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Isoform 5 of Peroxisomal coenzyme A diphosphatase NUDT7 AlphaSync

Canonical isoform description: Fatty acyl-coenzyme A (CoA) diphosphatase that hydrolyzes fatty acyl-CoA to yield acyl-4'-phosphopantetheine and adenosine 3',5'-bisphosphate^1,2,3. Cleaves CoA, CoA esters and oxidized CoA with similar efficiencies⁴. Preferentially hydrolyzes medium-chain acyl-CoAs and bile acid-CoAs⁵. Has no activity toward NDP-sugars, CDP-alcohols, (deoxy)nucleoside 5'-triphosphates, nucleoside 5'-di or monophosphates, diadenosine polyphosphates, NAD, NADH, NADP, NADPH or thymidine-5'-monophospho-p-nitrophenyl ester⁶. May be required to eliminate oxidized CoA from peroxisomes, or regulate CoA and acyl-CoA levels in this organelle in response to metabolic demand⁷. Does not play a role in U8 snoRNA decapping activity⁸. Binds U8 snoRNA⁹. Exhibits decapping activity towards dpCoA-capped RNAs in vitro¹⁰.

AlphaFold DB , UniProt , Accession Q99P30-5 (canonical: Q99P30), Species MOUSE (Mus musculus, Mouse), Gene Nudt7, Length 171 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.8	Very low	49.3	Very low	242 Å²	242	120.6 Å²	120.6	100%	1.192	69%	0.692	S	S	*	*				0	102.1	0	-68.4	-173.9	173.9	0	0	107.2	R3	M1-R3 PolarHBondContact O-N 2.99Å
2	S	41.7	Very low	49.9	Very low	122 Å²	122	115.6 Å²	115.6	85%	0.853	65%	0.653	S	S	*	*			trans	-66.3	120.7	175.4	-55.2	0	0	0	0	108
3	R	42.3	Very low	50.9	Low	225 Å²	225	111.5 Å²	111.5	85%	0.849	63%	0.628	S	S	*	*			trans	-58.1	138.5	172.2	-69.9	177.7	82.5	-175.4	5.2	107.3	M1 C5	M1-R3 PolarHBondContact O-N 2.99Å; R3-C5 VanDerWaalsContact C-N 3.33Å; R3-C5 PolarHBondContact O-N 2.68Å
4	P	46.8	Very low	53.1	Low	128 Å²	128	110.8 Å²	110.8	83%	0.831	62%	0.623	S	S	*	*			trans	-62.4	102.6	165.6	-9.3	23.4	0	0	0	106.4	G6	P4-G6 PolarHBondContact O-N 3.49Å
5	C	50.7	Low	55.2	Low	122 Å²	122	106.7 Å²	106.7	82%	0.824	60%	0.598	S	S	*	*			trans	-82.2	54	173.8	-159.6	0	0	0	0	108.6	R3	R3-C5 VanDerWaalsContact C-N 3.33Å; R3-C5 PolarHBondContact O-N 2.68Å
6	G	46.7	Very low	57	Low	60 Å²	60	100.6 Å²	100.6	62%	0.619	56%	0.564	S	S	*	*			trans	-122.8	113.2	175.5	0	0	0	0	0	108.1	P4	P4-G6 PolarHBondContact O-N 3.49Å
7	L	48.8	Very low	58.8	Low	87 Å²	87	99.6 Å²	99.6	46%	0.455	56%	0.557	S	S	.	*			trans	-64.7	155.2	161.3	-106.8	114.4	0	0	0	108.9	E9 V11	L7-E9 PolarHBondContact O-N 3.16Å; L7-V11 HydrophobicContact CD2-CB 4Å; L7-V11 HydrophobicContact CD2-CG1 3.98Å; L7-V11 HydrophobicContact CD2-CG2 4.02Å
