A0A087YR37_POEFO Loading...

B9 domain-containing protein 2

Component of the tectonic-like complex, a complex localized at the transition zone of primary cilia and acting as a barrier that prevents diffusion of transmembrane proteins between the cilia and plasma membranes.

AlphaFold DB , UniProt , Accession A0A087YR37, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 175 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	80.8	Confident	94.7	Very high	72 Å²	72	30.8 Å²	30.8	36%	0.355	16%	0.163	S	C	.	.				0	143	0	-162.2	168.8	-64.3	0	0	106.2	A66 T67 K68 Y171	M1-A66 HydrophobicContact CB-CB 4.45Å; M1-A66 HydrophobicContact CG-CB 3.95Å; M1-A66 HydrophobicContact SD-CB 3.53Å; M1-A66 VanDerWaalsContact SD-CB 3.53Å; M1-T67 VanDerWaalsContact CG-C 3.41Å; M1-T67 WeakPolarHBondContact CG-O 3.23Å; M1-K68 HydrophobicContact CE-CD 4.01Å; M1-K68 HydrophobicContact CE-CG 3.56Å; M1-K68 HydrophobicContact CG-CG 4.17Å; M1-K68 HydrophobicContact SD-CG 3.98Å; M1-Y171 WeakPolarHBondContact CA-OH 3.34Å; M1-Y171 PolarHBondContact N-OH 2.79Å
2	A	90.6	Very high	94.8	Very high	4 Å²	4	28.3 Å²	28.3	3%	0.033	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	141.9	174.2	0	0	0	0	0	108.4	A66 T67 F168 Y171	A2-A66 CarbonylContact O-C 3.52Å; A2-A66 VanDerWaalsContact O-CA 3.29Å; A2-A66 WeakPolarHBondContact O-CA 3.16Å; A2-T67 HydrophobicContact CB-CG2 3.92Å; A2-T67 PolarHBondContact N-O 3.23Å; A2-T67 VanDerWaalsContact N-O 3.12Å; A2-T67 PolarHBondContact O-N 2.93Å; A2-F168 HydrophobicContact CB-CD1 4.29Å; A2-F168 HydrophobicContact CB-CD2 3.77Å; A2-F168 HydrophobicContact CB-CE1 4.25Å; A2-F168 HydrophobicContact CB-CE2 3.75Å; A2-F168 HydrophobicContact CB-CG 4.06Å; A2-F168 HydrophobicContact CB-CZ 4Å; A2-Y171 HydrophobicContact CB-CD2 3.89Å; A2-Y171 HydrophobicContact CB-CE2 4.38Å
3	E	94.3	Very high	94.9	Very high	37 Å²	37	26.1 Å²	26.1	17%	0.173	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	136.4	-176.7	-66.2	168.8	-156.5	0	0	110.4	H64 Y65 A66 R166 F168	E3-H64 IonicContact OE2-CE1 3.3Å; E3-H64 IonicContact OE2-NE2 3.45Å; E3-H64 PolarHBondContact OE2-NE2 3.45Å; E3-Y65 CarbonylContact C-O 3.55Å; E3-Y65 VanDerWaalsContact CA-O 3.26Å; E3-Y65 WeakPolarHBondContact CA-O 3.5Å; E3-A66 HydrophobicContact CG-CB 4.36Å; E3-R166 HydrophobicContact CB-CB 4.19Å; E3-R166 PolarHBondContact N-O 3.05Å; E3-R166 PolarHBondContact O-N 2.95Å; E3-R166 IonicContact OE2-NH1 2.72Å; E3-F168 VanDerWaalsContact O-CE2 3.28Å; E3-F168 WeakPolarHBondContact O-CE2 3.45Å
4	L	95.3	Very high	94.9	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120.7	-179.5	178.3	70.3	0	0	0	108.5	I6 W33 Y65 W73 P74 I163 M165 F168	L4-I6 HydrophobicContact CD2-CD1 4.03Å; L4-I6 HydrophobicContact CD2-CG1 4.07Å; L4-I6 HydrophobicContact CG-CD1 4.48Å; L4-I6 HydrophobicContact CG-CG1 4.03Å; L4-W33 HydrophobicContact CB-CZ3 3.9Å; L4-W33 HydrophobicContact CD2-CH2 3.98Å; L4-W33 HydrophobicContact CD2-CZ3 3.62Å; L4-W33 HydrophobicContact CG-CZ3 4.42Å; L4-Y65 PolarHBondContact N-O 3.34Å; L4-Y65 PolarHBondContact O-N 3.21Å; L4-W73 HydrophobicContact CD1-CH2 4.4Å; L4-W73 HydrophobicContact CD1-CZ2 4.42Å; L4-W73 HydrophobicContact CD2-CH2 4.29Å; L4-W73 HydrophobicContact CD2-CZ2 4.09Å; L4-P74 HydrophobicContact CD2-CG 3.85Å; L4-I163 HydrophobicContact CD1-CG2 3.67Å; L4-M165 HydrophobicContact CD1-CE 3.89Å; L4-M165 HydrophobicContact CD1-CG 3.83Å; L4-F168 HydrophobicContact CB-CE2 4.28Å; L4-F168 HydrophobicContact CB-CZ 4.41Å
5	H	96.9	Very high	94.7	Very high	43 Å²	43	29.2 Å²	29.2	20%	0.199	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	131.1	168.5	-55.1	-104.1	0	0	0	109.1	I7 L63 H64 I164	H5-I7 HydrophobicContact CB-CD1 4.33Å; H5-I7 HydrophobicContact CB-CG1 4.48Å; H5-L63 WeakPolarHBondContact CA-O 3.29Å; H5-H64 AromaticContact CD2-CD2 3.94Å; H5-H64 AromaticContact CE1-CD2 3.18Å; H5-H64 PolarHBondContact CE1-CD2 3.05Å; H5-H64 AromaticContact CE1-CE1 3.51Å; H5-H64 AromaticContact CE1-CG 3.5Å; H5-H64 VanDerWaalsContact CE1-CG 3.5Å; H5-H64 AromaticContact CE1-ND1 3.72Å; H5-H64 AromaticContact CE1-NE2 3.19Å; H5-H64 PolarHBondContact CE1-NE2 3.49Å; H5-H64 AromaticContact CG-CD2 3.95Å; H5-H64 AromaticContact ND1-CD2 3.5Å; H5-H64 PolarHBondContact ND1-CD2 3.32Å; H5-H64 AromaticContact ND1-CG 3.67Å; H5-H64 AromaticContact ND1-NE2 3.98Å; H5-H64 AromaticContact NE2-CD2 3.47Å; H5-H64 PolarHBondContact NE2-CD2 3.15Å; H5-H64 AromaticContact NE2-CE1 3.95Å; H5-H64 AromaticContact NE2-NE2 3.26Å; H5-H64 PolarHBondContact NE2-NE2 2.85Å; H5-I164 HydrophobicContact CB-CB 4.12Å; H5-I164 PolarHBondContact N-O 2.7Å; H5-I164 PolarHBondContact O-N 2.97Å
6	I	97.1	Very high	94.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	105.2	176.9	-51.2	164.6	0	0	0	105.6	L4 I61 D62 L63 Y65 P74 V99 L161 I163	L4-I6 HydrophobicContact CD2-CD1 4.03Å; L4-I6 HydrophobicContact CD2-CG1 4.07Å; L4-I6 HydrophobicContact CG-CD1 4.48Å; L4-I6 HydrophobicContact CG-CG1 4.03Å; I6-I61 HydrophobicContact CG2-CG2 4.21Å; I6-D62 WeakPolarHBondContact O-CA 3.06Å; I6-L63 HydrophobicContact CB-CB 4.22Å; I6-L63 PolarHBondContact N-O 2.82Å; I6-L63 PolarHBondContact O-N 3.45Å; I6-Y65 HydrophobicContact CD1-CD2 4.12Å; I6-Y65 HydrophobicContact CD1-CE2 4.1Å; I6-P74 HydrophobicContact CD1-CB 4.38Å; I6-V99 HydrophobicContact CD1-CB 4.45Å; I6-V99 HydrophobicContact CD1-CG1 3.82Å; I6-V99 HydrophobicContact CD1-CG2 3.92Å; I6-V99 HydrophobicContact CG1-CG1 3.94Å; I6-V99 HydrophobicContact CG2-CG1 4.49Å; I6-L161 HydrophobicContact CG2-CD1 4.36Å; I6-L161 HydrophobicContact CG2-CD2 4.16Å; I6-I163 HydrophobicContact CB-CD1 4.34Å; I6-I163 HydrophobicContact CG1-CD1 4.17Å; I6-I163 HydrophobicContact CG2-CD1 3.97Å
7	I	97.1	Very high	94.1	Very high	76 Å²	76	31.9 Å²	31.9	39%	0.39	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	130	-175.5	-59.5	166.5	0	0	0	107.7	H5 I61 G162 I164	H5-I7 HydrophobicContact CB-CD1 4.33Å; H5-I7 HydrophobicContact CB-CG1 4.48Å; I7-I61 CarbonylContact C-O 3.51Å; I7-I61 VanDerWaalsContact CA-O 3.31Å; I7-I61 WeakPolarHBondContact CA-O 3.43Å; I7-G162 PolarHBondContact N-O 2.96Å; I7-G162 VanDerWaalsContact O-CA 3.3Å; I7-G162 WeakPolarHBondContact O-CA 3.29Å; I7-G162 PolarHBondContact O-N 3.1Å; I7-I164 HydrophobicContact CD1-CD1 4.25Å
8	G	96.6	Very high	93.7	Very high	23 Å²	23	35.8 Å²	35.8	24%	0.237	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.4	-149.3	-176.4	0	0	0	0	0	112.8	I61 E160	G8-I61 PolarHBondContact N-O 3.06Å; G8-I61 PolarHBondContact O-N 3.03Å; G8-E160 CarbonylContact C-O 3.57Å; G8-E160 WeakPolarHBondContact CA-O 3.27Å
9	Q	97.4	Very high	93.2	Very high	58 Å²	58	36.3 Å²	36.3	27%	0.271	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	152.5	-177.3	57.4	-175.8	-26.7	0	0	112.9	I11 H59 E160	Q9-I11 HydrophobicContact CG-CG1 4.24Å; Q9-H59 CarbonylContact C-O 3.6Å; Q9-H59 WeakPolarHBondContact CA-O 3.41Å; Q9-H59 WeakPolarHBondContact CB-O 3.37Å; Q9-E160 HydrophobicContact CG-CB 4.12Å; Q9-E160 PolarHBondContact N-O 3.11Å; Q9-E160 PolarHBondContact NE2-OE1 3.46Å; Q9-E160 VanDerWaalsContact NE2-OE1 3.15Å; Q9-E160 PolarHBondContact O-N 3.5Å
10	I	97.7	Very high	93.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	106.9	160.6	-47.5	176.7	0	0	0	106.1	W25 T44 W57 S58 H59 I61 L78 V157 L159	I10-W25 HydrophobicContact CD1-CB 3.72Å; I10-W25 HydrophobicContact CD1-CD2 4.24Å; I10-W25 HydrophobicContact CD1-CG 3.56Å; I10-T44 HydrophobicContact CD1-CG2 4.46Å; I10-W57 HydrophobicContact CG2-CE3 3.63Å; I10-W57 HydrophobicContact CG2-CZ3 3.95Å; I10-S58 CarbonylContact O-C 3.48Å; I10-S58 WeakPolarHBondContact O-CA 3.4Å; I10-S58 PolarHBondContact O-N 3.29Å; I10-S58 VanDerWaalsContact O-N 3.09Å; I10-H59 HydrophobicContact CB-CB 4.43Å; I10-H59 PolarHBondContact N-O 2.92Å; I10-H59 PolarHBondContact O-N 3.23Å; I10-I61 HydrophobicContact CD1-CD1 4.29Å; I10-I61 HydrophobicContact CG1-CD1 3.61Å; I10-I61 HydrophobicContact CG1-CG1 4.08Å; I10-L78 HydrophobicContact CD1-CD2 4.1Å; I10-V157 HydrophobicContact CG2-CG1 3.7Å; I10-L159 HydrophobicContact CG1-CD2 4.22Å
11	I	97.4	Very high	93.3	Very high	26 Å²	26	33.8 Å²	33.8	13%	0.133	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	-52.3	-175.6	-60.7	169.8	0	0	0	109.1	Q9 M54 Y56 W57 S58 E158 E160	Q9-I11 HydrophobicContact CG-CG1 4.24Å; I11-M54 HydrophobicContact CG2-CE 3.76Å; I11-Y56 HydrophobicContact CG2-CD1 4.33Å; I11-Y56 HydrophobicContact CG2-CE1 4.49Å; I11-W57 PolarHBondContact O-N 3.32Å; I11-S58 PolarHBondContact O-N 3.49Å; I11-S58 VanDerWaalsContact O-N 3.09Å; I11-E158 HydrophobicContact CB-CB 4.13Å; I11-E158 WeakPolarHBondContact CB-O 3.28Å; I11-E158 HydrophobicContact CD1-CB 4.28Å; I11-E158 PolarHBondContact N-O 3.34Å; I11-E160 HydrophobicContact CD1-CB 3.94Å; I11-E160 HydrophobicContact CG1-CB 4.18Å
12	G	96.1	Very high	94.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166.5	-169.9	-172.1	0	0	0	0	0	113.4	A55 V157 E158	G12-A55 CarbonylContact C-O 3.55Å; G12-A55 WeakPolarHBondContact CA-O 3.41Å; G12-V157 WeakPolarHBondContact O-CA 3.44Å; G12-E158 PolarHBondContact O-N 2.82Å
13	A	95.9	Very high	94.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	144.9	-176.8	0	0	0	0	0	111.6	F16 L21 M54 A55 W57 T156 V157	A13-F16 HydrophobicContact CB-CD2 4.09Å; A13-F16 HydrophobicContact CB-CE2 3.72Å; A13-L21 HydrophobicContact CB-CD1 4.26Å; A13-M54 CarbonylContact O-C 3.47Å; A13-M54 WeakPolarHBondContact O-CA 2.95Å; A13-A55 PolarHBondContact N-O 3.02Å; A13-A55 PolarHBondContact O-N 3.13Å; A13-W57 HydrophobicContact CB-CH2 3.32Å; A13-W57 HydrophobicContact CB-CZ2 3.9Å; A13-W57 HydrophobicContact CB-CZ3 3.85Å; A13-T156 WeakPolarHBondContact CA-O 3.43Å; A13-V157 HydrophobicContact CB-CG2 4.23Å
14	S	94.8	Very high	94.4	Very high	40 Å²	40	32.5 Å²	32.5	28%	0.28	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	163.4	178.2	63.2	0	0	0	0	111.9	G155 T156	S14-G155 CarbonylContact O-C 3.56Å; S14-G155 VanDerWaalsContact O-CA 3.26Å; S14-G155 WeakPolarHBondContact O-CA 3.48Å; S14-T156 PolarHBondContact N-O 2.9Å; S14-T156 PolarHBondContact O-N 3.44Å
15	G	92	Very high	94.4	Very high	59 Å²	59	32.8 Å²	32.8	61%	0.608	19%	0.191	S	C	*	.	S	Bend	trans	75.1	21.8	178.6	0	0	0	0	0	114.3	G155	G15-G155 WeakPolarHBondContact O-CA 3.42Å
16	F	90.9	Very high	94.3	Very high	17 Å²	17	30.8 Å²	30.8	8%	0.075	18%	0.182	C	C	.	.			trans	-92.7	155.6	171.8	-71.6	-87.8	0	0	0	110.7	A13 Q18 L21 V80 Y92 T112 M154 G155	A13-F16 HydrophobicContact CB-CD2 4.09Å; A13-F16 HydrophobicContact CB-CE2 3.72Å; F16-Q18 PolarHBondContact O-N 3.08Å; F16-L21 HydrophobicContact CB-CD1 3.85Å; F16-L21 HydrophobicContact CD2-CD1 3.71Å; F16-L21 HydrophobicContact CG-CD1 3.87Å; F16-V80 HydrophobicContact CD1-CG1 4.36Å; F16-V80 HydrophobicContact CE1-CB 4.02Å; F16-V80 HydrophobicContact CE1-CG1 3.86Å; F16-V80 HydrophobicContact CE1-CG2 4.42Å; F16-V80 HydrophobicContact CE2-CG1 4.12Å; F16-V80 HydrophobicContact CE2-CG2 4.44Å; F16-V80 HydrophobicContact CZ-CB 3.87Å; F16-V80 HydrophobicContact CZ-CG1 3.73Å; F16-V80 HydrophobicContact CZ-CG2 3.79Å; F16-Y92 HydrophobicContact CB-CD2 4.15Å; F16-Y92 HydrophobicContact CB-CE2 4.5Å; F16-Y92 AromaticContact CD1-CD2 3.81Å; F16-Y92 HydrophobicContact CD1-CD2 3.81Å; F16-Y92 HydrophobicContact CD1-CG 4.42Å; F16-Y92 HydrophobicContact CG-CD2 4.34Å; F16-T112 WeakPolarHBondContact CE1-OG1 3.26Å; F16-T112 HydrophobicContact CZ-CG2 4.07Å; F16-T112 WeakPolarHBondContact CZ-OG1 3.29Å; F16-M154 HydrophobicContact CD1-CB 4.14Å; F16-M154 HydrophobicContact CE1-CB 3.81Å; F16-G155 VanDerWaalsContact CE2-CA 3.44Å
17	P	88	Confident	94.1	Very high	88 Å²	88	30.8 Å²	30.8	57%	0.571	18%	0.182	S	C	*	.	S	Bend	trans	-64	-21	-179.4	-24.2	34.5	0	0	0	115.3	M154	P17-M154 HydrophobicContact CG-CE 4.39Å
18	Q	88.1	Confident	93.9	Very high	101 Å²	101	30 Å²	30	47%	0.472	18%	0.176	S	C	.	.			trans	-139.2	154.9	179.5	-63.8	-68.8	-11.8	0	0	109.7	F16 L21 H82 Y92	F16-Q18 PolarHBondContact O-N 3.08Å; Q18-L21 WeakPolarHBondContact O-CD2 3.34Å; Q18-H82 WeakPolarHBondContact CB-CD2 2.87Å; Q18-H82 WeakPolarHBondContact CB-NE2 3.17Å; Q18-Y92 HydrophobicContact CB-CE2 3.92Å; Q18-Y92 VanDerWaalsContact CB-OH 3.29Å; Q18-Y92 WeakPolarHBondContact CB-OH 3.44Å; Q18-Y92 HydrophobicContact CG-CE2 4.43Å; Q18-Y92 WeakPolarHBondContact CG-OH 3.41Å
19	N	84.7	Confident	93.6	Very high	46 Å²	46	30 Å²	30	25%	0.246	17%	0.172	C	C	.	.	S	Bend	trans	-100.5	-18.6	-166.4	-63.7	-2.9	0	0	0	114.2	L21 D47 P49	N19-L21 PolarHBondContact O-N 3.45Å; N19-D47 VanDerWaalsContact O-O 3.07Å; N19-P49 HydrophobicContact CB-CG 3.74Å; N19-P49 VanDerWaalsContact O-CD 3.27Å; N19-P49 WeakPolarHBondContact O-CD 3.23Å
20	S	93	Very high	93.2	Very high	17 Å²	17	28.1 Å²	28.1	12%	0.119	17%	0.168	C	C	.	.			trans	-77.1	85.1	178.7	-177.7	0	0	0	0	110.9	D47 H82 Q83	S20-D47 CarbonylContact C-O 3.57Å; S20-D47 VanDerWaalsContact CA-O 3.29Å; S20-D47 WeakPolarHBondContact CA-O 3.48Å; S20-H82 CarbonylContact O-C 3.56Å; S20-H82 VanDerWaalsContact O-CA 3.22Å; S20-H82 WeakPolarHBondContact O-CA 3.47Å; S20-H82 PolarHBondContact O-CD2 3.47Å; S20-Q83 WeakPolarHBondContact CB-O 3.49Å; S20-Q83 PolarHBondContact O-N 3.18Å; S20-Q83 PolarHBondContact OG-O 3.5Å
