA-O 3.33Å; F85-F107 HydrophobicContact CD1-CB 4.05Å; F85-F107 HydrophobicContact CD1-CD2 4.04Å; F85-F107 HydrophobicContact CD2-CD2 4.4Å; F85-F107 HydrophobicContact CE1-CB 3.84Å; F85-F107 AromaticContact CE1-CD2 3.48Å; F85-F107 HydrophobicContact CE1-CD2 3.48Å; F85-F107 VanDerWaalsContact CE1-CD2 3.48Å; F85-F107 HydrophobicContact CE1-CE2 4.4Å; F85-F107 HydrophobicContact CE1-CG 4.03Å; F85-F107 AromaticContact CE2-CD2 3.88Å; F85-F107 HydrophobicContact CE2-CD2 3.88Å; F85-F107 HydrophobicContact CE2-CE2 4.2Å; F85-F107 HydrophobicContact CG-CD2 4.48Å; F85-F107 AromaticContact CZ-CD2 3.39Å; F85-F107 HydrophobicContact CZ-CD2 3.39Å; F85-F107 AromaticContact CZ-CE2 3.88Å; F85-F107 HydrophobicContact CZ-CE2 3.88Å; F85-F107 HydrophobicContact CZ-CG 4.32Å
86	I	97.2	Very high	86.6	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	112	176	-50.8	179.4	0	0	0	107.7	L46 F48 C56 V58 H74 V75 M84 F104 L106	L46-I86 HydrophobicContact CD1-CD1 3.48Å; L46-I86 VanDerWaalsContact CD1-CD1 3.48Å; L46-I86 HydrophobicContact CD2-CD1 3.97Å; L46-I86 HydrophobicContact CG-CD1 4.29Å; F48-I86 HydrophobicContact CZ-CD1 3.8Å; C56-I86 VanDerWaalsContact SG-CG2 3.53Å; V58-I86 HydrophobicContact CG2-CG2 3.97Å; H74-I86 WeakPolarHBondContact O-CA 3.13Å; V75-I86 HydrophobicContact CG2-CG1 4.37Å; M84-I86 HydrophobicContact CE-CD1 4.01Å; M84-I86 HydrophobicContact CG-CD1 4.49Å; M84-I86 HydrophobicContact CG-CG1 4.05Å; M84-I86 HydrophobicContact SD-CD1 4.11Å; M84-I86 HydrophobicContact SD-CG1 4.26Å; I86-F104 HydrophobicContact CG2-CE2 4.18Å; I86-F104 WeakPolarHBondContact O-CE2 3.32Å; I86-L106 HydrophobicContact CB-CB 4.29Å; I86-L106 HydrophobicContact CD1-CD2 4.24Å; I86-L106 PolarHBondContact N-O 3.35Å; I86-L106 PolarHBondContact O-N 3.07Å
87	T	96.6	Very high	85.8	Confident	47 Å²	47	64.5 Å²	64.5	29%	0.288	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	139.6	-177.5	56.7	0	0	0	0	110.7	G73 H74 F104 C105	G73-T87 CarbonylContact C-O 3.33Å; G73-T87 VanDerWaalsContact CA-O 3.26Å; G73-T87 WeakPolarHBondContact CA-O 3.28Å; H74-T87 PolarHBondContact N-O 2.88Å; H74-T87 PolarHBondContact O-N 2.91Å; H74-T87 PolarHBondContact O-OG1 3.1Å; T87-F104 WeakPolarHBondContact CA-O 3.46Å; T87-C105 HydrophobicContact CG2-CB 4.2Å
88	G	95.4	Very high	85	Confident	15 Å²	15	69.2 Å²	69.2	16%	0.155	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	-166.7	-179.9	0	0	0	0	0	112.4	H103 F104	G88-H103 VanDerWaalsContact O-CA 3.3Å; G88-H103 WeakPolarHBondContact O-CA 3.27Å; G88-F104 VanDerWaalsContact C-CD1 3.44Å; G88-F104 PolarHBondContact N-O 2.93Å; G88-F104 VanDerWaalsContact N-O 3.07Å; G88-F104 PolarHBondContact O-N 3.16Å
89	K	93	Very high	84.4	Confident	94 Å²	94	68.8 Å²	68.8	41%	0.409	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	131.8	173.2	62	179.6	-179.4	-177.7	0	112.2	T71 K91 P102	T71-K89 WeakPolarHBondContact CB-O 3.44Å; T71-K89 PolarHBondContact OG1-O 2.85Å; K89-K91 PolarHBondContact O-N 3.3Å; K89-P102 CarbonylContact C-O 3.58Å; K89-P102 WeakPolarHBondContact CA-O 3.27Å; K89-P102 VanDerWaalsContact CB-O 3.25Å; K89-P102 WeakPolarHBondContact CB-O 3.4Å
90	F	89.6	Confident	84.5	Confident	1 Å²	1	66.1 Å²	66.1	0%	0.004	32%	0.322	C	S	.	.			trans	-86.7	104	172.1	-70.2	-78.7	0	0	0	109.5	W44 V58 Q60 Y69 T71 Q92 D93 P102 F104	W44-F90 AromaticContact CH2-CE2 3.95Å; W44-F90 HydrophobicContact CH2-CE2 3.95Å; W44-F90 AromaticContact CZ2-CE2 3.88Å; W44-F90 HydrophobicContact CZ2-CE2 3.88Å; W44-F90 HydrophobicContact CZ3-CE2 4.41Å; V58-F90 HydrophobicContact CB-CZ 4.46Å; V58-F90 HydrophobicContact CG1-CZ 3.76Å; Q60-F90 HydrophobicContact CB-CE1 3.82Å; Q60-F90 HydrophobicContact CB-CE2 4.41Å; Q60-F90 HydrophobicContact CB-CZ 3.71Å; Y69-F90 WeakPolarHBondContact O-CE1 3.48Å; T71-F90 HydrophobicContact CG2-CD1 3.64Å; T71-F90 HydrophobicContact CG2-CD2 4.44Å; T71-F90 HydrophobicContact CG2-CE1 3.4Å; T71-F90 HydrophobicContact CG2-CE2 4.25Å; T71-F90 HydrophobicContact CG2-CG 4.18Å; T71-F90 HydrophobicContact CG2-CZ 3.75Å; F90-Q92 PolarHBondContact O-N 2.91Å; F90-D93 HydrophobicContact CB-CB 3.48Å; F90-D93 VanDerWaalsContact CB-CB 3.48Å; F90-D93 HydrophobicContact CG-CB 4.36Å; F90-P102 PolarHBondContact N-O 3.22Å; F90-F104 AromaticContact CD2-CD1 3.66Å; F90-F104 HydrophobicContact CD2-CD1 3.66Å; F90-F104 AromaticContact CD2-CE1 3.93Å; F90-F104 HydrophobicContact CD2-CE1 3.93Å; F90-F104 AromaticContact CE2-CD1 3.58Å; F90-F104 HydrophobicContact CE2-CD1 3.58Å; F90-F104 AromaticContact CE2-CE1 3.66Å; F90-F104 HydrophobicContact CE2-CE1 3.66Å; F90-F104 HydrophobicContact CE2-CG 4.28Å; F90-F104 HydrophobicContact CE2-CZ 4.41Å; F90-F104 HydrophobicContact CZ-CE1 4.24Å
91	K	83.6	Confident	85	Confident	151 Å²	151	59 Å²	59	66%	0.657	29%	0.285	S	S	*	.	S	Bend	trans	-68.1	-23.9	178.8	-66.2	-177	-177.4	177.4	0	113.1	K89 K97	K89-K91 PolarHBondContact O-N 3.3Å; K91-K97 WeakPolarHBondContact O-CE 3.44Å; K91-K97 PolarHBondContact O-NZ 2.78Å
92	Q	81.2	Confident	85.6	Confident	132 Å²	132	55.1 Å²	55.1	62%	0.617	27%	0.269	S	S	*	.	S	Bend	trans	-107.3	-10.1	-172.5	-68.2	177.6	-8.9	0	0	113.4	Y69 F90 S94	Y69-Q92 HydrophobicContact CD1-CB 3.7Å; Y69-Q92 HydrophobicContact CE1-CB 4.09Å; Y69-Q92 WeakPolarHBondContact CE1-O 3.31Å; F90-Q92 PolarHBondContact O-N 2.91Å; Q92-S94 PolarHBondContact O-N 2.84Å
