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Mediator of RNA polymerase II transcription subunit 20

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB , UniProt , Accession A0A077Z392, Species TRITR (Trichuris trichiura, Whipworm), Gene MED20, Length 202 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	59.4	Low	88.4	Confident	145 Å²	145	67.6 Å²	67.6	71%	0.714	35%	0.351	S	S	*	.				0	134.8	0	-171.2	159.6	16.6	0	0	107.9	E5 N6 E9	M1-E5 HydrophobicContact CG-CB 3.76Å; M1-E5 HydrophobicContact SD-CB 4.26Å; M1-N6 VanDerWaalsContact CE-OD1 3.27Å; M1-N6 WeakPolarHBondContact CE-OD1 3.36Å; M1-N6 WeakPolarHBondContact CG-OD1 3.23Å; M1-N6 PolarHBondContact SD-OD1 2.95Å; M1-E9 VanDerWaalsContact SD-OE2 3.41Å
2	S	81.6	Confident	89	Confident	40 Å²	40	66.3 Å²	66.3	28%	0.28	37%	0.366	S	S	.	.			trans	-77.2	152.2	-178.9	77.9	0	0	0	0	111	V4 E5 N6 K121	S2-V4 PolarHBondContact O-N 3.2Å; S2-V4 VanDerWaalsContact O-N 3.15Å; S2-E5 WeakPolarHBondContact CB-OE2 3.27Å; S2-E5 PolarHBondContact N-OE2 3.08Å; S2-E5 PolarHBondContact O-N 3.44Å; S2-E5 VanDerWaalsContact OG-CG 3.3Å; S2-E5 WeakPolarHBondContact OG-CG 3.35Å; S2-E5 PolarHBondContact OG-N 3.43Å; S2-E5 PolarHBondContact OG-OE2 3.15Å; S2-N6 PolarHBondContact O-N 2.91Å; S2-N6 VanDerWaalsContact O-N 3.15Å; S2-K121 VanDerWaalsContact CB-NZ 3.29Å; S2-K121 PolarHBondContact OG-NZ 3.35Å
3	V	87.6	Confident	89.6	Confident	108 Å²	108	61.8 Å²	61.8	66%	0.655	34%	0.343	S	S	*	.	H	α-helix	trans	-52.5	-40.3	-178.4	177	0	0	0	0	112.6	N6 I7	V3-N6 WeakPolarHBondContact O-CB 3.5Å; V3-N6 PolarHBondContact O-N 2.99Å; V3-I7 HydrophobicContact CG1-CD1 4.06Å; V3-I7 WeakPolarHBondContact O-CG1 3.28Å; V3-I7 PolarHBondContact O-N 3.21Å; V3-I7 VanDerWaalsContact O-N 3.1Å
4	V	88.4	Confident	90.2	Very high	20 Å²	20	63.4 Å²	63.4	12%	0.121	36%	0.355	C	S	.	.	H	α-helix	trans	-69.4	-38.3	179.6	177.7	0	0	0	0	112.3	S2 N6 I7 I8 K121 I123 L148	S2-V4 PolarHBondContact O-N 3.2Å; S2-V4 VanDerWaalsContact O-N 3.15Å; V4-N6 VanDerWaalsContact C-N 3.3Å; V4-N6 PolarHBondContact O-N 2.97Å; V4-I7 PolarHBondContact O-N 3.33Å; V4-I8 HydrophobicContact CG1-CD1 3.73Å; V4-I8 HydrophobicContact CG1-CG1 4.3Å; V4-I8 VanDerWaalsContact O-CG1 3.28Å; V4-I8 WeakPolarHBondContact O-CG1 3.48Å; V4-I8 PolarHBondContact O-N 3.44Å; V4-K121 HydrophobicContact CB-CD 4.48Å; V4-K121 HydrophobicContact CG2-CD 3.88Å; V4-K121 VanDerWaalsContact CG2-CE 3.45Å; V4-I123 HydrophobicContact CB-CD1 4.44Å; V4-I123 HydrophobicContact CG1-CD1 3.49Å; V4-I123 VanDerWaalsContact CG1-CD1 3.49Å; V4-I123 HydrophobicContact CG1-CG1 4.16Å; V4-I123 HydrophobicContact CG2-CD1 4.13Å; V4-L148 HydrophobicContact CG1-CD2 4.39Å
5	E	91.7	Very high	90.7	Very high	29 Å²	29	64.6 Å²	64.6	14%	0.136	36%	0.361	C	S	.	.	H	α-helix	trans	-63.5	-41.3	176.7	-69.9	167.6	136.5	0	0	110.2	M1 S2 I7 I8 E9 K94 Y96	M1-E5 HydrophobicContact CG-CB 3.76Å; M1-E5 HydrophobicContact SD-CB 4.26Å; S2-E5 WeakPolarHBondContact CB-OE2 3.27Å; S2-E5 PolarHBondContact N-OE2 3.08Å; S2-E5 PolarHBondContact O-N 3.44Å; S2-E5 VanDerWaalsContact OG-CG 3.3Å; S2-E5 WeakPolarHBondContact OG-CG 3.35Å; S2-E5 PolarHBondContact OG-N 3.43Å; S2-E5 PolarHBondContact OG-OE2 3.15Å; E5-I7 VanDerWaalsContact C-N 3.33Å; E5-I7 PolarHBondContact O-N 3.25Å; E5-I8 PolarHBondContact O-N 3.48Å; E5-E9 WeakPolarHBondContact O-CB 3.12Å; E5-E9 WeakPolarHBondContact O-CG 3.47Å; E5-E9 PolarHBondContact O-N 2.98Å; E5-K94 WeakPolarHBondContact OE1-CD 3.03Å; E5-K94 IonicContact OE1-NZ 3.63Å; E5-Y96 HydrophobicContact CG-CE2 4.38Å
6	N	92.6	Very high	91.1	Very high	60 Å²	60	66 Å²	66	32%	0.321	37%	0.371	S	S	.	.	H	α-helix	trans	-58.8	-44.7	174.3	-69	-16.8	0	0	0	111.5	M1 S2 V3 V4 E9 Q10	M1-N6 VanDerWaalsContact CE-OD1 3.27Å; M1-N6 WeakPolarHBondContact CE-OD1 3.36Å; M1-N6 WeakPolarHBondContact CG-OD1 3.23Å; M1-N6 PolarHBondContact SD-OD1 2.95Å; S2-N6 PolarHBondContact O-N 2.91Å; S2-N6 VanDerWaalsContact O-N 3.15Å; V3-N6 WeakPolarHBondContact O-CB 3.5Å; V3-N6 PolarHBondContact O-N 2.99Å; V4-N6 VanDerWaalsContact C-N 3.3Å; V4-N6 PolarHBondContact O-N 2.97Å; N6-E9 PolarHBondContact O-N 3.4Å; N6-Q10 WeakPolarHBondContact O-CB 3.36Å; N6-Q10 VanDerWaalsContact O-CG 3.23Å; N6-Q10 WeakPolarHBondContact O-CG 3.47Å; N6-Q10 PolarHBondContact O-N 3.1Å
7	I	92.9	Very high	91.4	Very high	54 Å²	54	63.8 Å²	63.8	28%	0.277	37%	0.367	S	S	.	.	H	α-helix	trans	-62.4	-47.6	178.9	-68.1	165.3	0	0	0	110.5	V3 V4 E5 E9 Q10 M11 M147	V3-I7 HydrophobicContact CG1-CD1 4.06Å; V3-I7 WeakPolarHBondContact O-CG1 3.28Å; V3-I7 PolarHBondContact O-N 3.21Å; V3-I7 VanDerWaalsContact O-N 3.1Å; V4-I7 PolarHBondContact O-N 3.33Å; E5-I7 VanDerWaalsContact C-N 3.33Å; E5-I7 PolarHBondContact O-N 3.25Å; I7-E9 VanDerWaalsContact C-N 3.32Å; I7-E9 PolarHBondContact O-N 3.2Å; I7-Q10 PolarHBondContact O-N 2.77Å; I7-M11 HydrophobicContact CG2-SD 4.25Å; I7-M11 WeakPolarHBondContact O-CG 3.3Å; I7-M11 PolarHBondContact O-N 3.48Å; I7-M147 HydrophobicContact CG2-CG 4.12Å
8	I	94.5	Very high	91.7	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-57.9	-45.5	179.2	-71.5	165.8	0	0	0	110.9	V4 E5 M11 A13 Y96 I103 A105 M147	V4-I8 HydrophobicContact CG1-CD1 3.73Å; V4-I8 HydrophobicContact CG1-CG1 4.3Å; V4-I8 VanDerWaalsContact O-CG1 3.28Å; V4-I8 WeakPolarHBondContact O-CG1 3.48Å; V4-I8 PolarHBondContact O-N 3.44Å; E5-I8 PolarHBondContact O-N 3.48Å; I8-M11 PolarHBondContact O-N 3.15Å; I8-A13 HydrophobicContact CG2-CB 3.43Å; I8-A13 VanDerWaalsContact CG2-CB 3.43Å; I8-A13 WeakPolarHBondContact O-CB 3.31Å; I8-A13 PolarHBondContact O-N 3.38Å; I8-Y96 HydrophobicContact CD1-CD2 4.37Å; I8-Y96 HydrophobicContact CG2-CD1 3.68Å; I8-Y96 HydrophobicContact CG2-CD2 3.87Å; I8-Y96 HydrophobicContact CG2-CE1 4.18Å; I8-Y96 HydrophobicContact CG2-CE2 4.34Å; I8-Y96 HydrophobicContact CG2-CG 3.49Å; I8-Y96 VanDerWaalsContact CG2-CG 3.49Å; I8-I103 HydrophobicContact CD1-CG2 3.72Å; I8-I103 HydrophobicContact CG1-CG2 4.34Å; I8-I103 HydrophobicContact CG2-CD1 4.21Å; I8-A105 HydrophobicContact CD1-CB 3.85Å; I8-M147 HydrophobicContact CD1-SD 4.4Å; I8-M147 HydrophobicContact CG1-SD 3.69Å
9	E	94.8	Very high	92	Very high	71 Å²	71	63 Å²	63	33%	0.332	36%	0.364	S	S	.	.	H	α-helix	trans	-69.4	-35.7	179.1	-69.7	174	-166.5	0	0	112	M1 E5 N6 I7 M11 G12 Y96	M1-E9 VanDerWaalsContact SD-OE2 3.41Å; E5-E9 WeakPolarHBondContact O-CB 3.12Å; E5-E9 WeakPolarHBondContact O-CG 3.47Å; E5-E9 PolarHBondContact O-N 2.98Å; N6-E9 PolarHBondContact O-N 3.4Å; I7-E9 VanDerWaalsContact C-N 3.32Å; I7-E9 PolarHBondContact O-N 3.2Å; E9-M11 VanDerWaalsContact C-N 3.29Å; E9-M11 PolarHBondContact O-N 3.02Å; E9-G12 WeakPolarHBondContact O-CA 3.41Å; E9-G12 PolarHBondContact O-N 3.04Å; E9-Y96 HydrophobicContact CG-CD1 4.36Å; E9-Y96 HydrophobicContact CG-CE1 3.59Å; E9-Y96 VanDerWaalsContact OE1-CE1 3.31Å; E9-Y96 WeakPolarHBondContact OE1-CE1 3.4Å; E9-Y96 PolarHBondContact OE1-OH 3.1Å
10	Q	94.5	Very high	92.3	Very high	164 Å²	164	61.6 Å²	61.6	77%	0.766	36%	0.358	S	S	*	.	H	α-helix	trans	-65.6	-29.9	174.1	-78.6	177.1	-10.9	0	0	113.2	N6 I7 G12	N6-Q10 WeakPolarHBondContact O-CB 3.36Å; N6-Q10 VanDerWaalsContact O-CG 3.23Å; N6-Q10 WeakPolarHBondContact O-CG 3.47Å; N6-Q10 PolarHBondContact O-N 3.1Å; I7-Q10 PolarHBondContact O-N 2.77Å; Q10-G12 PolarHBondContact O-N 2.82Å
11	M	94.1	Very high	92.5	Very high	53 Å²	53	58.7 Å²	58.7	26%	0.261	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72	0.4	170.7	-65.7	176	76.4	0	0	113	I7 I8 E9 L98 F143 M147	I7-M11 HydrophobicContact CG2-SD 4.25Å; I7-M11 WeakPolarHBondContact O-CG 3.3Å; I7-M11 PolarHBondContact O-N 3.48Å; I8-M11 PolarHBondContact O-N 3.15Å; E9-M11 VanDerWaalsContact C-N 3.29Å; E9-M11 PolarHBondContact O-N 3.02Å; M11-L98 HydrophobicContact CB-CD2 3.9Å; M11-L98 HydrophobicContact CE-CD2 4.37Å; M11-L98 WeakPolarHBondContact O-CD1 3.37Å; M11-F143 HydrophobicContact CE-CE2 4.15Å; M11-M147 HydrophobicContact CE-CB 4.07Å; M11-M147 HydrophobicContact SD-CB 3.68Å; M11-M147 HydrophobicContact SD-CG 3.64Å; M11-M147 HydrophobicContact SD-SD 4.32Å
12	G	96.1	Very high	94.2	Very high	51 Å²	51	54.2 Å²	54.2	53%	0.526	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	12.8	179.9	0	0	0	0	0	114	E9 Q10	E9-G12 WeakPolarHBondContact O-CA 3.41Å; E9-G12 PolarHBondContact O-N 3.04Å; Q10-G12 PolarHBondContact O-N 2.82Å
13	A	97	Very high	94.9	Very high	9 Å²	9	52.5 Å²	52.5	7%	0.074	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-71	141.4	176.7	0	0	0	0	0	111	I8 Y96 K97 L98	I8-A13 HydrophobicContact CG2-CB 3.43Å; I8-A13 VanDerWaalsContact CG2-CB 3.43Å; I8-A13 WeakPolarHBondContact O-CB 3.31Å; I8-A13 PolarHBondContact O-N 3.38Å; A13-Y96 HydrophobicContact CB-CD1 4.42Å; A13-K97 WeakPolarHBondContact CA-O 3.21Å; A13-L98 HydrophobicContact CB-CB 3.8Å; A13-L98 HydrophobicContact CB-CD2 4.4Å; A13-L98 HydrophobicContact CB-CG 4.49Å
14	T	97.4	Very high	95.2	Very high	83 Å²	83	48 Å²	48	51%	0.509	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	134.3	179.6	55.3	0	0	0	0	110.4	V16 Y96 K97	T14-V16 PolarHBondContact O-N 3.24Å; T14-Y96 CarbonylContact O-C 3.49Å; T14-Y96 WeakPolarHBondContact O-CA 3.38Å; T14-K97 PolarHBondContact N-O 2.79Å; T14-K97 PolarHBondContact O-N 2.87Å; T14-K97 PolarHBondContact OG1-O 3.39Å
15	N	97.1	Very high	95.5	Very high	82 Å²	82	47.1 Å²	47.1	44%	0.439	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	122.6	172.5	-178.3	-15.4	0	0	0	109.6	G17 K95 Y96	N15-G17 PolarHBondContact OD1-N 2.87Å; N15-G17 PolarHBondContact OD1-O 3.28Å; N15-K95 WeakPolarHBondContact CA-O 3.17Å; N15-K95 PolarHBondContact OD1-O 3.23Å; N15-Y96 HydrophobicContact CB-CD1 4.1Å; N15-Y96 HydrophobicContact CB-CE1 3.88Å
16	V	97.4	Very high	95.6	Very high	87 Å²	87	46 Å²	46	53%	0.527	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	10.1	-177.4	-62.2	0	0	0	0	112.9	T14 K95 K97	T14-V16 PolarHBondContact O-N 3.24Å; V16-K95 HydrophobicContact CG2-CB 3.67Å; V16-K95 PolarHBondContact N-O 2.84Å; V16-K97 HydrophobicContact CG1-CB 3.81Å; V16-K97 HydrophobicContact CG2-CB 4.45Å
17	G	96.8	Very high	95.6	Very high	29 Å²	29	45.7 Å²	45.7	30%	0.299	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	133.9	-152.3	172.6	0	0	0	0	0	113.6	N15 K94 K95	N15-G17 PolarHBondContact OD1-N 2.87Å; N15-G17 PolarHBondContact OD1-O 3.28Å; G17-K94 WeakPolarHBondContact O-CA 3.4Å; G17-K95 PolarHBondContact O-N 2.8Å
18	V	96.8	Very high	95.5	Very high	110 Å²	110	44.5 Å²	44.5	67%	0.667	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	151.3	-174.9	-62.8	0	0	0	0	111.6	G93 K95	V18-G93 WeakPolarHBondContact CA-O 3.33Å; V18-K95 VanDerWaalsContact O-CD 3.31Å; V18-K95 WeakPolarHBondContact O-CD 3.38Å; V18-K95 WeakPolarHBondContact O-CE 3.44Å; V18-K95 PolarHBondContact O-NZ 2.68Å
19	Y	96.9	Very high	95.2	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.008	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	138.5	172.8	-179.3	-102.4	0	0	0	109.7	L21 C44 S45 R92 G93 R104 S106 Y177	Y19-L21 HydrophobicContact CE1-CB 3.86Å; Y19-L21 WeakPolarHBondContact OH-CD1 3.44Å; Y19-C44 VanDerWaalsContact CE2-SG 3.54Å; Y19-C44 PolarHBondContact OH-SG 2.84Å; Y19-S45 WeakPolarHBondContact CD2-OG 3.37Å; Y19-R92 WeakPolarHBondContact O-CA 3.26Å; Y19-G93 PolarHBondContact N-O 2.87Å; Y19-G93 PolarHBondContact O-N 3.44Å; Y19-R104 HydrophobicContact CD1-CB 4.49Å; Y19-R104 HydrophobicContact CD2-CG 4.39Å; Y19-R104 HydrophobicContact CG-CB 4.33Å; Y19-R104 HydrophobicContact CG-CG 4.41Å; Y19-S106 WeakPolarHBondContact CD1-OG 3.12Å; Y19-Y177 AromaticContact CE1-CZ 3.92Å; Y19-Y177 VanDerWaalsContact CE1-OH 3.24Å; Y19-Y177 WeakPolarHBondContact CE1-OH 3.3Å; Y19-Y177 WeakPolarHBondContact OH-CE2 3.44Å
20	S	97.2	Very high	94.4	Very high	35 Å²	35	48.3 Å²	48.3	25%	0.245	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	134.4	173.2	60.8	0	0	0	0	111.1	S45 C91 R92	S20-S45 PolarHBondContact N-OG 2.92Å; S20-S45 PolarHBondContact O-N 3.25Å; S20-S45 PolarHBondContact O-OG 3.32Å; S20-S45 WeakPolarHBondContact OG-CB 3.07Å; S20-C91 CarbonylContact C-O 3.53Å; S20-C91 WeakPolarHBondContact CA-O 3.45Å; S20-R92 VanDerWaalsContact CB-CZ 3.42Å
21	L	97.3	Very high	93.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	124.7	169.5	-179.4	156.8	0	0	0	109.5	Y19 A23 F42 H43 C91 R92 M174 Y177 F181	Y19-L21 HydrophobicContact CE1-CB 3.86Å; Y19-L21 WeakPolarHBondContact OH-CD1 3.44Å; L21-A23 HydrophobicContact CD2-CB 4.44Å; L21-F42 HydrophobicContact CD2-CD1 4.17Å; L21-H43 CarbonylContact C-O 3.52Å; L21-H43 VanDerWaalsContact CA-O 3.26Å; L21-H43 WeakPolarHBondContact CA-O 3.18Å; L21-C91 HydrophobicContact CB-CB 4.18Å; L21-C91 PolarHBondContact N-O 3.43Å; L21-C91 WeakPolarHBondContact O-CA 3.39Å; L21-C91 WeakPolarHBondContact O-CB 3.32Å; L21-C91 PolarHBondContact O-N 2.88Å; L21-R92 PolarHBondContact O-NH1 3.05Å; L21-M174 HydrophobicContact CD1-CE 4.02Å; L21-M174 HydrophobicContact CD1-SD 3.85Å; L21-Y177 HydrophobicContact CD1-CD1 4.24Å; L21-Y177 HydrophobicContact CD1-CD2 3.5Å; L21-Y177 VanDerWaalsContact CD1-CD2 3.5Å; L21-Y177 HydrophobicContact CD1-CE1 4.43Å; L21-Y177 HydrophobicContact CD1-CE2 3.75Å; L21-Y177 HydrophobicContact CD1-CG 3.77Å; L21-Y177 HydrophobicContact CD2-CD1 4.35Å; L21-Y177 HydrophobicContact CD2-CG 4.32Å; L21-F181 HydrophobicContact CD2-CE2 3.61Å; L21-F181 HydrophobicContact CD2-CZ 3.7Å
22	D	95.6	Very high	92.2	Very high	51 Å²	51	47.1 Å²	47.1	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	133.9	176.3	-65.2	-41.1	0	0	0	109.5	F42 H43 R92	D22-F42 CarbonylContact O-C 3.56Å; D22-F42 VanDerWaalsContact O-CA 3.26Å; D22-F42 WeakPolarHBondContact O-CA 3.23Å; D22-H43 PolarHBondContact N-O 3.18Å; D22-H43 PolarHBondContact O-N 2.88Å; D22-R92 IonicContact OD1-CZ 3.2Å; D22-R92 IonicContact OD1-NH1 3.17Å; D22-R92 PolarHBondContact OD1-NH1 2.96Å; D22-R92 IonicContact OD1-NH2 2.88Å; D22-R92 PolarHBondContact OD1-NH2 2.76Å; D22-R92 IonicContact OD2-CZ 2.79Å; D22-R92 IonicContact OD2-NH1 3.66Å; D22-R92 IonicContact OD2-NH2 2.75Å; D22-R92 PolarHBondContact OD2-NH2 3.46Å
23	A	95.9	Very high	90.7	Very high	4 Å²	4	47.9 Å²	47.9	3%	0.033	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.6	175.4	0	0	0	0	0	111	L21 V41 F42 K88 V89 F181	L21-A23 HydrophobicContact CD2-CB 4.44Å; A23-V41 CarbonylContact C-O 3.58Å; A23-V41 VanDerWaalsContact CA-O 3.25Å; A23-V41 WeakPolarHBondContact CA-O 3.37Å; A23-F42 HydrophobicContact CB-CD1 3.58Å; A23-F42 HydrophobicContact CB-CE1 3.67Å; A23-F42 HydrophobicContact CB-CG 4.46Å; A23-K88 CarbonylContact O-C 3.49Å; A23-K88 WeakPolarHBondContact O-CA 3.24Å; A23-V89 HydrophobicContact CB-CB 4.46Å; A23-V89 PolarHBondContact N-O 2.75Å; A23-V89 PolarHBondContact O-N 2.79Å; A23-F181 HydrophobicContact CB-CD2 3.75Å; A23-F181 HydrophobicContact CB-CE2 3.54Å