21	L	95.4	Very high	92.8	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.016	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	146.2	-167.1	-57.2	174.9	0	0	0	112.9	A13 F16 Q18 N19 V46 D47 A55 W57 V80 W81 H82 Y92	A13-L21 HydrophobicContact CB-CD1 4.26Å; F16-L21 HydrophobicContact CB-CD1 3.85Å; F16-L21 HydrophobicContact CD2-CD1 3.71Å; F16-L21 HydrophobicContact CG-CD1 3.87Å; Q18-L21 WeakPolarHBondContact O-CD2 3.34Å; N19-L21 PolarHBondContact O-N 3.45Å; L21-V46 WeakPolarHBondContact O-CA 3.26Å; L21-D47 PolarHBondContact N-O 2.73Å; L21-D47 PolarHBondContact O-N 3.12Å; L21-A55 HydrophobicContact CB-CB 3.99Å; L21-A55 HydrophobicContact CD1-CB 4.15Å; L21-A55 HydrophobicContact CG-CB 4.43Å; L21-W57 HydrophobicContact CB-CZ2 3.9Å; L21-W57 PolarHBondContact O-NE1 2.87Å; L21-V80 HydrophobicContact CB-CG1 4.49Å; L21-V80 HydrophobicContact CD1-CG1 4.39Å; L21-V80 HydrophobicContact CD2-CG1 4.23Å; L21-W81 CarbonylContact C-O 3.49Å; L21-W81 VanDerWaalsContact CA-O 3.29Å; L21-W81 WeakPolarHBondContact CA-O 3.08Å; L21-H82 HydrophobicContact CD2-CB 3.96Å; L21-Y92 HydrophobicContact CD2-CD2 3.75Å; L21-Y92 HydrophobicContact CD2-CE2 4.01Å
22	F	96.6	Very high	92.4	Very high	8 Å²	8	33 Å²	33	4%	0.035	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	162	163.2	71.8	-82.7	0	0	0	110.6	K24 Q43 Q45 V46 W81 C89	F22-K24 HydrophobicContact CE2-CG 4.18Å; F22-Q43 HydrophobicContact CD2-CG 3.8Å; F22-Q43 HydrophobicContact CE2-CG 4.11Å; F22-Q45 WeakPolarHBondContact CB-O 2.95Å; F22-V46 HydrophobicContact CB-CB 4.4Å; F22-V46 HydrophobicContact CB-CG2 3.82Å; F22-V46 HydrophobicContact CD1-CG2 3.78Å; F22-V46 HydrophobicContact CG-CG2 4.03Å; F22-W81 HydrophobicContact CD1-CB 3.69Å; F22-W81 HydrophobicContact CD2-CB 4.16Å; F22-W81 HydrophobicContact CE1-CB 3.22Å; F22-W81 HydrophobicContact CE1-CG 4.09Å; F22-W81 HydrophobicContact CE2-CB 3.73Å; F22-W81 AromaticContact CE2-CD1 3.98Å; F22-W81 AromaticContact CE2-CG 3.85Å; F22-W81 HydrophobicContact CE2-CG 3.85Å; F22-W81 HydrophobicContact CG-CB 4.15Å; F22-W81 HydrophobicContact CZ-CB 3.24Å; F22-W81 HydrophobicContact CZ-CD2 4.15Å; F22-W81 AromaticContact CZ-CG 3.59Å; F22-W81 HydrophobicContact CZ-CG 3.59Å; F22-W81 PolarHBondContact N-O 3.26Å; F22-W81 PolarHBondContact O-N 2.86Å; F22-C89 HydrophobicContact CE1-CB 4.1Å; F22-C89 HydrophobicContact CZ-CB 4.18Å
23	C	95.9	Very high	92.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.6	179.4	-177	0	0	0	0	111.7	Q43 T44 W57 Q79	C23-Q43 CarbonylContact O-C 3.46Å; C23-Q43 WeakPolarHBondContact O-CA 3.33Å; C23-T44 HydrophobicContact CB-CG2 3.99Å; C23-T44 PolarHBondContact N-OG1 3.22Å; C23-T44 PolarHBondContact O-N 3.21Å; C23-T44 PolarHBondContact O-OG1 2.89Å; C23-W57 HydrophobicContact CB-CD2 4.25Å; C23-W57 HydrophobicContact CB-CE3 3.75Å; C23-W57 HydrophobicContact CB-CH2 3.4Å; C23-W57 VanDerWaalsContact CB-CH2 3.4Å; C23-W57 HydrophobicContact CB-CZ2 3.91Å; C23-W57 HydrophobicContact CB-CZ3 3.31Å; C23-Q79 CarbonylContact C-O 3.56Å; C23-Q79 WeakPolarHBondContact CA-O 3.43Å
24	K	95.8	Very high	92.1	Very high	77 Å²	77	41.2 Å²	41.2	34%	0.335	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.4	160.7	-66.3	-179.5	178	-179.3	0	108.2	F22 G42 Q43 L78 Q79	F22-K24 HydrophobicContact CE2-CG 4.18Å; K24-G42 WeakPolarHBondContact CA-O 3.2Å; K24-Q43 HydrophobicContact CG-CB 4.33Å; K24-Q43 HydrophobicContact CG-CG 3.88Å; K24-L78 CarbonylContact O-C 3.56Å; K24-L78 WeakPolarHBondContact O-CA 3.22Å; K24-Q79 HydrophobicContact CB-CB 4.25Å; K24-Q79 HydrophobicContact CB-CG 4.5Å; K24-Q79 PolarHBondContact N-O 3.48Å; K24-Q79 PolarHBondContact O-N 3.4Å
25	W	95.1	Very high	92.2	Very high	7 Å²	7	42.3 Å²	42.3	3%	0.027	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	159.1	-177.1	68.1	-87.6	0	0	0	110.5	I10 V27 L39 E41 G42 H59 I61 L63 Y77 L78	I10-W25 HydrophobicContact CD1-CB 3.72Å; I10-W25 HydrophobicContact CD1-CD2 4.24Å; I10-W25 HydrophobicContact CD1-CG 3.56Å; W25-V27 HydrophobicContact CE3-CG2 4.4Å; W25-V27 HydrophobicContact CZ3-CG2 4.08Å; W25-L39 WeakPolarHBondContact CH2-O 3.32Å; W25-E41 VanDerWaalsContact O-CA 3.27Å; W25-E41 WeakPolarHBondContact O-CA 3.3Å; W25-E41 WeakPolarHBondContact O-CB 3.4Å; W25-G42 PolarHBondContact N-O 2.84Å; W25-G42 PolarHBondContact O-N 3.35Å; W25-H59 AromaticContact CD1-CD2 3.92Å; W25-H59 AromaticContact CD1-NE2 3.99Å; W25-H59 AromaticContact CE2-CD2 3.99Å; W25-H59 AromaticContact CE2-NE2 3.86Å; W25-H59 AromaticContact NE1-CD2 3.18Å; W25-H59 PolarHBondContact NE1-CD2 2.85Å; W25-H59 AromaticContact NE1-NE2 3.01Å; W25-H59 PolarHBondContact NE1-NE2 2.86Å; W25-I61 HydrophobicContact CH2-CG1 4.31Å; W25-I61 HydrophobicContact CZ2-CG1 4.44Å; W25-I61 HydrophobicContact CZ3-CG1 4.41Å; W25-L63 HydrophobicContact CZ3-CD1 4.24Å; W25-Y77 WeakPolarHBondContact CA-O 2.93Å; W25-L78 HydrophobicContact CB-CD2 3.7Å
26	G	94.2	Very high	92.4	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	172.5	166.1	0	0	0	0	0	112.2	K40 I76 Y77	G26-K40 CarbonylContact C-O 3.58Å; G26-K40 WeakPolarHBondContact CA-O 3.44Å; G26-I76 CarbonylContact O-C 3.6Å; G26-I76 WeakPolarHBondContact O-CA 3.43Å; G26-Y77 VanDerWaalsContact CA-CZ 3.44Å; G26-Y77 PolarHBondContact N-O 2.92Å; G26-Y77 WeakPolarHBondContact O-CD1 3.49Å; G26-Y77 WeakPolarHBondContact O-CE1 3.39Å; G26-Y77 PolarHBondContact O-N 2.96Å
27	V	93.9	Very high	92.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	121.1	-176.2	-175.3	0	0	0	0	110.5	W25 T29 K40 L63 Y65 P74 K75 I76	W25-V27 HydrophobicContact CE3-CG2 4.4Å; W25-V27 HydrophobicContact CZ3-CG2 4.08Å; V27-T29 HydrophobicContact CG1-CG2 4.06Å; V27-K40 PolarHBondContact N-O 2.63Å; V27-K40 WeakPolarHBondContact O-CE 3.41Å; V27-K40 WeakPolarHBondContact O-CG 3.49Å; V27-L63 HydrophobicContact CB-CD1 4.14Å; V27-L63 HydrophobicContact CG2-CD1 3.38Å; V27-Y65 HydrophobicContact CG1-CE2 4.3Å; V27-Y65 WeakPolarHBondContact CG1-OH 3.46Å; V27-P74 HydrophobicContact CG1-CB 4.02Å; V27-K75 CarbonylContact C-O 3.57Å; V27-K75 WeakPolarHBondContact CA-O 3.25Å; V27-I76 HydrophobicContact CG2-CG1 3.84Å
28	H	91.4	Very high	93	Very high	59 Å²	59	43.8 Å²	43.8	27%	0.273	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133	172	-177.2	81.2	0	0	0	110.1	P74 K75 Y77 Y141	H28-P74 WeakPolarHBondContact O-CA 3.42Å; H28-K75 PolarHBondContact N-O 2.89Å; H28-K75 PolarHBondContact O-N 2.81Å; H28-Y77 HydrophobicContact CB-CD1 4.38Å; H28-Y141 HydrophobicContact CB-CD1 4.02Å; H28-Y141 HydrophobicContact CB-CD2 4.34Å; H28-Y141 HydrophobicContact CB-CE1 4Å; H28-Y141 HydrophobicContact CB-CE2 4.33Å; H28-Y141 HydrophobicContact CB-CG 4.17Å; H28-Y141 AromaticContact CD2-CD2 3.65Å; H28-Y141 AromaticContact CD2-CE2 3.49Å; H28-Y141 VanDerWaalsContact CD2-CE2 3.49Å; H28-Y141 WeakPolarHBondContact CD2-CE2 3.27Å; H28-Y141 AromaticContact CE1-CE2 3.32Å; H28-Y141 WeakPolarHBondContact CE1-CE2 3.05Å; H28-Y141 AromaticContact CE1-CZ 3.45Å; H28-Y141 VanDerWaalsContact CE1-CZ 3.45Å; H28-Y141 PolarHBondContact CE1-OH 3.17Å; H28-Y141 AromaticContact CG-CD2 3.79Å; H28-Y141 AromaticContact CG-CE1 3.88Å; H28-Y141 AromaticContact CG-CE2 3.48Å; H28-Y141 VanDerWaalsContact CG-CE2 3.48Å; H28-Y141 AromaticContact CG-CZ 3.5Å; H28-Y141 VanDerWaalsContact CG-CZ 3.5Å; H28-Y141 AromaticContact ND1-CE1 3.78Å; H28-Y141 AromaticContact ND1-CE2 3.39Å; H28-Y141 WeakPolarHBondContact ND1-CE2 3.46Å; H28-Y141 AromaticContact ND1-CZ 3.13Å; H28-Y141 PolarHBondContact ND1-OH 3.3Å; H28-Y141 AromaticContact NE2-CD2 3.97Å; H28-Y141 AromaticContact NE2-CE2 3.4Å; H28-Y141 WeakPolarHBondContact NE2-CE2 3.29Å; H28-Y141 AromaticContact NE2-CZ 3.98Å
29	T	92.2	Very high	93.2	Very high	23 Å²	23	44.8 Å²	44.8	14%	0.141	27%	0.267	C	S	.	.			trans	-135.7	154.1	177.9	60.1	0	0	0	0	110	V27 W33 Y65 P74	V27-T29 HydrophobicContact CG1-CG2 4.06Å; T29-W33 HydrophobicContact CG2-CB 4.28Å; T29-Y65 HydrophobicContact CG2-CD1 4.3Å; T29-Y65 HydrophobicContact CG2-CE1 3.71Å; T29-Y65 HydrophobicContact CG2-CE2 4.44Å; T29-P74 HydrophobicContact CG2-CB 3.82Å; T29-P74 HydrophobicContact CG2-CG 3.81Å
30	G	88.9	Confident	93.5	Very high	19 Å²	19	47.3 Å²	47.3	20%	0.196	28%	0.275	C	S	.	.			trans	-76.7	170	173.3	0	0	0	0	0	113.3	A32 W33 G72	G30-A32 PolarHBondContact O-N 3.49Å; G30-W33 WeakPolarHBondContact O-CB 3.14Å; G30-W33 PolarHBondContact O-N 2.83Å; G30-G72 PolarHBondContact N-O 3.45Å
31	G	87.4	Confident	93.6	Very high	92 Å²	92	52.7 Å²	52.7	95%	0.948	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.6	-174.1	0	0	0	0	0	116.1	W33	G31-W33 VanDerWaalsContact C-N 3.28Å
32	A	89.1	Confident	93.5	Very high	38 Å²	38	53.7 Å²	53.7	31%	0.314	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-14.2	174.7	0	0	0	0	0	113.5	G30 T67 K68	G30-A32 PolarHBondContact O-N 3.49Å; A32-T67 WeakPolarHBondContact O-CA 3.49Å; A32-T67 PolarHBondContact O-OG1 3.17Å; A32-K68 PolarHBondContact O-N 3Å
33	W	92.8	Very high	93.4	Very high	16 Å²	16	58.3 Å²	58.3	6%	0.061	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	133.9	-175.5	-63.8	80.3	0	0	0	111.2	L4 T29 G30 G31 Y65 T67 Q71 G72 W73 P74 F168	L4-W33 HydrophobicContact CB-CZ3 3.9Å; L4-W33 HydrophobicContact CD2-CH2 3.98Å; L4-W33 HydrophobicContact CD2-CZ3 3.62Å; L4-W33 HydrophobicContact CG-CZ3 4.42Å; T29-W33 HydrophobicContact CG2-CB 4.28Å; G30-W33 WeakPolarHBondContact O-CB 3.14Å; G30-W33 PolarHBondContact O-N 2.83Å; G31-W33 VanDerWaalsContact C-N 3.28Å; W33-Y65 HydrophobicContact CE3-CG 4.36Å; W33-T67 HydrophobicContact CD2-CG2 4.38Å; W33-T67 HydrophobicContact CE3-CG2 4.14Å; W33-T67 HydrophobicContact CH2-CG2 3.75Å; W33-T67 HydrophobicContact CZ2-CG2 3.98Å; W33-T67 HydrophobicContact CZ3-CG2 3.82Å; W33-Q71 PolarHBondContact NE1-O 3.2Å; W33-G72 VanDerWaalsContact CD1-O 3.24Å; W33-G72 PolarHBondContact NE1-O 2.85Å; W33-W73 HydrophobicContact CH2-CD2 4.31Å; W33-W73 AromaticContact CH2-CE3 3.64Å; W33-W73 HydrophobicContact CH2-CE3 3.64Å; W33-W73 HydrophobicContact CH2-CH2 4.02Å; W33-W73 AromaticContact CH2-CZ3 3.48Å; W33-W73 HydrophobicContact CH2-CZ3 3.48Å; W33-W73 VanDerWaalsContact CH2-CZ3 3.48Å; W33-W73 HydrophobicContact CZ2-CD2 4.14Å; W33-W73 AromaticContact CZ2-CE3 3.42Å; W33-W73 HydrophobicContact CZ2-CE3 3.42Å; W33-W73 VanDerWaalsContact CZ2-CE3 3.42Å; W33-W73 AromaticContact CZ2-CZ3 3.72Å; W33-W73 HydrophobicContact CZ2-CZ3 3.72Å; W33-P74 HydrophobicContact CD2-CG 4.15Å; W33-P74 HydrophobicContact CE3-CG 3.89Å; W33-P74 HydrophobicContact CH2-CG 4.21Å; W33-P74 HydrophobicContact CZ2-CG 4.45Å; W33-P74 HydrophobicContact CZ3-CG 3.93Å; W33-F168 HydrophobicContact CH2-CZ 4.03Å; W33-F168 HydrophobicContact CZ3-CZ 4.5Å
34	R	94.4	Very high	93.5	Very high	156 Å²	156	58.5 Å²	58.5	59%	0.589	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.1	125.1	176.2	-177.5	178.7	-63.5	166.7	-3.1	109.5	L36 Y65 A66	R34-L36 HydrophobicContact CG-CD2 4.35Å; R34-L36 PolarHBondContact O-N 3.38Å; R34-Y65 CarbonylContact O-C 3.45Å; R34-Y65 WeakPolarHBondContact O-CA 3.49Å; R34-A66 PolarHBondContact N-O 3.2Å; R34-A66 PolarHBondContact O-N 2.87Å
35	L	95.8	Very high	93.5	Very high	62 Å²	62	59.7 Å²	59.7	33%	0.325	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	123.4	170.2	-174.8	66.3	0	0	0	108.7	S37 K40 L63 Y65	L35-S37 VanDerWaalsContact CD1-O 3.23Å; L35-S37 WeakPolarHBondContact CD1-O 3.18Å; L35-K40 HydrophobicContact CD2-CB 3.92Å; L35-L63 HydrophobicContact CD1-CD2 3.6Å; L35-Y65 HydrophobicContact CB-CD1 4.1Å; L35-Y65 HydrophobicContact CB-CE1 3.74Å; L35-Y65 HydrophobicContact CD1-CD1 4.09Å; L35-Y65 HydrophobicContact CD1-CD2 4.43Å; L35-Y65 HydrophobicContact CD1-CE1 3.65Å; L35-Y65 HydrophobicContact CD1-CE2 4.04Å; L35-Y65 HydrophobicContact CD1-CG 4.45Å; L35-Y65 HydrophobicContact CG-CE1 4.29Å
36	L	96.3	Very high	93.5	Very high	86 Å²	86	61.9 Å²	61.9	45%	0.45	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-40.4	176.9	-62.5	-174.8	0	0	0	111.7	R34 H64 A66	R34-L36 HydrophobicContact CG-CD2 4.35Å; R34-L36 PolarHBondContact O-N 3.38Å; L36-H64 WeakPolarHBondContact CB-O 3.34Å; L36-H64 PolarHBondContact N-O 3.41Å; L36-A66 HydrophobicContact CD1-CB 3.64Å; L36-A66 HydrophobicContact CD2-CB 4.13Å; L36-A66 HydrophobicContact CG-CB 3.9Å
37	S	96.1	Very high	93.5	Very high	73 Å²	73	64 Å²	64	51%	0.51	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	159.9	-179.7	-172	0	0	0	0	111	L35 H64	L35-S37 VanDerWaalsContact CD1-O 3.23Å; L35-S37 WeakPolarHBondContact CD1-O 3.18Å; S37-H64 PolarHBondContact N-O 3.42Å; S37-H64 PolarHBondContact O-N 2.85Å
38	G	95	Very high	93.4	Very high	36 Å²	36	68.1 Å²	68.1	37%	0.371	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	98	176.6	179.1	0	0	0	0	0	114.2	D62	G38-D62 WeakPolarHBondContact CA-O 3.24Å
39	L	92.4	Very high	93.2	Very high	123 Å²	123	66.2 Å²	66.2	64%	0.644	38%	0.38	S	S	*	.			trans	-98.4	117.1	-179.1	-67.3	175	0	0	0	110.2	W25 E41 L63	W25-L39 WeakPolarHBondContact CH2-O 3.32Å; L39-E41 PolarHBondContact O-N 3.05Å; L39-L63 WeakPolarHBondContact O-CD2 3.22Å