8	P	52.4	Low	60.5	Low	83 Å²	83	99.9 Å²	99.9	54%	0.539	56%	0.557	S	S	.	*			trans	-53.8	131.2	173.4	-23.6	33.3	0	0	0	111.4	P10 V11	P8-P10 VanDerWaalsContact C-N 3.25Å; P8-P10 HydrophobicContact CB-CG 3.97Å; P8-P10 WeakPolarHBondContact O-CD 3.47Å; P8-V11 PolarHBondContact O-N 3.47Å
9	E	55.1	Low	61.9	Low	108 Å²	108	95.1 Å²	95.1	51%	0.505	53%	0.532	S	S	.	.	H	α-helix	trans	-33	-43.4	172.4	-69.1	-61.3	140.1	0	0	116.1	L7 V11 R12 N13	L7-E9 PolarHBondContact O-N 3.16Å; E9-V11 VanDerWaalsContact C-N 3.31Å; E9-V11 PolarHBondContact O-N 3.06Å; E9-R12 PolarHBondContact O-N 3.49Å; E9-R12 IonicContact OE1-NE 2.6Å; E9-R12 IonicContact OE2-CZ 2.7Å; E9-R12 VanDerWaalsContact OE2-CZ 3.26Å; E9-R12 IonicContact OE2-NE 3.74Å; E9-R12 PolarHBondContact OE2-NE 2.88Å; E9-R12 IonicContact OE2-NH2 3.27Å; E9-R12 PolarHBondContact OE2-NH2 3.28Å; E9-N13 PolarHBondContact O-N 3.33Å
10	P	58.8	Low	63.3	Low	81 Å²	81	91.5 Å²	91.5	53%	0.526	51%	0.51	S	S	.	.	H	α-helix	trans	-59.1	-34.4	179.7	18.7	-33.5	0	0	0	114.8	P8 N14	P8-P10 VanDerWaalsContact C-N 3.25Å; P8-P10 HydrophobicContact CB-CG 3.97Å; P8-P10 WeakPolarHBondContact O-CD 3.47Å; P10-N14 PolarHBondContact O-N 3.38Å; P10-N14 PolarHBondContact O-ND2 3.26Å; P10-N14 PolarHBondContact O-OD1 2.99Å
11	V	59.4	Low	64.6	Low	69 Å²	69	89.4 Å²	89.4	42%	0.418	51%	0.505	S	S	.	.	H	α-helix	trans	-73.7	-38.2	179.2	-176.5	0	0	0	0	110.7	L7 P8 E9 L15	L7-V11 HydrophobicContact CD2-CB 4Å; L7-V11 HydrophobicContact CD2-CG1 3.98Å; L7-V11 HydrophobicContact CD2-CG2 4.02Å; P8-V11 PolarHBondContact O-N 3.47Å; E9-V11 VanDerWaalsContact C-N 3.31Å; E9-V11 PolarHBondContact O-N 3.06Å; V11-L15 PolarHBondContact O-N 3.29Å
12	R	56.6	Low	67.1	Low	60 Å²	60	87 Å²	87	23%	0.226	48%	0.482	C	S	.	.	H	α-helix	trans	-63.3	-47.3	177.1	-174.5	-174.3	69.1	78.6	3.4	111.3	E9 N14 L15 I16 A48	E9-R12 PolarHBondContact O-N 3.49Å; E9-R12 IonicContact OE1-NE 2.6Å; E9-R12 IonicContact OE2-CZ 2.7Å; E9-R12 VanDerWaalsContact OE2-CZ 3.26Å; E9-R12 IonicContact OE2-NE 3.74Å; E9-R12 PolarHBondContact OE2-NE 2.88Å; E9-R12 IonicContact OE2-NH2 3.27Å; E9-R12 PolarHBondContact OE2-NH2 3.28Å; R12-N14 PolarHBondContact O-N 3.38Å; R12-L15 PolarHBondContact O-N 3.48Å; R12-I16 PolarHBondContact O-N 2.81Å; R12-A48 HydrophobicContact CG-CB 4.14Å
13	N	62.7	Low	69.4	Low	62 Å²	62	82.8 Å²	82.8	33%	0.332	45%	0.45	S	S	.	.	H	α-helix	trans	-61.4	-45	-179.5	-69.5	-13.3	0	0	0	111	E9 L15 I16 D17	E9-N13 PolarHBondContact O-N 3.33Å; N13-L15 VanDerWaalsContact C-N 3.32Å; N13-L15 PolarHBondContact O-N 2.98Å; N13-I16 PolarHBondContact O-N 2.7Å; N13-D17 VanDerWaalsContact O-CB 3.24Å; N13-D17 WeakPolarHBondContact O-CB 3.31Å; N13-D17 PolarHBondContact O-N 3.13Å; N13-D17 VanDerWaalsContact O-OD2 3.08Å