93	D	80.2	Confident	86.1	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.027	28%	0.276	C	S	.	.			trans	-65.3	117.6	176.9	173.8	17.9	0	0	0	110	Y69 F90 T95 G96 K97 R129	Y69-D93 HydrophobicContact CD2-CB 4.19Å; Y69-D93 HydrophobicContact CE2-CB 4.44Å; Y69-D93 HydrophobicContact CG-CB 4.34Å; F90-D93 HydrophobicContact CB-CB 3.48Å; F90-D93 VanDerWaalsContact CB-CB 3.48Å; F90-D93 HydrophobicContact CG-CB 4.36Å; D93-T95 VanDerWaalsContact C-N 3.34Å; D93-T95 WeakPolarHBondContact OD1-CB 3.48Å; D93-T95 PolarHBondContact OD1-N 3.14Å; D93-G96 PolarHBondContact OD2-N 2.79Å; D93-K97 WeakPolarHBondContact O-CB 3.43Å; D93-K97 WeakPolarHBondContact O-CG 3.42Å; D93-K97 PolarHBondContact O-N 3.48Å; D93-K97 VanDerWaalsContact O-N 3.16Å; D93-R129 IonicContact OD2-CZ 3.49Å; D93-R129 IonicContact OD2-NH1 3.16Å; D93-R129 PolarHBondContact OD2-NH1 2.78Å; D93-R129 IonicContact OD2-NH2 2.73Å; D93-R129 PolarHBondContact OD2-NH2 2.83Å
94	S	72.8	Confident	86.1	Confident	44 Å²	44	56.5 Å²	56.5	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-66.3	-37	-180	47.3	0	0	0	0	111.9	Q92 K97 Q98	Q92-S94 PolarHBondContact O-N 2.84Å; S94-K97 PolarHBondContact O-N 2.63Å; S94-Q98 WeakPolarHBondContact O-CG 3.49Å; S94-Q98 PolarHBondContact O-N 2.83Å
95	T	73.5	Confident	86.1	Confident	60 Å²	60	57.1 Å²	57.1	37%	0.368	28%	0.279	S	S	.	.	H	α-helix	trans	-67.3	-49.7	-177.4	-55.1	0	0	0	0	110	D93 K97 Q98 Q99	D93-T95 VanDerWaalsContact C-N 3.34Å; D93-T95 WeakPolarHBondContact OD1-CB 3.48Å; D93-T95 PolarHBondContact OD1-N 3.14Å; T95-K97 VanDerWaalsContact C-N 3.26Å; T95-K97 PolarHBondContact O-N 3.31Å; T95-Q98 PolarHBondContact O-N 3.01Å; T95-Q99 WeakPolarHBondContact O-CG 3.48Å; T95-Q99 PolarHBondContact O-N 2.83Å; T95-Q99 VanDerWaalsContact O-N 3.09Å
96	G	73.4	Confident	86.2	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-32.3	174.5	0	0	0	0	0	113.9	D93 K100 M101	D93-G96 PolarHBondContact OD2-N 2.79Å; G96-K100 CarbonylContact O-C 3.57Å; G96-K100 PolarHBondContact O-N 2.87Å; G96-M101 WeakPolarHBondContact CA-O 3.4Å; G96-M101 CarbonylContact O-C 3.47Å; G96-M101 PolarHBondContact O-N 3.03Å
97	K	76.8	Confident	86.1	Confident	130 Å²	130	56.9 Å²	56.9	57%	0.565	28%	0.278	S	S	*	.	H	α-helix	trans	-70.5	-48.1	175.1	-86.2	175.1	160.9	168.3	0	112.7	K91 D93 S94 T95 Q99 K100	K91-K97 WeakPolarHBondContact O-CE 3.44Å; K91-K97 PolarHBondContact O-NZ 2.78Å; D93-K97 WeakPolarHBondContact O-CB 3.43Å; D93-K97 WeakPolarHBondContact O-CG 3.42Å; D93-K97 PolarHBondContact O-N 3.48Å; D93-K97 VanDerWaalsContact O-N 3.16Å; S94-K97 PolarHBondContact O-N 2.63Å; T95-K97 VanDerWaalsContact C-N 3.26Å; T95-K97 PolarHBondContact O-N 3.31Å; K97-Q99 VanDerWaalsContact C-N 3.27Å; K97-Q99 PolarHBondContact O-N 3.36Å; K97-K100 PolarHBondContact O-N 2.88Å; K97-K100 VanDerWaalsContact O-N 3.09Å
98	Q	76.7	Confident	86.1	Confident	163 Å²	163	54.7 Å²	54.7	76%	0.762	26%	0.264	S	S	*	.	H	α-helix	trans	-60.1	-40.3	179.9	-75.7	175.3	-21.5	0	0	111.3	S94 T95 K100	S94-Q98 WeakPolarHBondContact O-CG 3.49Å; S94-Q98 PolarHBondContact O-N 2.83Å; T95-Q98 PolarHBondContact O-N 3.01Å; Q98-K100 VanDerWaalsContact C-N 3.28Å; Q98-K100 PolarHBondContact O-N 2.83Å
99	Q	77.7	Confident	86.1	Confident	35 Å²	35	54.6 Å²	54.6	16%	0.164	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-1.5	179	-65.2	168.9	-1.8	0	0	113.7	Y37 T95 K97 M101	Y37-Q99 HydrophobicContact CE1-CG 4.45Å; Y37-Q99 HydrophobicContact CE2-CG 4.18Å; Y37-Q99 VanDerWaalsContact CZ-NE2 3.33Å; T95-Q99 WeakPolarHBondContact O-CG 3.48Å; T95-Q99 PolarHBondContact O-N 2.83Å; T95-Q99 VanDerWaalsContact O-N 3.09Å; K97-Q99 VanDerWaalsContact C-N 3.27Å; K97-Q99 PolarHBondContact O-N 3.36Å; Q99-M101 HydrophobicContact CB-CB 4.29Å; Q99-M101 HydrophobicContact CB-CG 4.36Å; Q99-M101 HydrophobicContact CB-SD 4.21Å; Q99-M101 WeakPolarHBondContact O-CG 3.25Å; Q99-M101 PolarHBondContact O-N 2.85Å; Q99-M101 VanDerWaalsContact O-N 3.13Å
100	K	84.2	Confident	86	Confident	156 Å²	156	50.2 Å²	50.2	68%	0.678	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	27	-170.1	-58	177	179.5	173.5	0	113.4	G96 K97 Q98 P102 N131	G96-K100 CarbonylContact O-C 3.57Å; G96-K100 PolarHBondContact O-N 2.87Å; K97-K100 PolarHBondContact O-N 2.88Å; K97-K100 VanDerWaalsContact O-N 3.09Å; Q98-K100 VanDerWaalsContact C-N 3.28Å; Q98-K100 PolarHBondContact O-N 2.83Å; K100-P102 WeakPolarHBondContact O-CD 3.43Å; K100-N131 WeakPolarHBondContact O-CB 3.29Å; K100-N131 PolarHBondContact O-ND2 2.86Å
101	M	87.9	Confident	86.1	Confident	17 Å²	17	52.4 Å²	52.4	8%	0.084	26%	0.257	C	S	.	.			trans	-116.9	65.7	178.9	-67.3	167.2	79.4	0	0	111.2	G96 Q99 H103 R129 G130 E138	G96-M101 WeakPolarHBondContact CA-O 3.4Å; G96-M101 CarbonylContact O-C 3.47Å; G96-M101 PolarHBondContact O-N 3.03Å; Q99-M101 HydrophobicContact CB-CB 4.29Å; Q99-M101 HydrophobicContact CB-CG 4.36Å; Q99-M101 HydrophobicContact CB-SD 4.21Å; Q99-M101 WeakPolarHBondContact O-CG 3.25Å; Q99-M101 PolarHBondContact O-N 2.85Å; Q99-M101 VanDerWaalsContact O-N 3.13Å; M101-H103 VanDerWaalsContact C-N 3.26Å; M101-H103 PolarHBondContact O-N 2.93Å; M101-R129 HydrophobicContact CE-CB 4.18Å; M101-R129 WeakPolarHBondContact CE-O 3.09Å; M101-R129 PolarHBondContact O-NH2 3.09Å; M101-G130 CarbonylContact C-O 3.58Å; M101-G130 WeakPolarHBondContact CA-O 3.36Å; M101-E138 HydrophobicContact CE-CB 3.89Å; M101-E138 HydrophobicContact CE-CG 3.86Å
102	P	89.3	Confident	86.4	Confident	31 Å²	31	45.6 Å²	45.6	20%	0.201	23%	0.228	C	C	.	.			trans	-76.6	-15	-175.6	32.6	-36.5	0	0	0	112.9	K89 F90 K100	K89-P102 CarbonylContact C-O 3.58Å; K89-P102 WeakPolarHBondContact CA-O 3.27Å; K89-P102 VanDerWaalsContact CB-O 3.25Å; K89-P102 WeakPolarHBondContact CB-O 3.4Å; F90-P102 PolarHBondContact N-O 3.22Å; K100-P102 WeakPolarHBondContact O-CD 3.43Å