40	K	91.9	Very high	92.7	Very high	99 Å²	99	72.8 Å²	72.8	43%	0.43	41%	0.409	S	S	.	.	S	Bend	trans	-65.3	-28.9	179.1	-168.2	179.1	172.9	-172.8	0	113	G26 V27 L35	G26-K40 CarbonylContact C-O 3.58Å; G26-K40 WeakPolarHBondContact CA-O 3.44Å; V27-K40 PolarHBondContact N-O 2.63Å; V27-K40 WeakPolarHBondContact O-CE 3.41Å; V27-K40 WeakPolarHBondContact O-CG 3.49Å; L35-K40 HydrophobicContact CD2-CB 3.92Å
41	E	93.9	Very high	92.3	Very high	129 Å²	129	78.2 Å²	78.2	60%	0.603	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.6	156.5	-176.6	61.5	-176.6	-164.3	0	0	110.3	W25 L39	W25-E41 VanDerWaalsContact O-CA 3.27Å; W25-E41 WeakPolarHBondContact O-CA 3.3Å; W25-E41 WeakPolarHBondContact O-CB 3.4Å; L39-E41 PolarHBondContact O-N 3.05Å
42	G	93.8	Very high	91.9	Very high	25 Å²	25	76 Å²	76	26%	0.258	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	179.7	-177.2	0	0	0	0	0	113.1	K24 W25	K24-G42 WeakPolarHBondContact CA-O 3.2Å; W25-G42 PolarHBondContact N-O 2.84Å; W25-G42 PolarHBondContact O-N 3.35Å
43	Q	95.9	Very high	91.7	Very high	104 Å²	104	80.2 Å²	80.2	49%	0.486	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	138.3	178.1	-170.5	-173.6	-79.6	0	0	109.6	F22 C23 K24 H59	F22-Q43 HydrophobicContact CD2-CG 3.8Å; F22-Q43 HydrophobicContact CE2-CG 4.11Å; C23-Q43 CarbonylContact O-C 3.46Å; C23-Q43 WeakPolarHBondContact O-CA 3.33Å; K24-Q43 HydrophobicContact CG-CB 4.33Å; K24-Q43 HydrophobicContact CG-CG 3.88Å; Q43-H59 PolarHBondContact O-CE1 3.01Å
44	T	96.9	Very high	91.7	Very high	5 Å²	5	81.1 Å²	81.1	3%	0.031	44%	0.438	C	S	.	.	P	Polyproline II helix	trans	-80	169	173.3	73.9	0	0	0	0	111.6	I10 C23 W57 H59	I10-T44 HydrophobicContact CD1-CG2 4.46Å; C23-T44 HydrophobicContact CB-CG2 3.99Å; C23-T44 PolarHBondContact N-OG1 3.22Å; C23-T44 PolarHBondContact O-N 3.21Å; C23-T44 PolarHBondContact O-OG1 2.89Å; T44-W57 HydrophobicContact CG2-CB 3.95Å; T44-W57 HydrophobicContact CG2-CD2 4.07Å; T44-W57 HydrophobicContact CG2-CE3 4.19Å; T44-W57 HydrophobicContact CG2-CG 3.98Å; T44-H59 HydrophobicContact CG2-CB 3.55Å
45	Q	95.1	Very high	91.7	Very high	102 Å²	102	73.7 Å²	73.7	48%	0.477	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-66.6	161.5	161	71.1	-83.1	23.9	0	0	111.3	F22 W57	F22-Q45 WeakPolarHBondContact CB-O 2.95Å; Q45-W57 PolarHBondContact NE2-O 3.41Å; Q45-W57 VanDerWaalsContact O-CD1 3.29Å; Q45-W57 PolarHBondContact OE1-O 2.83Å
46	V	95.3	Very high	91.7	Very high	53 Å²	53	77.1 Å²	77.1	32%	0.321	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-81.5	127.2	167.3	-177.5	0	0	0	0	107.5	L21 F22 Q83	L21-V46 WeakPolarHBondContact O-CA 3.26Å; F22-V46 HydrophobicContact CB-CB 4.4Å; F22-V46 HydrophobicContact CB-CG2 3.82Å; F22-V46 HydrophobicContact CD1-CG2 3.78Å; F22-V46 HydrophobicContact CG-CG2 4.03Å; V46-Q83 HydrophobicContact CG1-CB 4.18Å; V46-Q83 HydrophobicContact CG2-CB 4.41Å
47	D	94.8	Very high	91.7	Very high	43 Å²	43	73.1 Å²	73.1	23%	0.23	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-111	139.1	169	-175.9	42.2	0	0	0	109.5	N19 S20 L21 A55 Y56	N19-D47 VanDerWaalsContact O-O 3.07Å; S20-D47 CarbonylContact C-O 3.57Å; S20-D47 VanDerWaalsContact CA-O 3.29Å; S20-D47 WeakPolarHBondContact CA-O 3.48Å; L21-D47 PolarHBondContact N-O 2.73Å; L21-D47 PolarHBondContact O-N 3.12Å; D47-A55 HydrophobicContact CB-CB 4.29Å; D47-A55 VanDerWaalsContact OD2-CA 3.27Å; D47-A55 WeakPolarHBondContact OD2-CA 3.42Å; D47-Y56 WeakPolarHBondContact CB-O 3.47Å; D47-Y56 PolarHBondContact OD2-N 3.05Å
48	N	91.4	Very high	91.7	Very high	87 Å²	87	73 Å²	73	47%	0.465	40%	0.398	S	S	.	.			trans	-132.1	82.8	178.2	-176.7	19	0	0	0	108.5	Q50	N48-Q50 PolarHBondContact O-N 2.95Å; N48-Q50 PolarHBondContact O-NE2 2.81Å; N48-Q50 VanDerWaalsContact O-NE2 3.1Å
49	P	87.2	Confident	91.8	Very high	20 Å²	20	73 Å²	73	13%	0.13	39%	0.388	C	S	.	.			trans	-64.5	129	-172.1	28	-35.6	0	0	0	110	N19 T51	N19-P49 HydrophobicContact CB-CG 3.74Å; N19-P49 VanDerWaalsContact O-CD 3.27Å; N19-P49 WeakPolarHBondContact O-CD 3.23Å; P49-T51 VanDerWaalsContact C-N 3.3Å
50	Q	82.6	Confident	92	Very high	161 Å²	161	71.4 Å²	71.4	75%	0.752	39%	0.386	S	S	*	.	S	Bend	trans	-81.4	-14.6	174.9	-58.4	-57.6	-60.6	0	0	112.1	N48	N48-Q50 PolarHBondContact O-N 2.95Å; N48-Q50 PolarHBondContact O-NE2 2.81Å; N48-Q50 VanDerWaalsContact O-NE2 3.1Å
51	T	80	Confident	92.2	Very high	133 Å²	133	66.8 Å²	66.8	82%	0.816	37%	0.366	S	S	*	.	S	Bend	trans	-148.1	125.9	-176.8	-54.7	0	0	0	0	109.2	P49	P49-T51 VanDerWaalsContact C-N 3.3Å
52	G	80.3	Confident	92.3	Very high	46 Å²	46	65 Å²	65	47%	0.474	36%	0.36	S	S	.	.	S	Bend	trans	86.4	168.4	-174.9	0	0	0	0	0	113.6
53	D	84.8	Confident	92.5	Very high	126 Å²	126	63.8 Å²	63.8	67%	0.674	35%	0.348	S	S	*	.	S	Bend	trans	-103.7	8.9	-171.4	-57.5	-32.5	0	0	0	113.2
54	M	91.6	Very high	92.5	Very high	34 Å²	34	60.6 Å²	60.6	17%	0.167	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	124.2	-178.9	-175.5	166.1	-178	0	0	110.5	I11 A13 Y56 E158	I11-M54 HydrophobicContact CG2-CE 3.76Å; A13-M54 CarbonylContact O-C 3.47Å; A13-M54 WeakPolarHBondContact O-CA 2.95Å; M54-Y56 HydrophobicContact CB-CE2 3.93Å; M54-Y56 HydrophobicContact CE-CD1 4.08Å; M54-Y56 HydrophobicContact CE-CE1 3.75Å; M54-Y56 HydrophobicContact CG-CD1 4.39Å; M54-Y56 HydrophobicContact CG-CD2 4.32Å; M54-Y56 HydrophobicContact CG-CE1 4.01Å; M54-Y56 HydrophobicContact CG-CE2 3.94Å; M54-Y56 WeakPolarHBondContact O-CD2 3.17Å; M54-Y56 HydrophobicContact SD-CD1 4.31Å; M54-Y56 HydrophobicContact SD-CE1 3.55Å; M54-Y56 VanDerWaalsContact SD-CE1 3.55Å; M54-Y56 HydrophobicContact SD-CE2 4.36Å; M54-Y56 VanDerWaalsContact SD-CZ 3.58Å; M54-E158 HydrophobicContact CE-CB 4.37Å; M54-E158 HydrophobicContact CE-CG 4.37Å
55	A	94.3	Very high	92.5	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.008	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	123.7	168.2	0	0	0	0	0	109	G12 A13 L21 D47	G12-A55 CarbonylContact C-O 3.55Å; G12-A55 WeakPolarHBondContact CA-O 3.41Å; A13-A55 PolarHBondContact N-O 3.02Å; A13-A55 PolarHBondContact O-N 3.13Å; L21-A55 HydrophobicContact CB-CB 3.99Å; L21-A55 HydrophobicContact CD1-CB 4.15Å; L21-A55 HydrophobicContact CG-CB 4.43Å; D47-A55 HydrophobicContact CB-CB 4.29Å; D47-A55 VanDerWaalsContact OD2-CA 3.27Å; D47-A55 WeakPolarHBondContact OD2-CA 3.42Å
56	Y	95.4	Very high	92.5	Very high	134 Å²	134	55.8 Å²	55.8	53%	0.525	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.8	-179.2	-69.1	-83.2	0	0	0	111.1	I11 D47 M54	I11-Y56 HydrophobicContact CG2-CD1 4.33Å; I11-Y56 HydrophobicContact CG2-CE1 4.49Å; D47-Y56 WeakPolarHBondContact CB-O 3.47Å; D47-Y56 PolarHBondContact OD2-N 3.05Å; M54-Y56 HydrophobicContact CB-CE2 3.93Å; M54-Y56 HydrophobicContact CE-CD1 4.08Å; M54-Y56 HydrophobicContact CE-CE1 3.75Å; M54-Y56 HydrophobicContact CG-CD1 4.39Å; M54-Y56 HydrophobicContact CG-CD2 4.32Å; M54-Y56 HydrophobicContact CG-CE1 4.01Å; M54-Y56 HydrophobicContact CG-CE2 3.94Å; M54-Y56 WeakPolarHBondContact O-CD2 3.17Å; M54-Y56 HydrophobicContact SD-CD1 4.31Å; M54-Y56 HydrophobicContact SD-CE1 3.55Å; M54-Y56 VanDerWaalsContact SD-CE1 3.55Å; M54-Y56 HydrophobicContact SD-CE2 4.36Å; M54-Y56 VanDerWaalsContact SD-CZ 3.58Å
57	W	96.3	Very high	92.3	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.008	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-35.8	177.3	-58.3	-40.8	0	0	0	112.6	I10 I11 A13 L21 C23 T44 Q45 H59 V80 V157	I10-W57 HydrophobicContact CG2-CE3 3.63Å; I10-W57 HydrophobicContact CG2-CZ3 3.95Å; I11-W57 PolarHBondContact O-N 3.32Å; A13-W57 HydrophobicContact CB-CH2 3.32Å; A13-W57 HydrophobicContact CB-CZ2 3.9Å; A13-W57 HydrophobicContact CB-CZ3 3.85Å; L21-W57 HydrophobicContact CB-CZ2 3.9Å; L21-W57 PolarHBondContact O-NE1 2.87Å; C23-W57 HydrophobicContact CB-CD2 4.25Å; C23-W57 HydrophobicContact CB-CE3 3.75Å; C23-W57 HydrophobicContact CB-CH2 3.4Å; C23-W57 VanDerWaalsContact CB-CH2 3.4Å; C23-W57 HydrophobicContact CB-CZ2 3.91Å; C23-W57 HydrophobicContact CB-CZ3 3.31Å; T44-W57 HydrophobicContact CG2-CB 3.95Å; T44-W57 HydrophobicContact CG2-CD2 4.07Å; T44-W57 HydrophobicContact CG2-CE3 4.19Å; T44-W57 HydrophobicContact CG2-CG 3.98Å; Q45-W57 PolarHBondContact NE2-O 3.41Å; Q45-W57 VanDerWaalsContact O-CD1 3.29Å; Q45-W57 PolarHBondContact OE1-O 2.83Å; W57-H59 HydrophobicContact CB-CB 4.26Å; W57-H59 PolarHBondContact O-N 2.81Å; W57-V80 HydrophobicContact CH2-CG1 4.3Å; W57-V80 HydrophobicContact CH2-CG2 4.31Å; W57-V157 HydrophobicContact CZ3-CG1 4Å; W57-V157 HydrophobicContact CZ3-CG2 4.46Å
58	S	96	Very high	91.9	Very high	71 Å²	71	59.2 Å²	59.2	50%	0.497	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.3	39.9	-175	-54.5	0	0	0	0	112.3	I10 I11	I10-S58 CarbonylContact O-C 3.48Å; I10-S58 WeakPolarHBondContact O-CA 3.4Å; I10-S58 PolarHBondContact O-N 3.29Å; I10-S58 VanDerWaalsContact O-N 3.09Å; I11-S58 PolarHBondContact O-N 3.49Å; I11-S58 VanDerWaalsContact O-N 3.09Å
59	H	97.1	Very high	91.5	Very high	35 Å²	35	56.5 Å²	56.5	16%	0.162	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126.7	-169.7	-175.8	84.7	0	0	0	109.8	Q9 I10 W25 Q43 T44 W57	Q9-H59 CarbonylContact C-O 3.6Å; Q9-H59 WeakPolarHBondContact CA-O 3.41Å; Q9-H59 WeakPolarHBondContact CB-O 3.37Å; I10-H59 HydrophobicContact CB-CB 4.43Å; I10-H59 PolarHBondContact N-O 2.92Å; I10-H59 PolarHBondContact O-N 3.23Å; W25-H59 AromaticContact CD1-CD2 3.92Å; W25-H59 AromaticContact CD1-NE2 3.99Å; W25-H59 AromaticContact CE2-CD2 3.99Å; W25-H59 AromaticContact CE2-NE2 3.86Å; W25-H59 AromaticContact NE1-CD2 3.18Å; W25-H59 PolarHBondContact NE1-CD2 2.85Å; W25-H59 AromaticContact NE1-NE2 3.01Å; W25-H59 PolarHBondContact NE1-NE2 2.86Å; Q43-H59 PolarHBondContact O-CE1 3.01Å; T44-H59 HydrophobicContact CG2-CB 3.55Å; W57-H59 HydrophobicContact CB-CB 4.26Å; W57-H59 PolarHBondContact O-N 2.81Å
60	P	96.8	Very high	91.2	Very high	90 Å²	90	59.4 Å²	59.4	58%	0.584	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	143.5	-172.2	29	-35.5	0	0	0	112.1
61	I	96.2	Very high	91.4	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	123.6	166.4	-66.5	174.3	0	0	0	106.7	I6 I7 G8 I10 W25 L63 L159 L161	I6-I61 HydrophobicContact CG2-CG2 4.21Å; I7-I61 CarbonylContact C-O 3.51Å; I7-I61 VanDerWaalsContact CA-O 3.31Å; I7-I61 WeakPolarHBondContact CA-O 3.43Å; G8-I61 PolarHBondContact N-O 3.06Å; G8-I61 PolarHBondContact O-N 3.03Å; I10-I61 HydrophobicContact CD1-CD1 4.29Å; I10-I61 HydrophobicContact CG1-CD1 3.61Å; I10-I61 HydrophobicContact CG1-CG1 4.08Å; W25-I61 HydrophobicContact CH2-CG1 4.31Å; W25-I61 HydrophobicContact CZ2-CG1 4.44Å; W25-I61 HydrophobicContact CZ3-CG1 4.41Å; I61-L63 HydrophobicContact CG2-CD1 4.08Å; I61-L159 HydrophobicContact CD1-CD2 4.19Å; I61-L161 HydrophobicContact CD1-CD2 3.88Å; I61-L161 HydrophobicContact CG2-CD2 4.42Å
62	D	96.8	Very high	91.7	Very high	91 Å²	91	55.4 Å²	55.4	49%	0.487	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	114.6	171.7	-173.6	-2.9	0	0	0	108.9	I6 G38	I6-D62 WeakPolarHBondContact O-CA 3.06Å; G38-D62 WeakPolarHBondContact CA-O 3.24Å
63	L	96.9	Very high	92.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	133.8	-175.1	-73.7	161.4	0	0	0	109.9	H5 I6 W25 V27 L35 L39 I61 Y65	H5-L63 WeakPolarHBondContact CA-O 3.29Å; I6-L63 HydrophobicContact CB-CB 4.22Å; I6-L63 PolarHBondContact N-O 2.82Å; I6-L63 PolarHBondContact O-N 3.45Å; W25-L63 HydrophobicContact CZ3-CD1 4.24Å; V27-L63 HydrophobicContact CB-CD1 4.14Å; V27-L63 HydrophobicContact CG2-CD1 3.38Å; L35-L63 HydrophobicContact CD1-CD2 3.6Å; L39-L63 WeakPolarHBondContact O-CD2 3.22Å; I61-L63 HydrophobicContact CG2-CD1 4.08Å; L63-Y65 HydrophobicContact CB-CD2 4.28Å; L63-Y65 HydrophobicContact CB-CE2 3.84Å; L63-Y65 HydrophobicContact CD1-CE2 4.17Å; L63-Y65 HydrophobicContact CD2-CE2 4.1Å; L63-Y65 HydrophobicContact CG-CE2 4.29Å
64	H	97.3	Very high	92.6	Very high	37 Å²	37	49.2 Å²	49.2	17%	0.171	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	116.5	173.3	180	-160.5	0	0	0	109.8	E3 H5 L36 S37	E3-H64 IonicContact OE2-CE1 3.3Å; E3-H64 IonicContact OE2-NE2 3.45Å; E3-H64 PolarHBondContact OE2-NE2 3.45Å; H5-H64 AromaticContact CD2-CD2 3.94Å; H5-H64 AromaticContact CE1-CD2 3.18Å; H5-H64 PolarHBondContact CE1-CD2 3.05Å; H5-H64 AromaticContact CE1-CE1 3.51Å; H5-H64 AromaticContact CE1-CG 3.5Å; H5-H64 VanDerWaalsContact CE1-CG 3.5Å; H5-H64 AromaticContact CE1-ND1 3.72Å; H5-H64 AromaticContact CE1-NE2 3.19Å; H5-H64 PolarHBondContact CE1-NE2 3.49Å; H5-H64 AromaticContact CG-CD2 3.95Å; H5-H64 AromaticContact ND1-CD2 3.5Å; H5-H64 PolarHBondContact ND1-CD2 3.32Å; H5-H64 AromaticContact ND1-CG 3.67Å; H5-H64 AromaticContact ND1-NE2 3.98Å; H5-H64 AromaticContact NE2-CD2 3.47Å; H5-H64 PolarHBondContact NE2-CD2 3.15Å; H5-H64 AromaticContact NE2-CE1 3.95Å; H5-H64 AromaticContact NE2-NE2 3.26Å; H5-H64 PolarHBondContact NE2-NE2 2.85Å; L36-H64 WeakPolarHBondContact CB-O 3.34Å; L36-H64 PolarHBondContact N-O 3.41Å; S37-H64 PolarHBondContact N-O 3.42Å; S37-H64 PolarHBondContact O-N 2.85Å