24	E	94.6	Very high	89	Confident	15 Å²	15	53 Å²	53	7%	0.07	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.2	173.4	-174	163.4	-163.4	0	0	109.3	F26 V41 F71 K75 T83 K88	E24-F26 HydrophobicContact CB-CE2 3.99Å; E24-F26 HydrophobicContact CB-CZ 4.35Å; E24-F26 HydrophobicContact CG-CD2 4.47Å; E24-F26 HydrophobicContact CG-CE1 4.47Å; E24-F26 HydrophobicContact CG-CE2 3.79Å; E24-F26 HydrophobicContact CG-CZ 3.79Å; E24-V41 PolarHBondContact N-O 2.89Å; E24-V41 PolarHBondContact O-N 2.85Å; E24-F71 HydrophobicContact CB-CE2 4.11Å; E24-F71 HydrophobicContact CB-CZ 4.43Å; E24-F71 WeakPolarHBondContact OE2-CE2 3.49Å; E24-F71 WeakPolarHBondContact OE2-CZ 3.41Å; E24-K75 VanDerWaalsContact OE2-CE 3.24Å; E24-K75 WeakPolarHBondContact OE2-CE 3.07Å; E24-K75 IonicContact OE2-NZ 2.84Å; E24-K75 PolarHBondContact OE2-NZ 3.22Å; E24-T83 HydrophobicContact CG-CG2 4.38Å; E24-K88 HydrophobicContact CB-CG 4.24Å; E24-K88 HydrophobicContact CG-CG 3.82Å; E24-K88 WeakPolarHBondContact OE1-CE 3.47Å; E24-K88 IonicContact OE1-NZ 2.8Å; E24-K88 WeakPolarHBondContact OE2-CE 3.48Å
25	T	94.6	Very high	87.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.2	177.6	-59.9	0	0	0	0	111.4	Y27 P38 H40 S87 R185	T25-Y27 HydrophobicContact CG2-CD2 4.4Å; T25-Y27 HydrophobicContact CG2-CE1 4.12Å; T25-Y27 HydrophobicContact CG2-CE2 3.76Å; T25-P38 HydrophobicContact CG2-CB 3.93Å; T25-H40 VanDerWaalsContact CG2-CE1 3.44Å; T25-H40 WeakPolarHBondContact CG2-CE1 3.21Å; T25-H40 VanDerWaalsContact CG2-ND1 3.29Å; T25-H40 WeakPolarHBondContact CG2-ND1 3.35Å; T25-H40 PolarHBondContact OG1-ND1 2.75Å; T25-S87 PolarHBondContact N-O 2.89Å; T25-S87 WeakPolarHBondContact O-CB 3.37Å; T25-R185 PolarHBondContact OG1-NH2 3.47Å
26	F	93.9	Very high	86.8	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.026	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.6	175.7	-62.7	-90.4	0	0	0	109	E24 P38 L39 V41 F71 I74 K75 Y81 T83	E24-F26 HydrophobicContact CB-CE2 3.99Å; E24-F26 HydrophobicContact CB-CZ 4.35Å; E24-F26 HydrophobicContact CG-CD2 4.47Å; E24-F26 HydrophobicContact CG-CE1 4.47Å; E24-F26 HydrophobicContact CG-CE2 3.79Å; E24-F26 HydrophobicContact CG-CZ 3.79Å; F26-P38 CarbonylContact O-C 3.58Å; F26-P38 WeakPolarHBondContact O-CA 3.21Å; F26-L39 HydrophobicContact CB-CB 4.29Å; F26-L39 PolarHBondContact N-O 3.05Å; F26-L39 PolarHBondContact O-N 3.47Å; F26-V41 HydrophobicContact CD2-CB 4.45Å; F26-V41 HydrophobicContact CD2-CG2 3.78Å; F26-V41 HydrophobicContact CE2-CB 4.09Å; F26-V41 HydrophobicContact CE2-CG2 3.77Å; F26-F71 HydrophobicContact CE2-CD2 4.11Å; F26-F71 AromaticContact CE2-CE2 3.76Å; F26-F71 HydrophobicContact CE2-CE2 3.76Å; F26-F71 HydrophobicContact CZ-CD2 4.1Å; F26-F71 AromaticContact CZ-CE2 3.64Å; F26-F71 HydrophobicContact CZ-CE2 3.64Å; F26-I74 HydrophobicContact CB-CG2 4.32Å; F26-I74 HydrophobicContact CD1-CG2 3.63Å; F26-I74 HydrophobicContact CD2-CG2 3.85Å; F26-I74 HydrophobicContact CE1-CG2 3.81Å; F26-I74 HydrophobicContact CE2-CG2 4.02Å; F26-I74 HydrophobicContact CG-CG2 3.65Å; F26-I74 HydrophobicContact CZ-CG2 4Å; F26-K75 HydrophobicContact CE1-CG 4.1Å; F26-K75 HydrophobicContact CZ-CG 4.1Å; F26-Y81 HydrophobicContact CB-CD1 3.8Å; F26-Y81 HydrophobicContact CB-CG 4.14Å; F26-T83 HydrophobicContact CD1-CG2 3.58Å; F26-T83 HydrophobicContact CE1-CG2 3.65Å; F26-T83 HydrophobicContact CG-CG2 4.37Å; F26-T83 HydrophobicContact CZ-CG2 4.47Å
27	Y	92.1	Very high	86.5	Confident	52 Å²	52	55.4 Å²	55.4	20%	0.204	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.5	176.9	-62.4	-87.3	0	0	0	107.8	T25 V29 P38 Y81 V82 K84	T25-Y27 HydrophobicContact CG2-CD2 4.4Å; T25-Y27 HydrophobicContact CG2-CE1 4.12Å; T25-Y27 HydrophobicContact CG2-CE2 3.76Å; Y27-V29 PolarHBondContact O-N 2.93Å; Y27-P38 HydrophobicContact CD1-CB 4.07Å; Y27-P38 HydrophobicContact CE1-CB 4.02Å; Y27-Y81 CarbonylContact O-C 3.53Å; Y27-Y81 VanDerWaalsContact O-CA 3.3Å; Y27-Y81 WeakPolarHBondContact O-CA 3.47Å; Y27-V82 PolarHBondContact N-O 3.42Å; Y27-V82 PolarHBondContact O-N 2.87Å; Y27-K84 HydrophobicContact CD2-CB 4.45Å; Y27-K84 HydrophobicContact CD2-CD 3.81Å; Y27-K84 HydrophobicContact CD2-CG 3.69Å; Y27-K84 HydrophobicContact CE1-CD 4.43Å; Y27-K84 HydrophobicContact CE2-CB 4.02Å; Y27-K84 HydrophobicContact CE2-CD 3.53Å; Y27-K84 HydrophobicContact CE2-CG 3.62Å; Y27-K84 HydrophobicContact CG-CD 4.36Å
28	P	90.9	Very high	86.3	Confident	29 Å²	29	54.8 Å²	54.8	19%	0.188	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	140.6	173.8	-14.6	24.9	0	0	0	109.6	A30 Q36 K37 A80 Y81	P28-A30 PolarHBondContact O-N 3.49Å; P28-Q36 PolarHBondContact O-OE1 2.87Å; P28-K37 VanDerWaalsContact CD-O 3.23Å; P28-K37 WeakPolarHBondContact CD-O 3.29Å; P28-K37 WeakPolarHBondContact CG-O 3.38Å; P28-A80 CarbonylContact C-O 3.54Å; P28-A80 VanDerWaalsContact CA-O 3.26Å; P28-A80 WeakPolarHBondContact CA-O 3.36Å; P28-Y81 HydrophobicContact CB-CD1 4.37Å; P28-Y81 HydrophobicContact CB-CE1 4.19Å; P28-Y81 HydrophobicContact CG-CD1 4.28Å; P28-Y81 HydrophobicContact CG-CE1 3.86Å
29	V	88.7	Confident	86.2	Confident	62 Å²	62	50.2 Å²	50.2	38%	0.376	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-66.6	131.4	169.5	177.2	0	0	0	0	107	Y27 G31 Q36 A80 V82	Y27-V29 PolarHBondContact O-N 2.93Å; V29-G31 PolarHBondContact O-N 3.15Å; V29-Q36 PolarHBondContact O-OE1 3.11Å; V29-A80 PolarHBondContact N-O 3.47Å; V29-V82 HydrophobicContact CG2-CG1 3.7Å
30	A	78.3	Confident	86.2	Confident	89 Å²	89	50.2 Å²	50.2	74%	0.736	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-53.5	116.4	179.1	0	0	0	0	0	109.6	P28	P28-A30 PolarHBondContact O-N 3.49Å
31	G	72.2	Confident	86.2	Confident	42 Å²	42	48.6 Å²	48.6	43%	0.433	30%	0.302	S	S	.	.			trans	-127.7	179.4	176.8	0	0	0	0	0	110	V29 A33	V29-G31 PolarHBondContact O-N 3.15Å; G31-A33 PolarHBondContact O-N 2.82Å
32	P	68.6	Low	86.2	Confident	151 Å²	151	48.6 Å²	48.6	98%	0.981	30%	0.302	S	S	*	.	S	Bend	trans	-62.4	-14.4	-179.6	23.2	-32	0	0	0	113.9
33	A	65	Low	86.2	Confident	67 Å²	67	48.1 Å²	48.1	55%	0.554	30%	0.298	S	S	*	.			trans	-79.2	128.4	176.5	0	0	0	0	0	112.1	G31 N35 Q36	G31-A33 PolarHBondContact O-N 2.82Å; A33-N35 VanDerWaalsContact C-N 3.31Å; A33-N35 PolarHBondContact O-N 3.37Å; A33-Q36 PolarHBondContact O-NE2 3.11Å; A33-Q36 VanDerWaalsContact O-NE2 3.1Å
34	S	62.4	Low	86.2	Confident	115 Å²	115	48.2 Å²	48.2	80%	0.804	30%	0.298	S	S	*	.	S	Bend	trans	-70.6	-15.4	-175	57.3	0	0	0	0	115.4	Q36	S34-Q36 PolarHBondContact O-N 3.47Å
35	N	65.8	Low	86.3	Confident	121 Å²	121	49.2 Å²	49.2	65%	0.647	31%	0.307	S	S	*	.			trans	-95.6	78.8	-177	-85	-49.2	0	0	0	112	A33 K37	A33-N35 VanDerWaalsContact C-N 3.31Å; A33-N35 PolarHBondContact O-N 3.37Å; N35-K37 PolarHBondContact O-N 2.96Å; N35-K37 VanDerWaalsContact O-N 3.11Å
36	Q	82	Confident	86.4	Confident	77 Å²	77	51.2 Å²	51.2	36%	0.36	32%	0.318	S	S	.	.			trans	-85.6	55.5	176.6	-61.7	-69.3	-40.9	0	0	111.5	P28 V29 A33 S34	P28-Q36 PolarHBondContact O-OE1 2.87Å; V29-Q36 PolarHBondContact O-OE1 3.11Å; A33-Q36 PolarHBondContact O-NE2 3.11Å; A33-Q36 VanDerWaalsContact O-NE2 3.1Å; S34-Q36 PolarHBondContact O-N 3.47Å
37	K	91.3	Very high	86.5	Confident	106 Å²	106	54.6 Å²	54.6	46%	0.461	33%	0.331	S	S	.	.			trans	-77	131.9	179.1	-68.6	-177.4	-177.6	179.7	0	110.5	P28 N35	P28-K37 VanDerWaalsContact CD-O 3.23Å; P28-K37 WeakPolarHBondContact CD-O 3.29Å; P28-K37 WeakPolarHBondContact CG-O 3.38Å; N35-K37 PolarHBondContact O-N 2.96Å; N35-K37 VanDerWaalsContact O-N 3.11Å
38	P	92.9	Very high	86.7	Confident	15 Å²	15	56.7 Å²	56.7	10%	0.097	35%	0.351	C	S	.	.			trans	-63.2	146	172.9	27.8	-34.9	0	0	0	110.9	T25 F26 Y27 H40 G56	T25-P38 HydrophobicContact CG2-CB 3.93Å; F26-P38 CarbonylContact O-C 3.58Å; F26-P38 WeakPolarHBondContact O-CA 3.21Å; Y27-P38 HydrophobicContact CD1-CB 4.07Å; Y27-P38 HydrophobicContact CE1-CB 4.02Å; P38-H40 WeakPolarHBondContact CG-NE2 3.49Å; P38-G56 PolarHBondContact O-N 3.45Å
39	L	94.9	Very high	86.9	Confident	14 Å²	14	58.7 Å²	58.7	7%	0.073	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	115.2	172.8	-177.7	71.5	0	0	0	108.7	F26 V41 A53 I54 I74 Y81	F26-L39 HydrophobicContact CB-CB 4.29Å; F26-L39 PolarHBondContact N-O 3.05Å; F26-L39 PolarHBondContact O-N 3.47Å; L39-V41 HydrophobicContact CD2-CG2 4.18Å; L39-V41 HydrophobicContact CG-CG2 4.1Å; L39-A53 HydrophobicContact CD1-CB 3.98Å; L39-I54 WeakPolarHBondContact CA-O 3.25Å; L39-I74 HydrophobicContact CD2-CD1 3.69Å; L39-I74 HydrophobicContact CD2-CG1 3.99Å; L39-I74 HydrophobicContact CD2-CG2 4.27Å; L39-Y81 HydrophobicContact CB-CE1 4.06Å; L39-Y81 HydrophobicContact CD2-CE1 4.36Å
40	H	95.9	Very high	87.2	Confident	3 Å²	3	57.6 Å²	57.6	1%	0.014	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	119.8	178.1	-50	-69.6	0	0	0	108.8	T25 P38 F42 A53 I54 G56 D57 Q178	T25-H40 VanDerWaalsContact CG2-CE1 3.44Å; T25-H40 WeakPolarHBondContact CG2-CE1 3.21Å; T25-H40 VanDerWaalsContact CG2-ND1 3.29Å; T25-H40 WeakPolarHBondContact CG2-ND1 3.35Å; T25-H40 PolarHBondContact OG1-ND1 2.75Å; P38-H40 WeakPolarHBondContact CG-NE2 3.49Å; H40-F42 HydrophobicContact CB-CE2 3.53Å; H40-F42 HydrophobicContact CB-CZ 3.64Å; H40-F42 WeakPolarHBondContact O-CE2 3.38Å; H40-A53 CarbonylContact O-C 3.52Å; H40-A53 WeakPolarHBondContact O-CA 3.34Å; H40-I54 PolarHBondContact N-O 2.99Å; H40-I54 PolarHBondContact O-N 2.85Å; H40-G56 PolarHBondContact CD2-O 2.9Å; H40-D57 IonicContact CE1-OD1 3.52Å; H40-D57 IonicContact NE2-OD1 3.11Å; H40-D57 PolarHBondContact NE2-OD1 3.2Å; H40-D57 VanDerWaalsContact NE2-OD1 3.11Å; H40-Q178 PolarHBondContact CD2-NE2 2.8Å; H40-Q178 PolarHBondContact CE1-NE2 2.83Å; H40-Q178 PolarHBondContact ND1-NE2 2.84Å; H40-Q178 PolarHBondContact NE2-NE2 2.8Å
41	V	96.6	Very high	88.1	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132	-177.7	-174.8	0	0	0	0	109.7	A23 E24 F26 L39 T51 F52 A53 F71	A23-V41 CarbonylContact C-O 3.58Å; A23-V41 VanDerWaalsContact CA-O 3.25Å; A23-V41 WeakPolarHBondContact CA-O 3.37Å; E24-V41 PolarHBondContact N-O 2.89Å; E24-V41 PolarHBondContact O-N 2.85Å; F26-V41 HydrophobicContact CD2-CB 4.45Å; F26-V41 HydrophobicContact CD2-CG2 3.78Å; F26-V41 HydrophobicContact CE2-CB 4.09Å; F26-V41 HydrophobicContact CE2-CG2 3.77Å; L39-V41 HydrophobicContact CD2-CG2 4.18Å; L39-V41 HydrophobicContact CG-CG2 4.1Å; V41-T51 HydrophobicContact CG1-CG2 3.28Å; V41-F52 CarbonylContact C-O 3.57Å; V41-F52 WeakPolarHBondContact CA-O 3.48Å; V41-A53 HydrophobicContact CG2-CB 4.12Å; V41-F71 HydrophobicContact CB-CD2 4.22Å; V41-F71 HydrophobicContact CG1-CB 4.4Å; V41-F71 HydrophobicContact CG1-CD2 3.7Å; V41-F71 HydrophobicContact CG1-CE2 4.34Å; V41-F71 HydrophobicContact CG1-CG 4.44Å
42	F	97.5	Very high	89.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.2	-173.4	-52.3	-96.9	0	0	0	111.4	L21 D22 A23 H40 F52 I54 M174 Q178 F181	L21-F42 HydrophobicContact CD2-CD1 4.17Å; D22-F42 CarbonylContact O-C 3.56Å; D22-F42 VanDerWaalsContact O-CA 3.26Å; D22-F42 WeakPolarHBondContact O-CA 3.23Å; A23-F42 HydrophobicContact CB-CD1 3.58Å; A23-F42 HydrophobicContact CB-CE1 3.67Å; A23-F42 HydrophobicContact CB-CG 4.46Å; H40-F42 HydrophobicContact CB-CE2 3.53Å; H40-F42 HydrophobicContact CB-CZ 3.64Å; H40-F42 WeakPolarHBondContact O-CE2 3.38Å; F42-F52 HydrophobicContact CB-CB 4.28Å; F42-F52 HydrophobicContact CD2-CB 4.48Å; F42-F52 PolarHBondContact N-O 3.11Å; F42-F52 PolarHBondContact O-N 3.47Å; F42-I54 HydrophobicContact CE2-CB 4.39Å; F42-I54 HydrophobicContact CE2-CD1 3.76Å; F42-I54 HydrophobicContact CE2-CG1 4.05Å; F42-I54 HydrophobicContact CZ-CD1 4.29Å; F42-M174 HydrophobicContact CB-CG 4.39Å; F42-M174 HydrophobicContact CB-SD 3.56Å; F42-M174 VanDerWaalsContact CB-SD 3.56Å; F42-M174 HydrophobicContact CD1-SD 4.17Å; F42-M174 HydrophobicContact CD2-CB 4.15Å; F42-M174 HydrophobicContact CE2-CB 4.42Å; F42-M174 HydrophobicContact CG-CB 4.26Å; F42-M174 HydrophobicContact CG-CG 4.38Å; F42-M174 HydrophobicContact CG-SD 3.87Å; F42-Q178 HydrophobicContact CE1-CB 4.31Å; F42-Q178 HydrophobicContact CZ-CB 3.79Å; F42-Q178 HydrophobicContact CZ-CG 4.28Å; F42-F181 HydrophobicContact CE1-CD2 4.28Å; F42-F181 HydrophobicContact CE1-CE2 4.29Å
43	H	96.6	Very high	90.7	Very high	40 Å²	40	44.7 Å²	44.7	19%	0.185	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.1	166.7	-60.6	84.8	0	0	0	108.7	L21 D22 T51 F71	L21-H43 CarbonylContact C-O 3.52Å; L21-H43 VanDerWaalsContact CA-O 3.26Å; L21-H43 WeakPolarHBondContact CA-O 3.18Å; D22-H43 PolarHBondContact N-O 3.18Å; D22-H43 PolarHBondContact O-N 2.88Å; H43-T51 PolarHBondContact NE2-OG1 3.26Å; H43-F71 AromaticContact CE1-CD1 3.57Å; H43-F71 AromaticContact CE1-CD2 3.8Å; H43-F71 AromaticContact CE1-CG 3.4Å; H43-F71 VanDerWaalsContact CE1-CG 3.4Å; H43-F71 WeakPolarHBondContact CE1-CG 3.33Å; H43-F71 AromaticContact NE2-CG 3.92Å
44	C	96.6	Very high	92.2	Very high	6 Å²	6	41.5 Å²	41.5	4%	0.041	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.3	-175	179.3	0	0	0	0	109.5	Y19 D46 Y47 M174	Y19-C44 VanDerWaalsContact CE2-SG 3.54Å; Y19-C44 PolarHBondContact OH-SG 2.84Å; C44-D46 PolarHBondContact O-N 3.21Å; C44-D46 VanDerWaalsContact O-N 3.1Å; C44-Y47 HydrophobicContact CB-CD2 4.17Å; C44-Y47 CarbonylContact O-C 3.56Å; C44-Y47 PolarHBondContact O-N 2.68Å; C44-M174 HydrophobicContact CB-CE 3.81Å
45	S	96.6	Very high	93.7	Very high	37 Å²	37	38.2 Å²	38.2	26%	0.259	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-22.9	177.4	53.6	0	0	0	0	113.8	Y19 S20 Y47	Y19-S45 WeakPolarHBondContact CD2-OG 3.37Å; S20-S45 PolarHBondContact N-OG 2.92Å; S20-S45 PolarHBondContact O-N 3.25Å; S20-S45 PolarHBondContact O-OG 3.32Å; S20-S45 WeakPolarHBondContact OG-CB 3.07Å; S45-Y47 VanDerWaalsContact C-N 3.3Å
46	D	95.2	Very high	95	Very high	43 Å²	43	32.7 Å²	32.7	23%	0.23	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-19.1	179.3	-64.7	-2.1	0	0	0	111.7	C44 P48 K95 R104	C44-D46 PolarHBondContact O-N 3.21Å; C44-D46 VanDerWaalsContact O-N 3.1Å; D46-P48 VanDerWaalsContact C-CD 3.48Å; D46-K95 WeakPolarHBondContact OD1-CE 3.33Å; D46-K95 IonicContact OD1-NZ 3.57Å; D46-K95 PolarHBondContact OD1-NZ 2.87Å; D46-R104 IonicContact OD2-CZ 3.34Å; D46-R104 IonicContact OD2-NE 2.89Å; D46-R104 PolarHBondContact OD2-NE 3.04Å; D46-R104 IonicContact OD2-NH2 3.32Å; D46-R104 PolarHBondContact OD2-NH2 3.15Å