103	H	93.8	Very high	86.9	Confident	36 Å²	36	44.2 Å²	44.2	17%	0.167	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	151.5	-176.7	-63.1	-87.1	0	0	0	111.3	G88 M101 R129 G130 W137	G88-H103 VanDerWaalsContact O-CA 3.3Å; G88-H103 WeakPolarHBondContact O-CA 3.27Å; M101-H103 VanDerWaalsContact C-N 3.26Å; M101-H103 PolarHBondContact O-N 2.93Å; H103-R129 WeakPolarHBondContact O-CA 3.25Å; H103-R129 PolarHBondContact O-NE 3.07Å; H103-G130 VanDerWaalsContact CB-O 3.31Å; H103-G130 WeakPolarHBondContact CB-O 3.31Å; H103-G130 PolarHBondContact N-O 3Å; H103-G130 PolarHBondContact O-N 3.31Å; H103-W137 HydrophobicContact CB-CH2 3.69Å; H103-W137 HydrophobicContact CB-CZ3 4.01Å
104	F	94	Very high	87.4	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	153.7	169.6	70.3	-90.3	0	0	0	111	W44 V58 T71 I86 T87 G88 F90 E128	W44-F104 HydrophobicContact CH2-CB 3.87Å; W44-F104 AromaticContact CH2-CD2 3.9Å; W44-F104 HydrophobicContact CH2-CD2 3.9Å; W44-F104 AromaticContact CH2-CG 3.84Å; W44-F104 HydrophobicContact CH2-CG 3.84Å; W44-F104 HydrophobicContact CZ3-CB 4.42Å; W44-F104 AromaticContact CZ3-CD2 3.58Å; W44-F104 HydrophobicContact CZ3-CD2 3.58Å; W44-F104 AromaticContact CZ3-CE2 3.97Å; W44-F104 HydrophobicContact CZ3-CE2 3.97Å; W44-F104 HydrophobicContact CZ3-CG 4.01Å; V58-F104 HydrophobicContact CB-CZ 4.24Å; V58-F104 HydrophobicContact CG1-CZ 4.16Å; V58-F104 HydrophobicContact CG2-CE2 4.45Å; V58-F104 HydrophobicContact CG2-CZ 4.01Å; T71-F104 HydrophobicContact CG2-CE1 3.63Å; T71-F104 HydrophobicContact CG2-CZ 4.01Å; I86-F104 HydrophobicContact CG2-CE2 4.18Å; I86-F104 WeakPolarHBondContact O-CE2 3.32Å; T87-F104 WeakPolarHBondContact CA-O 3.46Å; G88-F104 VanDerWaalsContact C-CD1 3.44Å; G88-F104 PolarHBondContact N-O 2.93Å; G88-F104 VanDerWaalsContact N-O 3.07Å; G88-F104 PolarHBondContact O-N 3.16Å; F90-F104 AromaticContact CD2-CD1 3.66Å; F90-F104 HydrophobicContact CD2-CD1 3.66Å; F90-F104 AromaticContact CD2-CE1 3.93Å; F90-F104 HydrophobicContact CD2-CE1 3.93Å; F90-F104 AromaticContact CE2-CD1 3.58Å; F90-F104 HydrophobicContact CE2-CD1 3.58Å; F90-F104 AromaticContact CE2-CE1 3.66Å; F90-F104 HydrophobicContact CE2-CE1 3.66Å; F90-F104 HydrophobicContact CE2-CG 4.28Å; F90-F104 HydrophobicContact CE2-CZ 4.41Å; F90-F104 HydrophobicContact CZ-CE1 4.24Å; F104-E128 CarbonylContact C-O 3.56Å; F104-E128 WeakPolarHBondContact CA-O 3.5Å
105	C	95.9	Very high	88.3	Confident	17 Å²	17	48.5 Å²	48.5	12%	0.115	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	114.6	166.6	-173.3	0	0	0	0	107.3	T87 V127 E128 W137	T87-C105 HydrophobicContact CG2-CB 4.2Å; C105-V127 WeakPolarHBondContact O-CA 3.43Å; C105-E128 HydrophobicContact CB-CB 4.24Å; C105-E128 PolarHBondContact N-O 3.02Å; C105-E128 PolarHBondContact O-N 3.27Å; C105-W137 HydrophobicContact CB-CE3 4.48Å; C105-W137 HydrophobicContact CB-CZ3 4.06Å
106	L	97	Very high	89.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.1	173.4	167.9	64.1	0	0	0	108.4	V27 W44 L46 F85 I86 L108 V127 A143	V27-L106 HydrophobicContact CG1-CD1 4.45Å; V27-L106 HydrophobicContact CG2-CD2 4.3Å; W44-L106 HydrophobicContact CE3-CD2 4.25Å; W44-L106 HydrophobicContact CZ3-CB 4.27Å; L46-L106 HydrophobicContact CD1-CD2 3.88Å; L46-L106 HydrophobicContact CD2-CD2 4.1Å; L46-L106 HydrophobicContact CG-CD2 4.49Å; F85-L106 CarbonylContact C-O 3.49Å; F85-L106 VanDerWaalsContact CA-O 3.29Å; F85-L106 WeakPolarHBondContact CA-O 3.33Å; I86-L106 HydrophobicContact CB-CB 4.29Å; I86-L106 HydrophobicContact CD1-CD2 4.24Å; I86-L106 PolarHBondContact N-O 3.35Å; I86-L106 PolarHBondContact O-N 3.07Å; L106-L108 HydrophobicContact CD1-CD1 4.45Å; L106-L108 HydrophobicContact CD1-CD2 4.07Å; L106-L108 HydrophobicContact CD1-CG 3.94Å; L106-L108 HydrophobicContact CD2-CD1 3.97Å; L106-L108 HydrophobicContact CD2-CG 4.31Å; L106-L108 HydrophobicContact CG-CD1 4.21Å; L106-L108 HydrophobicContact CG-CG 4.01Å; L106-V127 HydrophobicContact CB-CG2 4.33Å; L106-V127 HydrophobicContact CD1-CG2 3.54Å; L106-V127 HydrophobicContact CG-CG2 4.47Å; L106-A143 HydrophobicContact CD1-CB 3.73Å
107	F	96.1	Very high	89.9	Confident	60 Å²	60	47.5 Å²	47.5	26%	0.263	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	134.2	169.8	169.9	-108	0	0	0	109.6	M84 F85 T109 G125 M126	M84-F107 CarbonylContact O-C 3.52Å; M84-F107 WeakPolarHBondContact O-CA 3.41Å; F85-F107 HydrophobicContact CD1-CB 4.05Å; F85-F107 HydrophobicContact CD1-CD2 4.04Å; F85-F107 HydrophobicContact CD2-CD2 4.4Å; F85-F107 HydrophobicContact CE1-CB 3.84Å; F85-F107 AromaticContact CE1-CD2 3.48Å; F85-F107 HydrophobicContact CE1-CD2 3.48Å; F85-F107 VanDerWaalsContact CE1-CD2 3.48Å; F85-F107 HydrophobicContact CE1-CE2 4.4Å; F85-F107 HydrophobicContact CE1-CG 4.03Å; F85-F107 AromaticContact CE2-CD2 3.88Å; F85-F107 HydrophobicContact CE2-CD2 3.88Å; F85-F107 HydrophobicContact CE2-CE2 4.2Å; F85-F107 HydrophobicContact CG-CD2 4.48Å; F85-F107 AromaticContact CZ-CD2 3.39Å; F85-F107 HydrophobicContact CZ-CD2 3.39Å; F85-F107 AromaticContact CZ-CE2 3.88Å; F85-F107 HydrophobicContact CZ-CE2 3.88Å; F85-F107 HydrophobicContact CZ-CG 4.32Å; F107-T109 HydrophobicContact CE1-CG2 4.11Å; F107-T109 HydrophobicContact CZ-CG2 4.16Å; F107-G125 CarbonylContact O-C 3.54Å; F107-G125 VanDerWaalsContact O-CA 3.28Å; F107-G125 WeakPolarHBondContact O-CA 3.29Å; F107-M126 PolarHBondContact N-O 3.25Å; F107-M126 PolarHBondContact O-N 2.79Å; F107-M126 VanDerWaalsContact O-N 3.1Å