65	Y	96	Very high	92.8	Very high	1 Å²	1	50 Å²	50	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	151	176.7	-71	-83.5	0	0	0	111.9	E3 L4 I6 V27 T29 W33 R34 L35 L63	E3-Y65 CarbonylContact C-O 3.55Å; E3-Y65 VanDerWaalsContact CA-O 3.26Å; E3-Y65 WeakPolarHBondContact CA-O 3.5Å; L4-Y65 PolarHBondContact N-O 3.34Å; L4-Y65 PolarHBondContact O-N 3.21Å; I6-Y65 HydrophobicContact CD1-CD2 4.12Å; I6-Y65 HydrophobicContact CD1-CE2 4.1Å; V27-Y65 HydrophobicContact CG1-CE2 4.3Å; V27-Y65 WeakPolarHBondContact CG1-OH 3.46Å; T29-Y65 HydrophobicContact CG2-CD1 4.3Å; T29-Y65 HydrophobicContact CG2-CE1 3.71Å; T29-Y65 HydrophobicContact CG2-CE2 4.44Å; W33-Y65 HydrophobicContact CE3-CG 4.36Å; R34-Y65 CarbonylContact O-C 3.45Å; R34-Y65 WeakPolarHBondContact O-CA 3.49Å; L35-Y65 HydrophobicContact CB-CD1 4.1Å; L35-Y65 HydrophobicContact CB-CE1 3.74Å; L35-Y65 HydrophobicContact CD1-CD1 4.09Å; L35-Y65 HydrophobicContact CD1-CD2 4.43Å; L35-Y65 HydrophobicContact CD1-CE1 3.65Å; L35-Y65 HydrophobicContact CD1-CE2 4.04Å; L35-Y65 HydrophobicContact CD1-CG 4.45Å; L35-Y65 HydrophobicContact CG-CE1 4.29Å; L63-Y65 HydrophobicContact CB-CD2 4.28Å; L63-Y65 HydrophobicContact CB-CE2 3.84Å; L63-Y65 HydrophobicContact CD1-CE2 4.17Å; L63-Y65 HydrophobicContact CD2-CE2 4.1Å; L63-Y65 HydrophobicContact CG-CE2 4.29Å
66	A	94.4	Very high	92.8	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.033	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	143.4	162	0	0	0	0	0	110.6	M1 A2 E3 R34 L36	M1-A66 HydrophobicContact CB-CB 4.45Å; M1-A66 HydrophobicContact CG-CB 3.95Å; M1-A66 HydrophobicContact SD-CB 3.53Å; M1-A66 VanDerWaalsContact SD-CB 3.53Å; A2-A66 CarbonylContact O-C 3.52Å; A2-A66 VanDerWaalsContact O-CA 3.29Å; A2-A66 WeakPolarHBondContact O-CA 3.16Å; E3-A66 HydrophobicContact CG-CB 4.36Å; R34-A66 PolarHBondContact N-O 3.2Å; R34-A66 PolarHBondContact O-N 2.87Å; L36-A66 HydrophobicContact CD1-CB 3.64Å; L36-A66 HydrophobicContact CD2-CB 4.13Å; L36-A66 HydrophobicContact CG-CB 3.9Å
67	T	92	Very high	92.7	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.018	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	145.1	-179.4	-170	0	0	0	0	113.5	M1 A2 A32 W33 G69 F168	M1-T67 VanDerWaalsContact CG-C 3.41Å; M1-T67 WeakPolarHBondContact CG-O 3.23Å; A2-T67 HydrophobicContact CB-CG2 3.92Å; A2-T67 PolarHBondContact N-O 3.23Å; A2-T67 VanDerWaalsContact N-O 3.12Å; A2-T67 PolarHBondContact O-N 2.93Å; A32-T67 WeakPolarHBondContact O-CA 3.49Å; A32-T67 PolarHBondContact O-OG1 3.17Å; W33-T67 HydrophobicContact CD2-CG2 4.38Å; W33-T67 HydrophobicContact CE3-CG2 4.14Å; W33-T67 HydrophobicContact CH2-CG2 3.75Å; W33-T67 HydrophobicContact CZ2-CG2 3.98Å; W33-T67 HydrophobicContact CZ3-CG2 3.82Å; T67-G69 PolarHBondContact OG1-N 2.82Å; T67-G69 VanDerWaalsContact OG1-N 3.13Å; T67-G69 PolarHBondContact OG1-O 3.44Å; T67-F168 HydrophobicContact CG2-CE1 4.33Å; T67-F168 HydrophobicContact CG2-CZ 3.93Å
68	K	85.8	Confident	92.6	Very high	166 Å²	166	45 Å²	45	72%	0.722	24%	0.244	S	C	*	.	S	Bend	trans	-96.2	-4.7	170.3	-65	-174.7	180	-177.4	0	113.1	M1 A32	M1-K68 HydrophobicContact CE-CD 4.01Å; M1-K68 HydrophobicContact CE-CG 3.56Å; M1-K68 HydrophobicContact CG-CG 4.17Å; M1-K68 HydrophobicContact SD-CG 3.98Å; A32-K68 PolarHBondContact O-N 3Å
69	G	82.8	Confident	92.5	Very high	29 Å²	29	43.1 Å²	43.1	30%	0.299	23%	0.228	S	C	.	.	S	Bend	trans	-171	164.7	-179.9	0	0	0	0	0	113.3	T67 Q71	T67-G69 PolarHBondContact OG1-N 2.82Å; T67-G69 VanDerWaalsContact OG1-N 3.13Å; T67-G69 PolarHBondContact OG1-O 3.44Å; G69-Q71 PolarHBondContact O-N 2.92Å
70	L	82.4	Confident	92.3	Very high	81 Å²	81	41.5 Å²	41.5	42%	0.424	22%	0.22	S	C	.	.	S	Bend	trans	-81.7	-11.3	-175.1	-67.7	179.9	0	0	0	114.8	G72 W73 F168 V173	L70-G72 PolarHBondContact O-N 2.6Å; L70-W73 HydrophobicContact CD2-CE3 4.07Å; L70-W73 HydrophobicContact CD2-CZ3 3.75Å; L70-W73 PolarHBondContact O-N 2.83Å; L70-F168 HydrophobicContact CD2-CD1 4.26Å; L70-F168 HydrophobicContact CD2-CE1 3.77Å; L70-V173 HydrophobicContact CD1-CB 4.29Å; L70-V173 HydrophobicContact CD1-CG1 3.8Å; L70-V173 HydrophobicContact CD1-CG2 3.55Å; L70-V173 HydrophobicContact CD2-CG1 4.19Å; L70-V173 HydrophobicContact CD2-CG2 3.87Å; L70-V173 HydrophobicContact CG-CG2 3.76Å
71	Q	85.1	Confident	92.2	Very high	170 Å²	170	38.1 Å²	38.1	79%	0.794	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	133.2	-178.3	-73.1	-175.1	-14.4	0	0	111.5	W33 G69	W33-Q71 PolarHBondContact NE1-O 3.2Å; G69-Q71 PolarHBondContact O-N 2.92Å
72	G	86.5	Confident	92	Very high	41 Å²	41	39.1 Å²	39.1	42%	0.423	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.8	47.2	-179.7	0	0	0	0	0	113.5	G30 W33 L70	G30-G72 PolarHBondContact N-O 3.45Å; W33-G72 VanDerWaalsContact CD1-O 3.24Å; W33-G72 PolarHBondContact NE1-O 2.85Å; L70-G72 PolarHBondContact O-N 2.6Å
73	W	91.9	Very high	91.8	Very high	42 Å²	42	37.7 Å²	37.7	16%	0.159	19%	0.191	C	C	.	.			trans	-45.7	142.1	174.3	-169.9	-95.2	0	0	0	112.5	L4 W33 L70 K75 V99 M165 F168	L4-W73 HydrophobicContact CD1-CH2 4.4Å; L4-W73 HydrophobicContact CD1-CZ2 4.42Å; L4-W73 HydrophobicContact CD2-CH2 4.29Å; L4-W73 HydrophobicContact CD2-CZ2 4.09Å; W33-W73 HydrophobicContact CH2-CD2 4.31Å; W33-W73 AromaticContact CH2-CE3 3.64Å; W33-W73 HydrophobicContact CH2-CE3 3.64Å; W33-W73 HydrophobicContact CH2-CH2 4.02Å; W33-W73 AromaticContact CH2-CZ3 3.48Å; W33-W73 HydrophobicContact CH2-CZ3 3.48Å; W33-W73 VanDerWaalsContact CH2-CZ3 3.48Å; W33-W73 HydrophobicContact CZ2-CD2 4.14Å; W33-W73 AromaticContact CZ2-CE3 3.42Å; W33-W73 HydrophobicContact CZ2-CE3 3.42Å; W33-W73 VanDerWaalsContact CZ2-CE3 3.42Å; W33-W73 AromaticContact CZ2-CZ3 3.72Å; W33-W73 HydrophobicContact CZ2-CZ3 3.72Å; L70-W73 HydrophobicContact CD2-CE3 4.07Å; L70-W73 HydrophobicContact CD2-CZ3 3.75Å; L70-W73 PolarHBondContact O-N 2.83Å; W73-K75 PolarHBondContact O-N 2.68Å; W73-V99 PolarHBondContact NE1-O 2.82Å; W73-M165 HydrophobicContact CH2-CE 3.62Å; W73-M165 HydrophobicContact CH2-SD 4.39Å; W73-M165 HydrophobicContact CZ2-CE 3.82Å; W73-F168 HydrophobicContact CH2-CE1 4.21Å; W73-F168 HydrophobicContact CH2-CZ 4.3Å; W73-F168 AromaticContact CZ3-CE1 3.89Å; W73-F168 HydrophobicContact CZ3-CE1 3.89Å; W73-F168 HydrophobicContact CZ3-CZ 4.24Å
74	P	93.9	Very high	91.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.2	C	C	.	.			trans	-56.9	136.7	-177.5	-25.6	34.1	0	0	0	114.2	L4 I6 V27 H28 T29 W33 V99	L4-P74 HydrophobicContact CD2-CG 3.85Å; I6-P74 HydrophobicContact CD1-CB 4.38Å; V27-P74 HydrophobicContact CG1-CB 4.02Å; H28-P74 WeakPolarHBondContact O-CA 3.42Å; T29-P74 HydrophobicContact CG2-CB 3.82Å; T29-P74 HydrophobicContact CG2-CG 3.81Å; W33-P74 HydrophobicContact CD2-CG 4.15Å; W33-P74 HydrophobicContact CE3-CG 3.89Å; W33-P74 HydrophobicContact CH2-CG 4.21Å; W33-P74 HydrophobicContact CZ2-CG 4.45Å; W33-P74 HydrophobicContact CZ3-CG 3.93Å; P74-V99 HydrophobicContact CB-CB 4.16Å; P74-V99 HydrophobicContact CB-CG2 3.79Å; P74-V99 WeakPolarHBondContact O-CB 3.27Å; P74-V99 WeakPolarHBondContact O-CG2 3.16Å; P74-V99 PolarHBondContact O-N 3.1Å
75	K	94	Very high	90.8	Very high	49 Å²	49	43.7 Å²	43.7	21%	0.213	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.8	174.6	-58.4	179.5	-170.9	-174.5	0	109.1	V27 H28 W73 C97 H98 Y141	V27-K75 CarbonylContact C-O 3.57Å; V27-K75 WeakPolarHBondContact CA-O 3.25Å; H28-K75 PolarHBondContact N-O 2.89Å; H28-K75 PolarHBondContact O-N 2.81Å; W73-K75 PolarHBondContact O-N 2.68Å; K75-C97 CarbonylContact C-O 3.6Å; K75-C97 WeakPolarHBondContact CA-O 3.45Å; K75-H98 WeakPolarHBondContact CE-CE1 3.32Å; K75-Y141 PolarHBondContact NZ-O 2.79Å
76	I	94.1	Very high	90.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	126.3	172.2	-62.8	160.2	0	0	0	107.2	G26 V27 L78 Y96 C97 V99 L159 L161	G26-I76 CarbonylContact O-C 3.6Å; G26-I76 WeakPolarHBondContact O-CA 3.43Å; V27-I76 HydrophobicContact CG2-CG1 3.84Å; I76-L78 HydrophobicContact CG2-CD2 4.03Å; I76-L78 HydrophobicContact CG2-CG 4.25Å; I76-Y96 CarbonylContact O-C 3.58Å; I76-Y96 WeakPolarHBondContact O-CA 3.21Å; I76-Y96 WeakPolarHBondContact O-CB 3.48Å; I76-C97 PolarHBondContact N-O 3.26Å; I76-C97 PolarHBondContact O-N 3.42Å; I76-V99 HydrophobicContact CD1-CG2 3.91Å; I76-V99 HydrophobicContact CG1-CG2 3.92Å; I76-L159 HydrophobicContact CD1-CD2 4.46Å; I76-L159 HydrophobicContact CG2-CD2 4.24Å; I76-L161 HydrophobicContact CD1-CD1 3.5Å; I76-L161 VanDerWaalsContact CD1-CD1 3.5Å; I76-L161 HydrophobicContact CD1-CD2 4.31Å
77	Y	93.8	Very high	89.8	Confident	34 Å²	34	53.6 Å²	53.6	13%	0.133	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	149.2	168.7	64.7	-95.5	0	0	0	110.1	W25 G26 H28 G95 Y141	W25-Y77 WeakPolarHBondContact CA-O 2.93Å; G26-Y77 VanDerWaalsContact CA-CZ 3.44Å; G26-Y77 PolarHBondContact N-O 2.92Å; G26-Y77 WeakPolarHBondContact O-CD1 3.49Å; G26-Y77 WeakPolarHBondContact O-CE1 3.39Å; G26-Y77 PolarHBondContact O-N 2.96Å; H28-Y77 HydrophobicContact CB-CD1 4.38Å; Y77-G95 CarbonylContact C-O 3.54Å; Y77-G95 WeakPolarHBondContact CA-O 3.49Å; Y77-Y141 HydrophobicContact CD1-CD1 4.26Å
78	L	94.2	Very high	89.6	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	141.3	-173.5	-58.8	164.8	0	0	0	108.4	I10 K24 W25 I76 Y94 G95 C110 V157 L159	I10-L78 HydrophobicContact CD1-CD2 4.1Å; K24-L78 CarbonylContact O-C 3.56Å; K24-L78 WeakPolarHBondContact O-CA 3.22Å; W25-L78 HydrophobicContact CB-CD2 3.7Å; I76-L78 HydrophobicContact CG2-CD2 4.03Å; I76-L78 HydrophobicContact CG2-CG 4.25Å; L78-Y94 CarbonylContact O-C 3.41Å; L78-Y94 WeakPolarHBondContact O-CA 3.37Å; L78-G95 PolarHBondContact N-O 3.17Å; L78-G95 PolarHBondContact O-N 3.29Å; L78-C110 HydrophobicContact CD1-CB 3.91Å; L78-V157 HydrophobicContact CD1-CB 3.95Å; L78-V157 HydrophobicContact CD1-CG1 3.87Å; L78-V157 HydrophobicContact CD1-CG2 4.39Å; L78-L159 HydrophobicContact CD1-CD1 3.86Å; L78-L159 HydrophobicContact CD1-CD2 4.33Å; L78-L159 HydrophobicContact CD2-CD2 4.42Å
79	Q	93.7	Very high	89.6	Confident	31 Å²	31	55.7 Å²	55.7	15%	0.145	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	113.6	171.8	-40.1	-176.3	12.1	0	0	106.8	C23 K24 W81 L91 G93 Y94 I140	C23-Q79 CarbonylContact C-O 3.56Å; C23-Q79 WeakPolarHBondContact CA-O 3.43Å; K24-Q79 HydrophobicContact CB-CB 4.25Å; K24-Q79 HydrophobicContact CB-CG 4.5Å; K24-Q79 PolarHBondContact N-O 3.48Å; K24-Q79 PolarHBondContact O-N 3.4Å; Q79-W81 VanDerWaalsContact O-CD1 3.25Å; Q79-L91 HydrophobicContact CB-CD1 4.12Å; Q79-G93 WeakPolarHBondContact CA-O 3.23Å; Q79-Y94 HydrophobicContact CB-CD1 4.2Å; Q79-Y94 HydrophobicContact CB-CE1 4.33Å; Q79-Y94 HydrophobicContact CG-CD1 3.86Å; Q79-Y94 HydrophobicContact CG-CE1 3.98Å; Q79-I140 HydrophobicContact CG-CD1 4.36Å
80	V	94.6	Very high	89.9	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.2	178.6	-176.4	0	0	0	0	108.5	F16 L21 W57 Y92 G93 T112 V157	F16-V80 HydrophobicContact CD1-CG1 4.36Å; F16-V80 HydrophobicContact CE1-CB 4.02Å; F16-V80 HydrophobicContact CE1-CG1 3.86Å; F16-V80 HydrophobicContact CE1-CG2 4.42Å; F16-V80 HydrophobicContact CE2-CG1 4.12Å; F16-V80 HydrophobicContact CE2-CG2 4.44Å; F16-V80 HydrophobicContact CZ-CB 3.87Å; F16-V80 HydrophobicContact CZ-CG1 3.73Å; F16-V80 HydrophobicContact CZ-CG2 3.79Å; L21-V80 HydrophobicContact CB-CG1 4.49Å; L21-V80 HydrophobicContact CD1-CG1 4.39Å; L21-V80 HydrophobicContact CD2-CG1 4.23Å; W57-V80 HydrophobicContact CH2-CG1 4.3Å; W57-V80 HydrophobicContact CH2-CG2 4.31Å; V80-Y92 PolarHBondContact O-N 2.87Å; V80-G93 PolarHBondContact N-O 2.81Å; V80-G93 PolarHBondContact O-N 3.13Å; V80-T112 HydrophobicContact CG2-CG2 4.16Å; V80-V157 HydrophobicContact CG2-CG2 3.48Å; V80-V157 VanDerWaalsContact CG2-CG2 3.48Å
81	W	93.7	Very high	90	Very high	20 Å²	20	54.3 Å²	54.3	8%	0.076	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.6	-177.7	-66.2	78.6	0	0	0	109.5	L21 F22 Q79 C89 Q90 L91	L21-W81 CarbonylContact C-O 3.49Å; L21-W81 VanDerWaalsContact CA-O 3.29Å; L21-W81 WeakPolarHBondContact CA-O 3.08Å; F22-W81 HydrophobicContact CD1-CB 3.69Å; F22-W81 HydrophobicContact CD2-CB 4.16Å; F22-W81 HydrophobicContact CE1-CB 3.22Å; F22-W81 HydrophobicContact CE1-CG 4.09Å; F22-W81 HydrophobicContact CE2-CB 3.73Å; F22-W81 AromaticContact CE2-CD1 3.98Å; F22-W81 AromaticContact CE2-CG 3.85Å; F22-W81 HydrophobicContact CE2-CG 3.85Å; F22-W81 HydrophobicContact CG-CB 4.15Å; F22-W81 HydrophobicContact CZ-CB 3.24Å; F22-W81 HydrophobicContact CZ-CD2 4.15Å; F22-W81 AromaticContact CZ-CG 3.59Å; F22-W81 HydrophobicContact CZ-CG 3.59Å; F22-W81 PolarHBondContact N-O 3.26Å; F22-W81 PolarHBondContact O-N 2.86Å; Q79-W81 VanDerWaalsContact O-CD1 3.25Å; W81-C89 HydrophobicContact CE3-CB 4.09Å; W81-Q90 CarbonylContact C-O 3.53Å; W81-Q90 WeakPolarHBondContact CA-O 3.31Å; W81-L91 HydrophobicContact CD2-CB 4.2Å; W81-L91 HydrophobicContact CD2-CD1 4.07Å; W81-L91 HydrophobicContact CE3-CB 3.98Å; W81-L91 HydrophobicContact CG-CD1 4.44Å; W81-L91 HydrophobicContact CH2-CB 4.04Å; W81-L91 HydrophobicContact CH2-CD1 4.5Å; W81-L91 HydrophobicContact CZ2-CB 4.24Å; W81-L91 HydrophobicContact CZ2-CD1 3.85Å; W81-L91 HydrophobicContact CZ3-CB 3.91Å