47	Y	96.2	Very high	95.4	Very high	76 Å²	76	33.3 Å²	33.3	30%	0.298	19%	0.193	S	C	.	.	S	Bend	trans	-130	64	178.3	-51.7	-75	0	0	0	109.6	C44 S45 A49 S50 F52 P170	C44-Y47 HydrophobicContact CB-CD2 4.17Å; C44-Y47 CarbonylContact O-C 3.56Å; C44-Y47 PolarHBondContact O-N 2.68Å; S45-Y47 VanDerWaalsContact C-N 3.3Å; Y47-A49 PolarHBondContact O-N 2.9Å; Y47-A49 VanDerWaalsContact O-N 3.08Å; Y47-S50 PolarHBondContact O-N 2.97Å; Y47-F52 AromaticContact CD2-CE2 3.84Å; Y47-F52 HydrophobicContact CD2-CE2 3.84Å; Y47-F52 AromaticContact CD2-CZ 3.91Å; Y47-F52 HydrophobicContact CD2-CZ 3.91Å; Y47-F52 HydrophobicContact CG-CE2 4Å; Y47-F52 AromaticContact CG-CZ 3.91Å; Y47-F52 HydrophobicContact CG-CZ 3.91Å; Y47-P170 HydrophobicContact CD2-CB 4.29Å; Y47-P170 HydrophobicContact CE1-CB 4.17Å; Y47-P170 HydrophobicContact CE1-CG 3.77Å; Y47-P170 HydrophobicContact CE2-CB 3.68Å; Y47-P170 HydrophobicContact CE2-CG 4.15Å; Y47-P170 WeakPolarHBondContact OH-CG 3.35Å
48	P	95.6	Very high	95.3	Very high	96 Å²	96	31.5 Å²	31.5	62%	0.623	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-17.6	-169.6	27.5	-36.2	0	0	0	113.7	D46 L68	D46-P48 VanDerWaalsContact C-CD 3.48Å; P48-L68 WeakPolarHBondContact O-CD1 3.44Å
49	A	95.5	Very high	94.8	Very high	71 Å²	71	33.6 Å²	33.6	59%	0.587	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	3.5	176.9	0	0	0	0	0	113.5	Y47	Y47-A49 PolarHBondContact O-N 2.9Å; Y47-A49 VanDerWaalsContact O-N 3.08Å
50	S	96.4	Very high	94.4	Very high	39 Å²	39	40.2 Å²	40.2	27%	0.273	25%	0.248	S	C	.	.			trans	-124.7	142.3	-171.7	-55.5	0	0	0	0	112.7	Y47 A66	Y47-S50 PolarHBondContact O-N 2.97Å; S50-A66 CarbonylContact C-O 3.51Å; S50-A66 WeakPolarHBondContact CA-O 3.41Å
51	T	97.4	Very high	94.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.6	167.2	-53.1	0	0	0	0	108.1	V41 H43 A65 A66 D67 L68 F70 F71	V41-T51 HydrophobicContact CG1-CG2 3.28Å; H43-T51 PolarHBondContact NE2-OG1 3.26Å; T51-A65 WeakPolarHBondContact O-CA 3.48Å; T51-A66 PolarHBondContact N-O 2.88Å; T51-A66 PolarHBondContact O-N 3.4Å; T51-D67 WeakPolarHBondContact CB-O 3.33Å; T51-D67 PolarHBondContact OG1-O 2.88Å; T51-L68 WeakPolarHBondContact OG1-CA 3.34Å; T51-F70 HydrophobicContact CG2-CB 4.43Å; T51-F70 HydrophobicContact CG2-CD1 3.97Å; T51-F71 HydrophobicContact CG2-CB 4.3Å
52	F	97.8	Very high	94.1	Very high	10 Å²	10	44 Å²	44	4%	0.044	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.2	171	-57	-88.4	0	0	0	108.9	V41 F42 Y47 V64 A65 P170 I171 M174	V41-F52 CarbonylContact C-O 3.57Å; V41-F52 WeakPolarHBondContact CA-O 3.48Å; F42-F52 HydrophobicContact CB-CB 4.28Å; F42-F52 HydrophobicContact CD2-CB 4.48Å; F42-F52 PolarHBondContact N-O 3.11Å; F42-F52 PolarHBondContact O-N 3.47Å; Y47-F52 AromaticContact CD2-CE2 3.84Å; Y47-F52 HydrophobicContact CD2-CE2 3.84Å; Y47-F52 AromaticContact CD2-CZ 3.91Å; Y47-F52 HydrophobicContact CD2-CZ 3.91Å; Y47-F52 HydrophobicContact CG-CE2 4Å; Y47-F52 AromaticContact CG-CZ 3.91Å; Y47-F52 HydrophobicContact CG-CZ 3.91Å; F52-V64 CarbonylContact C-O 3.54Å; F52-V64 WeakPolarHBondContact CA-O 3.47Å; F52-A65 HydrophobicContact CD1-CB 3.91Å; F52-A65 HydrophobicContact CE1-CB 3.96Å; F52-P170 HydrophobicContact CE1-CB 3.8Å; F52-P170 HydrophobicContact CZ-CB 3.74Å; F52-I171 HydrophobicContact CB-CD1 4.23Å; F52-I171 HydrophobicContact CD1-CD1 4.21Å; F52-M174 HydrophobicContact CB-CG 3.79Å; F52-M174 HydrophobicContact CB-SD 4.48Å; F52-M174 HydrophobicContact CD1-CG 4.39Å; F52-M174 HydrophobicContact CD2-CE 4.08Å; F52-M174 HydrophobicContact CD2-CG 4.08Å; F52-M174 HydrophobicContact CD2-SD 4.12Å; F52-M174 HydrophobicContact CE2-CE 4.21Å; F52-M174 HydrophobicContact CG-CG 3.82Å; F52-M174 HydrophobicContact CG-SD 4.44Å
53	A	96.9	Very high	94	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.008	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.8	174.6	0	0	0	0	0	111.8	L39 H40 V41 Y63 V64 F70	L39-A53 HydrophobicContact CD1-CB 3.98Å; H40-A53 CarbonylContact O-C 3.52Å; H40-A53 WeakPolarHBondContact O-CA 3.34Å; V41-A53 HydrophobicContact CG2-CB 4.12Å; A53-Y63 CarbonylContact O-C 3.55Å; A53-Y63 WeakPolarHBondContact O-CA 3.28Å; A53-Y63 WeakPolarHBondContact O-CB 3.46Å; A53-V64 HydrophobicContact CB-CG1 3.8Å; A53-V64 PolarHBondContact N-O 2.8Å; A53-V64 PolarHBondContact O-N 3.5Å; A53-F70 HydrophobicContact CB-CD1 4.35Å; A53-F70 HydrophobicContact CB-CE1 3.55Å; A53-F70 HydrophobicContact CB-CZ 4.18Å
54	I	96.5	Very high	93.9	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	128.4	-178.9	-59.5	171.8	0	0	0	108.6	L39 H40 F42 A61 I171 M174	L39-I54 WeakPolarHBondContact CA-O 3.25Å; H40-I54 PolarHBondContact N-O 2.99Å; H40-I54 PolarHBondContact O-N 2.85Å; F42-I54 HydrophobicContact CE2-CB 4.39Å; F42-I54 HydrophobicContact CE2-CD1 3.76Å; F42-I54 HydrophobicContact CE2-CG1 4.05Å; F42-I54 HydrophobicContact CZ-CD1 4.29Å; I54-A61 HydrophobicContact CG2-CB 3.59Å; I54-I171 HydrophobicContact CD1-CD1 4.26Å; I54-I171 HydrophobicContact CG1-CD1 3.97Å; I54-M174 HydrophobicContact CD1-CB 3.99Å
55	S	94.4	Very high	93.9	Very high	46 Å²	46	54.2 Å²	54.2	32%	0.322	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	97.7	-178.9	-175.9	0	0	0	0	111.6	A61 A62	S55-A61 WeakPolarHBondContact O-CB 3.28Å; S55-A62 PolarHBondContact N-O 2.71Å
56	G	92.9	Very high	93.9	Very high	5 Å²	5	53.9 Å²	53.9	5%	0.052	34%	0.336	C	S	.	.	S	Bend	trans	99.1	179.6	-178.3	0	0	0	0	0	113.7	P38 H40	P38-G56 PolarHBondContact O-N 3.45Å; H40-G56 PolarHBondContact CD2-O 2.9Å
57	D	90.2	Very high	93.9	Very high	89 Å²	89	56.2 Å²	56.2	48%	0.476	35%	0.349	S	S	.	.	S	Bend	trans	-101.3	-1.6	-171.7	-63.7	-57.5	0	0	0	113.9	H40 Q182	H40-D57 IonicContact CE1-OD1 3.52Å; H40-D57 IonicContact NE2-OD1 3.11Å; H40-D57 PolarHBondContact NE2-OD1 3.2Å; H40-D57 VanDerWaalsContact NE2-OD1 3.11Å; D57-Q182 VanDerWaalsContact CG-NE2 3.28Å; D57-Q182 PolarHBondContact OD1-NE2 3.23Å
58	S	88	Confident	93.8	Very high	69 Å²	69	56 Å²	56	48%	0.483	35%	0.352	S	S	.	.	S	Bend	trans	-75	153.8	-178.8	-173.2	0	0	0	0	112.1	D60 A61	S58-D60 PolarHBondContact O-N 2.81Å; S58-D60 PolarHBondContact OG-N 3.14Å; S58-A61 WeakPolarHBondContact O-CB 3.48Å; S58-A61 PolarHBondContact O-N 2.87Å; S58-A61 VanDerWaalsContact O-N 3.14Å
59	A	83.2	Confident	93.7	Very high	59 Å²	59	56.2 Å²	56.2	49%	0.488	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-34.3	169.8	0	0	0	0	0	112	A61	A59-A61 VanDerWaalsContact C-N 3.26Å; A59-A61 PolarHBondContact O-N 2.9Å
60	D	86.6	Confident	93.6	Very high	153 Å²	153	55.1 Å²	55.1	82%	0.818	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	16.7	175.9	-58.4	-42.3	0	0	0	112.8	S58 A62	S58-D60 PolarHBondContact O-N 2.81Å; S58-D60 PolarHBondContact OG-N 3.14Å; D60-A62 PolarHBondContact O-N 2.91Å
61	A	91.6	Very high	93.4	Very high	9 Å²	9	55 Å²	55	7%	0.074	32%	0.323	C	S	.	.			trans	-58.9	137.8	179	0	0	0	0	0	110.9	I54 S55 S58 A59 Y63	I54-A61 HydrophobicContact CG2-CB 3.59Å; S55-A61 WeakPolarHBondContact O-CB 3.28Å; S58-A61 WeakPolarHBondContact O-CB 3.48Å; S58-A61 PolarHBondContact O-N 2.87Å; S58-A61 VanDerWaalsContact O-N 3.14Å; A59-A61 VanDerWaalsContact C-N 3.26Å; A59-A61 PolarHBondContact O-N 2.9Å; A61-Y63 PolarHBondContact O-N 2.99Å
62	A	93.9	Very high	93.1	Very high	74 Å²	74	59.8 Å²	59.8	61%	0.612	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.9	140.5	174.2	0	0	0	0	0	109.7	S55 D60	S55-A62 PolarHBondContact N-O 2.71Å; D60-A62 PolarHBondContact O-N 2.91Å
63	Y	95.5	Very high	92.8	Very high	137 Å²	137	63.9 Å²	63.9	54%	0.537	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	160.8	179.4	67.7	-95.6	0	0	0	111.8	A53 A61 I171	A53-Y63 CarbonylContact O-C 3.55Å; A53-Y63 WeakPolarHBondContact O-CA 3.28Å; A53-Y63 WeakPolarHBondContact O-CB 3.46Å; A61-Y63 PolarHBondContact O-N 2.99Å; Y63-I171 HydrophobicContact CD1-CG1 3.89Å; Y63-I171 HydrophobicContact CD2-CB 4.09Å; Y63-I171 HydrophobicContact CD2-CD1 3.7Å; Y63-I171 HydrophobicContact CD2-CG1 3.5Å; Y63-I171 HydrophobicContact CD2-CG2 4.35Å; Y63-I171 HydrophobicContact CE1-CG1 4.28Å; Y63-I171 HydrophobicContact CE1-CG2 4.17Å; Y63-I171 HydrophobicContact CE2-CB 4.06Å; Y63-I171 HydrophobicContact CE2-CG1 3.94Å; Y63-I171 HydrophobicContact CE2-CG2 3.88Å; Y63-I171 HydrophobicContact CG-CB 4.48Å; Y63-I171 HydrophobicContact CG-CD1 3.74Å; Y63-I171 HydrophobicContact CG-CG1 3.48Å; Y63-I171 VanDerWaalsContact CG-CG1 3.48Å
64	V	95.5	Very high	92.6	Very high	61 Å²	61	64.3 Å²	64.3	37%	0.37	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	139.6	172.1	63.2	0	0	0	0	109.5	F52 A53 A66 F70	F52-V64 CarbonylContact C-O 3.54Å; F52-V64 WeakPolarHBondContact CA-O 3.47Å; A53-V64 HydrophobicContact CB-CG1 3.8Å; A53-V64 PolarHBondContact N-O 2.8Å; A53-V64 PolarHBondContact O-N 3.5Å; V64-A66 HydrophobicContact CG2-CB 4.5Å; V64-F70 HydrophobicContact CG1-CE1 4.43Å; V64-F70 HydrophobicContact CG1-CE2 4.31Å; V64-F70 HydrophobicContact CG1-CZ 3.99Å
65	A	96.4	Very high	92.2	Very high	63 Å²	63	68.5 Å²	68.5	52%	0.521	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.7	163.1	0	0	0	0	0	107.4	T51 F52	T51-A65 WeakPolarHBondContact O-CA 3.48Å; F52-A65 HydrophobicContact CD1-CB 3.91Å; F52-A65 HydrophobicContact CE1-CB 3.96Å
66	A	96.3	Very high	92.1	Very high	29 Å²	29	73.9 Å²	73.9	24%	0.24	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	177.6	-177	0	0	0	0	0	110.1	S50 T51 V64 F70	S50-A66 CarbonylContact C-O 3.51Å; S50-A66 WeakPolarHBondContact CA-O 3.41Å; T51-A66 PolarHBondContact N-O 2.88Å; T51-A66 PolarHBondContact O-N 3.4Å; V64-A66 HydrophobicContact CG2-CB 4.5Å; A66-F70 HydrophobicContact CB-CB 3.69Å; A66-F70 HydrophobicContact CB-CD2 4.03Å; A66-F70 HydrophobicContact CB-CG 3.91Å
67	D	95.8	Very high	91.9	Very high	93 Å²	93	77.1 Å²	77.1	50%	0.497	42%	0.421	S	S	.	.			trans	-73	177.9	171.3	63.3	56.2	0	0	0	112.4	T51 M69 F70	T51-D67 WeakPolarHBondContact CB-O 3.33Å; T51-D67 PolarHBondContact OG1-O 2.88Å; D67-M69 PolarHBondContact O-N 2.86Å; D67-M69 WeakPolarHBondContact OD1-CA 3.22Å; D67-M69 WeakPolarHBondContact OD1-CB 3.42Å; D67-M69 PolarHBondContact OD1-N 2.83Å; D67-F70 WeakPolarHBondContact O-CB 3.38Å; D67-F70 PolarHBondContact O-N 2.66Å; D67-F70 PolarHBondContact OD1-N 3.31Å
68	L	92.7	Very high	91.2	Very high	71 Å²	71	80 Å²	80	37%	0.372	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.4	-179.8	-62.2	179.7	0	0	0	114.2	P48 T51 F70	P48-L68 WeakPolarHBondContact O-CD1 3.44Å; T51-L68 WeakPolarHBondContact OG1-CA 3.34Å; L68-F70 PolarHBondContact O-N 2.91Å
69	M	93.8	Very high	91	Very high	101 Å²	101	84 Å²	84	50%	0.498	45%	0.448	S	S	.	.	H	α-helix	trans	-71.9	-21.3	179.5	-57.1	-63.7	98.3	0	0	111.6	D67 F71 Q72 L73	D67-M69 PolarHBondContact O-N 2.86Å; D67-M69 WeakPolarHBondContact OD1-CA 3.22Å; D67-M69 WeakPolarHBondContact OD1-CB 3.42Å; D67-M69 PolarHBondContact OD1-N 2.83Å; M69-F71 VanDerWaalsContact C-N 3.32Å; M69-F71 PolarHBondContact O-N 3.21Å; M69-Q72 PolarHBondContact O-N 2.76Å; M69-Q72 PolarHBondContact SD-OE1 2.83Å; M69-Q72 VanDerWaalsContact SD-OE1 3.38Å; M69-L73 WeakPolarHBondContact O-CB 3.46Å; M69-L73 PolarHBondContact O-N 2.97Å
70	F	94	Very high	91.3	Very high	47 Å²	47	83.2 Å²	83.2	21%	0.206	44%	0.441	C	S	.	.	H	α-helix	trans	-55.5	-45.8	175	-174.4	-95	0	0	0	112.1	T51 A53 V64 A66 D67 L68 Q72 L73 I74	T51-F70 HydrophobicContact CG2-CB 4.43Å; T51-F70 HydrophobicContact CG2-CD1 3.97Å; A53-F70 HydrophobicContact CB-CD1 4.35Å; A53-F70 HydrophobicContact CB-CE1 3.55Å; A53-F70 HydrophobicContact CB-CZ 4.18Å; V64-F70 HydrophobicContact CG1-CE1 4.43Å; V64-F70 HydrophobicContact CG1-CE2 4.31Å; V64-F70 HydrophobicContact CG1-CZ 3.99Å; A66-F70 HydrophobicContact CB-CB 3.69Å; A66-F70 HydrophobicContact CB-CD2 4.03Å; A66-F70 HydrophobicContact CB-CG 3.91Å; D67-F70 WeakPolarHBondContact O-CB 3.38Å; D67-F70 PolarHBondContact O-N 2.66Å; D67-F70 PolarHBondContact OD1-N 3.31Å; L68-F70 PolarHBondContact O-N 2.91Å; F70-Q72 VanDerWaalsContact C-N 3.35Å; F70-Q72 PolarHBondContact O-N 3.02Å; F70-L73 WeakPolarHBondContact O-CB 3.48Å; F70-L73 PolarHBondContact O-N 3.13Å; F70-I74 HydrophobicContact CD1-CG1 4.19Å; F70-I74 HydrophobicContact CE1-CD1 4.17Å; F70-I74 HydrophobicContact CE1-CG1 3.79Å; F70-I74 HydrophobicContact CZ-CD1 3.99Å; F70-I74 HydrophobicContact CZ-CG1 4.13Å; F70-I74 WeakPolarHBondContact O-CG1 3.1Å; F70-I74 PolarHBondContact O-N 2.88Å
71	F	91.1	Very high	91.5	Very high	37 Å²	37	79.1 Å²	79.1	16%	0.162	41%	0.414	C	S	.	.	H	α-helix	trans	-64.9	-38.7	178.6	-178.6	-126.3	0	0	0	113	E24 F26 V41 H43 T51 M69 L73 I74 K75	E24-F71 HydrophobicContact CB-CE2 4.11Å; E24-F71 HydrophobicContact CB-CZ 4.43Å; E24-F71 WeakPolarHBondContact OE2-CE2 3.49Å; E24-F71 WeakPolarHBondContact OE2-CZ 3.41Å; F26-F71 HydrophobicContact CE2-CD2 4.11Å; F26-F71 AromaticContact CE2-CE2 3.76Å; F26-F71 HydrophobicContact CE2-CE2 3.76Å; F26-F71 HydrophobicContact CZ-CD2 4.1Å; F26-F71 AromaticContact CZ-CE2 3.64Å; F26-F71 HydrophobicContact CZ-CE2 3.64Å; V41-F71 HydrophobicContact CB-CD2 4.22Å; V41-F71 HydrophobicContact CG1-CB 4.4Å; V41-F71 HydrophobicContact CG1-CD2 3.7Å; V41-F71 HydrophobicContact CG1-CE2 4.34Å; V41-F71 HydrophobicContact CG1-CG 4.44Å; H43-F71 AromaticContact CE1-CD1 3.57Å; H43-F71 AromaticContact CE1-CD2 3.8Å; H43-F71 AromaticContact CE1-CG 3.4Å; H43-F71 VanDerWaalsContact CE1-CG 3.4Å; H43-F71 WeakPolarHBondContact CE1-CG 3.33Å; H43-F71 AromaticContact NE2-CG 3.92Å; T51-F71 HydrophobicContact CG2-CB 4.3Å; M69-F71 VanDerWaalsContact C-N 3.32Å; M69-F71 PolarHBondContact O-N 3.21Å; F71-L73 VanDerWaalsContact C-N 3.32Å; F71-I74 PolarHBondContact O-N 2.62Å; F71-K75 HydrophobicContact CE1-CD 4.21Å; F71-K75 HydrophobicContact CZ-CD 4.28Å; F71-K75 PolarHBondContact O-N 3.33Å
72	Q	91.7	Very high	91.5	Very high	100 Å²	100	82 Å²	82	47%	0.467	43%	0.431	S	S	.	.	H	α-helix	trans	-65.3	-39.1	175.4	-61.7	-173.2	-8.9	0	0	111.5	M69 F70 K75 K76	M69-Q72 PolarHBondContact O-N 2.76Å; M69-Q72 PolarHBondContact SD-OE1 2.83Å; M69-Q72 VanDerWaalsContact SD-OE1 3.38Å; F70-Q72 VanDerWaalsContact C-N 3.35Å; F70-Q72 PolarHBondContact O-N 3.02Å; Q72-K75 PolarHBondContact O-N 3.27Å; Q72-K76 WeakPolarHBondContact O-CG 3.31Å; Q72-K76 PolarHBondContact O-N 3.23Å; Q72-K76 VanDerWaalsContact O-N 3.16Å
73	L	92.7	Very high	91.3	Very high	96 Å²	96	81.9 Å²	81.9	50%	0.503	42%	0.423	S	S	.	.	H	α-helix	trans	-59.8	-50.5	175.5	178.9	65	0	0	0	110.7	M69 F70 F71 K75 K76 L77	M69-L73 WeakPolarHBondContact O-CB 3.46Å; M69-L73 PolarHBondContact O-N 2.97Å; F70-L73 WeakPolarHBondContact O-CB 3.48Å; F70-L73 PolarHBondContact O-N 3.13Å; F71-L73 VanDerWaalsContact C-N 3.32Å; L73-K75 VanDerWaalsContact C-N 3.29Å; L73-K75 PolarHBondContact O-N 2.96Å; L73-K76 PolarHBondContact O-N 3.39Å; L73-L77 WeakPolarHBondContact O-CG 3.39Å; L73-L77 PolarHBondContact O-N 2.67Å