14	N	81.1	Confident	71.7	Confident	102 Å²	102	78.8 Å²	78.8	55%	0.545	44%	0.435	S	S	.	.	H	α-helix	trans	-57.9	-42.1	178.7	-70.3	-6	0	0	0	112.9	P10 R12 D17 D18	P10-N14 PolarHBondContact O-N 3.38Å; P10-N14 PolarHBondContact O-ND2 3.26Å; P10-N14 PolarHBondContact O-OD1 2.99Å; R12-N14 PolarHBondContact O-N 3.38Å; N14-D17 PolarHBondContact O-N 3.45Å; N14-D18 VanDerWaalsContact O-CB 3.29Å; N14-D18 WeakPolarHBondContact O-CB 3.5Å; N14-D18 PolarHBondContact O-N 3.39Å
15	L	84.5	Confident	73.8	Confident	50 Å²	50	81.4 Å²	81.4	26%	0.262	43%	0.433	S	S	.	.	H	α-helix	trans	-68.5	-44.2	-178.4	-175.3	66.5	0	0	0	112.6	V11 R12 N13 A19 G51 L53	V11-L15 PolarHBondContact O-N 3.29Å; R12-L15 PolarHBondContact O-N 3.48Å; N13-L15 VanDerWaalsContact C-N 3.32Å; N13-L15 PolarHBondContact O-N 2.98Å; L15-A19 WeakPolarHBondContact O-CB 3.29Å; L15-A19 PolarHBondContact O-N 3.3Å; L15-G51 WeakPolarHBondContact CD2-O 3.34Å; L15-L53 HydrophobicContact CD1-CD1 4.13Å; L15-L53 HydrophobicContact CD1-CG 4.09Å; L15-L53 HydrophobicContact CD2-CD2 3.97Å; L15-L53 HydrophobicContact CD2-CG 3.69Å; L15-L53 HydrophobicContact CG-CD1 4.13Å; L15-L53 HydrophobicContact CG-CD2 3.89Å; L15-L53 HydrophobicContact CG-CG 3.68Å
16	I	84.3	Confident	75.5	Confident	9 Å²	9	78.1 Å²	78.1	5%	0.046	41%	0.412	C	S	.	.	H	α-helix	trans	-64.4	-44.5	175	-71.6	-177	0	0	0	109.9	R12 N13 D18 A19 K20 A48 T139	R12-I16 PolarHBondContact O-N 2.81Å; N13-I16 PolarHBondContact O-N 2.7Å; I16-D18 PolarHBondContact O-N 3.49Å; I16-A19 WeakPolarHBondContact O-CB 3.43Å; I16-A19 PolarHBondContact O-N 3.41Å; I16-K20 HydrophobicContact CG2-CD 3.84Å; I16-K20 HydrophobicContact CG2-CG 4.2Å; I16-K20 WeakPolarHBondContact O-CB 3.39Å; I16-K20 VanDerWaalsContact O-CG 3.25Å; I16-K20 WeakPolarHBondContact O-CG 3.3Å; I16-K20 PolarHBondContact O-N 2.83Å; I16-A48 HydrophobicContact CD1-CB 3.6Å; I16-A48 HydrophobicContact CG1-CB 3.46Å; I16-A48 VanDerWaalsContact CG1-CB 3.46Å; I16-T139 HydrophobicContact CG2-CG2 4.48Å
17	D	88.4	Confident	77.6	Confident	83 Å²	83	78.2 Å²	78.2	44%	0.444	40%	0.398	S	S	.	.	H	α-helix	trans	-65.5	-40	-178.1	-69.6	-29.1	0	0	0	111.8	N13 N14 K20 A21	N13-D17 VanDerWaalsContact O-CB 3.24Å; N13-D17 WeakPolarHBondContact O-CB 3.31Å; N13-D17 PolarHBondContact O-N 3.13Å; N13-D17 VanDerWaalsContact O-OD2 3.08Å; N14-D17 PolarHBondContact O-N 3.45Å; D17-K20 WeakPolarHBondContact O-CB 3.41Å; D17-K20 PolarHBondContact O-N 3.28Å; D17-A21 VanDerWaalsContact O-CB 3.3Å; D17-A21 WeakPolarHBondContact O-CB 3.06Å; D17-A21 PolarHBondContact O-N 3.38Å