82	H	93.1	Very high	90.2	Very high	22 Å²	22	47 Å²	47	10%	0.102	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.7	170.3	171.6	-101.1	0	0	0	110.2	Q18 S20 L21 C89 Q90 Y92	Q18-H82 WeakPolarHBondContact CB-CD2 2.87Å; Q18-H82 WeakPolarHBondContact CB-NE2 3.17Å; S20-H82 CarbonylContact O-C 3.56Å; S20-H82 VanDerWaalsContact O-CA 3.22Å; S20-H82 WeakPolarHBondContact O-CA 3.47Å; S20-H82 PolarHBondContact O-CD2 3.47Å; L21-H82 HydrophobicContact CD2-CB 3.96Å; H82-C89 CarbonylContact O-C 3.5Å; H82-C89 VanDerWaalsContact O-CA 3.31Å; H82-C89 WeakPolarHBondContact O-CA 3.42Å; H82-Q90 PolarHBondContact N-O 3.19Å; H82-Q90 PolarHBondContact O-N 3.22Å; H82-Y92 HydrophobicContact CB-CD1 3.59Å; H82-Y92 HydrophobicContact CB-CD2 3.92Å; H82-Y92 HydrophobicContact CB-CE1 3.24Å; H82-Y92 HydrophobicContact CB-CE2 3.6Å; H82-Y92 HydrophobicContact CB-CG 3.95Å; H82-Y92 AromaticContact CG-CE1 3.82Å; H82-Y92 AromaticContact CG-CE2 4Å; H82-Y92 AromaticContact CG-CZ 3.47Å; H82-Y92 VanDerWaalsContact CG-CZ 3.47Å; H82-Y92 AromaticContact ND1-CZ 3.98Å
83	Q	92.4	Very high	90.3	Very high	62 Å²	62	45 Å²	45	29%	0.29	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.9	171.3	-174.6	175.1	55.5	0	0	109.9	S20 V46 G87 R88	S20-Q83 WeakPolarHBondContact CB-O 3.49Å; S20-Q83 PolarHBondContact O-N 3.18Å; S20-Q83 PolarHBondContact OG-O 3.5Å; V46-Q83 HydrophobicContact CG1-CB 4.18Å; V46-Q83 HydrophobicContact CG2-CB 4.41Å; Q83-G87 PolarHBondContact NE2-O 2.79Å; Q83-R88 WeakPolarHBondContact CA-O 3.39Å
84	D	87.8	Confident	90.2	Very high	37 Å²	37	43.3 Å²	43.3	20%	0.198	22%	0.222	C	C	.	.			trans	-77.5	172.3	175.9	77.5	4.9	0	0	0	112.8	F86 G87 R88	D84-F86 PolarHBondContact O-N 3.49Å; D84-F86 VanDerWaalsContact O-N 3.08Å; D84-F86 VanDerWaalsContact OD1-C 3.29Å; D84-F86 WeakPolarHBondContact OD1-CA 3.45Å; D84-F86 WeakPolarHBondContact OD1-CB 3.33Å; D84-F86 PolarHBondContact OD1-N 2.82Å; D84-G87 PolarHBondContact O-N 2.84Å; D84-G87 PolarHBondContact OD1-N 3.3Å; D84-R88 PolarHBondContact N-O 3.32Å; D84-R88 WeakPolarHBondContact OD1-CB 3.16Å; D84-R88 PolarHBondContact OD1-N 2.78Å; D84-R88 IonicContact OD1-NE 3.49Å; D84-R88 IonicContact OD2-CZ 3.65Å; D84-R88 IonicContact OD2-NE 3.1Å; D84-R88 PolarHBondContact OD2-NE 3.07Å; D84-R88 IonicContact OD2-NH2 3.26Å; D84-R88 PolarHBondContact OD2-NH2 3.24Å
85	S	84.9	Confident	90	Very high	126 Å²	126	43.3 Å²	43.3	88%	0.881	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-13.6	179.3	-48.4	0	0	0	0	114.4
86	F	86.2	Confident	89.9	Confident	172 Å²	172	44.4 Å²	44.4	75%	0.754	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	5.6	175.3	-57.6	-75.5	0	0	0	112.1	D84 R88	D84-F86 PolarHBondContact O-N 3.49Å; D84-F86 VanDerWaalsContact O-N 3.08Å; D84-F86 VanDerWaalsContact OD1-C 3.29Å; D84-F86 WeakPolarHBondContact OD1-CA 3.45Å; D84-F86 WeakPolarHBondContact OD1-CB 3.33Å; D84-F86 PolarHBondContact OD1-N 2.82Å; F86-R88 VanDerWaalsContact C-N 3.31Å; F86-R88 HydrophobicContact CB-CG 4.49Å; F86-R88 PolarHBondContact O-N 2.9Å
87	G	82.9	Confident	89.9	Confident	40 Å²	40	45 Å²	45	41%	0.412	23%	0.229	S	C	.	.	S	Bend	trans	79.7	6.3	179.6	0	0	0	0	0	114.6	Q83 D84	Q83-G87 PolarHBondContact NE2-O 2.79Å; D84-G87 PolarHBondContact O-N 2.84Å; D84-G87 PolarHBondContact OD1-N 3.3Å
88	R	86.9	Confident	89.8	Confident	154 Å²	154	48.2 Å²	48.2	58%	0.581	25%	0.245	S	C	*	.			trans	-77.8	132.5	179.2	-58.5	178.7	-66.5	-176.4	-0.3	109.8	Q83 D84 F86	Q83-R88 WeakPolarHBondContact CA-O 3.39Å; D84-R88 PolarHBondContact N-O 3.32Å; D84-R88 WeakPolarHBondContact OD1-CB 3.16Å; D84-R88 PolarHBondContact OD1-N 2.78Å; D84-R88 IonicContact OD1-NE 3.49Å; D84-R88 IonicContact OD2-CZ 3.65Å; D84-R88 IonicContact OD2-NE 3.1Å; D84-R88 PolarHBondContact OD2-NE 3.07Å; D84-R88 IonicContact OD2-NH2 3.26Å; D84-R88 PolarHBondContact OD2-NH2 3.24Å; F86-R88 VanDerWaalsContact C-N 3.31Å; F86-R88 HydrophobicContact CB-CG 4.49Å; F86-R88 PolarHBondContact O-N 2.9Å
89	C	87.3	Confident	89.8	Confident	60 Å²	60	48.3 Å²	48.3	41%	0.405	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	123.5	-178.6	-60.2	0	0	0	0	111.1	F22 W81 H82	F22-C89 HydrophobicContact CE1-CB 4.1Å; F22-C89 HydrophobicContact CZ-CB 4.18Å; W81-C89 HydrophobicContact CE3-CB 4.09Å; H82-C89 CarbonylContact O-C 3.5Å; H82-C89 VanDerWaalsContact O-CA 3.31Å; H82-C89 WeakPolarHBondContact O-CA 3.42Å
90	Q	87.7	Confident	89.9	Confident	65 Å²	65	47.9 Å²	47.9	30%	0.304	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.7	174.7	-172.8	176.9	28.5	0	0	110	W81 H82 Y92	W81-Q90 CarbonylContact C-O 3.53Å; W81-Q90 WeakPolarHBondContact CA-O 3.31Å; H82-Q90 PolarHBondContact N-O 3.19Å; H82-Q90 PolarHBondContact O-N 3.22Å; Q90-Y92 HydrophobicContact CB-CE1 4.41Å; Q90-Y92 HydrophobicContact CG-CD1 4.46Å; Q90-Y92 HydrophobicContact CG-CE1 4.39Å; Q90-Y92 PolarHBondContact O-N 2.93Å
91	L	86.1	Confident	89.7	Confident	15 Å²	15	52.2 Å²	52.2	8%	0.079	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	126.4	173.4	177.9	78.1	0	0	0	109.9	Q79 W81 Y94 Q133	Q79-L91 HydrophobicContact CB-CD1 4.12Å; W81-L91 HydrophobicContact CD2-CB 4.2Å; W81-L91 HydrophobicContact CD2-CD1 4.07Å; W81-L91 HydrophobicContact CE3-CB 3.98Å; W81-L91 HydrophobicContact CG-CD1 4.44Å; W81-L91 HydrophobicContact CH2-CB 4.04Å; W81-L91 HydrophobicContact CH2-CD1 4.5Å; W81-L91 HydrophobicContact CZ2-CB 4.24Å; W81-L91 HydrophobicContact CZ2-CD1 3.85Å; W81-L91 HydrophobicContact CZ3-CB 3.91Å; L91-Y94 HydrophobicContact CD1-CD1 4.44Å; L91-Y94 HydrophobicContact CD1-CE1 3.99Å; L91-Y94 HydrophobicContact CD2-CD2 4.2Å; L91-Y94 HydrophobicContact CD2-CE1 3.93Å; L91-Y94 HydrophobicContact CD2-CE2 3.36Å; L91-Y94 WeakPolarHBondContact CD2-OH 3.34Å; L91-Y94 HydrophobicContact CG-CE2 4.5Å; L91-Q133 HydrophobicContact CD2-CG 4.21Å
92	Y	89.3	Confident	89.6	Confident	17 Å²	17	53.9 Å²	53.9	7%	0.067	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-42.2	176.9	-88.3	20.3	0	0	0	112.1	F16 Q18 L21 V80 H82 Q90 R114 M154	F16-Y92 HydrophobicContact CB-CD2 4.15Å; F16-Y92 HydrophobicContact CB-CE2 4.5Å; F16-Y92 AromaticContact CD1-CD2 3.81Å; F16-Y92 HydrophobicContact CD1-CD2 3.81Å; F16-Y92 HydrophobicContact CD1-CG 4.42Å; F16-Y92 HydrophobicContact CG-CD2 4.34Å; Q18-Y92 HydrophobicContact CB-CE2 3.92Å; Q18-Y92 VanDerWaalsContact CB-OH 3.29Å; Q18-Y92 WeakPolarHBondContact CB-OH 3.44Å; Q18-Y92 HydrophobicContact CG-CE2 4.43Å; Q18-Y92 WeakPolarHBondContact CG-OH 3.41Å; L21-Y92 HydrophobicContact CD2-CD2 3.75Å; L21-Y92 HydrophobicContact CD2-CE2 4.01Å; V80-Y92 PolarHBondContact O-N 2.87Å; H82-Y92 HydrophobicContact CB-CD1 3.59Å; H82-Y92 HydrophobicContact CB-CD2 3.92Å; H82-Y92 HydrophobicContact CB-CE1 3.24Å; H82-Y92 HydrophobicContact CB-CE2 3.6Å; H82-Y92 HydrophobicContact CB-CG 3.95Å; H82-Y92 AromaticContact CG-CE1 3.82Å; H82-Y92 AromaticContact CG-CE2 4Å; H82-Y92 AromaticContact CG-CZ 3.47Å; H82-Y92 VanDerWaalsContact CG-CZ 3.47Å; H82-Y92 AromaticContact ND1-CZ 3.98Å; Q90-Y92 HydrophobicContact CB-CE1 4.41Å; Q90-Y92 HydrophobicContact CG-CD1 4.46Å; Q90-Y92 HydrophobicContact CG-CE1 4.39Å; Q90-Y92 PolarHBondContact O-N 2.93Å; Y92-R114 WeakPolarHBondContact O-CB 3.41Å; Y92-M154 HydrophobicContact CG-CE 4.35Å; Y92-M154 WeakPolarHBondContact O-CE 3.47Å; Y92-M154 WeakPolarHBondContact O-CG 3.38Å
93	G	88.3	Confident	89.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.8	162.2	179.7	0	0	0	0	0	113.8	Q79 V80 W113	Q79-G93 WeakPolarHBondContact CA-O 3.23Å; V80-G93 PolarHBondContact N-O 2.81Å; V80-G93 PolarHBondContact O-N 3.13Å; G93-W113 CarbonylContact C-O 3.58Å; G93-W113 WeakPolarHBondContact CA-O 3.44Å
94	Y	89.4	Confident	89.7	Confident	6 Å²	6	55.2 Å²	55.2	2%	0.024	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	144.3	171.3	-61.3	-70.9	0	0	0	109.7	L78 Q79 L91 T112 W113 L134 I140	L78-Y94 CarbonylContact O-C 3.41Å; L78-Y94 WeakPolarHBondContact O-CA 3.37Å; Q79-Y94 HydrophobicContact CB-CD1 4.2Å; Q79-Y94 HydrophobicContact CB-CE1 4.33Å; Q79-Y94 HydrophobicContact CG-CD1 3.86Å; Q79-Y94 HydrophobicContact CG-CE1 3.98Å; L91-Y94 HydrophobicContact CD1-CD1 4.44Å; L91-Y94 HydrophobicContact CD1-CE1 3.99Å; L91-Y94 HydrophobicContact CD2-CD2 4.2Å; L91-Y94 HydrophobicContact CD2-CE1 3.93Å; L91-Y94 HydrophobicContact CD2-CE2 3.36Å; L91-Y94 WeakPolarHBondContact CD2-OH 3.34Å; L91-Y94 HydrophobicContact CG-CE2 4.5Å; Y94-T112 CarbonylContact O-C 3.58Å; Y94-T112 VanDerWaalsContact O-CA 3.23Å; Y94-T112 WeakPolarHBondContact O-CA 3.44Å; Y94-T112 WeakPolarHBondContact O-CB 3.29Å; Y94-W113 PolarHBondContact N-O 2.93Å; Y94-W113 PolarHBondContact O-N 2.86Å; Y94-W113 PolarHBondContact O-NE1 2.51Å; Y94-L134 HydrophobicContact CD1-CD1 4.37Å; Y94-L134 HydrophobicContact CD2-CD1 3.53Å; Y94-L134 HydrophobicContact CD2-CG 4.06Å; Y94-L134 HydrophobicContact CE1-CD1 4.34Å; Y94-L134 HydrophobicContact CE2-CB 4.12Å; Y94-L134 HydrophobicContact CE2-CD1 3.46Å; Y94-L134 VanDerWaalsContact CE2-CD1 3.46Å; Y94-L134 HydrophobicContact CE2-CG 3.52Å; Y94-L134 HydrophobicContact CG-CD1 3.97Å; Y94-L134 PolarHBondContact OH-N 3.25Å; Y94-I140 HydrophobicContact CD1-CD1 3.42Å; Y94-I140 VanDerWaalsContact CD1-CD1 3.42Å; Y94-I140 HydrophobicContact CD1-CG1 3.75Å; Y94-I140 HydrophobicContact CE1-CD1 3.7Å; Y94-I140 HydrophobicContact CE1-CG1 4.26Å; Y94-I140 HydrophobicContact CG-CD1 4.22Å; Y94-I140 HydrophobicContact CG-CG1 4.04Å
95	G	90	Very high	90.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	158	172.3	0	0	0	0	0	109.9	Y77 L78 I140	Y77-G95 CarbonylContact C-O 3.54Å; Y77-G95 WeakPolarHBondContact CA-O 3.49Å; L78-G95 PolarHBondContact N-O 3.17Å; L78-G95 PolarHBondContact O-N 3.29Å; G95-I140 WeakPolarHBondContact O-CG2 3.4Å
96	Y	92.4	Very high	90.8	Very high	71 Å²	71	55.3 Å²	55.3	28%	0.278	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	150.2	164.6	79.6	-81.7	0	0	0	109.9	I76 H98 C110 I140	I76-Y96 CarbonylContact O-C 3.58Å; I76-Y96 WeakPolarHBondContact O-CA 3.21Å; I76-Y96 WeakPolarHBondContact O-CB 3.48Å; Y96-H98 AromaticContact CE2-NE2 3.83Å; Y96-C110 PolarHBondContact N-SG 2.93Å; Y96-C110 PolarHBondContact O-SG 2.79Å; Y96-C110 VanDerWaalsContact O-SG 3.4Å; Y96-I140 WeakPolarHBondContact CD1-O 3.39Å
97	C	92.8	Very high	91.3	Very high	12 Å²	12	55.2 Å²	55.2	8%	0.081	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	153.5	172.1	58	0	0	0	0	110	K75 I76 I108 C110	K75-C97 CarbonylContact C-O 3.6Å; K75-C97 WeakPolarHBondContact CA-O 3.45Å; I76-C97 PolarHBondContact N-O 3.26Å; I76-C97 PolarHBondContact O-N 3.42Å; C97-I108 HydrophobicContact CB-CG2 3.87Å; C97-C110 HydrophobicContact CB-CB 4.35Å
98	H	92.8	Very high	91.9	Very high	102 Å²	102	54.6 Å²	54.6	47%	0.472	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	140.5	172.5	-71.9	-102.4	0	0	0	109.3	K75 Y96	K75-H98 WeakPolarHBondContact CE-CE1 3.32Å; Y96-H98 AromaticContact CE2-NE2 3.83Å
99	V	94.4	Very high	92.4	Very high	3 Å²	3	50.9 Å²	50.9	2%	0.018	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-65.6	134.6	170	175.6	0	0	0	0	108	I6 W73 P74 I76 S101 I163	I6-V99 HydrophobicContact CD1-CB 4.45Å; I6-V99 HydrophobicContact CD1-CG1 3.82Å; I6-V99 HydrophobicContact CD1-CG2 3.92Å; I6-V99 HydrophobicContact CG1-CG1 3.94Å; I6-V99 HydrophobicContact CG2-CG1 4.49Å; W73-V99 PolarHBondContact NE1-O 2.82Å; P74-V99 HydrophobicContact CB-CB 4.16Å; P74-V99 HydrophobicContact CB-CG2 3.79Å; P74-V99 WeakPolarHBondContact O-CB 3.27Å; P74-V99 WeakPolarHBondContact O-CG2 3.16Å; P74-V99 PolarHBondContact O-N 3.1Å; I76-V99 HydrophobicContact CD1-CG2 3.91Å; I76-V99 HydrophobicContact CG1-CG2 3.92Å; V99-S101 PolarHBondContact O-N 3.49Å; V99-I163 HydrophobicContact CG1-CD1 3.58Å
100	P	94.3	Very high	92.8	Very high	21 Å²	21	48.2 Å²	48.2	14%	0.136	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-58.2	137.3	179.2	-23.4	32.4	0	0	0	111.7	S102 H106 I108 I163	P100-S102 VanDerWaalsContact C-N 3.33Å; P100-H106 HydrophobicContact CB-CB 4.32Å; P100-H106 HydrophobicContact CG-CB 3.62Å; P100-I108 HydrophobicContact CG-CD1 3.7Å; P100-I108 HydrophobicContact CG-CG1 4.44Å; P100-I163 HydrophobicContact CB-CG1 4.12Å; P100-I163 HydrophobicContact CG-CG1 4.25Å
101	S	90.8	Very high	93	Very high	92 Å²	92	49.5 Å²	49.5	64%	0.643	27%	0.272	S	S	*	.	S	Bend	trans	-90.2	5	-179.3	58.7	0	0	0	0	113.8	V99 M165	V99-S101 PolarHBondContact O-N 3.49Å; S101-M165 WeakPolarHBondContact O-CE 3.43Å
102	S	91.1	Very high	93.3	Very high	54 Å²	54	48.8 Å²	48.8	38%	0.378	27%	0.268	S	S	.	.	S	Bend	trans	-114	137	177.3	53.9	0	0	0	0	110.4	P100 H106	P100-S102 VanDerWaalsContact C-N 3.33Å; S102-H106 PolarHBondContact O-NE2 2.89Å; S102-H106 PolarHBondContact OG-CE1 2.92Å; S102-H106 PolarHBondContact OG-NE2 3.45Å
103	P	94	Very high	93.2	Very high	76 Å²	76	48.2 Å²	48.2	49%	0.494	27%	0.266	S	S	.	.	S	Bend	trans	-57.9	149.7	171.9	-21.2	32.2	0	0	0	112.2	I163 M165	P103-I163 CarbonylContact C-O 3.56Å; P103-I163 WeakPolarHBondContact CA-O 3.47Å; P103-M165 HydrophobicContact CG-CB 4.14Å; P103-M165 HydrophobicContact CG-CG 4.08Å; P103-M165 HydrophobicContact CG-SD 4.25Å