74	I	92.1	Very high	90.9	Very high	10 Å²	10	80.3 Å²	80.3	5%	0.051	42%	0.419	C	S	.	.	H	α-helix	trans	-57.2	-42.3	178.7	-63	-56.7	0	0	0	111.5	F26 L39 F70 F71 K76 L77 Y81	F26-I74 HydrophobicContact CB-CG2 4.32Å; F26-I74 HydrophobicContact CD1-CG2 3.63Å; F26-I74 HydrophobicContact CD2-CG2 3.85Å; F26-I74 HydrophobicContact CE1-CG2 3.81Å; F26-I74 HydrophobicContact CE2-CG2 4.02Å; F26-I74 HydrophobicContact CG-CG2 3.65Å; F26-I74 HydrophobicContact CZ-CG2 4Å; L39-I74 HydrophobicContact CD2-CD1 3.69Å; L39-I74 HydrophobicContact CD2-CG1 3.99Å; L39-I74 HydrophobicContact CD2-CG2 4.27Å; F70-I74 HydrophobicContact CD1-CG1 4.19Å; F70-I74 HydrophobicContact CE1-CD1 4.17Å; F70-I74 HydrophobicContact CE1-CG1 3.79Å; F70-I74 HydrophobicContact CZ-CD1 3.99Å; F70-I74 HydrophobicContact CZ-CG1 4.13Å; F70-I74 WeakPolarHBondContact O-CG1 3.1Å; F70-I74 PolarHBondContact O-N 2.88Å; F71-I74 PolarHBondContact O-N 2.62Å; I74-K76 VanDerWaalsContact C-N 3.27Å; I74-K76 PolarHBondContact O-N 3.26Å; I74-L77 HydrophobicContact CD1-CD1 4.29Å; I74-L77 PolarHBondContact O-N 3.07Å; I74-L77 VanDerWaalsContact O-N 3.14Å; I74-Y81 HydrophobicContact CD1-CE2 4.36Å; I74-Y81 HydrophobicContact CG2-CD2 4.34Å
75	K	88.7	Confident	90.4	Very high	89 Å²	89	82.2 Å²	82.2	39%	0.387	43%	0.432	S	S	.	.	H	α-helix	trans	-65.1	-27.7	177.5	-75	-175.8	171.2	177.2	0	114.1	E24 F26 F71 Q72 L73	E24-K75 VanDerWaalsContact OE2-CE 3.24Å; E24-K75 WeakPolarHBondContact OE2-CE 3.07Å; E24-K75 IonicContact OE2-NZ 2.84Å; E24-K75 PolarHBondContact OE2-NZ 3.22Å; F26-K75 HydrophobicContact CE1-CG 4.1Å; F26-K75 HydrophobicContact CZ-CG 4.1Å; F71-K75 HydrophobicContact CE1-CD 4.21Å; F71-K75 HydrophobicContact CZ-CD 4.28Å; F71-K75 PolarHBondContact O-N 3.33Å; Q72-K75 PolarHBondContact O-N 3.27Å; L73-K75 VanDerWaalsContact C-N 3.29Å; L73-K75 PolarHBondContact O-N 2.96Å
76	K	91.3	Very high	89.8	Confident	160 Å²	160	81.9 Å²	81.9	70%	0.696	42%	0.421	S	S	*	.	H	α-helix	trans	-79.7	-17.8	175.9	-72.2	179.7	178.6	-180	0	112.7	Q72 L73 I74 Q78	Q72-K76 WeakPolarHBondContact O-CG 3.31Å; Q72-K76 PolarHBondContact O-N 3.23Å; Q72-K76 VanDerWaalsContact O-N 3.16Å; L73-K76 PolarHBondContact O-N 3.39Å; I74-K76 VanDerWaalsContact C-N 3.27Å; I74-K76 PolarHBondContact O-N 3.26Å; K76-Q78 PolarHBondContact O-N 3.34Å
77	L	88.7	Confident	89.5	Confident	72 Å²	72	80.7 Å²	80.7	38%	0.377	41%	0.411	S	S	.	.			trans	-80.1	52.9	174.7	-61.1	175.9	0	0	0	111.7	L73 I74 N79 A80 Y81	L73-L77 WeakPolarHBondContact O-CG 3.39Å; L73-L77 PolarHBondContact O-N 2.67Å; I74-L77 HydrophobicContact CD1-CD1 4.29Å; I74-L77 PolarHBondContact O-N 3.07Å; I74-L77 VanDerWaalsContact O-N 3.14Å; L77-N79 PolarHBondContact O-N 3.45Å; L77-A80 HydrophobicContact CB-CB 3.93Å; L77-A80 PolarHBondContact O-N 3.1Å; L77-Y81 HydrophobicContact CB-CD2 4.33Å; L77-Y81 HydrophobicContact CD1-CD2 4.43Å; L77-Y81 HydrophobicContact CD1-CE2 4.33Å; L77-Y81 PolarHBondContact O-N 3.38Å
78	Q	76.5	Confident	89.4	Confident	150 Å²	150	81.5 Å²	81.5	70%	0.701	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.3	-172.2	-66.3	179.2	-19.5	0	0	114.1	K76	K76-Q78 PolarHBondContact O-N 3.34Å
79	N	83.9	Confident	89.5	Confident	154 Å²	154	78.1 Å²	78.1	82%	0.824	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-6.1	178.3	-63.4	-28.4	0	0	0	113.6	L77	L77-N79 PolarHBondContact O-N 3.45Å
80	A	87.6	Confident	89.5	Confident	42 Å²	42	78.1 Å²	78.1	35%	0.347	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-32.7	176.5	0	0	0	0	0	111.8	P28 V29 L77	P28-A80 CarbonylContact C-O 3.54Å; P28-A80 VanDerWaalsContact CA-O 3.26Å; P28-A80 WeakPolarHBondContact CA-O 3.36Å; V29-A80 PolarHBondContact N-O 3.47Å; L77-A80 HydrophobicContact CB-CB 3.93Å; L77-A80 PolarHBondContact O-N 3.1Å
81	Y	91.1	Very high	89.6	Confident	66 Å²	66	75.9 Å²	75.9	26%	0.259	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	142	-176.8	-67.3	-82.5	0	0	0	112.8	F26 Y27 P28 L39 I74 L77	F26-Y81 HydrophobicContact CB-CD1 3.8Å; F26-Y81 HydrophobicContact CB-CG 4.14Å; Y27-Y81 CarbonylContact O-C 3.53Å; Y27-Y81 VanDerWaalsContact O-CA 3.3Å; Y27-Y81 WeakPolarHBondContact O-CA 3.47Å; P28-Y81 HydrophobicContact CB-CD1 4.37Å; P28-Y81 HydrophobicContact CB-CE1 4.19Å; P28-Y81 HydrophobicContact CG-CD1 4.28Å; P28-Y81 HydrophobicContact CG-CE1 3.86Å; L39-Y81 HydrophobicContact CB-CE1 4.06Å; L39-Y81 HydrophobicContact CD2-CE1 4.36Å; I74-Y81 HydrophobicContact CD1-CE2 4.36Å; I74-Y81 HydrophobicContact CG2-CD2 4.34Å; L77-Y81 HydrophobicContact CB-CD2 4.33Å; L77-Y81 HydrophobicContact CD1-CD2 4.43Å; L77-Y81 HydrophobicContact CD1-CE2 4.33Å; L77-Y81 PolarHBondContact O-N 3.38Å
82	V	91.2	Very high	89.9	Confident	69 Å²	69	79 Å²	79	42%	0.418	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	153.1	171.1	-68.4	0	0	0	0	110.8	Y27 V29	Y27-V82 PolarHBondContact N-O 3.42Å; Y27-V82 PolarHBondContact O-N 2.87Å; V29-V82 HydrophobicContact CG2-CG1 3.7Å
83	T	90	Very high	90.1	Very high	72 Å²	72	75.1 Å²	75.1	44%	0.442	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	155	172	56.3	0	0	0	0	110.1	E24 F26	E24-T83 HydrophobicContact CG-CG2 4.38Å; F26-T83 HydrophobicContact CD1-CG2 3.58Å; F26-T83 HydrophobicContact CE1-CG2 3.65Å; F26-T83 HydrophobicContact CG-CG2 4.37Å; F26-T83 HydrophobicContact CZ-CG2 4.47Å
84	K	88.1	Confident	90.3	Very high	105 Å²	105	73.4 Å²	73.4	46%	0.457	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	157.3	176.8	-63.3	-178.3	-171.6	178.7	0	109.1	Y27 I86 S87	Y27-K84 HydrophobicContact CD2-CB 4.45Å; Y27-K84 HydrophobicContact CD2-CD 3.81Å; Y27-K84 HydrophobicContact CD2-CG 3.69Å; Y27-K84 HydrophobicContact CE1-CD 4.43Å; Y27-K84 HydrophobicContact CE2-CB 4.02Å; Y27-K84 HydrophobicContact CE2-CD 3.53Å; Y27-K84 HydrophobicContact CE2-CG 3.62Å; Y27-K84 HydrophobicContact CG-CD 4.36Å; K84-I86 PolarHBondContact O-N 2.85Å; K84-S87 WeakPolarHBondContact O-CB 3.46Å; K84-S87 PolarHBondContact O-N 3.15Å; K84-S87 PolarHBondContact O-OG 3.46Å
85	P	83.8	Confident	90.5	Very high	101 Å²	101	75 Å²	75	66%	0.656	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.3	-34.8	-176.7	-30.4	36.3	0	0	0	115.5
86	I	85.4	Confident	90.9	Very high	56 Å²	56	70.9 Å²	70.9	29%	0.287	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	18	179.3	62.9	168.6	0	0	0	113.8	K84 I110 R185	K84-I86 PolarHBondContact O-N 2.85Å; I86-I110 HydrophobicContact CB-CG2 4.01Å; I86-I110 HydrophobicContact CG2-CG2 4.29Å; I86-R185 HydrophobicContact CD1-CB 4.42Å; I86-R185 HydrophobicContact CD1-CG 4.43Å; I86-R185 PolarHBondContact O-NE 3.23Å; I86-R185 VanDerWaalsContact O-NE 3.12Å
87	S	89.6	Confident	91.2	Very high	4 Å²	4	69 Å²	69	3%	0.028	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	-26.6	-174.9	67.7	0	0	0	0	113.7	T25 K84 R185	T25-S87 PolarHBondContact N-O 2.89Å; T25-S87 WeakPolarHBondContact O-CB 3.37Å; K84-S87 WeakPolarHBondContact O-CB 3.46Å; K84-S87 PolarHBondContact O-N 3.15Å; K84-S87 PolarHBondContact O-OG 3.46Å; S87-R185 PolarHBondContact O-NH2 2.83Å
88	K	93.1	Very high	91.6	Very high	109 Å²	109	67.1 Å²	67.1	47%	0.474	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	135.4	-178.4	-68.3	-178.7	-180	176.4	0	111.2	A23 E24	A23-K88 CarbonylContact O-C 3.49Å; A23-K88 WeakPolarHBondContact O-CA 3.24Å; E24-K88 HydrophobicContact CB-CG 4.24Å; E24-K88 HydrophobicContact CG-CG 3.82Å; E24-K88 WeakPolarHBondContact OE1-CE 3.47Å; E24-K88 IonicContact OE1-NZ 2.8Å; E24-K88 WeakPolarHBondContact OE2-CE 3.48Å
89	V	94.4	Very high	92.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130.5	174.2	-167	0	0	0	0	108	A23 A108 S109 I110 F181	A23-V89 HydrophobicContact CB-CB 4.46Å; A23-V89 PolarHBondContact N-O 2.75Å; A23-V89 PolarHBondContact O-N 2.79Å; V89-A108 HydrophobicContact CG1-CB 4.31Å; V89-S109 WeakPolarHBondContact CA-O 3.47Å; V89-S109 WeakPolarHBondContact CG1-O 3.26Å; V89-I110 HydrophobicContact CB-CG1 4.31Å; V89-I110 HydrophobicContact CG1-CG1 3.96Å; V89-I110 HydrophobicContact CG2-CD1 3.82Å; V89-I110 HydrophobicContact CG2-CG1 3.83Å; V89-F181 HydrophobicContact CB-CD1 4.42Å; V89-F181 HydrophobicContact CB-CD2 4.05Å; V89-F181 HydrophobicContact CB-CE2 4.17Å; V89-F181 HydrophobicContact CB-CG 4.17Å; V89-F181 HydrophobicContact CB-CZ 4.41Å; V89-F181 HydrophobicContact CG1-CD1 3.68Å; V89-F181 HydrophobicContact CG1-CD2 4.17Å; V89-F181 HydrophobicContact CG1-CE1 3.7Å; V89-F181 HydrophobicContact CG1-CE2 4.17Å; V89-F181 HydrophobicContact CG1-CG 3.92Å; V89-F181 HydrophobicContact CG1-CZ 3.93Å; V89-F181 HydrophobicContact CG2-CB 4.17Å; V89-F181 HydrophobicContact CG2-CD2 4.17Å; V89-F181 HydrophobicContact CG2-CG 4.09Å
90	E	95	Very high	93.2	Very high	101 Å²	101	60.2 Å²	60.2	47%	0.472	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.5	176.2	-61.5	-176.4	177.7	0	0	108.6	A108 S109	E90-A108 CarbonylContact O-C 3.59Å; E90-A108 WeakPolarHBondContact O-CA 3.32Å; E90-S109 PolarHBondContact N-O 2.87Å; E90-S109 PolarHBondContact O-N 3.05Å; E90-S109 PolarHBondContact O-OG 3.38Å
91	C	96.2	Very high	93.6	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.1	174.9	-171	0	0	0	0	109	S20 L21 S106 V107 A108 Y177 F181	S20-C91 CarbonylContact C-O 3.53Å; S20-C91 WeakPolarHBondContact CA-O 3.45Å; L21-C91 HydrophobicContact CB-CB 4.18Å; L21-C91 PolarHBondContact N-O 3.43Å; L21-C91 WeakPolarHBondContact O-CA 3.39Å; L21-C91 WeakPolarHBondContact O-CB 3.32Å; L21-C91 PolarHBondContact O-N 2.88Å; C91-S106 WeakPolarHBondContact SG-CB 3.27Å; C91-V107 WeakPolarHBondContact CA-O 3.47Å; C91-A108 HydrophobicContact CB-CB 4.41Å; C91-Y177 HydrophobicContact CB-CE1 4.49Å; C91-F181 HydrophobicContact CB-CZ 4.19Å
92	R	96.4	Very high	93.9	Very high	102 Å²	102	57.3 Å²	57.3	39%	0.385	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	141.8	-178	-65.7	-65.8	-178	-83.2	1.2	111.1	Y19 S20 L21 D22 S106 V107	Y19-R92 WeakPolarHBondContact O-CA 3.26Å; S20-R92 VanDerWaalsContact CB-CZ 3.42Å; L21-R92 PolarHBondContact O-NH1 3.05Å; D22-R92 IonicContact OD1-CZ 3.2Å; D22-R92 IonicContact OD1-NH1 3.17Å; D22-R92 PolarHBondContact OD1-NH1 2.96Å; D22-R92 IonicContact OD1-NH2 2.88Å; D22-R92 PolarHBondContact OD1-NH2 2.76Å; D22-R92 IonicContact OD2-CZ 2.79Å; D22-R92 IonicContact OD2-NH1 3.66Å; D22-R92 IonicContact OD2-NH2 2.75Å; D22-R92 PolarHBondContact OD2-NH2 3.46Å; R92-S106 CarbonylContact O-C 3.21Å; R92-S106 VanDerWaalsContact O-CA 3.28Å; R92-S106 WeakPolarHBondContact O-CA 3.21Å; R92-S106 WeakPolarHBondContact O-CB 3.48Å; R92-V107 PolarHBondContact N-O 3.5Å; R92-V107 PolarHBondContact O-N 3.41Å
93	G	95.7	Very high	94.1	Very high	20 Å²	20	54 Å²	54	21%	0.206	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.3	-169.3	-178.7	0	0	0	0	0	114.8	V18 Y19 A105	V18-G93 WeakPolarHBondContact CA-O 3.33Å; Y19-G93 PolarHBondContact N-O 2.87Å; Y19-G93 PolarHBondContact O-N 3.44Å; G93-A105 WeakPolarHBondContact CA-O 3.38Å
94	K	96.7	Very high	94.4	Very high	59 Å²	59	51.6 Å²	51.6	26%	0.257	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	149.3	178.3	-70.6	176.7	-178.4	170.6	0	111.2	E5 G17 Y96 R104 A105	E5-K94 WeakPolarHBondContact OE1-CD 3.03Å; E5-K94 IonicContact OE1-NZ 3.63Å; G17-K94 WeakPolarHBondContact O-CA 3.4Å; K94-Y96 HydrophobicContact CB-CD2 4.17Å; K94-Y96 HydrophobicContact CB-CE2 3.48Å; K94-Y96 VanDerWaalsContact CB-CE2 3.48Å; K94-Y96 HydrophobicContact CD-CE2 4.18Å; K94-Y96 WeakPolarHBondContact CD-OH 3.3Å; K94-R104 WeakPolarHBondContact O-CA 3.41Å; K94-A105 PolarHBondContact N-O 2.96Å; K94-A105 PolarHBondContact O-N 3.09Å
95	K	97.4	Very high	94.7	Very high	45 Å²	45	46.9 Å²	46.9	20%	0.196	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	137.6	170.2	-65.4	178.1	173.5	165.5	0	109.1	N15 V16 G17 V18 D46 I103 R104	N15-K95 WeakPolarHBondContact CA-O 3.17Å; N15-K95 PolarHBondContact OD1-O 3.23Å; V16-K95 HydrophobicContact CG2-CB 3.67Å; V16-K95 PolarHBondContact N-O 2.84Å; G17-K95 PolarHBondContact O-N 2.8Å; V18-K95 VanDerWaalsContact O-CD 3.31Å; V18-K95 WeakPolarHBondContact O-CD 3.38Å; V18-K95 WeakPolarHBondContact O-CE 3.44Å; V18-K95 PolarHBondContact O-NZ 2.68Å; D46-K95 WeakPolarHBondContact OD1-CE 3.33Å; D46-K95 IonicContact OD1-NZ 3.57Å; D46-K95 PolarHBondContact OD1-NZ 2.87Å; K95-I103 CarbonylContact C-O 3.57Å; K95-I103 WeakPolarHBondContact CA-O 3.49Å; K95-R104 HydrophobicContact CG-CG 4.34Å
96	Y	97.7	Very high	95.2	Very high	2 Å²	2	42.1 Å²	42.1	1%	0.008	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	148.6	177.1	-64.6	-89.9	0	0	0	109.9	E5 I8 E9 A13 T14 N15 K94 I103 A105	E5-Y96 HydrophobicContact CG-CE2 4.38Å; I8-Y96 HydrophobicContact CD1-CD2 4.37Å; I8-Y96 HydrophobicContact CG2-CD1 3.68Å; I8-Y96 HydrophobicContact CG2-CD2 3.87Å; I8-Y96 HydrophobicContact CG2-CE1 4.18Å; I8-Y96 HydrophobicContact CG2-CE2 4.34Å; I8-Y96 HydrophobicContact CG2-CG 3.49Å; I8-Y96 VanDerWaalsContact CG2-CG 3.49Å; E9-Y96 HydrophobicContact CG-CD1 4.36Å; E9-Y96 HydrophobicContact CG-CE1 3.59Å; E9-Y96 VanDerWaalsContact OE1-CE1 3.31Å; E9-Y96 WeakPolarHBondContact OE1-CE1 3.4Å; E9-Y96 PolarHBondContact OE1-OH 3.1Å; A13-Y96 HydrophobicContact CB-CD1 4.42Å; T14-Y96 CarbonylContact O-C 3.49Å; T14-Y96 WeakPolarHBondContact O-CA 3.38Å; N15-Y96 HydrophobicContact CB-CD1 4.1Å; N15-Y96 HydrophobicContact CB-CE1 3.88Å; K94-Y96 HydrophobicContact CB-CD2 4.17Å; K94-Y96 HydrophobicContact CB-CE2 3.48Å; K94-Y96 VanDerWaalsContact CB-CE2 3.48Å; K94-Y96 HydrophobicContact CD-CE2 4.18Å; K94-Y96 WeakPolarHBondContact CD-OH 3.3Å; Y96-I103 PolarHBondContact N-O 3.33Å; Y96-I103 PolarHBondContact O-N 2.83Å; Y96-A105 HydrophobicContact CE2-CB 4.37Å
97	K	97.8	Very high	95.6	Very high	119 Å²	119	42.7 Å²	42.7	52%	0.517	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	129.8	171.6	-174.4	179.1	179.7	-178.9	0	109.6	A13 T14 V16 A99 F101	A13-K97 WeakPolarHBondContact CA-O 3.21Å; T14-K97 PolarHBondContact N-O 2.79Å; T14-K97 PolarHBondContact O-N 2.87Å; T14-K97 PolarHBondContact OG1-O 3.39Å; V16-K97 HydrophobicContact CG1-CB 3.81Å; V16-K97 HydrophobicContact CG2-CB 4.45Å; K97-A99 WeakPolarHBondContact CE-O 3.5Å; K97-F101 WeakPolarHBondContact CA-O 3.35Å
98	L	97.1	Very high	95.8	Very high	33 Å²	33	42.5 Å²	42.5	17%	0.173	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	106.5	175	178.7	55.4	0	0	0	108.8	M11 A13 D100 F101 I103 F143	M11-L98 HydrophobicContact CB-CD2 3.9Å; M11-L98 HydrophobicContact CE-CD2 4.37Å; M11-L98 WeakPolarHBondContact O-CD1 3.37Å; A13-L98 HydrophobicContact CB-CB 3.8Å; A13-L98 HydrophobicContact CB-CD2 4.4Å; A13-L98 HydrophobicContact CB-CG 4.49Å; L98-D100 PolarHBondContact O-N 3.49Å; L98-D100 VanDerWaalsContact O-N 3.11Å; L98-F101 PolarHBondContact N-O 3.46Å; L98-F101 WeakPolarHBondContact O-CB 3.37Å; L98-F101 PolarHBondContact O-N 3.02Å; L98-I103 HydrophobicContact CB-CD1 4.45Å; L98-F143 HydrophobicContact CD2-CE2 3.84Å; L98-F143 HydrophobicContact CD2-CZ 4.1Å