108	L	96.2	Very high	90.5	Very high	1 Å²	1	50 Å²	50	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	137.2	174.4	-70.9	174.4	0	0	0	111	C14 V27 L46 M84 L106 L123 T124 A143	C14-L108 PolarHBondContact SG-O 3.45Å; V27-L108 HydrophobicContact CG2-CD1 4.12Å; L46-L108 HydrophobicContact CD1-CD1 3.89Å; M84-L108 HydrophobicContact CE-CB 4.12Å; M84-L108 HydrophobicContact CE-CD1 3.79Å; M84-L108 PolarHBondContact N-O 2.89Å; M84-L108 PolarHBondContact O-N 3.41Å; L106-L108 HydrophobicContact CD1-CD1 4.45Å; L106-L108 HydrophobicContact CD1-CD2 4.07Å; L106-L108 HydrophobicContact CD1-CG 3.94Å; L106-L108 HydrophobicContact CD2-CD1 3.97Å; L106-L108 HydrophobicContact CD2-CG 4.31Å; L106-L108 HydrophobicContact CG-CD1 4.21Å; L106-L108 HydrophobicContact CG-CG 4.01Å; L108-L123 HydrophobicContact CD1-CD1 4.34Å; L108-L123 HydrophobicContact CD2-CB 4.32Å; L108-T124 CarbonylContact C-O 3.36Å; L108-T124 WeakPolarHBondContact CA-O 3.07Å; L108-A143 HydrophobicContact CD2-CB 4.37Å
109	T	94.6	Very high	91.2	Very high	13 Å²	13	48 Å²	48	8%	0.08	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.8	178.9	-168.6	0	0	0	0	111.6	S83 F107 S111 L123 T124	S83-T109 PolarHBondContact OG-OG1 2.89Å; F107-T109 HydrophobicContact CE1-CG2 4.11Å; F107-T109 HydrophobicContact CZ-CG2 4.16Å; T109-S111 PolarHBondContact OG1-N 2.89Å; T109-S111 VanDerWaalsContact OG1-N 3.16Å; T109-L123 VanDerWaalsContact O-CA 3.3Å; T109-L123 WeakPolarHBondContact O-CA 3.17Å; T109-L123 WeakPolarHBondContact O-CD2 3.49Å; T109-T124 WeakPolarHBondContact CG2-O 3.46Å; T109-T124 PolarHBondContact N-O 3.38Å; T109-T124 PolarHBondContact O-N 2.9Å
110	T	91.9	Very high	91.7	Very high	3 Å²	3	47.4 Å²	47.4	2%	0.018	24%	0.242	C	C	.	.	S	Bend	trans	-87.5	-14.2	168.2	51.4	0	0	0	0	112	G11 I12 L17 I112 L123	G11-T110 WeakPolarHBondContact CA-OG1 3.5Å; G11-T110 PolarHBondContact N-O 3.47Å; I12-T110 HydrophobicContact CG1-CG2 4.1Å; I12-T110 PolarHBondContact N-OG1 3.4Å; I12-T110 WeakPolarHBondContact O-CB 3.32Å; I12-T110 VanDerWaalsContact O-CG2 3.29Å; I12-T110 WeakPolarHBondContact O-CG2 3.5Å; I12-T110 PolarHBondContact O-OG1 2.92Å; L17-T110 HydrophobicContact CD1-CG2 3.75Å; L17-T110 HydrophobicContact CG-CG2 4.42Å; T110-I112 PolarHBondContact O-N 3.28Å; T110-L123 HydrophobicContact CG2-CD2 3.35Å
111	S	91	Very high	92.1	Very high	47 Å²	47	41 Å²	41	33%	0.329	21%	0.214	S	C	.	.			trans	-75.4	62.8	171.9	-52.8	0	0	0	0	109.4	T109	T109-S111 PolarHBondContact OG1-N 2.89Å; T109-S111 VanDerWaalsContact OG1-N 3.16Å
112	I	90.9	Very high	92.3	Very high	8 Å²	8	41.7 Å²	41.7	4%	0.041	22%	0.218	C	C	.	.			trans	-76.7	154	-179.8	68.8	180	0	0	0	109.7	R10 T110 D116 F117 Y121 T124	R10-I112 HydrophobicContact CG-CG1 4.26Å; R10-I112 PolarHBondContact NE-O 2.84Å; R10-I112 PolarHBondContact NH2-O 3.03Å; T110-I112 PolarHBondContact O-N 3.28Å; I112-D116 HydrophobicContact CB-CB 4.31Å; I112-F117 HydrophobicContact CD1-CB 3.82Å; I112-F117 HydrophobicContact CD1-CD2 3.86Å; I112-F117 HydrophobicContact CD1-CG 4.3Å; I112-F117 HydrophobicContact CG1-CB 4.12Å; I112-F117 HydrophobicContact CG1-CD2 4.35Å; I112-Y121 WeakPolarHBondContact CD1-O 3.21Å; I112-T124 HydrophobicContact CB-CG2 4.25Å; I112-T124 HydrophobicContact CG2-CG2 3.77Å; I112-T124 WeakPolarHBondContact CG2-OG1 3.26Å
113	I	90.5	Very high	92.5	Very high	103 Å²	103	40.2 Å²	40.2	53%	0.528	21%	0.208	S	C	.	.			trans	-79	165.4	173.7	59.4	168.1	0	0	0	111.2	A115 D116 F117	I113-A115 VanDerWaalsContact C-N 3.33Å; I113-A115 HydrophobicContact CD1-CB 4.13Å; I113-A115 HydrophobicContact CG1-CB 4.46Å; I113-A115 PolarHBondContact O-N 2.92Å; I113-D116 HydrophobicContact CG1-CB 3.89Å; I113-D116 VanDerWaalsContact CG1-CG 3.48Å; I113-D116 WeakPolarHBondContact CG1-OD2 3.35Å; I113-D116 PolarHBondContact O-N 2.91Å; I113-F117 WeakPolarHBondContact O-CB 3.41Å; I113-F117 PolarHBondContact O-N 2.83Å
114	D	90.6	Very high	92.6	Very high	91 Å²	91	38.9 Å²	38.9	49%	0.487	20%	0.203	S	C	.	.	H	α-helix	trans	-61.4	-41.7	-176.1	-68.7	-17.5	0	0	0	112.1	R10 D116 F117 Y118	R10-D114 IonicContact CZ-OD1 2.74Å; R10-D114 IonicContact NH1-OD1 2.66Å; R10-D114 PolarHBondContact NH1-OD1 2.84Å; R10-D114 IonicContact NH2-OD1 2.89Å; R10-D114 PolarHBondContact NH2-OD1 3.37Å; D114-D116 PolarHBondContact O-N 2.85Å; D114-F117 WeakPolarHBondContact O-CB 3.4Å; D114-F117 PolarHBondContact O-N 3.3Å; D114-F117 VanDerWaalsContact O-N 3.16Å; D114-Y118 HydrophobicContact CB-CD2 4.41Å; D114-Y118 HydrophobicContact CB-CE2 4.03Å; D114-Y118 WeakPolarHBondContact O-CD2 3.37Å; D114-Y118 PolarHBondContact O-N 2.83Å
115	A	91.9	Very high	92.6	Very high	48 Å²	48	39.2 Å²	39.2	40%	0.397	21%	0.206	S	C	.	.	H	α-helix	trans	-55.8	-52.8	176.4	0	0	0	0	0	111.3	I113 F117 Y118 H119	I113-A115 VanDerWaalsContact C-N 3.33Å; I113-A115 HydrophobicContact CD1-CB 4.13Å; I113-A115 HydrophobicContact CG1-CB 4.46Å; I113-A115 PolarHBondContact O-N 2.92Å; A115-F117 VanDerWaalsContact C-N 3.28Å; A115-F117 PolarHBondContact O-N 2.8Å; A115-Y118 PolarHBondContact O-N 3.47Å; A115-Y118 VanDerWaalsContact O-N 3.12Å; A115-H119 PolarHBondContact O-N 2.89Å; A115-H119 PolarHBondContact O-ND1 2.85Å
116	D	91.9	Very high	92.6	Very high	23 Å²	23	41.5 Å²	41.5	12%	0.123	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-37	177.5	-68.2	-9	0	0	0	112.4	I112 I113 D114 Y118 H119 G120 Y121 T124 Y142	I112-D116 HydrophobicContact CB-CB 4.31Å; I113-D116 HydrophobicContact CG1-CB 3.89Å; I113-D116 VanDerWaalsContact CG1-CG 3.48Å; I113-D116 WeakPolarHBondContact CG1-OD2 3.35Å; I113-D116 PolarHBondContact O-N 2.91Å; D114-D116 PolarHBondContact O-N 2.85Å; D116-Y118 VanDerWaalsContact C-N 3.34Å; D116-Y118 PolarHBondContact O-N 3.47Å; D116-H119 PolarHBondContact O-N 2.83Å; D116-G120 PolarHBondContact O-N 2.73Å; D116-Y121 HydrophobicContact CB-CD2 3.82Å; D116-Y121 WeakPolarHBondContact O-CB 3.43Å; D116-Y121 PolarHBondContact O-N 3.22Å; D116-Y121 VanDerWaalsContact O-N 3.1Å; D116-T124 HydrophobicContact CB-CG2 3.88Å; D116-T124 WeakPolarHBondContact OD2-CG2 3.32Å; D116-Y142 PolarHBondContact OD1-OH 2.91Å; D116-Y142 PolarHBondContact OD2-OH 3.26Å