104	G	94.9	Very high	93.1	Very high	37 Å²	37	51.8 Å²	51.8	38%	0.381	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.3	-169.2	176.7	0	0	0	0	0	114	H106 G162 I163	G104-H106 PolarHBondContact O-CD2 2.86Å; G104-H106 VanDerWaalsContact O-CD2 3.23Å; G104-G162 WeakPolarHBondContact O-CA 3.14Å; G104-I163 PolarHBondContact N-O 3.15Å; G104-I163 PolarHBondContact O-N 2.98Å
105	H	96.8	Very high	92.4	Very high	122 Å²	122	52.3 Å²	52.3	57%	0.565	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.2	-178.7	-168.3	79.8	0	0	0	110.9	E160	H105-E160 WeakPolarHBondContact CE1-CG 3.19Å; H105-E160 IonicContact CE1-OE1 3.15Å; H105-E160 PolarHBondContact CE1-OE1 2.84Å; H105-E160 IonicContact CE1-OE2 3.01Å; H105-E160 PolarHBondContact CE1-OE2 3.26Å; H105-E160 WeakPolarHBondContact NE2-CG 3.44Å; H105-E160 IonicContact NE2-OE1 3.41Å; H105-E160 IonicContact NE2-OE2 3.9Å; H105-E160 PolarHBondContact NE2-OE2 2.67Å
106	H	97.4	Very high	91.4	Very high	43 Å²	43	55.4 Å²	55.4	20%	0.199	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	133.5	-174.2	-62.5	-83.3	0	0	0	110.8	P100 S102 G104 I108 E160 L161	P100-H106 HydrophobicContact CB-CB 4.32Å; P100-H106 HydrophobicContact CG-CB 3.62Å; S102-H106 PolarHBondContact O-NE2 2.89Å; S102-H106 PolarHBondContact OG-CE1 2.92Å; S102-H106 PolarHBondContact OG-NE2 3.45Å; G104-H106 PolarHBondContact O-CD2 2.86Å; G104-H106 VanDerWaalsContact O-CD2 3.23Å; H106-I108 HydrophobicContact CB-CG1 4.5Å; H106-E160 CarbonylContact O-C 3.57Å; H106-E160 WeakPolarHBondContact O-CA 3.18Å; H106-L161 PolarHBondContact N-O 3.33Å; H106-L161 PolarHBondContact O-N 3.33Å
107	R	97.3	Very high	89.9	Confident	170 Å²	170	52.7 Å²	52.7	64%	0.642	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.4	168.9	-170.6	172.9	174	162.6	0	109.2	E158 L159	R107-E158 IonicContact CZ-OE2 3.61Å; R107-E158 IonicContact NE-OE2 2.92Å; R107-E158 PolarHBondContact NE-OE2 2.86Å; R107-E158 VanDerWaalsContact NE-OE2 3.1Å; R107-E158 IonicContact NH2-OE2 3.74Å; R107-E158 PolarHBondContact NH2-OE2 2.81Å; R107-L159 WeakPolarHBondContact CA-O 3.44Å
108	I	96.7	Very high	88.2	Confident	27 Å²	27	55 Å²	55	14%	0.138	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	120.9	-172.4	-53.5	174.7	0	0	0	109	C97 P100 H106 L159 L161	C97-I108 HydrophobicContact CB-CG2 3.87Å; P100-I108 HydrophobicContact CG-CD1 3.7Å; P100-I108 HydrophobicContact CG-CG1 4.44Å; H106-I108 HydrophobicContact CB-CG1 4.5Å; I108-L159 HydrophobicContact CB-CB 4.38Å; I108-L159 PolarHBondContact N-O 2.78Å; I108-L159 PolarHBondContact O-N 2.8Å; I108-L161 HydrophobicContact CD1-CD1 3.58Å; I108-L161 HydrophobicContact CD1-CG 4.24Å
109	S	96.8	Very high	86.1	Confident	76 Å²	76	58.8 Å²	58.8	53%	0.531	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	109.6	170.6	-58.4	0	0	0	0	109.1	E158	S109-E158 WeakPolarHBondContact CB-OE1 3.38Å; S109-E158 PolarHBondContact OG-OE1 2.72Å; S109-E158 PolarHBondContact OG-OE2 3.01Å
110	C	94.9	Very high	84	Confident	3 Å²	3	65.5 Å²	65.5	2%	0.02	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	106.2	-179.1	-173.9	0	0	0	0	110.3	L78 Y96 C97 T156 V157 L159	L78-C110 HydrophobicContact CD1-CB 3.91Å; Y96-C110 PolarHBondContact N-SG 2.93Å; Y96-C110 PolarHBondContact O-SG 2.79Å; Y96-C110 VanDerWaalsContact O-SG 3.4Å; C97-C110 HydrophobicContact CB-CB 4.35Å; C110-T156 WeakPolarHBondContact O-CA 3.31Å; C110-V157 HydrophobicContact CB-CB 4.48Å; C110-V157 PolarHBondContact N-O 3.27Å; C110-V157 PolarHBondContact O-N 3.34Å; C110-L159 HydrophobicContact CB-CD1 3.83Å
111	V	93.4	Very high	82.2	Confident	92 Å²	92	69.3 Å²	69.3	56%	0.558	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	132	176.8	-177	0	0	0	0	109.8
112	T	91.8	Very high	80.3	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.006	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	155.8	-179.8	70	0	0	0	0	112.3	F16 V80 Y94 M154 G155 V157	F16-T112 WeakPolarHBondContact CE1-OG1 3.26Å; F16-T112 HydrophobicContact CZ-CG2 4.07Å; F16-T112 WeakPolarHBondContact CZ-OG1 3.29Å; V80-T112 HydrophobicContact CG2-CG2 4.16Å; Y94-T112 CarbonylContact O-C 3.58Å; Y94-T112 VanDerWaalsContact O-CA 3.23Å; Y94-T112 WeakPolarHBondContact O-CA 3.44Å; Y94-T112 WeakPolarHBondContact O-CB 3.29Å; T112-M154 PolarHBondContact O-N 3.16Å; T112-G155 WeakPolarHBondContact CB-O 3.37Å; T112-G155 PolarHBondContact N-O 3.49Å; T112-G155 PolarHBondContact OG1-N 3.19Å; T112-G155 PolarHBondContact OG1-O 3.48Å; T112-V157 HydrophobicContact CG2-CG2 3.86Å
113	W	87.5	Confident	78.2	Confident	4 Å²	4	69.9 Å²	69.9	2%	0.015	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	154.2	-178.3	60.3	-84.8	0	0	0	110.5	G93 Y94 L134 R146 L149 T151 E152	G93-W113 CarbonylContact C-O 3.58Å; G93-W113 WeakPolarHBondContact CA-O 3.44Å; Y94-W113 PolarHBondContact N-O 2.93Å; Y94-W113 PolarHBondContact O-N 2.86Å; Y94-W113 PolarHBondContact O-NE1 2.51Å; W113-L134 HydrophobicContact CH2-CD1 3.97Å; W113-R146 VanDerWaalsContact CD1-NH1 3.32Å; W113-R146 VanDerWaalsContact CG-CZ 3.46Å; W113-R146 HydrophobicContact CH2-CG 4.45Å; W113-L149 HydrophobicContact CH2-CD1 4.44Å; W113-L149 HydrophobicContact CZ3-CD1 4.32Å; W113-T151 HydrophobicContact CD2-CG2 4.43Å; W113-T151 HydrophobicContact CE3-CG2 3.49Å; W113-T151 VanDerWaalsContact CE3-CG2 3.49Å; W113-T151 HydrophobicContact CZ3-CG2 3.73Å; W113-E152 CarbonylContact C-O 3.59Å; W113-E152 VanDerWaalsContact CA-O 3.23Å; W113-E152 WeakPolarHBondContact CA-O 3.36Å
114	R	84.8	Confident	76.1	Confident	76 Å²	76	68.7 Å²	68.7	29%	0.287	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	146.3	171.1	64.5	174.2	177.5	-171.3	-1.4	111	Y92 L116 T151 E152 M154	Y92-R114 WeakPolarHBondContact O-CB 3.41Å; R114-L116 PolarHBondContact O-N 3.47Å; R114-T151 CarbonylContact O-C 3.57Å; R114-T151 VanDerWaalsContact O-CA 3.24Å; R114-T151 WeakPolarHBondContact O-CA 3.29Å; R114-E152 HydrophobicContact CG-CB 4.33Å; R114-E152 IonicContact CZ-OE2 2.74Å; R114-E152 VanDerWaalsContact CZ-OE2 3.3Å; R114-E152 PolarHBondContact N-O 2.8Å; R114-E152 IonicContact NE-OE2 3.87Å; R114-E152 PolarHBondContact NE-OE2 2.87Å; R114-E152 IonicContact NH2-OE2 2.72Å; R114-E152 PolarHBondContact NH2-OE2 2.88Å; R114-E152 PolarHBondContact O-N 2.74Å; R114-M154 HydrophobicContact CB-CG 4.21Å; R114-M154 VanDerWaalsContact CD-SD 3.59Å; R114-M154 HydrophobicContact CG-CE 4.48Å; R114-M154 HydrophobicContact CG-CG 3.77Å; R114-M154 HydrophobicContact CG-SD 3.9Å; R114-M154 VanDerWaalsContact CZ-CE 3.46Å; R114-M154 VanDerWaalsContact CZ-SD 3.56Å; R114-M154 PolarHBondContact NE-SD 3.46Å; R114-M154 VanDerWaalsContact NH1-CE 3.35Å
115	P	76.4	Confident	74.2	Confident	17 Å²	17	68.7 Å²	68.7	11%	0.11	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.2	168	28.8	-32.2	0	0	0	109.6	G117 H150	P115-G117 PolarHBondContact O-N 3.4Å; P115-H150 CarbonylContact C-O 3.58Å; P115-H150 WeakPolarHBondContact CA-O 3.22Å
116	L	67.6	Low	71.9	Confident	64 Å²	64	70.4 Å²	70.4	34%	0.335	35%	0.353	S	S	.	.			trans	-78.1	113.9	166.6	-69.2	168.7	0	0	0	107.3	R114 H150 E152	R114-L116 PolarHBondContact O-N 3.47Å; L116-H150 HydrophobicContact CB-CB 4.27Å; L116-H150 PolarHBondContact N-O 3.48Å; L116-E152 HydrophobicContact CD1-CB 4.02Å; L116-E152 HydrophobicContact CD2-CB 3.85Å; L116-E152 HydrophobicContact CG-CB 3.86Å
117	G	60.7	Low	69.2	Low	15 Å²	15	76.8 Å²	76.8	16%	0.155	38%	0.38	C	S	.	.			trans	-65.6	169.6	164.8	0	0	0	0	0	111.1	P115 E121 Q122	P115-G117 PolarHBondContact O-N 3.4Å; G117-E121 WeakPolarHBondContact CA-OE2 3.49Å; G117-Q122 PolarHBondContact O-NE2 3.01Å
118	S	58.4	Low	66.7	Low	61 Å²	61	74.5 Å²	74.5	43%	0.427	39%	0.385	S	S	.	.			trans	-58.7	154.1	170.5	62.7	0	0	0	0	111	Q120 E121 Q122	S118-Q120 PolarHBondContact O-N 2.75Å; S118-Q120 VanDerWaalsContact O-N 3.08Å; S118-E121 PolarHBondContact N-OE2 3.44Å; S118-E121 WeakPolarHBondContact O-CA 3.21Å; S118-E121 WeakPolarHBondContact O-CB 3.49Å; S118-E121 PolarHBondContact O-N 2.76Å; S118-E121 VanDerWaalsContact OG-CG 3.29Å; S118-E121 WeakPolarHBondContact OG-CG 3.15Å; S118-E121 PolarHBondContact OG-OE2 3.36Å; S118-Q122 PolarHBondContact O-N 3.01Å
119	W	47.6	Very low	64.1	Low	181 Å²	181	75.5 Å²	75.5	69%	0.686	40%	0.402	S	S	*	.	H	α-helix	trans	-58.2	-29.3	-174.7	99.5	-64.2	0	0	0	113.4	Q122 L123	W119-Q122 PolarHBondContact O-N 2.9Å; W119-L123 HydrophobicContact CD2-CD1 4.14Å; W119-L123 HydrophobicContact CE3-CD1 3.68Å; W119-L123 HydrophobicContact CH2-CD1 3.87Å; W119-L123 HydrophobicContact CZ2-CD1 4.3Å; W119-L123 HydrophobicContact CZ3-CD1 3.54Å; W119-L123 PolarHBondContact O-N 2.85Å
120	Q	50.8	Low	62	Low	143 Å²	143	74.4 Å²	74.4	67%	0.668	40%	0.403	S	S	*	.	H	α-helix	trans	-68.4	-38.7	175.1	-65.4	-179.1	-10.2	0	0	111.3	S118 L123 A124	S118-Q120 PolarHBondContact O-N 2.75Å; S118-Q120 VanDerWaalsContact O-N 3.08Å; Q120-L123 PolarHBondContact O-N 3.12Å; Q120-A124 WeakPolarHBondContact O-CB 3.36Å; Q120-A124 PolarHBondContact O-N 2.83Å
121	E	55.5	Low	59.9	Low	101 Å²	101	75 Å²	75	47%	0.472	41%	0.41	S	S	.	.	H	α-helix	trans	-69.5	-35.3	174.6	-67.2	165.5	150.9	0	0	111	G117 S118 A124 Q125	G117-E121 WeakPolarHBondContact CA-OE2 3.49Å; S118-E121 PolarHBondContact N-OE2 3.44Å; S118-E121 WeakPolarHBondContact O-CA 3.21Å; S118-E121 WeakPolarHBondContact O-CB 3.49Å; S118-E121 PolarHBondContact O-N 2.76Å; S118-E121 VanDerWaalsContact OG-CG 3.29Å; S118-E121 WeakPolarHBondContact OG-CG 3.15Å; S118-E121 PolarHBondContact OG-OE2 3.36Å; E121-A124 PolarHBondContact O-N 2.96Å; E121-Q125 VanDerWaalsContact O-CB 3.32Å; E121-Q125 WeakPolarHBondContact O-CB 3.2Å; E121-Q125 VanDerWaalsContact O-CD 3.25Å; E121-Q125 WeakPolarHBondContact O-CG 3.16Å; E121-Q125 PolarHBondContact O-N 3Å; E121-Q125 PolarHBondContact O-NE2 2.83Å
122	Q	52.3	Low	57.9	Low	80 Å²	80	73 Å²	73	37%	0.374	40%	0.398	S	S	.	.	H	α-helix	trans	-66	-39.3	174.5	-66.5	178.4	-12	0	0	112.5	G117 S118 W119 Q125 M126	G117-Q122 PolarHBondContact O-NE2 3.01Å; S118-Q122 PolarHBondContact O-N 3.01Å; W119-Q122 PolarHBondContact O-N 2.9Å; Q122-Q125 WeakPolarHBondContact O-CB 3.45Å; Q122-Q125 PolarHBondContact O-N 3.08Å; Q122-M126 PolarHBondContact O-N 2.8Å
123	L	46	Very low	56.1	Low	78 Å²	78	78.2 Å²	78.2	41%	0.408	42%	0.423	S	S	.	.	H	α-helix	trans	-67.5	-42.6	173.9	-101.1	149.3	0	0	0	112.2	W119 Q120 Q125 M126 F127	W119-L123 HydrophobicContact CD2-CD1 4.14Å; W119-L123 HydrophobicContact CE3-CD1 3.68Å; W119-L123 HydrophobicContact CH2-CD1 3.87Å; W119-L123 HydrophobicContact CZ2-CD1 4.3Å; W119-L123 HydrophobicContact CZ3-CD1 3.54Å; W119-L123 PolarHBondContact O-N 2.85Å; Q120-L123 PolarHBondContact O-N 3.12Å; L123-Q125 VanDerWaalsContact C-N 3.33Å; L123-Q125 PolarHBondContact O-N 2.88Å; L123-M126 PolarHBondContact O-N 2.98Å; L123-F127 PolarHBondContact O-N 2.96Å
124	A	49.9	Very low	54.4	Low	52 Å²	52	79.2 Å²	79.2	43%	0.43	43%	0.428	S	S	.	.	H	α-helix	trans	-64.8	-36.4	174.4	0	0	0	0	0	112.3	Q120 E121 M126 F127 V128	Q120-A124 WeakPolarHBondContact O-CB 3.36Å; Q120-A124 PolarHBondContact O-N 2.83Å; E121-A124 PolarHBondContact O-N 2.96Å; A124-M126 PolarHBondContact O-N 3.02Å; A124-F127 PolarHBondContact O-N 2.86Å; A124-V128 WeakPolarHBondContact O-CB 3.38Å; A124-V128 PolarHBondContact O-N 2.88Å
125	Q	55.7	Low	52.9	Low	36 Å²	36	87.7 Å²	87.7	17%	0.168	46%	0.46	C	S	.	.	H	α-helix	trans	-60.6	-41.1	174.1	-80	161.8	54.2	0	0	113	E121 Q122 L123 F127 G129 G130 P132	E121-Q125 VanDerWaalsContact O-CB 3.32Å; E121-Q125 WeakPolarHBondContact O-CB 3.2Å; E121-Q125 VanDerWaalsContact O-CD 3.25Å; E121-Q125 WeakPolarHBondContact O-CG 3.16Å; E121-Q125 PolarHBondContact O-N 3Å; E121-Q125 PolarHBondContact O-NE2 2.83Å; Q122-Q125 WeakPolarHBondContact O-CB 3.45Å; Q122-Q125 PolarHBondContact O-N 3.08Å; L123-Q125 VanDerWaalsContact C-N 3.33Å; L123-Q125 PolarHBondContact O-N 2.88Å; Q125-F127 VanDerWaalsContact C-N 3.27Å; Q125-F127 PolarHBondContact O-N 3.09Å; Q125-G129 WeakPolarHBondContact O-CA 3.34Å; Q125-G129 PolarHBondContact O-N 3.2Å; Q125-G129 VanDerWaalsContact O-N 3.11Å; Q125-G130 WeakPolarHBondContact CG-O 3.46Å; Q125-P132 VanDerWaalsContact CD-CD 3.46Å
126	M	49	Very low	51.8	Low	159 Å²	159	90.1 Å²	90.1	78%	0.783	47%	0.472	S	S	*	.	H	α-helix	trans	-68	-28.6	179.1	-164	-177.1	-64.6	0	0	112.1	Q122 L123 A124	Q122-M126 PolarHBondContact O-N 2.8Å; L123-M126 PolarHBondContact O-N 2.98Å; A124-M126 PolarHBondContact O-N 3.02Å
127	F	40	Very low	51.4	Low	176 Å²	176	90.1 Å²	90.1	77%	0.772	48%	0.476	S	S	*	.	H	α-helix	trans	-96	-34.5	-177.5	-98.5	-92.1	0	0	0	115.1	L123 A124 Q125	L123-F127 PolarHBondContact O-N 2.96Å; A124-F127 PolarHBondContact O-N 2.86Å; Q125-F127 VanDerWaalsContact C-N 3.27Å; Q125-F127 PolarHBondContact O-N 3.09Å
128	V	45.1	Very low	51.2	Low	122 Å²	122	92.8 Å²	92.8	74%	0.739	49%	0.487	S	S	*	.	H	α-helix	trans	-111.6	-21.2	-171.2	-174.9	0	0	0	0	112.6	A124	A124-V128 WeakPolarHBondContact O-CB 3.38Å; A124-V128 PolarHBondContact O-N 2.88Å