99	A	95.5	Very high	95.8	Very high	76 Å²	76	38.9 Å²	38.9	63%	0.628	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	-116.7	-171.5	0	0	0	0	0	111.6	K97 F101	K97-A99 WeakPolarHBondContact CE-O 3.5Å; A99-F101 VanDerWaalsContact C-N 3.34Å
100	D	96.6	Very high	95.6	Very high	84 Å²	84	38.9 Å²	38.9	45%	0.449	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-0.7	-179.5	-63.9	-34	0	0	0	113.9	L98 Y127 T128 P129	L98-D100 PolarHBondContact O-N 3.49Å; L98-D100 VanDerWaalsContact O-N 3.11Å; D100-Y127 HydrophobicContact CB-CD2 4.15Å; D100-Y127 HydrophobicContact CB-CE2 3.74Å; D100-T128 WeakPolarHBondContact O-CB 3.42Å; D100-T128 PolarHBondContact O-N 3.48Å; D100-T128 PolarHBondContact O-OG1 3.22Å; D100-P129 HydrophobicContact CB-CG 3.75Å
101	F	97	Very high	94.7	Very high	21 Å²	21	41.4 Å²	41.4	9%	0.092	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	134	-179.3	-64.3	-88.3	0	0	0	111.9	K97 L98 A99 V125 E126 Y127 L139 F143	K97-F101 WeakPolarHBondContact CA-O 3.35Å; L98-F101 PolarHBondContact N-O 3.46Å; L98-F101 WeakPolarHBondContact O-CB 3.37Å; L98-F101 PolarHBondContact O-N 3.02Å; A99-F101 VanDerWaalsContact C-N 3.34Å; F101-V125 HydrophobicContact CD1-CG1 3.83Å; F101-V125 HydrophobicContact CE1-CG1 4.45Å; F101-E126 WeakPolarHBondContact CA-O 2.89Å; F101-Y127 HydrophobicContact CD1-CD2 4.16Å; F101-Y127 AromaticContact CE1-CD2 3.74Å; F101-Y127 HydrophobicContact CE1-CD2 3.74Å; F101-Y127 HydrophobicContact CE1-CG 4.2Å; F101-Y127 HydrophobicContact CE2-CD2 4.21Å; F101-Y127 AromaticContact CZ-CD2 3.77Å; F101-Y127 HydrophobicContact CZ-CD2 3.77Å; F101-Y127 HydrophobicContact CZ-CE2 4.37Å; F101-L139 HydrophobicContact CZ-CD1 4.49Å; F101-L139 HydrophobicContact CZ-CD2 4.29Å; F101-L139 HydrophobicContact CZ-CG 4.09Å; F101-F143 HydrophobicContact CB-CE1 4.42Å; F101-F143 HydrophobicContact CB-CE2 4.47Å; F101-F143 HydrophobicContact CB-CZ 4.1Å; F101-F143 HydrophobicContact CD1-CD1 4.02Å; F101-F143 HydrophobicContact CD1-CD2 4.46Å; F101-F143 HydrophobicContact CD1-CE1 4.15Å; F101-F143 HydrophobicContact CD1-CG 4.18Å; F101-F143 HydrophobicContact CD1-CZ 4.41Å; F101-F143 AromaticContact CD2-CD2 3.93Å; F101-F143 HydrophobicContact CD2-CD2 3.93Å; F101-F143 AromaticContact CD2-CE2 3.84Å; F101-F143 HydrophobicContact CD2-CE2 3.84Å; F101-F143 HydrophobicContact CD2-CG 4.42Å; F101-F143 HydrophobicContact CD2-CZ 4.28Å; F101-F143 HydrophobicContact CE1-CB 4.11Å; F101-F143 HydrophobicContact CE1-CD1 4.06Å; F101-F143 HydrophobicContact CE1-CD2 4.32Å; F101-F143 AromaticContact CE1-CG 3.89Å; F101-F143 HydrophobicContact CE1-CG 3.89Å; F101-F143 AromaticContact CE2-CD2 3.78Å; F101-F143 HydrophobicContact CE2-CD2 3.78Å; F101-F143 HydrophobicContact CE2-CE2 4.18Å; F101-F143 HydrophobicContact CE2-CG 4.16Å; F101-F143 HydrophobicContact CG-CD1 4.4Å; F101-F143 HydrophobicContact CG-CD2 4.26Å; F101-F143 HydrophobicContact CG-CE1 4.2Å; F101-F143 HydrophobicContact CG-CE2 4.05Å; F101-F143 HydrophobicContact CG-CG 4.42Å; F101-F143 HydrophobicContact CG-CZ 4.02Å; F101-F143 HydrophobicContact CZ-CB 3.93Å; F101-F143 HydrophobicContact CZ-CD1 4.49Å; F101-F143 AromaticContact CZ-CD2 3.97Å; F101-F143 HydrophobicContact CZ-CD2 3.97Å; F101-F143 AromaticContact CZ-CG 3.87Å; F101-F143 HydrophobicContact CZ-CG 3.87Å
102	A	96.9	Very high	93.4	Very high	25 Å²	25	42.7 Å²	42.7	21%	0.207	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.6	162.9	0	0	0	0	0	109	E126 T128	A102-E126 HydrophobicContact CB-CB 4.3Å; A102-E126 PolarHBondContact N-O 3.19Å; A102-E126 PolarHBondContact O-N 3.19Å; A102-T128 HydrophobicContact CB-CG2 4.26Å
103	I	96.3	Very high	91.8	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	132.2	-178.3	-53	165.2	0	0	0	108.4	I8 K95 Y96 L98 I123 Q124 F143 M147	I8-I103 HydrophobicContact CD1-CG2 3.72Å; I8-I103 HydrophobicContact CG1-CG2 4.34Å; I8-I103 HydrophobicContact CG2-CD1 4.21Å; K95-I103 CarbonylContact C-O 3.57Å; K95-I103 WeakPolarHBondContact CA-O 3.49Å; Y96-I103 PolarHBondContact N-O 3.33Å; Y96-I103 PolarHBondContact O-N 2.83Å; L98-I103 HydrophobicContact CB-CD1 4.45Å; I103-I123 HydrophobicContact CG2-CG2 4.24Å; I103-Q124 CarbonylContact C-O 3.54Å; I103-Q124 WeakPolarHBondContact CA-O 3.43Å; I103-F143 HydrophobicContact CD1-CE1 4.03Å; I103-F143 HydrophobicContact CD1-CZ 3.65Å; I103-F143 HydrophobicContact CG1-CE1 4.25Å; I103-F143 HydrophobicContact CG1-CZ 4.24Å; I103-M147 HydrophobicContact CD1-SD 4.18Å
104	R	95.6	Very high	90.1	Very high	21 Å²	21	49.7 Å²	49.7	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	112.7	174.4	-49	170.2	177.6	79.6	-8.3	107.7	Y19 D46 K94 K95 I123 Q124 E126	Y19-R104 HydrophobicContact CD1-CB 4.49Å; Y19-R104 HydrophobicContact CD2-CG 4.39Å; Y19-R104 HydrophobicContact CG-CB 4.33Å; Y19-R104 HydrophobicContact CG-CG 4.41Å; D46-R104 IonicContact OD2-CZ 3.34Å; D46-R104 IonicContact OD2-NE 2.89Å; D46-R104 PolarHBondContact OD2-NE 3.04Å; D46-R104 IonicContact OD2-NH2 3.32Å; D46-R104 PolarHBondContact OD2-NH2 3.15Å; K94-R104 WeakPolarHBondContact O-CA 3.41Å; K95-R104 HydrophobicContact CG-CG 4.34Å; R104-I123 WeakPolarHBondContact O-CA 3.26Å; R104-Q124 HydrophobicContact CB-CB 4.16Å; R104-Q124 PolarHBondContact N-O 3.41Å; R104-Q124 PolarHBondContact O-N 3.25Å; R104-E126 IonicContact CZ-OE2 2.68Å; R104-E126 IonicContact NH1-OE2 3.18Å; R104-E126 PolarHBondContact NH1-OE2 3.13Å; R104-E126 IonicContact NH2-OE2 3.9Å; R104-E126 PolarHBondContact NH2-OE2 3.13Å
105	A	94.9	Very high	88.4	Confident	5 Å²	5	57.3 Å²	57.3	4%	0.041	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	106.7	178.4	0	0	0	0	0	108.7	I8 G93 K94 Y96	I8-A105 HydrophobicContact CD1-CB 3.85Å; G93-A105 WeakPolarHBondContact CA-O 3.38Å; K94-A105 PolarHBondContact N-O 2.96Å; K94-A105 PolarHBondContact O-N 3.09Å; Y96-A105 HydrophobicContact CE2-CB 4.37Å
106	S	94.3	Very high	87.2	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.007	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	160.5	-170.5	-54	0	0	0	0	112.8	Y19 C91 R92 V122	Y19-S106 WeakPolarHBondContact CD1-OG 3.12Å; C91-S106 WeakPolarHBondContact SG-CB 3.27Å; R92-S106 CarbonylContact O-C 3.21Å; R92-S106 VanDerWaalsContact O-CA 3.28Å; R92-S106 WeakPolarHBondContact O-CA 3.21Å; R92-S106 WeakPolarHBondContact O-CB 3.48Å; S106-V122 PolarHBondContact N-O 2.99Å; S106-V122 PolarHBondContact O-N 3.4Å; S106-V122 VanDerWaalsContact O-O 3.1Å
107	V	93.7	Very high	86.3	Confident	68 Å²	68	62.2 Å²	62.2	41%	0.412	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	119.9	172.2	-178.4	0	0	0	0	107.6	C91 R92 V119 E120	C91-V107 WeakPolarHBondContact CA-O 3.47Å; R92-V107 PolarHBondContact N-O 3.5Å; R92-V107 PolarHBondContact O-N 3.41Å; V107-V119 HydrophobicContact CG1-CB 3.95Å; V107-V119 HydrophobicContact CG1-CG1 4.1Å; V107-E120 WeakPolarHBondContact CA-O 3.25Å
108	A	94	Very high	85.6	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.3	169.4	0	0	0	0	0	109.2	V89 E90 C91 V119 E120 V122 F181 L184	V89-A108 HydrophobicContact CG1-CB 4.31Å; E90-A108 CarbonylContact O-C 3.59Å; E90-A108 WeakPolarHBondContact O-CA 3.32Å; C91-A108 HydrophobicContact CB-CB 4.41Å; A108-V119 CarbonylContact O-C 3.53Å; A108-V119 VanDerWaalsContact O-CA 3.28Å; A108-V119 WeakPolarHBondContact O-CA 3.33Å; A108-E120 PolarHBondContact N-O 3.17Å; A108-E120 PolarHBondContact O-N 3.18Å; A108-V122 HydrophobicContact CB-CG2 4.02Å; A108-F181 HydrophobicContact CB-CD1 4.23Å; A108-F181 HydrophobicContact CB-CE1 3.62Å; A108-L184 HydrophobicContact CB-CD2 4.22Å
109	S	92.7	Very high	85.1	Confident	33 Å²	33	61.2 Å²	61.2	23%	0.231	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.6	-177.7	65.9	0	0	0	0	112.6	V89 E90 L118	V89-S109 WeakPolarHBondContact CA-O 3.47Å; V89-S109 WeakPolarHBondContact CG1-O 3.26Å; E90-S109 PolarHBondContact N-O 2.87Å; E90-S109 PolarHBondContact O-N 3.05Å; E90-S109 PolarHBondContact O-OG 3.38Å; S109-L118 WeakPolarHBondContact CA-O 3.13Å
110	I	89.6	Confident	84.8	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.1	173.3	-53.8	-172.7	0	0	0	107.6	I86 V89 G112 L118 L184 R185	I86-I110 HydrophobicContact CB-CG2 4.01Å; I86-I110 HydrophobicContact CG2-CG2 4.29Å; V89-I110 HydrophobicContact CB-CG1 4.31Å; V89-I110 HydrophobicContact CG1-CG1 3.96Å; V89-I110 HydrophobicContact CG2-CD1 3.82Å; V89-I110 HydrophobicContact CG2-CG1 3.83Å; I110-G112 PolarHBondContact O-N 3.05Å; I110-L118 HydrophobicContact CB-CB 4.35Å; I110-L118 HydrophobicContact CB-CD1 4.26Å; I110-L118 HydrophobicContact CD1-CD1 4.38Å; I110-L118 PolarHBondContact N-O 3.47Å; I110-L118 VanDerWaalsContact N-O 3.13Å; I110-L118 PolarHBondContact O-N 3.18Å; I110-L184 HydrophobicContact CD1-CB 4.25Å; I110-L184 HydrophobicContact CD1-CD2 3.91Å; I110-L184 HydrophobicContact CD1-CG 3.82Å; I110-L184 HydrophobicContact CG1-CD2 3.77Å; I110-L184 HydrophobicContact CG1-CG 4.14Å; I110-R185 HydrophobicContact CD1-CB 4.49Å; I110-R185 HydrophobicContact CD1-CG 3.44Å; I110-R185 VanDerWaalsContact CD1-CG 3.44Å
111	M	77.6	Confident	84.4	Confident	154 Å²	154	58.8 Å²	58.8	76%	0.759	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	106.5	173.2	-168.3	175.9	-65.5	0	0	109
112	G	66.9	Low	84.1	Confident	27 Å²	27	58.3 Å²	58.3	28%	0.278	32%	0.323	S	S	.	.			trans	-81.6	170.2	174.6	0	0	0	0	0	113.1	I110 F114	I110-G112 PolarHBondContact O-N 3.05Å; G112-F114 VanDerWaalsContact C-N 3.31Å
113	S	62.9	Low	83.9	Confident	97 Å²	97	59.5 Å²	59.5	68%	0.678	33%	0.325	S	S	*	.	S	Bend	trans	-69.2	-29.7	172.2	53.6	0	0	0	0	113
114	F	60.1	Low	83.7	Confident	171 Å²	171	60.6 Å²	60.6	75%	0.75	33%	0.33	S	S	*	.	S	Bend	trans	-92.6	137	170.5	-63.7	-82.3	0	0	0	107.9	G112 A116	G112-F114 VanDerWaalsContact C-N 3.31Å; F114-A116 PolarHBondContact O-N 3.08Å
115	K	62.1	Low	83.6	Confident	219 Å²	219	60.7 Å²	60.7	95%	0.952	33%	0.333	S	S	*	.	S	Bend	trans	-52.1	9.1	-169	-61.6	178	176.5	178.4	0	117.8
116	A	70.8	Confident	83.6	Confident	68 Å²	68	63.5 Å²	63.5	56%	0.562	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-84.4	129.4	171.3	0	0	0	0	0	110.6	F114	F114-A116 PolarHBondContact O-N 3.08Å
117	V	80.2	Confident	83.7	Confident	83 Å²	83	65.8 Å²	65.8	50%	0.503	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	119.5	166.7	-178.4	0	0	0	0	107	V119	V117-V119 HydrophobicContact CG1-CG1 3.88Å
118	L	81.8	Confident	83.7	Confident	33 Å²	33	66.3 Å²	66.3	17%	0.173	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	132.4	168.8	-55	173.6	0	0	0	107.8	S109 I110 L184 T188	S109-L118 WeakPolarHBondContact CA-O 3.13Å; I110-L118 HydrophobicContact CB-CB 4.35Å; I110-L118 HydrophobicContact CB-CD1 4.26Å; I110-L118 HydrophobicContact CD1-CD1 4.38Å; I110-L118 PolarHBondContact N-O 3.47Å; I110-L118 VanDerWaalsContact N-O 3.13Å; I110-L118 PolarHBondContact O-N 3.18Å; L118-L184 HydrophobicContact CB-CD1 3.68Å; L118-L184 HydrophobicContact CB-CG 4.08Å; L118-L184 HydrophobicContact CD1-CG 4.44Å; L118-L184 WeakPolarHBondContact CD1-O 3.47Å; L118-T188 HydrophobicContact CD1-CG2 3.33Å; L118-T188 HydrophobicContact CD2-CG2 3.66Å; L118-T188 HydrophobicContact CG-CG2 3.92Å
119	V	86.9	Confident	83.8	Confident	97 Å²	97	69.9 Å²	69.9	59%	0.588	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.2	134.6	177.1	-64.5	0	0	0	0	110.6	V107 A108 V117	V107-V119 HydrophobicContact CG1-CB 3.95Å; V107-V119 HydrophobicContact CG1-CG1 4.1Å; A108-V119 CarbonylContact O-C 3.53Å; A108-V119 VanDerWaalsContact O-CA 3.28Å; A108-V119 WeakPolarHBondContact O-CA 3.33Å; V117-V119 HydrophobicContact CG1-CG1 3.88Å
120	E	88.9	Confident	83.9	Confident	26 Å²	26	70 Å²	70	12%	0.121	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.2	170.4	-178.1	170.3	-171.6	0	0	108.8	V107 A108 V122 H180 R183 L184	V107-E120 WeakPolarHBondContact CA-O 3.25Å; A108-E120 PolarHBondContact N-O 3.17Å; A108-E120 PolarHBondContact O-N 3.18Å; E120-V122 HydrophobicContact CG-CG2 4.46Å; E120-H180 IonicContact OE1-ND1 3.45Å; E120-H180 PolarHBondContact OE1-ND1 3.44Å; E120-R183 IonicContact OE1-CZ 2.62Å; E120-R183 IonicContact OE1-NE 2.67Å; E120-R183 PolarHBondContact OE1-NE 3.02Å; E120-R183 IonicContact OE1-NH2 3.47Å; E120-R183 PolarHBondContact OE1-NH2 3.16Å; E120-L184 HydrophobicContact CB-CD1 3.94Å; E120-L184 HydrophobicContact CB-CD2 4.12Å
121	K	89.2	Confident	84.2	Confident	83 Å²	83	75.2 Å²	75.2	36%	0.361	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	123.8	174	-166.8	168.3	-164.6	161.5	0	109.1	S2 V4	S2-K121 VanDerWaalsContact CB-NZ 3.29Å; S2-K121 PolarHBondContact OG-NZ 3.35Å; V4-K121 HydrophobicContact CB-CD 4.48Å; V4-K121 HydrophobicContact CG2-CD 3.88Å; V4-K121 VanDerWaalsContact CG2-CE 3.45Å
122	V	90.5	Very high	85	Confident	11 Å²	11	70 Å²	70	7%	0.067	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.2	179.1	-173.9	0	0	0	0	108.3	S106 A108 E120 Y177	S106-V122 PolarHBondContact N-O 2.99Å; S106-V122 PolarHBondContact O-N 3.4Å; S106-V122 VanDerWaalsContact O-O 3.1Å; A108-V122 HydrophobicContact CB-CG2 4.02Å; E120-V122 HydrophobicContact CG-CG2 4.46Å; V122-Y177 HydrophobicContact CB-CE1 4.3Å; V122-Y177 HydrophobicContact CG1-CD1 4.32Å; V122-Y177 HydrophobicContact CG1-CE1 3.65Å
123	I	92.4	Very high	86.2	Confident	50 Å²	50	69.5 Å²	69.5	26%	0.256	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.5	174.9	-55.5	170.5	0	0	0	106.5	V4 I103 R104 V125 M147 L148	V4-I123 HydrophobicContact CB-CD1 4.44Å; V4-I123 HydrophobicContact CG1-CD1 3.49Å; V4-I123 VanDerWaalsContact CG1-CD1 3.49Å; V4-I123 HydrophobicContact CG1-CG1 4.16Å; V4-I123 HydrophobicContact CG2-CD1 4.13Å; I103-I123 HydrophobicContact CG2-CG2 4.24Å; R104-I123 WeakPolarHBondContact O-CA 3.26Å; I123-V125 HydrophobicContact CG2-CG2 4.17Å; I123-M147 HydrophobicContact CG2-CE 4.04Å; I123-L148 HydrophobicContact CD1-CD1 3.77Å; I123-L148 HydrophobicContact CD1-CD2 3.52Å; I123-L148 HydrophobicContact CD1-CG 4.32Å
124	Q	93.2	Very high	87.5	Confident	24 Å²	24	68 Å²	68	11%	0.112	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.6	172.2	-178.2	-178.4	-12.3	0	0	108.2	I103 R104 Y177	I103-Q124 CarbonylContact C-O 3.54Å; I103-Q124 WeakPolarHBondContact CA-O 3.43Å; R104-Q124 HydrophobicContact CB-CB 4.16Å; R104-Q124 PolarHBondContact N-O 3.41Å; R104-Q124 PolarHBondContact O-N 3.25Å; Q124-Y177 PolarHBondContact OE1-OH 2.79Å