117	F	89.7	Confident	92.5	Very high	16 Å²	16	41.5 Å²	41.5	7%	0.07	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-43.8	174.5	-176.4	-82.3	0	0	0	111.3	Y7 I112 I113 D114 A115 H119 G120 R147	Y7-F117 HydrophobicContact CD2-CE2 4.37Å; Y7-F117 HydrophobicContact CD2-CZ 4.13Å; I112-F117 HydrophobicContact CD1-CB 3.82Å; I112-F117 HydrophobicContact CD1-CD2 3.86Å; I112-F117 HydrophobicContact CD1-CG 4.3Å; I112-F117 HydrophobicContact CG1-CB 4.12Å; I112-F117 HydrophobicContact CG1-CD2 4.35Å; I113-F117 WeakPolarHBondContact O-CB 3.41Å; I113-F117 PolarHBondContact O-N 2.83Å; D114-F117 WeakPolarHBondContact O-CB 3.4Å; D114-F117 PolarHBondContact O-N 3.3Å; D114-F117 VanDerWaalsContact O-N 3.16Å; A115-F117 VanDerWaalsContact C-N 3.28Å; A115-F117 PolarHBondContact O-N 2.8Å; F117-H119 VanDerWaalsContact C-N 3.34Å; F117-G120 PolarHBondContact O-N 2.79Å; F117-R147 VanDerWaalsContact CG-NH2 3.29Å; F117-R147 PolarHBondContact O-NH2 2.88Å; F117-R147 VanDerWaalsContact O-NH2 3.13Å
118	Y	89.1	Confident	92.3	Very high	182 Å²	182	41.9 Å²	41.9	71%	0.714	22%	0.218	S	C	*	.	H	α-helix	trans	-69.1	-29.4	177.2	-68.1	-57.5	0	0	0	113.1	D114 A115 D116 G120	D114-Y118 HydrophobicContact CB-CD2 4.41Å; D114-Y118 HydrophobicContact CB-CE2 4.03Å; D114-Y118 WeakPolarHBondContact O-CD2 3.37Å; D114-Y118 PolarHBondContact O-N 2.83Å; A115-Y118 PolarHBondContact O-N 3.47Å; A115-Y118 VanDerWaalsContact O-N 3.12Å; D116-Y118 VanDerWaalsContact C-N 3.34Å; D116-Y118 PolarHBondContact O-N 3.47Å; Y118-G120 PolarHBondContact O-N 2.9Å
119	H	90.1	Very high	92.1	Very high	121 Å²	121	42.5 Å²	42.5	56%	0.56	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-3.2	169.6	-67.5	99.5	0	0	0	113.6	A115 D116 F117 Y121	A115-H119 PolarHBondContact O-N 2.89Å; A115-H119 PolarHBondContact O-ND1 2.85Å; D116-H119 PolarHBondContact O-N 2.83Å; F117-H119 VanDerWaalsContact C-N 3.34Å; H119-Y121 HydrophobicContact CB-CD1 4.12Å; H119-Y121 HydrophobicContact CB-CD2 4.29Å; H119-Y121 HydrophobicContact CB-CE1 3.77Å; H119-Y121 HydrophobicContact CB-CE2 3.98Å; H119-Y121 HydrophobicContact CB-CG 4.37Å
120	G	90.2	Very high	92	Very high	22 Å²	22	41.9 Å²	41.9	23%	0.227	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	25.5	178.1	0	0	0	0	0	113.2	D116 F117 Y118 R147	D116-G120 PolarHBondContact O-N 2.73Å; F117-G120 PolarHBondContact O-N 2.79Å; Y118-G120 PolarHBondContact O-N 2.9Å; G120-R147 WeakPolarHBondContact O-CD 3.35Å; G120-R147 VanDerWaalsContact O-CG 3.25Å; G120-R147 WeakPolarHBondContact O-CG 3.32Å; G120-R147 PolarHBondContact O-N 2.84Å
121	Y	92.1	Very high	91.9	Very high	22 Å²	22	42.9 Å²	42.9	9%	0.086	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	144.8	175.8	-56.4	-15.8	0	0	0	110.6	I112 D116 H119 T124 Y142 Y144 K146 R147	I112-Y121 WeakPolarHBondContact CD1-O 3.21Å; D116-Y121 HydrophobicContact CB-CD2 3.82Å; D116-Y121 WeakPolarHBondContact O-CB 3.43Å; D116-Y121 PolarHBondContact O-N 3.22Å; D116-Y121 VanDerWaalsContact O-N 3.1Å; H119-Y121 HydrophobicContact CB-CD1 4.12Å; H119-Y121 HydrophobicContact CB-CD2 4.29Å; H119-Y121 HydrophobicContact CB-CE1 3.77Å; H119-Y121 HydrophobicContact CB-CE2 3.98Å; H119-Y121 HydrophobicContact CB-CG 4.37Å; Y121-T124 HydrophobicContact CD2-CG2 3.8Å; Y121-T124 HydrophobicContact CG-CG2 4.29Å; Y121-Y142 HydrophobicContact CE2-CE1 4.22Å; Y121-Y144 AromaticContact CD1-CD2 3.67Å; Y121-Y144 HydrophobicContact CD1-CD2 3.67Å; Y121-Y144 HydrophobicContact CD1-CE2 4.25Å; Y121-Y144 HydrophobicContact CD1-CG 4.33Å; Y121-Y144 HydrophobicContact CD2-CD2 4.24Å; Y121-Y144 HydrophobicContact CD2-CG 4.1Å; Y121-Y144 AromaticContact CE1-CD2 3.41Å; Y121-Y144 HydrophobicContact CE1-CD2 3.41Å; Y121-Y144 VanDerWaalsContact CE1-CD2 3.41Å; Y121-Y144 AromaticContact CE1-CE2 3.57Å; Y121-Y144 HydrophobicContact CE1-CE2 3.57Å; Y121-Y144 HydrophobicContact CE1-CG 4.15Å; Y121-Y144 HydrophobicContact CE2-CD1 4.32Å; Y121-Y144 HydrophobicContact CE2-CD2 4.01Å; Y121-Y144 HydrophobicContact CE2-CE2 4.5Å; Y121-Y144 AromaticContact CE2-CG 3.88Å; Y121-Y144 HydrophobicContact CE2-CG 3.88Å; Y121-Y144 HydrophobicContact CG-CD2 4.1Å; Y121-Y144 HydrophobicContact CG-CG 4.33Å; Y121-Y144 AromaticContact CZ-CD2 3.59Å; Y121-Y144 AromaticContact CZ-CE2 3.71Å; Y121-Y144 AromaticContact CZ-CG 3.91Å; Y121-K146 HydrophobicContact CD1-CG 4.15Å; Y121-K146 HydrophobicContact CE1-CG 4.23Å; Y121-R147 PolarHBondContact O-NE 3.01Å; Y121-R147 PolarHBondContact O-NH2 3.09Å
122	L	91	Very high	91.9	Very high	31 Å²	31	49.5 Å²	49.5	16%	0.162	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-44.3	174.8	176.6	65.1	0	0	0	110.6	Y6 F25 V145 R147	Y6-L122 HydrophobicContact CD1-CD1 3.88Å; Y6-L122 HydrophobicContact CE1-CD1 3.98Å; F25-L122 HydrophobicContact CE1-CD2 4.49Å; L122-V145 PolarHBondContact N-O 3.5Å; L122-R147 HydrophobicContact CB-CG 4Å
123	L	94.3	Very high	91.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	145.5	176.2	-62	174.7	0	0	0	109	L17 F25 L108 T109 T110 Y144 V145	L17-L123 HydrophobicContact CD1-CD1 4.28Å; L17-L123 HydrophobicContact CD1-CD2 3.77Å; L17-L123 HydrophobicContact CD1-CG 4.29Å; F25-L123 HydrophobicContact CD1-CD1 3.85Å; F25-L123 HydrophobicContact CE1-CD1 3.73Å; F25-L123 HydrophobicContact CZ-CD1 4.37Å; L108-L123 HydrophobicContact CD1-CD1 4.34Å; L108-L123 HydrophobicContact CD2-CB 4.32Å; T109-L123 VanDerWaalsContact O-CA 3.3Å; T109-L123 WeakPolarHBondContact O-CA 3.17Å; T109-L123 WeakPolarHBondContact O-CD2 3.49Å; T110-L123 HydrophobicContact CG2-CD2 3.35Å; L123-Y144 CarbonylContact O-C 3.5Å; L123-Y144 VanDerWaalsContact O-CA 3.22Å; L123-Y144 WeakPolarHBondContact O-CA 3.47Å; L123-V145 HydrophobicContact CB-CB 4.05Å; L123-V145 HydrophobicContact CB-CG2 4.07Å; L123-V145 HydrophobicContact CD1-CG2 4.23Å; L123-V145 PolarHBondContact N-O 2.99Å; L123-V145 PolarHBondContact O-N 2.86Å