129	G	42.2	Very low	51.2	Low	48 Å²	48	91.7 Å²	91.7	50%	0.495	48%	0.476	S	S	.	.			trans	75.7	146.5	-171.5	0	0	0	0	0	112.6	Q125	Q125-G129 WeakPolarHBondContact O-CA 3.34Å; Q125-G129 PolarHBondContact O-N 3.2Å; Q125-G129 VanDerWaalsContact O-N 3.11Å
130	G	51.7	Low	51.8	Low	53 Å²	53	83.1 Å²	83.1	55%	0.546	44%	0.444	S	S	.	.			trans	106.1	96.5	-178.4	0	0	0	0	0	113.1	Q125	Q125-G130 WeakPolarHBondContact CG-O 3.46Å
131	G	50.8	Low	52.2	Low	17 Å²	17	77.7 Å²	77.7	18%	0.175	42%	0.417	C	S	.	.			trans	-76.1	161.2	174.8	0	0	0	0	0	113.3	Q133	G131-Q133 PolarHBondContact O-N 3.09Å
132	P	51.3	Low	52.3	Low	48 Å²	48	75.1 Å²	75.1	31%	0.312	41%	0.411	S	S	.	.			trans	-59.2	113.2	172.6	24	-33.8	0	0	0	109.1	Q125	Q125-P132 VanDerWaalsContact CD-CD 3.46Å
133	Q	54.7	Low	52.5	Low	111 Å²	111	73.3 Å²	73.3	52%	0.519	41%	0.413	S	S	.	.			trans	-92.8	143.6	172.1	-65.1	178.6	14.2	0	0	108.6	L91 G131 R135	L91-Q133 HydrophobicContact CD2-CG 4.21Å; G131-Q133 PolarHBondContact O-N 3.09Å; Q133-R135 PolarHBondContact O-N 2.83Å; Q133-R135 VanDerWaalsContact O-N 3.12Å
134	L	52.2	Low	52.8	Low	25 Å²	25	72.6 Å²	72.6	13%	0.131	42%	0.419	C	S	.	.			trans	-60.8	119.1	171.7	-71.6	168.8	0	0	0	108.4	Y94 W113 N136 L139 I140 L149	Y94-L134 HydrophobicContact CD1-CD1 4.37Å; Y94-L134 HydrophobicContact CD2-CD1 3.53Å; Y94-L134 HydrophobicContact CD2-CG 4.06Å; Y94-L134 HydrophobicContact CE1-CD1 4.34Å; Y94-L134 HydrophobicContact CE2-CB 4.12Å; Y94-L134 HydrophobicContact CE2-CD1 3.46Å; Y94-L134 VanDerWaalsContact CE2-CD1 3.46Å; Y94-L134 HydrophobicContact CE2-CG 3.52Å; Y94-L134 HydrophobicContact CG-CD1 3.97Å; Y94-L134 PolarHBondContact OH-N 3.25Å; W113-L134 HydrophobicContact CH2-CD1 3.97Å; L134-N136 PolarHBondContact O-N 2.84Å; L134-L139 HydrophobicContact CD1-CB 4.26Å; L134-L139 HydrophobicContact CD2-CB 4.19Å; L134-L139 HydrophobicContact CD2-CD1 3.93Å; L134-I140 HydrophobicContact CD1-CD1 4.48Å; L134-I140 HydrophobicContact CD1-CG1 3.58Å; L134-L149 HydrophobicContact CD2-CD1 3.97Å
135	R	52.3	Low	53.1	Low	254 Å²	254	73 Å²	73	96%	0.958	41%	0.413	S	S	*	.	S	Bend	trans	-61.3	-28.7	175.2	-73.7	-174.6	176.1	-177.7	0.6	112.3	Q133	Q133-R135 PolarHBondContact O-N 2.83Å; Q133-R135 VanDerWaalsContact O-N 3.12Å
136	N	54.8	Low	53.2	Low	69 Å²	69	75.2 Å²	75.2	37%	0.369	42%	0.42	S	S	.	.			trans	-119.7	113.5	173.6	-169.4	-9.1	0	0	0	110	L134 D138 L139	L134-N136 PolarHBondContact O-N 2.84Å; N136-D138 PolarHBondContact ND2-OD2 2.85Å; N136-D138 PolarHBondContact O-N 2.87Å; N136-D138 VanDerWaalsContact O-N 3.13Å; N136-D138 VanDerWaalsContact OD1-CB 3.22Å; N136-D138 WeakPolarHBondContact OD1-CB 3.04Å; N136-D138 PolarHBondContact OD1-N 3.01Å; N136-D138 PolarHBondContact OD1-OD2 3.5Å; N136-L139 HydrophobicContact CB-CD1 4.26Å; N136-L139 HydrophobicContact CB-CG 4.31Å; N136-L139 WeakPolarHBondContact O-CB 3.35Å; N136-L139 PolarHBondContact O-N 3.38Å
137	P	58.1	Low	53.7	Low	64 Å²	64	75.6 Å²	75.6	42%	0.416	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-60.9	-17.7	175.1	26.4	-34.6	0	0	0	112.8	L139 I140	P137-L139 PolarHBondContact O-N 2.85Å; P137-I140 HydrophobicContact CB-CD1 4.25Å; P137-I140 VanDerWaalsContact O-CB 3.29Å; P137-I140 WeakPolarHBondContact O-CB 3.32Å; P137-I140 WeakPolarHBondContact O-CD1 3.42Å; P137-I140 VanDerWaalsContact O-CG1 3.25Å; P137-I140 WeakPolarHBondContact O-CG1 2.98Å; P137-I140 PolarHBondContact O-N 2.92Å
138	D	57.5	Low	54.8	Low	70 Å²	70	75 Å²	75	37%	0.374	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-64.4	-24.6	178.1	-56.5	-20.3	0	0	0	113.3	N136 I140 Y141 S142	N136-D138 PolarHBondContact ND2-OD2 2.85Å; N136-D138 PolarHBondContact O-N 2.87Å; N136-D138 VanDerWaalsContact O-N 3.13Å; N136-D138 VanDerWaalsContact OD1-CB 3.22Å; N136-D138 WeakPolarHBondContact OD1-CB 3.04Å; N136-D138 PolarHBondContact OD1-N 3.01Å; N136-D138 PolarHBondContact OD1-OD2 3.5Å; D138-I140 PolarHBondContact O-N 3.18Å; D138-Y141 VanDerWaalsContact CA-CE1 3.47Å; D138-Y141 VanDerWaalsContact CA-CZ 3.42Å; D138-Y141 HydrophobicContact CB-CE1 4.27Å; D138-Y141 HydrophobicContact CB-CE2 4.17Å; D138-Y141 WeakPolarHBondContact CB-OH 3.39Å; D138-Y141 PolarHBondContact O-N 3.47Å; D138-Y141 PolarHBondContact OD1-OH 3.37Å; D138-S142 WeakPolarHBondContact O-CB 3.36Å; D138-S142 PolarHBondContact O-N 2.98Å
139	L	58	Low	55.9	Low	39 Å²	39	72.2 Å²	72.2	20%	0.204	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-65.3	-19	175.2	-67.5	170.6	0	0	0	113	L134 N136 P137 Y141 D145	L134-L139 HydrophobicContact CD1-CB 4.26Å; L134-L139 HydrophobicContact CD2-CB 4.19Å; L134-L139 HydrophobicContact CD2-CD1 3.93Å; N136-L139 HydrophobicContact CB-CD1 4.26Å; N136-L139 HydrophobicContact CB-CG 4.31Å; N136-L139 WeakPolarHBondContact O-CB 3.35Å; N136-L139 PolarHBondContact O-N 3.38Å; P137-L139 PolarHBondContact O-N 2.85Å; L139-Y141 VanDerWaalsContact C-N 3.31Å; L139-Y141 PolarHBondContact O-N 3.03Å; L139-D145 HydrophobicContact CD2-CB 3.33Å
140	I	59.5	Low	57.3	Low	1 Å²	1	77.2 Å²	77.2	1%	0.005	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-67	-37.7	179.7	-59.2	166.1	0	0	0	110.1	Q79 Y94 G95 Y96 L134 P137 D138	Q79-I140 HydrophobicContact CG-CD1 4.36Å; Y94-I140 HydrophobicContact CD1-CD1 3.42Å; Y94-I140 VanDerWaalsContact CD1-CD1 3.42Å; Y94-I140 HydrophobicContact CD1-CG1 3.75Å; Y94-I140 HydrophobicContact CE1-CD1 3.7Å; Y94-I140 HydrophobicContact CE1-CG1 4.26Å; Y94-I140 HydrophobicContact CG-CD1 4.22Å; Y94-I140 HydrophobicContact CG-CG1 4.04Å; G95-I140 WeakPolarHBondContact O-CG2 3.4Å; Y96-I140 WeakPolarHBondContact CD1-O 3.39Å; L134-I140 HydrophobicContact CD1-CD1 4.48Å; L134-I140 HydrophobicContact CD1-CG1 3.58Å; P137-I140 HydrophobicContact CB-CD1 4.25Å; P137-I140 VanDerWaalsContact O-CB 3.29Å; P137-I140 WeakPolarHBondContact O-CB 3.32Å; P137-I140 WeakPolarHBondContact O-CD1 3.42Å; P137-I140 VanDerWaalsContact O-CG1 3.25Å; P137-I140 WeakPolarHBondContact O-CG1 2.98Å; P137-I140 PolarHBondContact O-N 2.92Å; D138-I140 PolarHBondContact O-N 3.18Å
141	Y	59.1	Low	58.6	Low	29 Å²	29	77.1 Å²	77.1	11%	0.114	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-12	-175.8	56	-101.5	0	0	0	114.2	H28 K75 Y77 D138 L139	H28-Y141 HydrophobicContact CB-CD1 4.02Å; H28-Y141 HydrophobicContact CB-CD2 4.34Å; H28-Y141 HydrophobicContact CB-CE1 4Å; H28-Y141 HydrophobicContact CB-CE2 4.33Å; H28-Y141 HydrophobicContact CB-CG 4.17Å; H28-Y141 AromaticContact CD2-CD2 3.65Å; H28-Y141 AromaticContact CD2-CE2 3.49Å; H28-Y141 VanDerWaalsContact CD2-CE2 3.49Å; H28-Y141 WeakPolarHBondContact CD2-CE2 3.27Å; H28-Y141 AromaticContact CE1-CE2 3.32Å; H28-Y141 WeakPolarHBondContact CE1-CE2 3.05Å; H28-Y141 AromaticContact CE1-CZ 3.45Å; H28-Y141 VanDerWaalsContact CE1-CZ 3.45Å; H28-Y141 PolarHBondContact CE1-OH 3.17Å; H28-Y141 AromaticContact CG-CD2 3.79Å; H28-Y141 AromaticContact CG-CE1 3.88Å; H28-Y141 AromaticContact CG-CE2 3.48Å; H28-Y141 VanDerWaalsContact CG-CE2 3.48Å; H28-Y141 AromaticContact CG-CZ 3.5Å; H28-Y141 VanDerWaalsContact CG-CZ 3.5Å; H28-Y141 AromaticContact ND1-CE1 3.78Å; H28-Y141 AromaticContact ND1-CE2 3.39Å; H28-Y141 WeakPolarHBondContact ND1-CE2 3.46Å; H28-Y141 AromaticContact ND1-CZ 3.13Å; H28-Y141 PolarHBondContact ND1-OH 3.3Å; H28-Y141 AromaticContact NE2-CD2 3.97Å; H28-Y141 AromaticContact NE2-CE2 3.4Å; H28-Y141 WeakPolarHBondContact NE2-CE2 3.29Å; H28-Y141 AromaticContact NE2-CZ 3.98Å; K75-Y141 PolarHBondContact NZ-O 2.79Å; Y77-Y141 HydrophobicContact CD1-CD1 4.26Å; D138-Y141 VanDerWaalsContact CA-CE1 3.47Å; D138-Y141 VanDerWaalsContact CA-CZ 3.42Å; D138-Y141 HydrophobicContact CB-CE1 4.27Å; D138-Y141 HydrophobicContact CB-CE2 4.17Å; D138-Y141 WeakPolarHBondContact CB-OH 3.39Å; D138-Y141 PolarHBondContact O-N 3.47Å; D138-Y141 PolarHBondContact OD1-OH 3.37Å; L139-Y141 VanDerWaalsContact C-N 3.31Å; L139-Y141 PolarHBondContact O-N 3.03Å
142	S	58.8	Low	60.1	Low	47 Å²	47	79.9 Å²	79.9	33%	0.329	39%	0.394	S	S	.	.			trans	-91.3	89.2	168	-174.6	0	0	0	0	109.1	D138 A144	D138-S142 WeakPolarHBondContact O-CB 3.36Å; D138-S142 PolarHBondContact O-N 2.98Å; S142-A144 PolarHBondContact O-N 3.47Å
143	G	55.8	Low	61.8	Low	41 Å²	41	82.7 Å²	82.7	42%	0.423	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-60	-9.2	177.8	0	0	0	0	0	114.6	D145 R146	G143-D145 VanDerWaalsContact C-N 3.29Å; G143-D145 PolarHBondContact O-N 2.93Å; G143-R146 PolarHBondContact O-N 2.87Å
144	A	53.4	Low	63.4	Low	64 Å²	64	78.6 Å²	78.6	53%	0.529	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-65.1	-23.9	-174.7	0	0	0	0	0	114.4	S142 Y147	S142-A144 PolarHBondContact O-N 3.47Å; A144-Y147 WeakPolarHBondContact O-CD1 3.47Å; A144-Y147 WeakPolarHBondContact O-CE1 3.37Å
145	D	54.3	Low	65.4	Low	59 Å²	59	77.5 Å²	77.5	32%	0.316	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-111.3	-3.5	179	-81	-51.7	0	0	0	112.8	L139 G143 Y147 R148	L139-D145 HydrophobicContact CD2-CB 3.33Å; G143-D145 VanDerWaalsContact C-N 3.29Å; G143-D145 PolarHBondContact O-N 2.93Å; D145-Y147 VanDerWaalsContact C-N 3.27Å; D145-Y147 PolarHBondContact O-N 2.77Å; D145-R148 PolarHBondContact O-N 3Å; D145-R148 IonicContact OD1-CZ 3.66Å; D145-R148 IonicContact OD1-NE 3.98Å; D145-R148 IonicContact OD1-NH1 2.83Å; D145-R148 PolarHBondContact OD1-NH1 2.91Å
146	R	59.4	Low	67.4	Low	84 Å²	84	67.1 Å²	67.1	32%	0.317	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-63.4	-31.7	179.9	-174.8	175.1	173.9	-179.8	-2	112.5	W113 G143 R148 L149 T151	W113-R146 VanDerWaalsContact CD1-NH1 3.32Å; W113-R146 VanDerWaalsContact CG-CZ 3.46Å; W113-R146 HydrophobicContact CH2-CG 4.45Å; G143-R146 PolarHBondContact O-N 2.87Å; R146-R148 PolarHBondContact O-N 3.06Å; R146-R148 VanDerWaalsContact O-N 3.15Å; R146-L149 PolarHBondContact O-N 2.87Å; R146-T151 HydrophobicContact CG-CG2 4.46Å
147	Y	59.4	Low	69.4	Low	167 Å²	167	63.9 Å²	63.9	66%	0.655	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-63.9	-19.1	179.5	73.4	-100.6	0	0	0	113.5	A144 D145 L149	A144-Y147 WeakPolarHBondContact O-CD1 3.47Å; A144-Y147 WeakPolarHBondContact O-CE1 3.37Å; D145-Y147 VanDerWaalsContact C-N 3.27Å; D145-Y147 PolarHBondContact O-N 2.77Å; Y147-L149 VanDerWaalsContact C-N 3.3Å
148	R	62.9	Low	71.3	Confident	164 Å²	164	61.9 Å²	61.9	62%	0.619	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-83	-11	177.7	-61.6	178.5	168.4	163.6	-11.6	112.6	D145 R146	D145-R148 PolarHBondContact O-N 3Å; D145-R148 IonicContact OD1-CZ 3.66Å; D145-R148 IonicContact OD1-NE 3.98Å; D145-R148 IonicContact OD1-NH1 2.83Å; D145-R148 PolarHBondContact OD1-NH1 2.91Å; R146-R148 PolarHBondContact O-N 3.06Å; R146-R148 VanDerWaalsContact O-N 3.15Å
149	L	67.9	Low	73.2	Confident	62 Å²	62	58.6 Å²	58.6	33%	0.325	30%	0.302	S	S	.	.	S	Bend	trans	-102.2	133.3	-177.7	-59.3	175.4	0	0	0	109.6	W113 L134 R146 Y147 T151	W113-L149 HydrophobicContact CH2-CD1 4.44Å; W113-L149 HydrophobicContact CZ3-CD1 4.32Å; L134-L149 HydrophobicContact CD2-CD1 3.97Å; R146-L149 PolarHBondContact O-N 2.87Å; Y147-L149 VanDerWaalsContact C-N 3.3Å; L149-T151 HydrophobicContact CB-CG2 3.9Å; L149-T151 PolarHBondContact O-N 2.9Å
150	H	71.8	Confident	75.1	Confident	154 Å²	154	59.2 Å²	59.2	71%	0.713	30%	0.304	S	S	*	.			trans	-71.8	123.3	160.8	-72.6	75	0	0	0	106.9	P115 L116	P115-H150 CarbonylContact C-O 3.58Å; P115-H150 WeakPolarHBondContact CA-O 3.22Å; L116-H150 HydrophobicContact CB-CB 4.27Å; L116-H150 PolarHBondContact N-O 3.48Å
151	T	78.8	Confident	77	Confident	50 Å²	50	59.1 Å²	59.1	31%	0.307	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.4	-176.8	65.2	0	0	0	0	110.9	W113 R114 R146 L149	W113-T151 HydrophobicContact CD2-CG2 4.43Å; W113-T151 HydrophobicContact CE3-CG2 3.49Å; W113-T151 VanDerWaalsContact CE3-CG2 3.49Å; W113-T151 HydrophobicContact CZ3-CG2 3.73Å; R114-T151 CarbonylContact O-C 3.57Å; R114-T151 VanDerWaalsContact O-CA 3.24Å; R114-T151 WeakPolarHBondContact O-CA 3.29Å; R146-T151 HydrophobicContact CG-CG2 4.46Å; L149-T151 HydrophobicContact CB-CG2 3.9Å; L149-T151 PolarHBondContact O-N 2.9Å
152	E	83.2	Confident	78.8	Confident	75 Å²	75	58.7 Å²	58.7	35%	0.35	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	142.5	172.7	-171.7	-178.1	-151.2	0	0	109.2	W113 R114 L116	W113-E152 CarbonylContact C-O 3.59Å; W113-E152 VanDerWaalsContact CA-O 3.23Å; W113-E152 WeakPolarHBondContact CA-O 3.36Å; R114-E152 HydrophobicContact CG-CB 4.33Å; R114-E152 IonicContact CZ-OE2 2.74Å; R114-E152 VanDerWaalsContact CZ-OE2 3.3Å; R114-E152 PolarHBondContact N-O 2.8Å; R114-E152 IonicContact NE-OE2 3.87Å; R114-E152 PolarHBondContact NE-OE2 2.87Å; R114-E152 IonicContact NH2-OE2 2.72Å; R114-E152 PolarHBondContact NH2-OE2 2.88Å; R114-E152 PolarHBondContact O-N 2.74Å; L116-E152 HydrophobicContact CD1-CB 4.02Å; L116-E152 HydrophobicContact CD2-CB 3.85Å; L116-E152 HydrophobicContact CG-CB 3.86Å
153	T	85.8	Confident	80.6	Confident	107 Å²	107	56.7 Å²	56.7	66%	0.656	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	136	171.6	49.5	0	0	0	0	110.2