125	V	93.8	Very high	89.1	Confident	23 Å²	23	65.6 Å²	65.6	14%	0.139	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	129.2	173.7	-179.2	0	0	0	0	107.7	F101 I123 M140 F143 M147	F101-V125 HydrophobicContact CD1-CG1 3.83Å; F101-V125 HydrophobicContact CE1-CG1 4.45Å; I123-V125 HydrophobicContact CG2-CG2 4.17Å; V125-M140 WeakPolarHBondContact O-CE 3.26Å; V125-F143 HydrophobicContact CG1-CD1 3.75Å; V125-F143 HydrophobicContact CG1-CE1 3.67Å; V125-F143 HydrophobicContact CG2-CE1 4.32Å; V125-M147 HydrophobicContact CG2-CE 3.8Å
126	E	94.3	Very high	90.6	Very high	64 Å²	64	55.5 Å²	55.5	30%	0.299	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	125	179.1	178.8	-175	155.6	0	0	108.5	F101 A102 R104	F101-E126 WeakPolarHBondContact CA-O 2.89Å; A102-E126 HydrophobicContact CB-CB 4.3Å; A102-E126 PolarHBondContact N-O 3.19Å; A102-E126 PolarHBondContact O-N 3.19Å; R104-E126 IonicContact CZ-OE2 2.68Å; R104-E126 IonicContact NH1-OE2 3.18Å; R104-E126 PolarHBondContact NH1-OE2 3.13Å; R104-E126 IonicContact NH2-OE2 3.9Å; R104-E126 PolarHBondContact NH2-OE2 3.13Å
127	Y	95.8	Very high	91.5	Very high	50 Å²	50	54.4 Å²	54.4	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	102.7	170.6	178.5	-115.8	0	0	0	108.9	D100 F101 P129 C130 C136 L139	D100-Y127 HydrophobicContact CB-CD2 4.15Å; D100-Y127 HydrophobicContact CB-CE2 3.74Å; F101-Y127 HydrophobicContact CD1-CD2 4.16Å; F101-Y127 AromaticContact CE1-CD2 3.74Å; F101-Y127 HydrophobicContact CE1-CD2 3.74Å; F101-Y127 HydrophobicContact CE1-CG 4.2Å; F101-Y127 HydrophobicContact CE2-CD2 4.21Å; F101-Y127 AromaticContact CZ-CD2 3.77Å; F101-Y127 HydrophobicContact CZ-CD2 3.77Å; F101-Y127 HydrophobicContact CZ-CE2 4.37Å; Y127-P129 VanDerWaalsContact C-CD 3.44Å; Y127-P129 HydrophobicContact CD2-CG 4.4Å; Y127-P129 HydrophobicContact CE1-CB 4.01Å; Y127-P129 HydrophobicContact CE1-CG 4.14Å; Y127-P129 HydrophobicContact CE2-CB 4.5Å; Y127-P129 VanDerWaalsContact CE2-CD 3.47Å; Y127-P129 HydrophobicContact CE2-CG 3.76Å; Y127-C130 HydrophobicContact CD1-CB 3.68Å; Y127-C130 HydrophobicContact CE1-CB 3.69Å; Y127-C130 PolarHBondContact O-N 2.62Å; Y127-C136 HydrophobicContact CD1-CB 3.65Å; Y127-C136 HydrophobicContact CE1-CB 4.1Å; Y127-L139 HydrophobicContact CD1-CD2 4.49Å; Y127-L139 HydrophobicContact CD2-CD2 4.09Å; Y127-L139 HydrophobicContact CE1-CD2 4.11Å; Y127-L139 HydrophobicContact CE2-CD2 3.68Å; Y127-L139 HydrophobicContact CG-CD2 4.48Å
128	T	94.3	Very high	92.1	Very high	78 Å²	78	56.9 Å²	56.9	48%	0.479	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-31.5	-168.8	58.4	0	0	0	0	116	D100 A102 C130	D100-T128 WeakPolarHBondContact O-CB 3.42Å; D100-T128 PolarHBondContact O-N 3.48Å; D100-T128 PolarHBondContact O-OG1 3.22Å; A102-T128 HydrophobicContact CB-CG2 4.26Å; T128-C130 VanDerWaalsContact C-N 3.33Å; T128-C130 PolarHBondContact O-N 3.35Å
129	P	96.1	Very high	92.6	Very high	76 Å²	76	58.7 Å²	58.7	49%	0.494	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-12.1	-177.2	-20.4	35.4	0	0	0	115.4	D100 Y127	D100-P129 HydrophobicContact CB-CG 3.75Å; Y127-P129 VanDerWaalsContact C-CD 3.44Å; Y127-P129 HydrophobicContact CD2-CG 4.4Å; Y127-P129 HydrophobicContact CE1-CB 4.01Å; Y127-P129 HydrophobicContact CE1-CG 4.14Å; Y127-P129 HydrophobicContact CE2-CB 4.5Å; Y127-P129 VanDerWaalsContact CE2-CD 3.47Å; Y127-P129 HydrophobicContact CE2-CG 3.76Å
130	C	95.4	Very high	92.9	Very high	35 Å²	35	56.3 Å²	56.3	24%	0.236	31%	0.309	C	S	.	.			trans	-132.9	116.2	-175.9	-168.2	0	0	0	0	112.1	Y127 T128 I132 C136	Y127-C130 HydrophobicContact CD1-CB 3.68Å; Y127-C130 HydrophobicContact CE1-CB 3.69Å; Y127-C130 PolarHBondContact O-N 2.62Å; T128-C130 VanDerWaalsContact C-N 3.33Å; T128-C130 PolarHBondContact O-N 3.35Å; C130-I132 VanDerWaalsContact C-N 3.34Å; C130-I132 PolarHBondContact SG-O 2.79Å; C130-I132 VanDerWaalsContact SG-O 3.41Å; C130-C136 HydrophobicContact CB-CB 4.1Å
131	I	94.5	Very high	93	Very high	111 Å²	111	60 Å²	60	57%	0.569	33%	0.325	S	S	*	.	S	Bend	trans	-80.4	-13.8	176.1	-164.1	167.6	0	0	0	113	P133 Y168	I131-P133 VanDerWaalsContact O-CD 3.3Å; I131-P133 WeakPolarHBondContact O-CD 3.48Å; I131-Y168 WeakPolarHBondContact CD1-O 3.13Å; I131-Y168 VanDerWaalsContact CG1-O 3.28Å; I131-Y168 WeakPolarHBondContact CG1-O 3.24Å; I131-Y168 WeakPolarHBondContact O-CB 3.36Å; I131-Y168 PolarHBondContact O-N 2.76Å
132	I	94.3	Very high	93.2	Very high	43 Å²	43	62.6 Å²	62.6	22%	0.221	34%	0.339	C	S	.	.			trans	-99.8	103.1	-176.5	-58.1	177.5	0	0	0	108.5	C130 S134 L135	C130-I132 VanDerWaalsContact C-N 3.34Å; C130-I132 PolarHBondContact SG-O 2.79Å; C130-I132 VanDerWaalsContact SG-O 3.41Å; I132-S134 WeakPolarHBondContact CG2-OG 3.32Å; I132-S134 PolarHBondContact O-N 3.09Å; I132-S134 VanDerWaalsContact O-N 3.15Å; I132-L135 HydrophobicContact CB-CD1 3.97Å; I132-L135 HydrophobicContact CB-CG 4.1Å; I132-L135 HydrophobicContact CD1-CD1 3.96Å; I132-L135 HydrophobicContact CG2-CD1 4.07Å; I132-L135 HydrophobicContact CG2-CG 3.82Å; I132-L135 PolarHBondContact O-N 3.38Å
133	P	92.5	Very high	93.3	Very high	18 Å²	18	63.3 Å²	63.3	12%	0.117	34%	0.341	C	S	.	.	H	α-helix	trans	-59.7	-34	-171.8	-25.6	36.7	0	0	0	113.4	I131 L135 C136 A137 I159 M162 Q166 Y168	I131-P133 VanDerWaalsContact O-CD 3.3Å; I131-P133 WeakPolarHBondContact O-CD 3.48Å; P133-L135 PolarHBondContact O-N 2.99Å; P133-C136 PolarHBondContact O-N 3.41Å; P133-A137 WeakPolarHBondContact O-CB 3.26Å; P133-A137 PolarHBondContact O-N 2.91Å; P133-I159 HydrophobicContact CB-CG2 4.06Å; P133-M162 HydrophobicContact CG-SD 4.19Å; P133-Q166 WeakPolarHBondContact CD-O 3.41Å; P133-Y168 HydrophobicContact CG-CD2 4.27Å
134	S	91.5	Very high	93.3	Very high	65 Å²	65	62 Å²	62	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-64.2	-21.2	180	59.8	0	0	0	0	113.9	I132 N165	I132-S134 WeakPolarHBondContact CG2-OG 3.32Å; I132-S134 PolarHBondContact O-N 3.09Å; I132-S134 VanDerWaalsContact O-N 3.15Å; S134-N165 PolarHBondContact OG-N 3.05Å
135	L	93.3	Very high	93.2	Very high	120 Å²	120	62.7 Å²	62.7	63%	0.628	34%	0.344	S	S	*	.	H	α-helix	trans	-88.7	-21.4	179	-61.6	-178.4	0	0	0	113	I132 P133	I132-L135 HydrophobicContact CB-CD1 3.97Å; I132-L135 HydrophobicContact CB-CG 4.1Å; I132-L135 HydrophobicContact CD1-CD1 3.96Å; I132-L135 HydrophobicContact CG2-CD1 4.07Å; I132-L135 HydrophobicContact CG2-CG 3.82Å; I132-L135 PolarHBondContact O-N 3.38Å; P133-L135 PolarHBondContact O-N 2.99Å
136	C	92.8	Very high	93	Very high	7 Å²	7	67.8 Å²	67.8	5%	0.047	37%	0.37	C	S	.	.	H	α-helix	trans	-114.4	6.2	-179.5	60.4	0	0	0	0	113.4	Y127 C130 P133 D138 L139 M140	Y127-C136 HydrophobicContact CD1-CB 3.65Å; Y127-C136 HydrophobicContact CE1-CB 4.1Å; C130-C136 HydrophobicContact CB-CB 4.1Å; P133-C136 PolarHBondContact O-N 3.41Å; C136-D138 PolarHBondContact O-N 3.27Å; C136-L139 PolarHBondContact O-N 2.85Å; C136-M140 WeakPolarHBondContact O-CG 3.33Å; C136-M140 PolarHBondContact O-N 2.84Å
137	A	90.6	Very high	92.7	Very high	46 Å²	46	65 Å²	65	38%	0.38	36%	0.357	S	S	.	.	H	α-helix	trans	-57.1	-43.8	-174	0	0	0	0	0	113.4	P133 M140 K141	P133-A137 WeakPolarHBondContact O-CB 3.26Å; P133-A137 PolarHBondContact O-N 2.91Å; A137-M140 PolarHBondContact O-N 3.41Å; A137-K141 VanDerWaalsContact O-CB 3.25Å; A137-K141 WeakPolarHBondContact O-CB 3.36Å; A137-K141 PolarHBondContact O-N 3.41Å
138	D	91.6	Very high	92.3	Very high	134 Å²	134	64.7 Å²	64.7	72%	0.717	36%	0.358	S	S	*	.	H	α-helix	trans	-67.5	-43.9	-179.5	-68.9	-36.7	0	0	0	111.8	C136 M140 K141 E142	C136-D138 PolarHBondContact O-N 3.27Å; D138-M140 PolarHBondContact O-N 2.94Å; D138-K141 PolarHBondContact O-N 3.46Å; D138-E142 WeakPolarHBondContact O-CB 3.44Å; D138-E142 PolarHBondContact O-N 3.15Å
139	L	93.7	Very high	91.9	Very high	71 Å²	71	62.7 Å²	62.7	37%	0.372	35%	0.353	S	S	.	.	H	α-helix	trans	-60.8	-46	175.1	176.1	64.9	0	0	0	111.2	F101 Y127 C136 K141 E142 F143	F101-L139 HydrophobicContact CZ-CD1 4.49Å; F101-L139 HydrophobicContact CZ-CD2 4.29Å; F101-L139 HydrophobicContact CZ-CG 4.09Å; Y127-L139 HydrophobicContact CD1-CD2 4.49Å; Y127-L139 HydrophobicContact CD2-CD2 4.09Å; Y127-L139 HydrophobicContact CE1-CD2 4.11Å; Y127-L139 HydrophobicContact CE2-CD2 3.68Å; Y127-L139 HydrophobicContact CG-CD2 4.48Å; C136-L139 PolarHBondContact O-N 2.85Å; L139-K141 VanDerWaalsContact C-N 3.32Å; L139-K141 PolarHBondContact O-N 3.31Å; L139-E142 PolarHBondContact O-N 3.21Å; L139-F143 WeakPolarHBondContact O-CB 3.38Å; L139-F143 PolarHBondContact O-N 3.01Å
140	M	92.7	Very high	91	Very high	47 Å²	47	68.4 Å²	68.4	23%	0.232	37%	0.37	C	S	.	.	H	α-helix	trans	-63	-40.3	177	-73.4	-172.4	71	0	0	111.8	V125 C136 A137 D138 C144	V125-M140 WeakPolarHBondContact O-CE 3.26Å; C136-M140 WeakPolarHBondContact O-CG 3.33Å; C136-M140 PolarHBondContact O-N 2.84Å; A137-M140 PolarHBondContact O-N 3.41Å; D138-M140 PolarHBondContact O-N 2.94Å; M140-C144 WeakPolarHBondContact O-CB 3.28Å; M140-C144 PolarHBondContact O-N 2.83Å; M140-C144 PolarHBondContact O-SG 2.92Å
141	K	91.5	Very high	90	Very high	104 Å²	104	74.2 Å²	74.2	45%	0.452	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-45.2	177.2	177.7	-179.5	172	179.8	0	111.5	A137 D138 L139 S145 A153	A137-K141 VanDerWaalsContact O-CB 3.25Å; A137-K141 WeakPolarHBondContact O-CB 3.36Å; A137-K141 PolarHBondContact O-N 3.41Å; D138-K141 PolarHBondContact O-N 3.46Å; L139-K141 VanDerWaalsContact C-N 3.32Å; L139-K141 PolarHBondContact O-N 3.31Å; K141-S145 WeakPolarHBondContact O-CB 3.34Å; K141-S145 PolarHBondContact O-N 2.91Å; K141-S145 PolarHBondContact O-OG 2.86Å; K141-A153 WeakPolarHBondContact CE-O 3.41Å
142	E	92.1	Very high	89	Confident	138 Å²	138	69.8 Å²	69.8	65%	0.645	38%	0.377	S	S	*	.	H	α-helix	trans	-59.1	-52.8	175.8	-176.3	178.4	178.3	0	0	110.5	D138 L139 C144 S145 D146	D138-E142 WeakPolarHBondContact O-CB 3.44Å; D138-E142 PolarHBondContact O-N 3.15Å; L139-E142 PolarHBondContact O-N 3.21Å; E142-C144 PolarHBondContact O-N 3.12Å; E142-S145 PolarHBondContact O-N 2.81Å; E142-S145 VanDerWaalsContact O-N 3.15Å; E142-D146 PolarHBondContact O-N 2.98Å
143	F	93	Very high	87.8	Confident	25 Å²	25	70.1 Å²	70.1	11%	0.11	39%	0.386	C	S	.	.	H	α-helix	trans	-55.9	-48.3	178.2	178.2	-95.3	0	0	0	112.6	M11 L98 F101 I103 V125 L139 S145 D146 M147	M11-F143 HydrophobicContact CE-CE2 4.15Å; L98-F143 HydrophobicContact CD2-CE2 3.84Å; L98-F143 HydrophobicContact CD2-CZ 4.1Å; F101-F143 HydrophobicContact CB-CE1 4.42Å; F101-F143 HydrophobicContact CB-CE2 4.47Å; F101-F143 HydrophobicContact CB-CZ 4.1Å; F101-F143 HydrophobicContact CD1-CD1 4.02Å; F101-F143 HydrophobicContact CD1-CD2 4.46Å; F101-F143 HydrophobicContact CD1-CE1 4.15Å; F101-F143 HydrophobicContact CD1-CG 4.18Å; F101-F143 HydrophobicContact CD1-CZ 4.41Å; F101-F143 AromaticContact CD2-CD2 3.93Å; F101-F143 HydrophobicContact CD2-CD2 3.93Å; F101-F143 AromaticContact CD2-CE2 3.84Å; F101-F143 HydrophobicContact CD2-CE2 3.84Å; F101-F143 HydrophobicContact CD2-CG 4.42Å; F101-F143 HydrophobicContact CD2-CZ 4.28Å; F101-F143 HydrophobicContact CE1-CB 4.11Å; F101-F143 HydrophobicContact CE1-CD1 4.06Å; F101-F143 HydrophobicContact CE1-CD2 4.32Å; F101-F143 AromaticContact CE1-CG 3.89Å; F101-F143 HydrophobicContact CE1-CG 3.89Å; F101-F143 AromaticContact CE2-CD2 3.78Å; F101-F143 HydrophobicContact CE2-CD2 3.78Å; F101-F143 HydrophobicContact CE2-CE2 4.18Å; F101-F143 HydrophobicContact CE2-CG 4.16Å; F101-F143 HydrophobicContact CG-CD1 4.4Å; F101-F143 HydrophobicContact CG-CD2 4.26Å; F101-F143 HydrophobicContact CG-CE1 4.2Å; F101-F143 HydrophobicContact CG-CE2 4.05Å; F101-F143 HydrophobicContact CG-CG 4.42Å; F101-F143 HydrophobicContact CG-CZ 4.02Å; F101-F143 HydrophobicContact CZ-CB 3.93Å; F101-F143 HydrophobicContact CZ-CD1 4.49Å; F101-F143 AromaticContact CZ-CD2 3.97Å; F101-F143 HydrophobicContact CZ-CD2 3.97Å; F101-F143 AromaticContact CZ-CG 3.87Å; F101-F143 HydrophobicContact CZ-CG 3.87Å; I103-F143 HydrophobicContact CD1-CE1 4.03Å; I103-F143 HydrophobicContact CD1-CZ 3.65Å; I103-F143 HydrophobicContact CG1-CE1 4.25Å; I103-F143 HydrophobicContact CG1-CZ 4.24Å; V125-F143 HydrophobicContact CG1-CD1 3.75Å; V125-F143 HydrophobicContact CG1-CE1 3.67Å; V125-F143 HydrophobicContact CG2-CE1 4.32Å; L139-F143 WeakPolarHBondContact O-CB 3.38Å; L139-F143 PolarHBondContact O-N 3.01Å; F143-S145 VanDerWaalsContact C-N 3.34Å; F143-S145 PolarHBondContact O-N 2.88Å; F143-D146 PolarHBondContact O-N 3.08Å; F143-M147 HydrophobicContact CE1-CE 4.32Å; F143-M147 HydrophobicContact CE1-SD 4.41Å; F143-M147 WeakPolarHBondContact O-CB 3.17Å; F143-M147 PolarHBondContact O-N 2.97Å; F143-M147 VanDerWaalsContact O-N 3.11Å
144	C	91.8	Very high	87.1	Confident	22 Å²	22	72.8 Å²	72.8	15%	0.149	41%	0.41	C	S	.	.	H	α-helix	trans	-70.7	-32.2	-179.2	-62.5	0	0	0	0	112	M140 E142 M147 L148 A152	M140-C144 WeakPolarHBondContact O-CB 3.28Å; M140-C144 PolarHBondContact O-N 2.83Å; M140-C144 PolarHBondContact O-SG 2.92Å; E142-C144 PolarHBondContact O-N 3.12Å; C144-M147 PolarHBondContact O-N 3.05Å; C144-L148 WeakPolarHBondContact O-CB 3.29Å; C144-L148 PolarHBondContact O-N 3.03Å; C144-A152 VanDerWaalsContact C-CB 3.44Å; C144-A152 HydrophobicContact CB-CB 3.52Å; C144-A152 VanDerWaalsContact O-CB 3.23Å; C144-A152 WeakPolarHBondContact O-CB 3.36Å
145	S	91.2	Very high	86.7	Confident	40 Å²	40	73.4 Å²	73.4	28%	0.28	41%	0.412	S	S	.	.	H	α-helix	trans	-70.1	-36.7	177.2	-61.8	0	0	0	0	112	K141 E142 F143 G149	K141-S145 WeakPolarHBondContact O-CB 3.34Å; K141-S145 PolarHBondContact O-N 2.91Å; K141-S145 PolarHBondContact O-OG 2.86Å; E142-S145 PolarHBondContact O-N 2.81Å; E142-S145 VanDerWaalsContact O-N 3.15Å; F143-S145 VanDerWaalsContact C-N 3.34Å; F143-S145 PolarHBondContact O-N 2.88Å; S145-G149 WeakPolarHBondContact O-CA 3.47Å; S145-G149 PolarHBondContact O-N 3.26Å
146	D	89.6	Confident	86.3	Confident	129 Å²	129	70.7 Å²	70.7	69%	0.69	40%	0.402	S	S	*	.	H	α-helix	trans	-65	-45.1	172.4	-171.9	53.3	0	0	0	111	E142 F143	E142-D146 PolarHBondContact O-N 2.98Å; F143-D146 PolarHBondContact O-N 3.08Å
147	M	88.6	Confident	85.9	Confident	6 Å²	6	73.6 Å²	73.6	3%	0.03	43%	0.426	C	S	.	.	H	α-helix	trans	-71.6	-41.9	-179.1	-175.6	176.2	64.3	0	0	114.3	I7 I8 M11 I103 I123 V125 F143 C144	I7-M147 HydrophobicContact CG2-CG 4.12Å; I8-M147 HydrophobicContact CD1-SD 4.4Å; I8-M147 HydrophobicContact CG1-SD 3.69Å; M11-M147 HydrophobicContact CE-CB 4.07Å; M11-M147 HydrophobicContact SD-CB 3.68Å; M11-M147 HydrophobicContact SD-CG 3.64Å; M11-M147 HydrophobicContact SD-SD 4.32Å; I103-M147 HydrophobicContact CD1-SD 4.18Å; I123-M147 HydrophobicContact CG2-CE 4.04Å; V125-M147 HydrophobicContact CG2-CE 3.8Å; F143-M147 HydrophobicContact CE1-CE 4.32Å; F143-M147 HydrophobicContact CE1-SD 4.41Å; F143-M147 WeakPolarHBondContact O-CB 3.17Å; F143-M147 PolarHBondContact O-N 2.97Å; F143-M147 VanDerWaalsContact O-N 3.11Å; C144-M147 PolarHBondContact O-N 3.05Å