124	T	95.2	Very high	91.8	Very high	9 Å²	9	59 Å²	59	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	164.3	171.4	63.8	0	0	0	0	110.7	L108 T109 I112 D116 Y121 Y142 A143	L108-T124 CarbonylContact C-O 3.36Å; L108-T124 WeakPolarHBondContact CA-O 3.07Å; T109-T124 WeakPolarHBondContact CG2-O 3.46Å; T109-T124 PolarHBondContact N-O 3.38Å; T109-T124 PolarHBondContact O-N 2.9Å; I112-T124 HydrophobicContact CB-CG2 4.25Å; I112-T124 HydrophobicContact CG2-CG2 3.77Å; I112-T124 WeakPolarHBondContact CG2-OG1 3.26Å; D116-T124 HydrophobicContact CB-CG2 3.88Å; D116-T124 WeakPolarHBondContact OD2-CG2 3.32Å; Y121-T124 HydrophobicContact CD2-CG2 3.8Å; Y121-T124 HydrophobicContact CG-CG2 4.29Å; T124-Y142 WeakPolarHBondContact CB-OH 2.92Å; T124-Y142 WeakPolarHBondContact CG2-OH 3.35Å; T124-A143 CarbonylContact C-O 3.4Å; T124-A143 VanDerWaalsContact CA-O 3.28Å; T124-A143 WeakPolarHBondContact CA-O 2.97Å
125	G	95.4	Very high	91.8	Very high	6 Å²	6	57.3 Å²	57.3	6%	0.062	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-152.8	178.6	0	0	0	0	0	112.1	F107 Y142 A143	F107-G125 CarbonylContact O-C 3.54Å; F107-G125 VanDerWaalsContact O-CA 3.28Å; F107-G125 WeakPolarHBondContact O-CA 3.29Å; G125-Y142 WeakPolarHBondContact O-CD2 3.47Å; G125-A143 PolarHBondContact N-O 2.82Å; G125-A143 PolarHBondContact O-N 3.39Å
126	M	95.4	Very high	91.8	Very high	66 Å²	66	58.9 Å²	58.9	33%	0.325	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	146.9	-168.7	-66.8	-67.1	-99	0	0	111.2	F107 H141 Y142	F107-M126 PolarHBondContact N-O 3.25Å; F107-M126 PolarHBondContact O-N 2.79Å; F107-M126 VanDerWaalsContact O-N 3.1Å; M126-H141 WeakPolarHBondContact CA-O 3.09Å; M126-Y142 HydrophobicContact SD-CD2 3.98Å
127	V	94.2	Very high	91.8	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	120.6	167.1	175.5	0	0	0	0	109.6	L29 W44 C105 L106 R129 T140 H141 A143	L29-V127 HydrophobicContact CD1-CG2 4.15Å; L29-V127 HydrophobicContact CD2-CG2 3.5Å; L29-V127 VanDerWaalsContact CD2-CG2 3.5Å; W44-V127 HydrophobicContact CH2-CG1 3.62Å; W44-V127 HydrophobicContact CH2-CG2 4.23Å; W44-V127 HydrophobicContact CZ2-CG1 4.18Å; W44-V127 HydrophobicContact CZ3-CG1 4.26Å; W44-V127 HydrophobicContact CZ3-CG2 4.18Å; C105-V127 WeakPolarHBondContact O-CA 3.43Å; L106-V127 HydrophobicContact CB-CG2 4.33Å; L106-V127 HydrophobicContact CD1-CG2 3.54Å; L106-V127 HydrophobicContact CG-CG2 4.47Å; V127-R129 HydrophobicContact CG1-CG 4.41Å; V127-T140 PolarHBondContact O-N 3Å; V127-T140 PolarHBondContact O-OG1 2.73Å; V127-H141 HydrophobicContact CB-CB 4.21Å; V127-H141 PolarHBondContact N-O 3.41Å; V127-H141 PolarHBondContact O-N 2.93Å; V127-A143 HydrophobicContact CG2-CB 4.19Å
128	E	93.1	Very high	91.8	Very high	68 Å²	68	65.6 Å²	65.6	32%	0.318	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	137.7	165.2	-58.4	-179.5	144.9	0	0	110.1	F104 C105 W137 E138	F104-E128 CarbonylContact C-O 3.56Å; F104-E128 WeakPolarHBondContact CA-O 3.5Å; C105-E128 HydrophobicContact CB-CB 4.24Å; C105-E128 PolarHBondContact N-O 3.02Å; C105-E128 PolarHBondContact O-N 3.27Å; E128-W137 HydrophobicContact CB-CE3 4.18Å; E128-E138 CarbonylContact C-O 3.2Å; E128-E138 WeakPolarHBondContact CA-O 3.44Å
129	R	91.3	Very high	91.9	Very high	14 Å²	14	59.8 Å²	59.8	5%	0.053	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	148.7	168	-63.8	-64.9	-62.2	-131.3	-12.5	108.1	D93 M101 H103 V127 E138 T140	D93-R129 IonicContact OD2-CZ 3.49Å; D93-R129 IonicContact OD2-NH1 3.16Å; D93-R129 PolarHBondContact OD2-NH1 2.78Å; D93-R129 IonicContact OD2-NH2 2.73Å; D93-R129 PolarHBondContact OD2-NH2 2.83Å; M101-R129 HydrophobicContact CE-CB 4.18Å; M101-R129 WeakPolarHBondContact CE-O 3.09Å; M101-R129 PolarHBondContact O-NH2 3.09Å; H103-R129 WeakPolarHBondContact O-CA 3.25Å; H103-R129 PolarHBondContact O-NE 3.07Å; V127-R129 HydrophobicContact CG1-CG 4.41Å; R129-E138 PolarHBondContact N-O 2.96Å; R129-E138 PolarHBondContact O-N 3.16Å; R129-T140 HydrophobicContact CB-CG2 3.66Å; R129-T140 HydrophobicContact CG-CG2 3.66Å
130	G	91.3	Very high	91.9	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	-173.3	-175.9	0	0	0	0	0	115.4	M101 H103 I136	M101-G130 CarbonylContact C-O 3.58Å; M101-G130 WeakPolarHBondContact CA-O 3.36Å; H103-G130 VanDerWaalsContact CB-O 3.31Å; H103-G130 WeakPolarHBondContact CB-O 3.31Å; H103-G130 PolarHBondContact N-O 3Å; H103-G130 PolarHBondContact O-N 3.31Å; G130-I136 CarbonylContact C-O 3.57Å; G130-I136 WeakPolarHBondContact CA-O 3.3Å
131	N	91.4	Very high	92	Very high	23 Å²	23	53.7 Å²	53.7	12%	0.123	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	102.8	173.1	-168.5	-33.4	0	0	0	110.1	K100 K133 L134 G135 I136	K100-N131 WeakPolarHBondContact O-CB 3.29Å; K100-N131 PolarHBondContact O-ND2 2.86Å; N131-K133 PolarHBondContact O-N 3.41Å; N131-K133 VanDerWaalsContact O-N 3.09Å; N131-K133 WeakPolarHBondContact OD1-CB 3.44Å; N131-K133 PolarHBondContact OD1-N 2.84Å; N131-L134 HydrophobicContact CB-CB 4.16Å; N131-L134 HydrophobicContact CB-CD1 4.14Å; N131-L134 HydrophobicContact CB-CG 4.2Å; N131-L134 PolarHBondContact O-N 2.93Å; N131-L134 PolarHBondContact OD1-N 3.36Å; N131-G135 PolarHBondContact O-N 2.98Å; N131-I136 PolarHBondContact N-O 3.3Å; N131-I136 PolarHBondContact O-N 3.44Å
132	R	89.6	Confident	92.1	Very high	187 Å²	187	55.2 Å²	55.2	71%	0.706	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-29.7	-179.9	-171.9	175.7	179.9	178.6	0.4	113.6	W137	R132-W137 HydrophobicContact CB-CZ2 4.03Å; R132-W137 HydrophobicContact CG-CZ2 4.44Å