154	M	88.9	Confident	82.5	Confident	25 Å²	25	59.2 Å²	59.2	12%	0.123	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	-133.5	174.6	-62.5	-67.1	-86.1	0	0	108.2	F16 P17 Y92 T112 R114	F16-M154 HydrophobicContact CD1-CB 4.14Å; F16-M154 HydrophobicContact CE1-CB 3.81Å; P17-M154 HydrophobicContact CG-CE 4.39Å; Y92-M154 HydrophobicContact CG-CE 4.35Å; Y92-M154 WeakPolarHBondContact O-CE 3.47Å; Y92-M154 WeakPolarHBondContact O-CG 3.38Å; T112-M154 PolarHBondContact O-N 3.16Å; R114-M154 HydrophobicContact CB-CG 4.21Å; R114-M154 VanDerWaalsContact CD-SD 3.59Å; R114-M154 HydrophobicContact CG-CE 4.48Å; R114-M154 HydrophobicContact CG-CG 3.77Å; R114-M154 HydrophobicContact CG-SD 3.9Å; R114-M154 VanDerWaalsContact CZ-CE 3.46Å; R114-M154 VanDerWaalsContact CZ-SD 3.56Å; R114-M154 PolarHBondContact NE-SD 3.46Å; R114-M154 VanDerWaalsContact NH1-CE 3.35Å
155	G	92.7	Very high	84.4	Confident	2 Å²	2	58.1 Å²	58.1	2%	0.021	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-170.1	177.4	0	0	0	0	0	113.9	S14 G15 F16 T112	S14-G155 CarbonylContact O-C 3.56Å; S14-G155 VanDerWaalsContact O-CA 3.26Å; S14-G155 WeakPolarHBondContact O-CA 3.48Å; G15-G155 WeakPolarHBondContact O-CA 3.42Å; F16-G155 VanDerWaalsContact CE2-CA 3.44Å; T112-G155 WeakPolarHBondContact CB-O 3.37Å; T112-G155 PolarHBondContact N-O 3.49Å; T112-G155 PolarHBondContact OG1-N 3.19Å; T112-G155 PolarHBondContact OG1-O 3.48Å
156	T	95.9	Very high	86.1	Confident	37 Å²	37	61.4 Å²	61.4	23%	0.227	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	138.2	179.3	-57.8	0	0	0	0	110	A13 S14 C110	A13-T156 WeakPolarHBondContact CA-O 3.43Å; S14-T156 PolarHBondContact N-O 2.9Å; S14-T156 PolarHBondContact O-N 3.44Å; C110-T156 WeakPolarHBondContact O-CA 3.31Å
157	V	96.8	Very high	87.5	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.9	173	-179	0	0	0	0	109.2	I10 G12 A13 W57 L78 V80 C110 T112 L159	I10-V157 HydrophobicContact CG2-CG1 3.7Å; G12-V157 WeakPolarHBondContact O-CA 3.44Å; A13-V157 HydrophobicContact CB-CG2 4.23Å; W57-V157 HydrophobicContact CZ3-CG1 4Å; W57-V157 HydrophobicContact CZ3-CG2 4.46Å; L78-V157 HydrophobicContact CD1-CB 3.95Å; L78-V157 HydrophobicContact CD1-CG1 3.87Å; L78-V157 HydrophobicContact CD1-CG2 4.39Å; V80-V157 HydrophobicContact CG2-CG2 3.48Å; V80-V157 VanDerWaalsContact CG2-CG2 3.48Å; C110-V157 HydrophobicContact CB-CB 4.48Å; C110-V157 PolarHBondContact N-O 3.27Å; C110-V157 PolarHBondContact O-N 3.34Å; T112-V157 HydrophobicContact CG2-CG2 3.86Å; V157-L159 HydrophobicContact CG1-CD1 4.19Å
158	E	97.6	Very high	88.6	Confident	23 Å²	23	52.7 Å²	52.7	11%	0.107	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.8	179.1	-67.7	-70.8	125.2	0	0	110	I11 G12 M54 R107 S109	I11-E158 HydrophobicContact CB-CB 4.13Å; I11-E158 WeakPolarHBondContact CB-O 3.28Å; I11-E158 HydrophobicContact CD1-CB 4.28Å; I11-E158 PolarHBondContact N-O 3.34Å; G12-E158 PolarHBondContact O-N 2.82Å; M54-E158 HydrophobicContact CE-CB 4.37Å; M54-E158 HydrophobicContact CE-CG 4.37Å; R107-E158 IonicContact CZ-OE2 3.61Å; R107-E158 IonicContact NE-OE2 2.92Å; R107-E158 PolarHBondContact NE-OE2 2.86Å; R107-E158 VanDerWaalsContact NE-OE2 3.1Å; R107-E158 IonicContact NH2-OE2 3.74Å; R107-E158 PolarHBondContact NH2-OE2 2.81Å; S109-E158 WeakPolarHBondContact CB-OE1 3.38Å; S109-E158 PolarHBondContact OG-OE1 2.72Å; S109-E158 PolarHBondContact OG-OE2 3.01Å
159	L	97.8	Very high	89.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	149.9	175.6	-55	94.4	0	0	0	110.2	I10 I61 I76 L78 R107 I108 C110 V157	I10-L159 HydrophobicContact CG1-CD2 4.22Å; I61-L159 HydrophobicContact CD1-CD2 4.19Å; I76-L159 HydrophobicContact CD1-CD2 4.46Å; I76-L159 HydrophobicContact CG2-CD2 4.24Å; L78-L159 HydrophobicContact CD1-CD1 3.86Å; L78-L159 HydrophobicContact CD1-CD2 4.33Å; L78-L159 HydrophobicContact CD2-CD2 4.42Å; R107-L159 WeakPolarHBondContact CA-O 3.44Å; I108-L159 HydrophobicContact CB-CB 4.38Å; I108-L159 PolarHBondContact N-O 2.78Å; I108-L159 PolarHBondContact O-N 2.8Å; C110-L159 HydrophobicContact CB-CD1 3.83Å; V157-L159 HydrophobicContact CG1-CD1 4.19Å
160	E	98	Very high	89.1	Confident	52 Å²	52	55.2 Å²	55.2	24%	0.243	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	118.9	172.7	-178.4	174.6	87.4	0	0	108.5	G8 Q9 I11 H105 H106	G8-E160 CarbonylContact C-O 3.57Å; G8-E160 WeakPolarHBondContact CA-O 3.27Å; Q9-E160 HydrophobicContact CG-CB 4.12Å; Q9-E160 PolarHBondContact N-O 3.11Å; Q9-E160 PolarHBondContact NE2-OE1 3.46Å; Q9-E160 VanDerWaalsContact NE2-OE1 3.15Å; Q9-E160 PolarHBondContact O-N 3.5Å; I11-E160 HydrophobicContact CD1-CB 3.94Å; I11-E160 HydrophobicContact CG1-CB 4.18Å; H105-E160 WeakPolarHBondContact CE1-CG 3.19Å; H105-E160 IonicContact CE1-OE1 3.15Å; H105-E160 PolarHBondContact CE1-OE1 2.84Å; H105-E160 IonicContact CE1-OE2 3.01Å; H105-E160 PolarHBondContact CE1-OE2 3.26Å; H105-E160 WeakPolarHBondContact NE2-CG 3.44Å; H105-E160 IonicContact NE2-OE1 3.41Å; H105-E160 IonicContact NE2-OE2 3.9Å; H105-E160 PolarHBondContact NE2-OE2 2.67Å; H106-E160 CarbonylContact O-C 3.57Å; H106-E160 WeakPolarHBondContact O-CA 3.18Å
161	L	97.7	Very high	88.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	122.7	-173.9	-56.1	179.7	0	0	0	110.6	I6 I61 I76 H106 I108 I163	I6-L161 HydrophobicContact CG2-CD1 4.36Å; I6-L161 HydrophobicContact CG2-CD2 4.16Å; I61-L161 HydrophobicContact CD1-CD2 3.88Å; I61-L161 HydrophobicContact CG2-CD2 4.42Å; I76-L161 HydrophobicContact CD1-CD1 3.5Å; I76-L161 VanDerWaalsContact CD1-CD1 3.5Å; I76-L161 HydrophobicContact CD1-CD2 4.31Å; H106-L161 PolarHBondContact N-O 3.33Å; H106-L161 PolarHBondContact O-N 3.33Å; I108-L161 HydrophobicContact CD1-CD1 3.58Å; I108-L161 HydrophobicContact CD1-CG 4.24Å; L161-I163 HydrophobicContact CB-CD1 4.2Å
162	G	97.3	Very high	87.8	Confident	20 Å²	20	55.2 Å²	55.2	21%	0.206	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.7	161.2	0	0	0	0	0	110.6	I7 G104	I7-G162 PolarHBondContact N-O 2.96Å; I7-G162 VanDerWaalsContact O-CA 3.3Å; I7-G162 WeakPolarHBondContact O-CA 3.29Å; I7-G162 PolarHBondContact O-N 3.1Å; G104-G162 WeakPolarHBondContact O-CA 3.14Å
163	I	97.3	Very high	86.6	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.7	179.7	-55.6	-56	0	0	0	109.4	L4 I6 V99 P100 P103 G104 L161 M165	L4-I163 HydrophobicContact CD1-CG2 3.67Å; I6-I163 HydrophobicContact CB-CD1 4.34Å; I6-I163 HydrophobicContact CG1-CD1 4.17Å; I6-I163 HydrophobicContact CG2-CD1 3.97Å; V99-I163 HydrophobicContact CG1-CD1 3.58Å; P100-I163 HydrophobicContact CB-CG1 4.12Å; P100-I163 HydrophobicContact CG-CG1 4.25Å; P103-I163 CarbonylContact C-O 3.56Å; P103-I163 WeakPolarHBondContact CA-O 3.47Å; G104-I163 PolarHBondContact N-O 3.15Å; G104-I163 PolarHBondContact O-N 2.98Å; L161-I163 HydrophobicContact CB-CD1 4.2Å; I163-M165 HydrophobicContact CG2-CE 3.58Å; I163-M165 HydrophobicContact CG2-CG 4.11Å
164	I	95.7	Very high	84.8	Confident	94 Å²	94	57.2 Å²	57.2	48%	0.482	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	121.6	174	-53.5	168.4	0	0	0	107.8	H5 I7	H5-I164 HydrophobicContact CB-CB 4.12Å; H5-I164 PolarHBondContact N-O 2.7Å; H5-I164 PolarHBondContact O-N 2.97Å; I7-I164 HydrophobicContact CD1-CD1 4.25Å
165	M	92.8	Very high	82.8	Confident	41 Å²	41	63.9 Å²	63.9	20%	0.202	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.7	177.4	-60.8	-166.8	-176.4	0	0	109.6	L4 W73 S101 P103 I163 F168	L4-M165 HydrophobicContact CD1-CE 3.89Å; L4-M165 HydrophobicContact CD1-CG 3.83Å; W73-M165 HydrophobicContact CH2-CE 3.62Å; W73-M165 HydrophobicContact CH2-SD 4.39Å; W73-M165 HydrophobicContact CZ2-CE 3.82Å; S101-M165 WeakPolarHBondContact O-CE 3.43Å; P103-M165 HydrophobicContact CG-CB 4.14Å; P103-M165 HydrophobicContact CG-CG 4.08Å; P103-M165 HydrophobicContact CG-SD 4.25Å; I163-M165 HydrophobicContact CG2-CE 3.58Å; I163-M165 HydrophobicContact CG2-CG 4.11Å; M165-F168 HydrophobicContact CB-CD2 3.72Å; M165-F168 HydrophobicContact CB-CE2 4.23Å; M165-F168 HydrophobicContact CB-CG 4.28Å; M165-F168 HydrophobicContact CG-CD2 4.25Å; M165-F168 HydrophobicContact CG-CE2 4.38Å; M165-F168 HydrophobicContact SD-CD1 4.5Å; M165-F168 HydrophobicContact SD-CD2 4.37Å; M165-F168 HydrophobicContact SD-CG 4.33Å
166	R	90.7	Very high	82.3	Confident	129 Å²	129	67 Å²	67	49%	0.487	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	132.5	178.3	-175.2	-171.4	-177.3	-179.7	6	110.2	E3 F168	E3-R166 HydrophobicContact CB-CB 4.19Å; E3-R166 PolarHBondContact N-O 3.05Å; E3-R166 PolarHBondContact O-N 2.95Å; E3-R166 IonicContact OE2-NH1 2.72Å; R166-F168 PolarHBondContact O-N 3.46Å
167	H	87.8	Confident	81.5	Confident	59 Å²	59	68.6 Å²	68.6	27%	0.273	36%	0.362	S	S	.	.	S	Bend	trans	62.8	14.3	178.5	-51.7	140	0	0	0	115.6	D169 K170 Y171	H167-D169 VanDerWaalsContact C-N 3.31Å; H167-D169 PolarHBondContact O-N 2.74Å; H167-K170 PolarHBondContact O-N 3.48Å; H167-Y171 HydrophobicContact CB-CE2 4.39Å; H167-Y171 WeakPolarHBondContact O-CD2 3.43Å
168	F	82.4	Confident	80.7	Confident	9 Å²	9	72.4 Å²	72.4	4%	0.039	38%	0.382	C	S	.	.	S	Bend	trans	-63.6	-36.4	177.4	-90.7	-99.3	0	0	0	112.4	A2 E3 L4 W33 T67 L70 W73 M165 R166 K170 Y171 V173	A2-F168 HydrophobicContact CB-CD1 4.29Å; A2-F168 HydrophobicContact CB-CD2 3.77Å; A2-F168 HydrophobicContact CB-CE1 4.25Å; A2-F168 HydrophobicContact CB-CE2 3.75Å; A2-F168 HydrophobicContact CB-CG 4.06Å; A2-F168 HydrophobicContact CB-CZ 4Å; E3-F168 VanDerWaalsContact O-CE2 3.28Å; E3-F168 WeakPolarHBondContact O-CE2 3.45Å; L4-F168 HydrophobicContact CB-CE2 4.28Å; L4-F168 HydrophobicContact CB-CZ 4.41Å; W33-F168 HydrophobicContact CH2-CZ 4.03Å; W33-F168 HydrophobicContact CZ3-CZ 4.5Å; T67-F168 HydrophobicContact CG2-CE1 4.33Å; T67-F168 HydrophobicContact CG2-CZ 3.93Å; L70-F168 HydrophobicContact CD2-CD1 4.26Å; L70-F168 HydrophobicContact CD2-CE1 3.77Å; W73-F168 HydrophobicContact CH2-CE1 4.21Å; W73-F168 HydrophobicContact CH2-CZ 4.3Å; W73-F168 AromaticContact CZ3-CE1 3.89Å; W73-F168 HydrophobicContact CZ3-CE1 3.89Å; W73-F168 HydrophobicContact CZ3-CZ 4.24Å; M165-F168 HydrophobicContact CB-CD2 3.72Å; M165-F168 HydrophobicContact CB-CE2 4.23Å; M165-F168 HydrophobicContact CB-CG 4.28Å; M165-F168 HydrophobicContact CG-CD2 4.25Å; M165-F168 HydrophobicContact CG-CE2 4.38Å; M165-F168 HydrophobicContact SD-CD1 4.5Å; M165-F168 HydrophobicContact SD-CD2 4.37Å; M165-F168 HydrophobicContact SD-CG 4.33Å; R166-F168 PolarHBondContact O-N 3.46Å; F168-K170 VanDerWaalsContact C-N 3.27Å; F168-K170 PolarHBondContact O-N 2.93Å; F168-Y171 PolarHBondContact O-N 3.08Å; F168-V173 HydrophobicContact CB-CB 4.46Å; F168-V173 HydrophobicContact CD1-CB 4.12Å; F168-V173 HydrophobicContact CD1-CG1 4.22Å; F168-V173 HydrophobicContact CD1-CG2 4.16Å; F168-V173 PolarHBondContact O-N 2.93Å
169	D	74.5	Confident	79.7	Confident	116 Å²	116	75.3 Å²	75.3	62%	0.62	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-62.5	-34.1	178.4	-37.1	-61.8	0	0	0	112.2	H167 Y171 G172	H167-D169 VanDerWaalsContact C-N 3.31Å; H167-D169 PolarHBondContact O-N 2.74Å; D169-Y171 PolarHBondContact O-N 2.72Å; D169-G172 PolarHBondContact O-N 3.03Å
170	K	67.6	Low	78.6	Confident	163 Å²	163	80 Å²	80	71%	0.709	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-69.4	-13.7	178.2	-67	-176.6	179.1	177.5	0	113.2	H167 F168	H167-K170 PolarHBondContact O-N 3.48Å; F168-K170 VanDerWaalsContact C-N 3.27Å; F168-K170 PolarHBondContact O-N 2.93Å
171	Y	65.8	Low	77.3	Confident	135 Å²	135	81.9 Å²	81.9	53%	0.529	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-114.6	19.5	-179.5	-64.5	-74.4	0	0	0	112.8	M1 A2 H167 F168 D169	M1-Y171 WeakPolarHBondContact CA-OH 3.34Å; M1-Y171 PolarHBondContact N-OH 2.79Å; A2-Y171 HydrophobicContact CB-CD2 3.89Å; A2-Y171 HydrophobicContact CB-CE2 4.38Å; H167-Y171 HydrophobicContact CB-CE2 4.39Å; H167-Y171 WeakPolarHBondContact O-CD2 3.43Å; F168-Y171 PolarHBondContact O-N 3.08Å; D169-Y171 PolarHBondContact O-N 2.72Å
172	G	58.7	Low	75.8	Confident	68 Å²	68	87.7 Å²	87.7	70%	0.701	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.6	26.8	169.7	0	0	0	0	0	114.6	D169	D169-G172 PolarHBondContact O-N 3.03Å
173	V	57.9	Low	74.2	Confident	41 Å²	41	92.9 Å²	92.9	25%	0.248	49%	0.487	C	S	.	.			trans	-106.3	86.3	172.9	-171	0	0	0	0	107	L70 F168	L70-V173 HydrophobicContact CD1-CB 4.29Å; L70-V173 HydrophobicContact CD1-CG1 3.8Å; L70-V173 HydrophobicContact CD1-CG2 3.55Å; L70-V173 HydrophobicContact CD2-CG1 4.19Å; L70-V173 HydrophobicContact CD2-CG2 3.87Å; L70-V173 HydrophobicContact CG-CG2 3.76Å; F168-V173 HydrophobicContact CB-CB 4.46Å; F168-V173 HydrophobicContact CD1-CB 4.12Å; F168-V173 HydrophobicContact CD1-CG1 4.22Å; F168-V173 HydrophobicContact CD1-CG2 4.16Å; F168-V173 PolarHBondContact O-N 2.93Å
174	E	47.4	Very low	72.2	Confident	184 Å²	184	100.3 Å²	100.3	86%	0.86	53%	0.525	S	S	*	.			trans	-72.6	141.7	171.6	-73.1	-176.8	161.7	0	0	109.6
175	S	45.7	Very low	70.1	Confident	165 Å²	165	100.9 Å²	100.9	100%	1.154	53%	0.529	S	S	*	.			trans	-81.6	0	-177.1	5.7	0	0	0	0	112.6

Retrieved 175 of 175 residues in 41.9 ms (Link to these results)

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