148	L	87.6	Confident	85.7	Confident	43 Å²	43	73.4 Å²	73.4	23%	0.225	42%	0.416	C	S	.	.	H	α-helix	trans	-118.2	2.2	-168.5	-56	176.9	0	0	0	113.6	V4 I123 C144 A152	V4-L148 HydrophobicContact CG1-CD2 4.39Å; I123-L148 HydrophobicContact CD1-CD1 3.77Å; I123-L148 HydrophobicContact CD1-CD2 3.52Å; I123-L148 HydrophobicContact CD1-CG 4.32Å; C144-L148 WeakPolarHBondContact O-CB 3.29Å; C144-L148 PolarHBondContact O-N 3.03Å; L148-A152 HydrophobicContact CB-CB 4.04Å; L148-A152 HydrophobicContact CD1-CB 4.38Å
149	G	84.9	Confident	85.5	Confident	36 Å²	36	68.9 Å²	68.9	37%	0.371	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	62	-146.4	-175.3	0	0	0	0	0	112.5	S145 I151 A152	S145-G149 WeakPolarHBondContact O-CA 3.47Å; S145-G149 PolarHBondContact O-N 3.26Å; G149-I151 PolarHBondContact O-N 3.18Å; G149-A152 PolarHBondContact O-N 3.16Å
150	K	78.5	Confident	85.2	Confident	197 Å²	197	68.9 Å²	68.9	86%	0.857	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-62.1	-17.4	-174.9	-63.3	-176.7	-179.1	179.8	0	114.5	A152 A153	K150-A152 PolarHBondContact O-N 3.2Å; K150-A153 VanDerWaalsContact O-CB 3.29Å; K150-A153 WeakPolarHBondContact O-CB 3.16Å; K150-A153 PolarHBondContact O-N 3.36Å
151	I	74.6	Confident	84.9	Confident	157 Å²	157	69.8 Å²	69.8	81%	0.805	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-63.6	-30.4	178.9	-61.8	174.6	0	0	0	110.7	G149	G149-I151 PolarHBondContact O-N 3.18Å
152	A	73.4	Confident	84.8	Confident	17 Å²	17	66.2 Å²	66.2	14%	0.14	41%	0.408	C	S	.	.	G	3₁₀ helix	trans	-94.9	13.6	-179.5	0	0	0	0	0	114.3	C144 L148 G149 K150 A154	C144-A152 VanDerWaalsContact C-CB 3.44Å; C144-A152 HydrophobicContact CB-CB 3.52Å; C144-A152 VanDerWaalsContact O-CB 3.23Å; C144-A152 WeakPolarHBondContact O-CB 3.36Å; L148-A152 HydrophobicContact CB-CB 4.04Å; L148-A152 HydrophobicContact CD1-CB 4.38Å; G149-A152 PolarHBondContact O-N 3.16Å; K150-A152 PolarHBondContact O-N 3.2Å; A152-A154 PolarHBondContact O-N 3.5Å
153	A	67.8	Low	84.5	Confident	50 Å²	50	69.4 Å²	69.4	41%	0.413	41%	0.414	S	S	.	.	S	Bend	trans	-66.9	-21.5	-173.4	0	0	0	0	0	114.1	K141 K150	K141-A153 WeakPolarHBondContact CE-O 3.41Å; K150-A153 VanDerWaalsContact O-CB 3.29Å; K150-A153 WeakPolarHBondContact O-CB 3.16Å; K150-A153 PolarHBondContact O-N 3.36Å
154	A	79.2	Confident	84.2	Confident	74 Å²	74	73.1 Å²	73.1	61%	0.612	44%	0.444	S	S	*	.	S	Bend	trans	-121.6	140.5	179.3	0	0	0	0	0	111.1	A152	A152-A154 PolarHBondContact O-N 3.5Å
155	P	82.5	Confident	84.1	Confident	78 Å²	78	77.3 Å²	77.3	51%	0.506	47%	0.465	S	S	.	.			trans	-63.3	154.2	174.4	27.9	-34.5	0	0	0	110.8	A157 A160	P155-A157 PolarHBondContact O-N 3.34Å; P155-A160 HydrophobicContact CG-CB 4.28Å
156	P	84.1	Confident	84.1	Confident	64 Å²	64	78.8 Å²	78.8	42%	0.416	47%	0.467	S	S	.	.			trans	-54.2	139.3	171.9	-24.2	33.7	0	0	0	111.3	Y158 I159 A160	P156-Y158 PolarHBondContact O-N 3.45Å; P156-Y158 VanDerWaalsContact O-N 3.09Å; P156-I159 HydrophobicContact CB-CG1 4.24Å; P156-I159 HydrophobicContact CG-CG1 4.35Å; P156-I159 PolarHBondContact O-N 3.03Å; P156-A160 PolarHBondContact O-N 2.66Å
157	A	84.8	Confident	84.3	Confident	67 Å²	67	74.3 Å²	74.3	55%	0.554	45%	0.452	S	S	*	.	H	α-helix	trans	-54.8	-34.5	-176	0	0	0	0	0	113.2	P155 A160 G161	P155-A157 PolarHBondContact O-N 3.34Å; A157-A160 PolarHBondContact O-N 3.1Å; A157-G161 PolarHBondContact O-N 3.01Å
158	Y	86.6	Confident	84.6	Confident	43 Å²	43	76.7 Å²	76.7	17%	0.169	46%	0.461	C	S	.	.	H	α-helix	trans	-62.8	-47.5	175.5	-174.4	-94.3	0	0	0	112.2	P156 A160 G161 M162 D172 H175 Q176	P156-Y158 PolarHBondContact O-N 3.45Å; P156-Y158 VanDerWaalsContact O-N 3.09Å; Y158-A160 VanDerWaalsContact C-N 3.34Å; Y158-A160 PolarHBondContact O-N 3.25Å; Y158-G161 PolarHBondContact O-N 3.09Å; Y158-G161 VanDerWaalsContact O-N 3.16Å; Y158-M162 HydrophobicContact CE1-CG 4.41Å; Y158-M162 HydrophobicContact CE1-SD 4.43Å; Y158-M162 PolarHBondContact O-N 2.91Å; Y158-D172 HydrophobicContact CE1-CB 3.68Å; Y158-D172 PolarHBondContact OH-OD1 3.38Å; Y158-H175 HydrophobicContact CD1-CB 4.5Å; Y158-H175 HydrophobicContact CD2-CB 3.71Å; Y158-H175 HydrophobicContact CE1-CB 4.13Å; Y158-H175 HydrophobicContact CE2-CB 3.26Å; Y158-H175 AromaticContact CE2-CG 3.54Å; Y158-H175 HydrophobicContact CG-CB 4.3Å; Y158-H175 VanDerWaalsContact CZ-CB 3.48Å; Y158-H175 AromaticContact CZ-CD2 3.87Å; Y158-H175 AromaticContact CZ-CG 3.75Å; Y158-H175 PolarHBondContact OH-CD2 3.25Å; Y158-H175 VanDerWaalsContact OH-CD2 3.25Å; Y158-Q176 HydrophobicContact CD1-CG 3.89Å; Y158-Q176 HydrophobicContact CG-CG 4.07Å
159	I	87.6	Confident	84.8	Confident	38 Å²	38	76.3 Å²	76.3	20%	0.195	46%	0.464	C	S	.	.	H	α-helix	trans	-65.8	-39.2	178.9	-60.6	-61.3	0	0	0	110.8	P133 P156 G161 M162 Y168	P133-I159 HydrophobicContact CB-CG2 4.06Å; P156-I159 HydrophobicContact CB-CG1 4.24Å; P156-I159 HydrophobicContact CG-CG1 4.35Å; P156-I159 PolarHBondContact O-N 3.03Å; I159-G161 PolarHBondContact O-N 3.33Å; I159-M162 HydrophobicContact CD1-SD 3.8Å; I159-M162 PolarHBondContact O-N 2.73Å; I159-Y168 HydrophobicContact CD1-CD2 4.44Å; I159-Y168 HydrophobicContact CD1-CE2 4.23Å
160	A	86.9	Confident	85.3	Confident	72 Å²	72	76.6 Å²	76.6	60%	0.595	46%	0.459	S	S	*	.	H	α-helix	trans	-63.2	-25	176.1	0	0	0	0	0	113.3	P155 P156 A157 Y158	P155-A160 HydrophobicContact CG-CB 4.28Å; P156-A160 PolarHBondContact O-N 2.66Å; A157-A160 PolarHBondContact O-N 3.1Å; Y158-A160 VanDerWaalsContact C-N 3.34Å; Y158-A160 PolarHBondContact O-N 3.25Å
161	G	87.5	Confident	86.1	Confident	65 Å²	65	67.6 Å²	67.6	67%	0.67	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-5.3	177.4	0	0	0	0	0	115.1	A157 Y158 I159	A157-G161 PolarHBondContact O-N 3.01Å; Y158-G161 PolarHBondContact O-N 3.09Å; Y158-G161 VanDerWaalsContact O-N 3.16Å; I159-G161 PolarHBondContact O-N 3.33Å
162	M	87.9	Confident	87	Confident	30 Å²	30	60.4 Å²	60.4	15%	0.148	38%	0.383	C	S	.	.	S	Bend	trans	-66.2	150.4	178	-72.1	-177.7	87.1	0	0	111.2	P133 Y158 I159 Q166 D172	P133-M162 HydrophobicContact CG-SD 4.19Å; Y158-M162 HydrophobicContact CE1-CG 4.41Å; Y158-M162 HydrophobicContact CE1-SD 4.43Å; Y158-M162 PolarHBondContact O-N 2.91Å; I159-M162 HydrophobicContact CD1-SD 3.8Å; I159-M162 PolarHBondContact O-N 2.73Å; M162-Q166 HydrophobicContact CE-CB 4.29Å; M162-Q166 HydrophobicContact CE-CG 3.75Å; M162-D172 WeakPolarHBondContact CE-OD2 3.19Å
163	R	87.2	Confident	88	Confident	204 Å²	204	59.9 Å²	59.9	77%	0.77	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-67.1	148.7	176.6	-60.3	-179.6	-174.9	178.8	2.2	110	N165 Q166	R163-N165 PolarHBondContact O-N 2.92Å; R163-Q166 HydrophobicContact CB-CB 4.21Å; R163-Q166 WeakPolarHBondContact O-CB 3.34Å; R163-Q166 PolarHBondContact O-N 3.37Å
164	S	86.8	Confident	89.3	Confident	104 Å²	104	57.5 Å²	57.5	73%	0.727	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	133.6	171.8	56.5	0	0	0	0	110.6	Q166	S164-Q166 PolarHBondContact O-N 2.93Å
165	N	88.9	Confident	90.1	Very high	110 Å²	110	54.6 Å²	54.6	59%	0.588	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	15.6	-178.2	-59	-27.9	0	0	0	115.5	S134 R163 G167	S134-N165 PolarHBondContact OG-N 3.05Å; R163-N165 PolarHBondContact O-N 2.92Å; N165-G167 PolarHBondContact O-N 2.76Å
166	Q	91.6	Very high	90.6	Very high	70 Å²	70	52.6 Å²	52.6	33%	0.327	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-69.4	128.2	169.9	-175.1	178	-17.6	0	0	109.9	P133 M162 R163 S164	P133-Q166 WeakPolarHBondContact CD-O 3.41Å; M162-Q166 HydrophobicContact CE-CB 4.29Å; M162-Q166 HydrophobicContact CE-CG 3.75Å; R163-Q166 HydrophobicContact CB-CB 4.21Å; R163-Q166 WeakPolarHBondContact O-CB 3.34Å; R163-Q166 PolarHBondContact O-N 3.37Å; S164-Q166 PolarHBondContact O-N 2.93Å
167	G	93.4	Very high	91.1	Very high	36 Å²	36	49.9 Å²	49.9	37%	0.371	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-72.6	139.1	171.6	0	0	0	0	0	111.3	N165	N165-G167 PolarHBondContact O-N 2.76Å
168	Y	93.8	Very high	91.5	Very high	56 Å²	56	46.9 Å²	46.9	22%	0.22	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-68.4	137.3	172.4	-171.6	-94.8	0	0	0	111.2	I131 P133 I159 D172 T173	I131-Y168 WeakPolarHBondContact CD1-O 3.13Å; I131-Y168 VanDerWaalsContact CG1-O 3.28Å; I131-Y168 WeakPolarHBondContact CG1-O 3.24Å; I131-Y168 WeakPolarHBondContact O-CB 3.36Å; I131-Y168 PolarHBondContact O-N 2.76Å; P133-Y168 HydrophobicContact CG-CD2 4.27Å; I159-Y168 HydrophobicContact CD1-CD2 4.44Å; I159-Y168 HydrophobicContact CD1-CE2 4.23Å; Y168-D172 WeakPolarHBondContact CA-OD2 3.18Å; Y168-D172 HydrophobicContact CD2-CB 3.8Å; Y168-D172 HydrophobicContact CE2-CB 3.53Å; Y168-T173 WeakPolarHBondContact OH-CA 3.45Å; Y168-T173 WeakPolarHBondContact OH-CB 3.4Å; Y168-T173 PolarHBondContact OH-N 2.88Å; Y168-T173 PolarHBondContact OH-OG1 2.86Å
169	A	93.5	Very high	91.8	Very high	34 Å²	34	50.5 Å²	50.5	28%	0.281	29%	0.287	S	S	.	.			trans	-129.6	159.2	176.8	0	0	0	0	0	110.9	I171 D172	A169-I171 HydrophobicContact CB-CG2 4.11Å; A169-I171 PolarHBondContact O-N 2.93Å; A169-D172 PolarHBondContact N-OD2 2.78Å; A169-D172 VanDerWaalsContact O-CB 3.26Å; A169-D172 WeakPolarHBondContact O-CB 3.4Å; A169-D172 PolarHBondContact O-N 3.02Å
170	P	94.4	Very high	91.9	Very high	43 Å²	43	50.7 Å²	50.7	28%	0.279	29%	0.287	S	S	.	.	H	α-helix	trans	-52.7	-33.5	178.9	-29.2	36	0	0	0	114.2	Y47 F52 D172 T173 M174	Y47-P170 HydrophobicContact CD2-CB 4.29Å; Y47-P170 HydrophobicContact CE1-CB 4.17Å; Y47-P170 HydrophobicContact CE1-CG 3.77Å; Y47-P170 HydrophobicContact CE2-CB 3.68Å; Y47-P170 HydrophobicContact CE2-CG 4.15Å; Y47-P170 WeakPolarHBondContact OH-CG 3.35Å; F52-P170 HydrophobicContact CE1-CB 3.8Å; F52-P170 HydrophobicContact CZ-CB 3.74Å; P170-D172 VanDerWaalsContact C-N 3.27Å; P170-D172 PolarHBondContact O-N 2.87Å; P170-T173 WeakPolarHBondContact O-CB 3.09Å; P170-T173 PolarHBondContact O-N 3.18Å; P170-T173 VanDerWaalsContact O-N 3.15Å; P170-T173 PolarHBondContact O-OG1 2.76Å; P170-M174 PolarHBondContact O-N 3.38Å
171	I	94.6	Very high	92.2	Very high	7 Å²	7	47.3 Å²	47.3	4%	0.036	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-31.1	178.1	-167.6	71.3	0	0	0	113.1	F52 I54 Y63 A169 T173 M174 H175	F52-I171 HydrophobicContact CB-CD1 4.23Å; F52-I171 HydrophobicContact CD1-CD1 4.21Å; I54-I171 HydrophobicContact CD1-CD1 4.26Å; I54-I171 HydrophobicContact CG1-CD1 3.97Å; Y63-I171 HydrophobicContact CD1-CG1 3.89Å; Y63-I171 HydrophobicContact CD2-CB 4.09Å; Y63-I171 HydrophobicContact CD2-CD1 3.7Å; Y63-I171 HydrophobicContact CD2-CG1 3.5Å; Y63-I171 HydrophobicContact CD2-CG2 4.35Å; Y63-I171 HydrophobicContact CE1-CG1 4.28Å; Y63-I171 HydrophobicContact CE1-CG2 4.17Å; Y63-I171 HydrophobicContact CE2-CB 4.06Å; Y63-I171 HydrophobicContact CE2-CG1 3.94Å; Y63-I171 HydrophobicContact CE2-CG2 3.88Å; Y63-I171 HydrophobicContact CG-CB 4.48Å; Y63-I171 HydrophobicContact CG-CD1 3.74Å; Y63-I171 HydrophobicContact CG-CG1 3.48Å; Y63-I171 VanDerWaalsContact CG-CG1 3.48Å; A169-I171 HydrophobicContact CB-CG2 4.11Å; A169-I171 PolarHBondContact O-N 2.93Å; I171-T173 PolarHBondContact O-N 3.4Å; I171-M174 HydrophobicContact CD1-CB 4.19Å; I171-M174 HydrophobicContact CD1-CG 4.43Å; I171-M174 CarbonylContact O-C 3.47Å; I171-M174 WeakPolarHBondContact O-CA 3.47Å; I171-M174 WeakPolarHBondContact O-CB 3.38Å; I171-M174 PolarHBondContact O-N 3.06Å; I171-H175 PolarHBondContact O-CD2 3.43Å; I171-H175 PolarHBondContact O-N 3.23Å
172	D	94.1	Very high	92.3	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.032	23%	0.233	C	C	.	.	H	α-helix	trans	-63.4	-33.2	177	-60	-31.3	0	0	0	110.7	Y158 M162 Y168 A169 P170 Q176	Y158-D172 HydrophobicContact CE1-CB 3.68Å; Y158-D172 PolarHBondContact OH-OD1 3.38Å; M162-D172 WeakPolarHBondContact CE-OD2 3.19Å; Y168-D172 WeakPolarHBondContact CA-OD2 3.18Å; Y168-D172 HydrophobicContact CD2-CB 3.8Å; Y168-D172 HydrophobicContact CE2-CB 3.53Å; A169-D172 PolarHBondContact N-OD2 2.78Å; A169-D172 VanDerWaalsContact O-CB 3.26Å; A169-D172 WeakPolarHBondContact O-CB 3.4Å; A169-D172 PolarHBondContact O-N 3.02Å; P170-D172 VanDerWaalsContact C-N 3.27Å; P170-D172 PolarHBondContact O-N 2.87Å; D172-Q176 WeakPolarHBondContact O-CG 3.4Å; D172-Q176 PolarHBondContact O-N 3.14Å; D172-Q176 VanDerWaalsContact O-N 3.13Å; D172-Q176 PolarHBondContact O-NE2 3.43Å; D172-Q176 VanDerWaalsContact O-NE2 3.13Å
173	T	94.8	Very high	92.3	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.043	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-48.1	169.7	-44.8	0	0	0	0	109.9	Y168 P170 I171 H175 Q176 Y177	Y168-T173 WeakPolarHBondContact OH-CA 3.45Å; Y168-T173 WeakPolarHBondContact OH-CB 3.4Å; Y168-T173 PolarHBondContact OH-N 2.88Å; Y168-T173 PolarHBondContact OH-OG1 2.86Å; P170-T173 WeakPolarHBondContact O-CB 3.09Å; P170-T173 PolarHBondContact O-N 3.18Å; P170-T173 VanDerWaalsContact O-N 3.15Å; P170-T173 PolarHBondContact O-OG1 2.76Å; I171-T173 PolarHBondContact O-N 3.4Å; T173-H175 PolarHBondContact O-N 3.34Å; T173-Q176 WeakPolarHBondContact O-CB 3.44Å; T173-Q176 PolarHBondContact O-N 3.44Å; T173-Y177 HydrophobicContact CG2-CD2 3.69Å; T173-Y177 HydrophobicContact CG2-CE2 3.53Å; T173-Y177 VanDerWaalsContact O-CD2 3.26Å; T173-Y177 WeakPolarHBondContact O-CD2 3.14Å; T173-Y177 PolarHBondContact O-N 2.76Å
174	M	95.9	Very high	92.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65	-39	-177.2	-54.7	-58.4	137.4	0	0	111.9	L21 F42 C44 F52 I54 P170 I171 Y177 Q178	L21-M174 HydrophobicContact CD1-CE 4.02Å; L21-M174 HydrophobicContact CD1-SD 3.85Å; F42-M174 HydrophobicContact CB-CG 4.39Å; F42-M174 HydrophobicContact CB-SD 3.56Å; F42-M174 VanDerWaalsContact CB-SD 3.56Å; F42-M174 HydrophobicContact CD1-SD 4.17Å; F42-M174 HydrophobicContact CD2-CB 4.15Å; F42-M174 HydrophobicContact CE2-CB 4.42Å; F42-M174 HydrophobicContact CG-CB 4.26Å; F42-M174 HydrophobicContact CG-CG 4.38Å; F42-M174 HydrophobicContact CG-SD 3.87Å; C44-M174 HydrophobicContact CB-CE 3.81Å; F52-M174 HydrophobicContact CB-CG 3.79Å; F52-M174 HydrophobicContact CB-SD 4.48Å; F52-M174 HydrophobicContact CD1-CG 4.39Å; F52-M174 HydrophobicContact CD2-CE 4.08Å; F52-M174 HydrophobicContact CD2-CG 4.08Å; F52-M174 HydrophobicContact CD2-SD 4.12Å; F52-M174 HydrophobicContact CE2-CE 4.21Å; F52-M174 HydrophobicContact CG-CG 3.82Å; F52-M174 HydrophobicContact CG-SD 4.44Å; I54-M174 HydrophobicContact CD1-CB 3.99Å; P170-M174 PolarHBondContact O-N 3.38Å; I171-M174 HydrophobicContact CD1-CB 4.19Å; I171-M174 HydrophobicContact CD1-CG 4.43Å; I171-M174 CarbonylContact O-C 3.47Å; I171-M174 WeakPolarHBondContact O-CA 3.47Å; I171-M174 WeakPolarHBondContact O-CB 3.38Å; I171-M174 PolarHBondContact O-N 3.06Å; M174-Y177 PolarHBondContact O-N 3.5Å; M174-Q178 VanDerWaalsContact O-CB 3.26Å; M174-Q178 WeakPolarHBondContact O-CB 3.43Å; M174-Q178 PolarHBondContact O-N 2.87Å