133	K	90.2	Very high	92.3	Very high	195 Å²	195	53.8 Å²	53.8	85%	0.848	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-32.9	178.4	-65.6	-173.4	174.6	-171.2	0	112.6	N131	N131-K133 PolarHBondContact O-N 3.41Å; N131-K133 VanDerWaalsContact O-N 3.09Å; N131-K133 WeakPolarHBondContact OD1-CB 3.44Å; N131-K133 PolarHBondContact OD1-N 2.84Å
134	L	90.3	Very high	92.3	Very high	114 Å²	114	54.5 Å²	54.5	60%	0.597	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-10.9	178.4	-58.8	177.9	0	0	0	112.3	N131 I136	N131-L134 HydrophobicContact CB-CB 4.16Å; N131-L134 HydrophobicContact CB-CD1 4.14Å; N131-L134 HydrophobicContact CB-CG 4.2Å; N131-L134 PolarHBondContact O-N 2.93Å; N131-L134 PolarHBondContact OD1-N 3.36Å; L134-I136 HydrophobicContact CB-CD1 3.84Å; L134-I136 HydrophobicContact CB-CG1 3.97Å; L134-I136 HydrophobicContact CD1-CD1 4.18Å; L134-I136 PolarHBondContact O-N 3.36Å
135	G	90.4	Very high	92.3	Very high	56 Å²	56	54.4 Å²	54.4	58%	0.577	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	10.6	-175.8	0	0	0	0	0	114.1	N131	N131-G135 PolarHBondContact O-N 2.98Å
136	I	90.9	Very high	92.1	Very high	81 Å²	81	59 Å²	59	42%	0.415	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	127.2	-176.6	-58.1	169.4	0	0	0	109.1	G130 N131 L134	G130-I136 CarbonylContact C-O 3.57Å; G130-I136 WeakPolarHBondContact CA-O 3.3Å; N131-I136 PolarHBondContact N-O 3.3Å; N131-I136 PolarHBondContact O-N 3.44Å; L134-I136 HydrophobicContact CB-CD1 3.84Å; L134-I136 HydrophobicContact CB-CG1 3.97Å; L134-I136 HydrophobicContact CD1-CD1 4.18Å; L134-I136 PolarHBondContact O-N 3.36Å
137	W	92.1	Very high	91.8	Very high	92 Å²	92	58 Å²	58	35%	0.348	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	136.5	174.9	-64.5	97.2	0	0	0	109.4	H103 C105 E128 R132	H103-W137 HydrophobicContact CB-CH2 3.69Å; H103-W137 HydrophobicContact CB-CZ3 4.01Å; C105-W137 HydrophobicContact CB-CE3 4.48Å; C105-W137 HydrophobicContact CB-CZ3 4.06Å; E128-W137 HydrophobicContact CB-CE3 4.18Å; R132-W137 HydrophobicContact CB-CZ2 4.03Å; R132-W137 HydrophobicContact CG-CZ2 4.44Å
138	E	90.8	Very high	91.1	Very high	88 Å²	88	64.1 Å²	64.1	41%	0.411	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	132.8	178.6	-64.4	179.3	178.1	0	0	109	W35 M101 E128 R129 T140	W35-E138 WeakPolarHBondContact CZ3-OE2 3.19Å; M101-E138 HydrophobicContact CE-CB 3.89Å; M101-E138 HydrophobicContact CE-CG 3.86Å; E128-E138 CarbonylContact C-O 3.2Å; E128-E138 WeakPolarHBondContact CA-O 3.44Å; R129-E138 PolarHBondContact N-O 2.96Å; R129-E138 PolarHBondContact O-N 3.16Å; E138-T140 WeakPolarHBondContact O-CG2 3.31Å; E138-T140 PolarHBondContact O-N 3.29Å
139	S	91.3	Very high	89.6	Confident	60 Å²	60	64.5 Å²	64.5	42%	0.42	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	122.4	169.4	-77.5	0	0	0	0	109.4
140	T	89.6	Confident	87.6	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	-37.3	-170.7	59.6	0	0	0	0	113	C32 W35 V127 R129 E138	C32-T140 PolarHBondContact N-O 2.83Å; W35-T140 HydrophobicContact CD2-CG2 4.06Å; W35-T140 HydrophobicContact CE3-CG2 3.55Å; W35-T140 HydrophobicContact CH2-CG2 3.5Å; W35-T140 VanDerWaalsContact CH2-CG2 3.5Å; W35-T140 HydrophobicContact CZ2-CG2 3.97Å; W35-T140 HydrophobicContact CZ3-CG2 3.27Å; V127-T140 PolarHBondContact O-N 3Å; V127-T140 PolarHBondContact O-OG1 2.73Å; R129-T140 HydrophobicContact CB-CG2 3.66Å; R129-T140 HydrophobicContact CG-CG2 3.66Å; E138-T140 WeakPolarHBondContact O-CG2 3.31Å; E138-T140 PolarHBondContact O-N 3.29Å
141	H	92.2	Very high	87.4	Confident	16 Å²	16	78.5 Å²	78.5	7%	0.074	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	139.8	-176.7	-54.3	72	0	0	0	111.1	L29 E30 S39 M126 V127	L29-H141 HydrophobicContact CB-CB 3.93Å; L29-H141 HydrophobicContact CD2-CB 4.28Å; E30-H141 CarbonylContact O-C 3.55Å; E30-H141 WeakPolarHBondContact O-CA 3.33Å; E30-H141 VanDerWaalsContact O-CB 3.3Å; E30-H141 WeakPolarHBondContact O-CB 3.11Å; S39-H141 WeakPolarHBondContact CB-NE2 3.12Å; S39-H141 PolarHBondContact OG-CD2 2.69Å; S39-H141 VanDerWaalsContact OG-CD2 3.31Å; S39-H141 PolarHBondContact OG-NE2 2.88Å; M126-H141 WeakPolarHBondContact CA-O 3.09Å; V127-H141 HydrophobicContact CB-CB 4.21Å; V127-H141 PolarHBondContact N-O 3.41Å; V127-H141 PolarHBondContact O-N 2.93Å
142	Y	93.5	Very high	87.2	Confident	54 Å²	54	81.4 Å²	81.4	21%	0.212	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.9	155.9	179.1	-103.4	0	0	0	109.1	L29 E30 D116 Y121 T124 G125 M126 Y144	L29-Y142 WeakPolarHBondContact CA-O 3.29Å; E30-Y142 PolarHBondContact N-O 3.14Å; E30-Y142 PolarHBondContact O-N 3.09Å; D116-Y142 PolarHBondContact OD1-OH 2.91Å; D116-Y142 PolarHBondContact OD2-OH 3.26Å; Y121-Y142 HydrophobicContact CE2-CE1 4.22Å; T124-Y142 WeakPolarHBondContact CB-OH 2.92Å; T124-Y142 WeakPolarHBondContact CG2-OH 3.35Å; G125-Y142 WeakPolarHBondContact O-CD2 3.47Å; M126-Y142 HydrophobicContact SD-CD2 3.98Å; Y142-Y144 AromaticContact CD1-CD1 3.72Å; Y142-Y144 HydrophobicContact CD1-CD1 3.72Å; Y142-Y144 HydrophobicContact CD1-CE1 4.33Å; Y142-Y144 AromaticContact CE1-CD1 3.56Å; Y142-Y144 HydrophobicContact CE1-CD1 3.56Å; Y142-Y144 HydrophobicContact CE1-CE1 4.4Å; Y142-Y144 HydrophobicContact CE1-CG 4.16Å
143	A	95.4	Very high	87	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	131.9	-172.5	0	0	0	0	0	110.5	V27 Q28 L29 L106 L108 T124 G125 V127	V27-A143 HydrophobicContact CG1-CB 3.83Å; Q28-A143 WeakPolarHBondContact O-CA 3.3Å; L29-A143 HydrophobicContact CD2-CB 3.49Å; L29-A143 VanDerWaalsContact CD2-CB 3.49Å; L106-A143 HydrophobicContact CD1-CB 3.73Å; L108-A143 HydrophobicContact CD2-CB 4.37Å; T124-A143 CarbonylContact C-O 3.4Å; T124-A143 VanDerWaalsContact CA-O 3.28Å; T124-A143 WeakPolarHBondContact CA-O 2.97Å; G125-A143 PolarHBondContact N-O 2.82Å; G125-A143 PolarHBondContact O-N 3.39Å; V127-A143 HydrophobicContact CG2-CB 4.19Å