18	D	89.3	Confident	79.6	Confident	105 Å²	105	74.5 Å²	74.5	56%	0.561	38%	0.379	S	S	*	.	H	α-helix	trans	-63	-43.8	173.1	-78.5	-19.5	0	0	0	111.6	N14 I16 A21 R22	N14-D18 VanDerWaalsContact O-CB 3.29Å; N14-D18 WeakPolarHBondContact O-CB 3.5Å; N14-D18 PolarHBondContact O-N 3.39Å; I16-D18 PolarHBondContact O-N 3.49Å; D18-A21 PolarHBondContact O-N 2.76Å; D18-R22 VanDerWaalsContact O-CG 3.31Å; D18-R22 WeakPolarHBondContact O-CG 3.45Å; D18-R22 PolarHBondContact O-N 2.91Å
19	A	87.8	Confident	81.3	Confident	9 Å²	9	71.9 Å²	71.9	7%	0.074	37%	0.367	C	S	.	.	H	α-helix	trans	-60	-52.6	174.4	0	0	0	0	0	110.3	L15 I16 A21 R22 L23 L46 L53	L15-A19 WeakPolarHBondContact O-CB 3.29Å; L15-A19 PolarHBondContact O-N 3.3Å; I16-A19 WeakPolarHBondContact O-CB 3.43Å; I16-A19 PolarHBondContact O-N 3.41Å; A19-A21 VanDerWaalsContact C-N 3.3Å; A19-A21 PolarHBondContact O-N 2.92Å; A19-R22 WeakPolarHBondContact O-CB 3.4Å; A19-R22 PolarHBondContact O-N 3.15Å; A19-L23 HydrophobicContact CB-CD1 4.24Å; A19-L23 WeakPolarHBondContact O-CB 3.29Å; A19-L23 VanDerWaalsContact O-CD1 3.28Å; A19-L23 WeakPolarHBondContact O-CD1 3.43Å; A19-L23 WeakPolarHBondContact O-CG 3.5Å; A19-L23 PolarHBondContact O-N 2.9Å; A19-L46 HydrophobicContact CB-CD2 3.76Å; A19-L53 HydrophobicContact CB-CD1 4.01Å
20	K	89.7	Confident	82.8	Confident	23 Å²	23	71.6 Å²	71.6	10%	0.1	37%	0.373	C	S	.	.	H	α-helix	trans	-52.2	-47.8	176.3	-74.5	177.1	179.8	171.7	0	111.9	I16 D17 R22 L23 R24 E105 V107 T139	I16-K20 HydrophobicContact CG2-CD 3.84Å; I16-K20 HydrophobicContact CG2-CG 4.2Å; I16-K20 WeakPolarHBondContact O-CB 3.39Å; I16-K20 VanDerWaalsContact O-CG 3.25Å; I16-K20 WeakPolarHBondContact O-CG 3.3Å; I16-K20 PolarHBondContact O-N 2.83Å; D17-K20 WeakPolarHBondContact O-CB 3.41Å; D17-K20 PolarHBondContact O-N 3.28Å; K20-R22 VanDerWaalsContact C-N 3.28Å; K20-R22 PolarHBondContact O-N 3.22Å; K20-L23 PolarHBondContact O-N 3.35Å; K20-R24 WeakPolarHBondContact O-CB 3.24Å; K20-R24 VanDerWaalsContact O-CG 3.29Å; K20-R24 WeakPolarHBondContact O-CG 3.26Å; K20-R24 PolarHBondContact O-N 2.81Å; K20-E105 VanDerWaalsContact CE-OE2 3.24Å; K20-E105 WeakPolarHBondContact CE-OE2 3.32Å; K20-E105 IonicContact NZ-OE1 3.59Å; K20-E105 IonicContact NZ-OE2 3.54Å; K20-E105 PolarHBondContact NZ-OE2 2.95Å; K20-V107 HydrophobicContact CD-CG1 4.11Å; K20-V107 HydrophobicContact CG-CB 4.32Å; K20-V107 HydrophobicContact CG-CG1 3.68Å; K20-T139 WeakPolarHBondContact CE-OG1 3.44Å; K20-T139 HydrophobicContact CG-CG2 4.28Å