175	H	94.5	Very high	92.3	Very high	13 Å²	13	36.8 Å²	36.8	6%	0.06	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-41.7	173	-80	-77.6	0	0	0	112.3	Y158 I171 T173 Q178 Y179	Y158-H175 HydrophobicContact CD1-CB 4.5Å; Y158-H175 HydrophobicContact CD2-CB 3.71Å; Y158-H175 HydrophobicContact CE1-CB 4.13Å; Y158-H175 HydrophobicContact CE2-CB 3.26Å; Y158-H175 AromaticContact CE2-CG 3.54Å; Y158-H175 HydrophobicContact CG-CB 4.3Å; Y158-H175 VanDerWaalsContact CZ-CB 3.48Å; Y158-H175 AromaticContact CZ-CD2 3.87Å; Y158-H175 AromaticContact CZ-CG 3.75Å; Y158-H175 PolarHBondContact OH-CD2 3.25Å; Y158-H175 VanDerWaalsContact OH-CD2 3.25Å; I171-H175 PolarHBondContact O-CD2 3.43Å; I171-H175 PolarHBondContact O-N 3.23Å; T173-H175 PolarHBondContact O-N 3.34Å; H175-Q178 PolarHBondContact O-N 3.35Å; H175-Y179 PolarHBondContact O-N 3.43Å
176	Q	93.3	Very high	92	Very high	36 Å²	36	40.4 Å²	40.4	17%	0.168	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-47.6	175.3	-73.3	174	82.9	0	0	111.8	Y158 D172 T173 Q178 Y179 H180	Y158-Q176 HydrophobicContact CD1-CG 3.89Å; Y158-Q176 HydrophobicContact CG-CG 4.07Å; D172-Q176 WeakPolarHBondContact O-CG 3.4Å; D172-Q176 PolarHBondContact O-N 3.14Å; D172-Q176 VanDerWaalsContact O-N 3.13Å; D172-Q176 PolarHBondContact O-NE2 3.43Å; D172-Q176 VanDerWaalsContact O-NE2 3.13Å; T173-Q176 WeakPolarHBondContact O-CB 3.44Å; T173-Q176 PolarHBondContact O-N 3.44Å; Q176-Q178 VanDerWaalsContact C-N 3.31Å; Q176-Q178 PolarHBondContact O-N 3.11Å; Q176-Y179 WeakPolarHBondContact O-CB 3.39Å; Q176-Y179 PolarHBondContact O-N 2.81Å; Q176-H180 PolarHBondContact O-CD2 3.34Å; Q176-H180 PolarHBondContact O-N 3.38Å
177	Y	94.8	Very high	91.2	Very high	6 Å²	6	42.2 Å²	42.2	2%	0.024	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-41.6	175.3	-84.9	-77.9	0	0	0	111.9	Y19 L21 C91 V122 Q124 T173 M174 Y179 H180 F181	Y19-Y177 AromaticContact CE1-CZ 3.92Å; Y19-Y177 VanDerWaalsContact CE1-OH 3.24Å; Y19-Y177 WeakPolarHBondContact CE1-OH 3.3Å; Y19-Y177 WeakPolarHBondContact OH-CE2 3.44Å; L21-Y177 HydrophobicContact CD1-CD1 4.24Å; L21-Y177 HydrophobicContact CD1-CD2 3.5Å; L21-Y177 VanDerWaalsContact CD1-CD2 3.5Å; L21-Y177 HydrophobicContact CD1-CE1 4.43Å; L21-Y177 HydrophobicContact CD1-CE2 3.75Å; L21-Y177 HydrophobicContact CD1-CG 3.77Å; L21-Y177 HydrophobicContact CD2-CD1 4.35Å; L21-Y177 HydrophobicContact CD2-CG 4.32Å; C91-Y177 HydrophobicContact CB-CE1 4.49Å; V122-Y177 HydrophobicContact CB-CE1 4.3Å; V122-Y177 HydrophobicContact CG1-CD1 4.32Å; V122-Y177 HydrophobicContact CG1-CE1 3.65Å; Q124-Y177 PolarHBondContact OE1-OH 2.79Å; T173-Y177 HydrophobicContact CG2-CD2 3.69Å; T173-Y177 HydrophobicContact CG2-CE2 3.53Å; T173-Y177 VanDerWaalsContact O-CD2 3.26Å; T173-Y177 WeakPolarHBondContact O-CD2 3.14Å; T173-Y177 PolarHBondContact O-N 2.76Å; M174-Y177 PolarHBondContact O-N 3.5Å; Y177-Y179 VanDerWaalsContact C-N 3.32Å; Y177-Y179 PolarHBondContact O-N 3.3Å; Y177-H180 PolarHBondContact O-N 3.18Å; Y177-F181 AromaticContact CD1-CE1 3.88Å; Y177-F181 HydrophobicContact CD1-CE1 3.88Å; Y177-F181 HydrophobicContact CD1-CE2 4.36Å; Y177-F181 AromaticContact CD1-CZ 3.58Å; Y177-F181 HydrophobicContact CD1-CZ 3.58Å; Y177-F181 HydrophobicContact CG-CZ 4.22Å; Y177-F181 WeakPolarHBondContact O-CB 3.14Å; Y177-F181 WeakPolarHBondContact O-CD1 3.44Å; Y177-F181 WeakPolarHBondContact O-CD2 3.49Å; Y177-F181 WeakPolarHBondContact O-CG 3.32Å; Y177-F181 PolarHBondContact O-N 3.04Å
178	Q	93.9	Very high	89.8	Confident	5 Å²	5	44.2 Å²	44.2	2%	0.023	21%	0.21	C	C	.	.	H	α-helix	trans	-59.4	-43.1	177.1	179.4	54.2	13.8	0	0	112.1	H40 F42 M174 H175 Q176 H180 F181 Q182	H40-Q178 PolarHBondContact CD2-NE2 2.8Å; H40-Q178 PolarHBondContact CE1-NE2 2.83Å; H40-Q178 PolarHBondContact ND1-NE2 2.84Å; H40-Q178 PolarHBondContact NE2-NE2 2.8Å; F42-Q178 HydrophobicContact CE1-CB 4.31Å; F42-Q178 HydrophobicContact CZ-CB 3.79Å; F42-Q178 HydrophobicContact CZ-CG 4.28Å; M174-Q178 VanDerWaalsContact O-CB 3.26Å; M174-Q178 WeakPolarHBondContact O-CB 3.43Å; M174-Q178 PolarHBondContact O-N 2.87Å; H175-Q178 PolarHBondContact O-N 3.35Å; Q176-Q178 VanDerWaalsContact C-N 3.31Å; Q176-Q178 PolarHBondContact O-N 3.11Å; Q178-H180 VanDerWaalsContact C-N 3.35Å; Q178-H180 PolarHBondContact O-N 3.14Å; Q178-F181 PolarHBondContact O-N 3.44Å; Q178-Q182 VanDerWaalsContact NE2-NE2 3.16Å; Q178-Q182 VanDerWaalsContact O-CG 3.32Å; Q178-Q182 WeakPolarHBondContact O-CG 3.39Å; Q178-Q182 PolarHBondContact O-N 3.18Å
179	Y	91.7	Very high	87.8	Confident	118 Å²	118	43.7 Å²	43.7	46%	0.463	22%	0.221	S	C	.	.	H	α-helix	trans	-57.5	-47	175	174.1	-92.5	0	0	0	111.6	H175 Q176 Y177 R183	H175-Y179 PolarHBondContact O-N 3.43Å; Q176-Y179 WeakPolarHBondContact O-CB 3.39Å; Q176-Y179 PolarHBondContact O-N 2.81Å; Y177-Y179 VanDerWaalsContact C-N 3.32Å; Y177-Y179 PolarHBondContact O-N 3.3Å; Y179-R183 PolarHBondContact O-N 3.29Å
180	H	90.8	Very high	85.4	Confident	43 Å²	43	49.2 Å²	49.2	20%	0.199	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-44.3	175.9	-72	-68.8	0	0	0	112.1	E120 Q176 Y177 Q178 Q182 R183 L184	E120-H180 IonicContact OE1-ND1 3.45Å; E120-H180 PolarHBondContact OE1-ND1 3.44Å; Q176-H180 PolarHBondContact O-CD2 3.34Å; Q176-H180 PolarHBondContact O-N 3.38Å; Y177-H180 PolarHBondContact O-N 3.18Å; Q178-H180 VanDerWaalsContact C-N 3.35Å; Q178-H180 PolarHBondContact O-N 3.14Å; H180-Q182 PolarHBondContact O-N 3.37Å; H180-R183 WeakPolarHBondContact O-CA 3.23Å; H180-R183 WeakPolarHBondContact O-CB 3.11Å; H180-R183 PolarHBondContact O-N 3.48Å; H180-R183 VanDerWaalsContact O-N 3.08Å; H180-L184 PolarHBondContact O-N 2.87Å
181	F	92	Very high	82.4	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.7	-35.6	-178.5	-63.5	-12.2	0	0	0	113.1	L21 A23 F42 V89 C91 A108 Y177 Q178 R183 L184 R185	L21-F181 HydrophobicContact CD2-CE2 3.61Å; L21-F181 HydrophobicContact CD2-CZ 3.7Å; A23-F181 HydrophobicContact CB-CD2 3.75Å; A23-F181 HydrophobicContact CB-CE2 3.54Å; F42-F181 HydrophobicContact CE1-CD2 4.28Å; F42-F181 HydrophobicContact CE1-CE2 4.29Å; V89-F181 HydrophobicContact CB-CD1 4.42Å; V89-F181 HydrophobicContact CB-CD2 4.05Å; V89-F181 HydrophobicContact CB-CE2 4.17Å; V89-F181 HydrophobicContact CB-CG 4.17Å; V89-F181 HydrophobicContact CB-CZ 4.41Å; V89-F181 HydrophobicContact CG1-CD1 3.68Å; V89-F181 HydrophobicContact CG1-CD2 4.17Å; V89-F181 HydrophobicContact CG1-CE1 3.7Å; V89-F181 HydrophobicContact CG1-CE2 4.17Å; V89-F181 HydrophobicContact CG1-CG 3.92Å; V89-F181 HydrophobicContact CG1-CZ 3.93Å; V89-F181 HydrophobicContact CG2-CB 4.17Å; V89-F181 HydrophobicContact CG2-CD2 4.17Å; V89-F181 HydrophobicContact CG2-CG 4.09Å; C91-F181 HydrophobicContact CB-CZ 4.19Å; A108-F181 HydrophobicContact CB-CD1 4.23Å; A108-F181 HydrophobicContact CB-CE1 3.62Å; Y177-F181 AromaticContact CD1-CE1 3.88Å; Y177-F181 HydrophobicContact CD1-CE1 3.88Å; Y177-F181 HydrophobicContact CD1-CE2 4.36Å; Y177-F181 AromaticContact CD1-CZ 3.58Å; Y177-F181 HydrophobicContact CD1-CZ 3.58Å; Y177-F181 HydrophobicContact CG-CZ 4.22Å; Y177-F181 WeakPolarHBondContact O-CB 3.14Å; Y177-F181 WeakPolarHBondContact O-CD1 3.44Å; Y177-F181 WeakPolarHBondContact O-CD2 3.49Å; Y177-F181 WeakPolarHBondContact O-CG 3.32Å; Y177-F181 PolarHBondContact O-N 3.04Å; Q178-F181 PolarHBondContact O-N 3.44Å; F181-R183 VanDerWaalsContact C-N 3.33Å; F181-L184 PolarHBondContact O-N 3.44Å; F181-R185 WeakPolarHBondContact O-CB 3.26Å; F181-R185 VanDerWaalsContact O-CG 3.27Å; F181-R185 WeakPolarHBondContact O-CG 3.49Å; F181-R185 PolarHBondContact O-N 3.11Å
182	Q	90	Very high	79.3	Confident	27 Å²	27	55.4 Å²	55.4	13%	0.126	32%	0.315	C	S	.	.	H	α-helix	trans	-62.2	-42.8	170.7	-73.5	168.3	-5.8	0	0	111.4	D57 Q178 H180 R185 R186	D57-Q182 VanDerWaalsContact CG-NE2 3.28Å; D57-Q182 PolarHBondContact OD1-NE2 3.23Å; Q178-Q182 VanDerWaalsContact NE2-NE2 3.16Å; Q178-Q182 VanDerWaalsContact O-CG 3.32Å; Q178-Q182 WeakPolarHBondContact O-CG 3.39Å; Q178-Q182 PolarHBondContact O-N 3.18Å; H180-Q182 PolarHBondContact O-N 3.37Å; Q182-R185 PolarHBondContact O-N 3.45Å; Q182-R186 WeakPolarHBondContact O-CG 3.47Å; Q182-R186 PolarHBondContact O-N 3.07Å; Q182-R186 VanDerWaalsContact O-N 3.09Å
183	R	87.8	Confident	76.1	Confident	122 Å²	122	63.2 Å²	63.2	46%	0.46	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-46.5	176.6	-170.2	171.2	71.9	176	5.9	111.2	E120 Y179 H180 F181 R185 R186 T187	E120-R183 IonicContact OE1-CZ 2.62Å; E120-R183 IonicContact OE1-NE 2.67Å; E120-R183 PolarHBondContact OE1-NE 3.02Å; E120-R183 IonicContact OE1-NH2 3.47Å; E120-R183 PolarHBondContact OE1-NH2 3.16Å; Y179-R183 PolarHBondContact O-N 3.29Å; H180-R183 WeakPolarHBondContact O-CA 3.23Å; H180-R183 WeakPolarHBondContact O-CB 3.11Å; H180-R183 PolarHBondContact O-N 3.48Å; H180-R183 VanDerWaalsContact O-N 3.08Å; F181-R183 VanDerWaalsContact C-N 3.33Å; R183-R185 VanDerWaalsContact C-N 3.32Å; R183-R185 PolarHBondContact O-N 3.3Å; R183-R186 PolarHBondContact O-N 2.75Å; R183-T187 PolarHBondContact O-N 2.94Å; R183-T187 PolarHBondContact O-OG1 3.32Å
184	L	88.3	Confident	72.9	Confident	8 Å²	8	68.2 Å²	68.2	4%	0.042	39%	0.391	C	S	.	.	H	α-helix	trans	-56.8	-44.2	176.2	-171.7	54.2	0	0	0	112.1	A108 I110 L118 E120 H180 F181 R186 T187	A108-L184 HydrophobicContact CB-CD2 4.22Å; I110-L184 HydrophobicContact CD1-CB 4.25Å; I110-L184 HydrophobicContact CD1-CD2 3.91Å; I110-L184 HydrophobicContact CD1-CG 3.82Å; I110-L184 HydrophobicContact CG1-CD2 3.77Å; I110-L184 HydrophobicContact CG1-CG 4.14Å; L118-L184 HydrophobicContact CB-CD1 3.68Å; L118-L184 HydrophobicContact CB-CG 4.08Å; L118-L184 HydrophobicContact CD1-CG 4.44Å; L118-L184 WeakPolarHBondContact CD1-O 3.47Å; E120-L184 HydrophobicContact CB-CD1 3.94Å; E120-L184 HydrophobicContact CB-CD2 4.12Å; H180-L184 PolarHBondContact O-N 2.87Å; F181-L184 PolarHBondContact O-N 3.44Å; L184-R186 VanDerWaalsContact C-N 3.31Å; L184-R186 PolarHBondContact O-N 2.81Å; L184-T187 PolarHBondContact O-N 3.23Å
185	R	85.9	Confident	69.7	Low	25 Å²	25	77.1 Å²	77.1	9%	0.094	43%	0.433	C	S	.	.	H	α-helix	trans	-67	-25.7	176.2	-72	176	-173.4	126.5	-2.8	113.8	T25 I86 S87 I110 F181 Q182 R183 T188	T25-R185 PolarHBondContact OG1-NH2 3.47Å; I86-R185 HydrophobicContact CD1-CB 4.42Å; I86-R185 HydrophobicContact CD1-CG 4.43Å; I86-R185 PolarHBondContact O-NE 3.23Å; I86-R185 VanDerWaalsContact O-NE 3.12Å; S87-R185 PolarHBondContact O-NH2 2.83Å; I110-R185 HydrophobicContact CD1-CB 4.49Å; I110-R185 HydrophobicContact CD1-CG 3.44Å; I110-R185 VanDerWaalsContact CD1-CG 3.44Å; F181-R185 WeakPolarHBondContact O-CB 3.26Å; F181-R185 VanDerWaalsContact O-CG 3.27Å; F181-R185 WeakPolarHBondContact O-CG 3.49Å; F181-R185 PolarHBondContact O-N 3.11Å; Q182-R185 PolarHBondContact O-N 3.45Å; R183-R185 VanDerWaalsContact C-N 3.32Å; R183-R185 PolarHBondContact O-N 3.3Å; R185-T188 PolarHBondContact O-OG1 3.31Å
186	R	82.8	Confident	66.7	Low	186 Å²	186	82.7 Å²	82.7	70%	0.702	47%	0.468	S	S	*	.	H	α-helix	trans	-79.8	-27.1	177.8	-73.2	177.9	-168.9	-171.5	5	112.6	Q182 R183 L184 T188 G189	Q182-R186 WeakPolarHBondContact O-CG 3.47Å; Q182-R186 PolarHBondContact O-N 3.07Å; Q182-R186 VanDerWaalsContact O-N 3.09Å; R183-R186 PolarHBondContact O-N 2.75Å; L184-R186 VanDerWaalsContact C-N 3.31Å; L184-R186 PolarHBondContact O-N 2.81Å; R186-T188 PolarHBondContact O-N 2.87Å; R186-G189 PolarHBondContact O-N 3.05Å
187	T	75.1	Confident	63.8	Low	109 Å²	109	86.8 Å²	86.8	67%	0.669	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.4	177	-51.7	0	0	0	0	112.8	R183 L184	R183-T187 PolarHBondContact O-N 2.94Å; R183-T187 PolarHBondContact O-OG1 3.32Å; L184-T187 PolarHBondContact O-N 3.23Å
188	T	64.4	Low	61	Low	78 Å²	78	93.1 Å²	93.1	48%	0.479	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-18.6	171.9	46.1	0	0	0	0	115.2	L118 R185 R186 T190	L118-T188 HydrophobicContact CD1-CG2 3.33Å; L118-T188 HydrophobicContact CD2-CG2 3.66Å; L118-T188 HydrophobicContact CG-CG2 3.92Å; R185-T188 PolarHBondContact O-OG1 3.31Å; R186-T188 PolarHBondContact O-N 2.87Å; T188-T190 PolarHBondContact O-N 3.04Å
189	G	51	Low	58.2	Low	45 Å²	45	97.2 Å²	97.2	46%	0.464	57%	0.569	S	S	.	*	S	Bend	trans	-93.1	100.3	-177	0	0	0	0	0	111.3	R186	R186-G189 PolarHBondContact O-N 3.05Å
190	T	43.3	Very low	55.5	Low	149 Å²	149	97.3 Å²	97.3	91%	0.914	58%	0.582	S	S	*	*	S	Bend	trans	53.9	96.4	159.8	52.2	0	0	0	0	116.6	T188	T188-T190 PolarHBondContact O-N 3.04Å
191	G	31.2	Very low	52.9	Low	80 Å²	80	100.5 Å²	100.5	83%	0.825	61%	0.61	S	S	*	*	S	Bend	trans	-173.1	-17.4	167	0	0	0	0	0	117.6
192	A	29.5	Very low	50.3	Low	100 Å²	100	113.6 Å²	113.6	83%	0.826	67%	0.671	S	S	*	*	S	Bend	trans	-131.8	25.5	-174.1	0	0	0	0	0	115.1
193	L	28	Very low	48.3	Very low	171 Å²	171	118 Å²	118	90%	0.895	70%	0.698	S	S	*	*			trans	-125.8	63.7	166.4	-81.6	152.9	0	0	0	108.5
194	S	27.3	Very low	46.3	Very low	111 Å²	111	117.7 Å²	117.7	78%	0.776	71%	0.711	S	S	*	*			trans	-126.8	83.9	160.4	-65.1	0	0	0	0	106.4
195	Q	28.3	Very low	43.9	Very low	187 Å²	187	123.8 Å²	123.8	87%	0.874	75%	0.748	S	S	*	*			trans	179.3	72.7	153.7	-98.9	166.1	30.3	0	0	108
196	T	31.6	Very low	41.5	Very low	131 Å²	131	129.6 Å²	129.6	80%	0.804	79%	0.786	S	S	*	*			trans	-116.3	93.9	147.9	-41.7	0	0	0	0	105.5	T198	T196-T198 PolarHBondContact O-N 3.1Å; T196-T198 VanDerWaalsContact O-N 3.14Å
197	T	33.4	Very low	38.9	Very low	122 Å²	122	126.1 Å²	126.1	75%	0.748	79%	0.792	S	S	*	*			trans	-48.8	108.7	169.6	35	0	0	0	0	110.4	A199	T197-A199 PolarHBondContact O-N 3.01Å
198	T	34.5	Very low	36.5	Very low	139 Å²	139	127.3 Å²	127.3	85%	0.853	80%	0.8	S	S	*	*			trans	-74.2	94.9	156.8	39.6	0	0	0	0	107.9	T196	T196-T198 PolarHBondContact O-N 3.1Å; T196-T198 VanDerWaalsContact O-N 3.14Å
199	A	35.2	Very low	34.5	Very low	90 Å²	90	130.8 Å²	130.8	74%	0.744	82%	0.823	S	S	*	*			trans	-109.3	97.8	161.5	0	0	0	0	0	107.4	T197	T197-A199 PolarHBondContact O-N 3.01Å
200	T	36.3	Very low	33.2	Very low	120 Å²	120	137.4 Å²	137.4	74%	0.736	85%	0.851	S	S	*	*			trans	-145.7	93.6	164.8	45.2	0	0	0	0	105.4
201	S	34.9	Very low	32.4	Very low	111 Å²	111	136.4 Å²	136.4	78%	0.776	85%	0.845	S	S	*	*				75.6	94.5	87.1	61.2	0	0	0	0	112.3
202	E	38.6	Very low	32.5	Very low	275 Å²	275	141.5 Å²	141.5	100%	1.285	85%	0.847	S	S	*	*			trans	-121.5	0	135.3	-76.5	-172.8	158.2	0	0	107.3

Retrieved 202 of 202 residues in 56.3 ms (Link to these results)

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