144	Y	95.2	Very high	86.8	Confident	15 Å²	15	68.5 Å²	68.5	6%	0.059	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	155.4	177.3	60.8	-85.6	0	0	0	112.5	V27 Q28 E30 Y121 L123 Y142 K146	V27-Y144 CarbonylContact C-O 3.48Å; V27-Y144 WeakPolarHBondContact CA-O 3.16Å; Q28-Y144 HydrophobicContact CB-CD1 4.36Å; Q28-Y144 HydrophobicContact CB-CD2 4.03Å; Q28-Y144 HydrophobicContact CB-CE1 3.91Å; Q28-Y144 HydrophobicContact CB-CE2 3.55Å; Q28-Y144 HydrophobicContact CB-CG 4.43Å; Q28-Y144 HydrophobicContact CG-CE2 4.11Å; Q28-Y144 PolarHBondContact N-O 3.44Å; Q28-Y144 PolarHBondContact O-N 2.75Å; Q28-Y144 PolarHBondContact OE1-OH 3.02Å; E30-Y144 VanDerWaalsContact CD-CE1 3.44Å; E30-Y144 HydrophobicContact CG-CE1 3.83Å; E30-Y144 WeakPolarHBondContact OE1-CE1 3.45Å; E30-Y144 VanDerWaalsContact OE1-CZ 3.24Å; E30-Y144 PolarHBondContact OE1-OH 3.13Å; Y121-Y144 AromaticContact CD1-CD2 3.67Å; Y121-Y144 HydrophobicContact CD1-CD2 3.67Å; Y121-Y144 HydrophobicContact CD1-CE2 4.25Å; Y121-Y144 HydrophobicContact CD1-CG 4.33Å; Y121-Y144 HydrophobicContact CD2-CD2 4.24Å; Y121-Y144 HydrophobicContact CD2-CG 4.1Å; Y121-Y144 AromaticContact CE1-CD2 3.41Å; Y121-Y144 HydrophobicContact CE1-CD2 3.41Å; Y121-Y144 VanDerWaalsContact CE1-CD2 3.41Å; Y121-Y144 AromaticContact CE1-CE2 3.57Å; Y121-Y144 HydrophobicContact CE1-CE2 3.57Å; Y121-Y144 HydrophobicContact CE1-CG 4.15Å; Y121-Y144 HydrophobicContact CE2-CD1 4.32Å; Y121-Y144 HydrophobicContact CE2-CD2 4.01Å; Y121-Y144 HydrophobicContact CE2-CE2 4.5Å; Y121-Y144 AromaticContact CE2-CG 3.88Å; Y121-Y144 HydrophobicContact CE2-CG 3.88Å; Y121-Y144 HydrophobicContact CG-CD2 4.1Å; Y121-Y144 HydrophobicContact CG-CG 4.33Å; Y121-Y144 AromaticContact CZ-CD2 3.59Å; Y121-Y144 AromaticContact CZ-CE2 3.71Å; Y121-Y144 AromaticContact CZ-CG 3.91Å; L123-Y144 CarbonylContact O-C 3.5Å; L123-Y144 VanDerWaalsContact O-CA 3.22Å; L123-Y144 WeakPolarHBondContact O-CA 3.47Å; Y142-Y144 AromaticContact CD1-CD1 3.72Å; Y142-Y144 HydrophobicContact CD1-CD1 3.72Å; Y142-Y144 HydrophobicContact CD1-CE1 4.33Å; Y142-Y144 AromaticContact CE1-CD1 3.56Å; Y142-Y144 HydrophobicContact CE1-CD1 3.56Å; Y142-Y144 HydrophobicContact CE1-CE1 4.4Å; Y142-Y144 HydrophobicContact CE1-CG 4.16Å; Y144-K146 HydrophobicContact CD2-CG 4.22Å; Y144-K146 HydrophobicContact CE2-CG 4.11Å
145	V	94.4	Very high	86.6	Confident	7 Å²	7	65.6 Å²	65.6	4%	0.042	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.6	172.9	-179.1	0	0	0	0	107.6	F25 V27 L122 L123	F25-V145 HydrophobicContact CB-CG1 4.46Å; F25-V145 HydrophobicContact CB-CG2 4.16Å; F25-V145 HydrophobicContact CD1-CG1 4.15Å; F25-V145 HydrophobicContact CD1-CG2 4.46Å; V27-V145 HydrophobicContact CB-CG2 4.39Å; V27-V145 HydrophobicContact CG2-CG2 3.83Å; L122-V145 PolarHBondContact N-O 3.5Å; L123-V145 HydrophobicContact CB-CB 4.05Å; L123-V145 HydrophobicContact CB-CG2 4.07Å; L123-V145 HydrophobicContact CD1-CG2 4.23Å; L123-V145 PolarHBondContact N-O 2.99Å; L123-V145 PolarHBondContact O-N 2.86Å
146	K	92.1	Very high	86.4	Confident	104 Å²	104	66.3 Å²	66.3	45%	0.452	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	149.4	173.4	-66.9	-169.8	177.8	-176.2	0	110.5	Q28 Y121 Y144 E148	Q28-K146 VanDerWaalsContact OE1-CE 3.23Å; Y121-K146 HydrophobicContact CD1-CG 4.15Å; Y121-K146 HydrophobicContact CE1-CG 4.23Å; Y144-K146 HydrophobicContact CD2-CG 4.22Å; Y144-K146 HydrophobicContact CE2-CG 4.11Å; K146-E148 PolarHBondContact O-N 3.4Å
147	R	88.4	Confident	86.1	Confident	45 Å²	45	65.2 Å²	65.2	17%	0.17	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-62.4	132.2	167.5	-64.4	164.1	-166.7	179.5	8.7	108.8	Y6 F117 G120 Y121 L122	Y6-R147 HydrophobicContact CD1-CG 3.75Å; Y6-R147 HydrophobicContact CD2-CG 4.3Å; Y6-R147 HydrophobicContact CE1-CB 4.02Å; Y6-R147 HydrophobicContact CE1-CG 3.57Å; Y6-R147 HydrophobicContact CE2-CB 4.2Å; Y6-R147 HydrophobicContact CE2-CG 4.12Å; Y6-R147 HydrophobicContact CG-CG 4.12Å; F117-R147 VanDerWaalsContact CG-NH2 3.29Å; F117-R147 PolarHBondContact O-NH2 2.88Å; F117-R147 VanDerWaalsContact O-NH2 3.13Å; G120-R147 WeakPolarHBondContact O-CD 3.35Å; G120-R147 VanDerWaalsContact O-CG 3.25Å; G120-R147 WeakPolarHBondContact O-CG 3.32Å; G120-R147 PolarHBondContact O-N 2.84Å; Y121-R147 PolarHBondContact O-NE 3.01Å; Y121-R147 PolarHBondContact O-NH2 3.09Å; L122-R147 HydrophobicContact CB-CG 4Å
148	E	79.2	Confident	85.6	Confident	127 Å²	127	63.2 Å²	63.2	59%	0.593	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-81.7	127.7	164.1	-66.7	-174.9	167.1	0	0	107.1	Y6 K146 Y150	Y6-E148 PolarHBondContact OH-O 2.95Å; K146-E148 PolarHBondContact O-N 3.4Å; E148-Y150 WeakPolarHBondContact O-CD2 3.49Å; E148-Y150 PolarHBondContact O-N 3.36Å
149	G	63	Low	85.2	Confident	77 Å²	77	61.1 Å²	61.1	79%	0.794	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-57.2	126.5	-174.5	0	0	0	0	0	111.9
150	Y	47.7	Very low	84.6	Confident	228 Å²	228	61.2 Å²	61.2	89%	0.894	30%	0.299	S	S	*	.			trans	-125.3	0	156.8	-70	-84.3	0	0	0	107	V2 E148	V2-Y150 WeakPolarHBondContact CB-O 3.19Å; V2-Y150 WeakPolarHBondContact CG1-O 3.41Å; V2-Y150 WeakPolarHBondContact CG2-O 3.42Å; E148-Y150 WeakPolarHBondContact O-CD2 3.49Å; E148-Y150 PolarHBondContact O-N 3.36Å

Retrieved 150 of 150 residues in 79.7 ms (Link to these results)

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