21	A	90.9	Very high	84.1	Confident	48 Å²	48	75.5 Å²	75.5	40%	0.397	38%	0.377	S	S	.	.	H	α-helix	trans	-61.9	-35.1	-180	0	0	0	0	0	112.6	D17 D18 A19 K25	D17-A21 VanDerWaalsContact O-CB 3.3Å; D17-A21 WeakPolarHBondContact O-CB 3.06Å; D17-A21 PolarHBondContact O-N 3.38Å; D18-A21 PolarHBondContact O-N 2.76Å; A19-A21 VanDerWaalsContact C-N 3.3Å; A19-A21 PolarHBondContact O-N 2.92Å; A21-K25 WeakPolarHBondContact O-CG 3.13Å
22	R	90.9	Very high	85.3	Confident	191 Å²	191	76.4 Å²	76.4	72%	0.721	37%	0.374	S	S	*	.	H	α-helix	trans	-73.3	-41.7	174.8	-69.2	171.5	65.9	-168.4	-0.7	111.9	D18 A19 K20 K25	D18-R22 VanDerWaalsContact O-CG 3.31Å; D18-R22 WeakPolarHBondContact O-CG 3.45Å; D18-R22 PolarHBondContact O-N 2.91Å; A19-R22 WeakPolarHBondContact O-CB 3.4Å; A19-R22 PolarHBondContact O-N 3.15Å; K20-R22 VanDerWaalsContact C-N 3.28Å; K20-R22 PolarHBondContact O-N 3.22Å; R22-K25 WeakPolarHBondContact O-CB 3.28Å; R22-K25 PolarHBondContact O-N 2.84Å
23	L	90.6	Very high	86.4	Confident	34 Å²	34	74.5 Å²	74.5	18%	0.178	37%	0.37	C	S	.	.	H	α-helix	trans	-71	-39	-175.3	-66.4	161.8	0	0	0	112.3	A19 K20 K25 S26 D27 L46 V107 S108 L137	A19-L23 HydrophobicContact CB-CD1 4.24Å; A19-L23 WeakPolarHBondContact O-CB 3.29Å; A19-L23 VanDerWaalsContact O-CD1 3.28Å; A19-L23 WeakPolarHBondContact O-CD1 3.43Å; A19-L23 WeakPolarHBondContact O-CG 3.5Å; A19-L23 PolarHBondContact O-N 2.9Å; K20-L23 PolarHBondContact O-N 3.35Å; L23-K25 PolarHBondContact O-N 3.32Å; L23-K25 VanDerWaalsContact O-N 3.13Å; L23-S26 PolarHBondContact O-N 3.22Å; L23-S26 PolarHBondContact O-OG 3.48Å; L23-D27 PolarHBondContact O-N 2.98Å; L23-L46 HydrophobicContact CD1-CD2 4.02Å; L23-V107 HydrophobicContact CB-CG2 4.32Å; L23-V107 HydrophobicContact CD1-CG2 4.03Å; L23-S108 PolarHBondContact O-OG 3.05Å; L23-L137 HydrophobicContact CB-CD2 3.91Å; L23-L137 HydrophobicContact CD1-CD2 3.13Å; L23-L137 HydrophobicContact CD1-CG 4.17Å; L23-L137 HydrophobicContact CD2-CD2 3.04Å; L23-L137 HydrophobicContact CG-CD2 3.41Å; L23-L137 VanDerWaalsContact CG-CD2 3.41Å
24	R	90.8	Very high	87.2	Confident	141 Å²	141	79.3 Å²	79.3	53%	0.532	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-59	-25.8	173.8	-72.9	172.9	-177.4	162	2.9	113.1	K20 S26 D27 E105 V107	K20-R24 WeakPolarHBondContact O-CB 3.24Å; K20-R24 VanDerWaalsContact O-CG 3.29Å; K20-R24 WeakPolarHBondContact O-CG 3.26Å; K20-R24 PolarHBondContact O-N 2.81Å; R24-S26 VanDerWaalsContact C-N 3.29Å; R24-S26 PolarHBondContact O-N 3.25Å; R24-D27 PolarHBondContact O-N 3.04Å; R24-E105 IonicContact NH2-OE1 3.95Å; R24-E105 PolarHBondContact NH2-OE1 3.45Å; R24-E105 VanDerWaalsContact NH2-OE1 3.11Å; R24-V107 WeakPolarHBondContact CG-O 3.49Å
25	K	91	Very high	86.8	Confident	182 Å²	182	79 Å²	79	79%	0.791	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-71.5	-24.7	175	-63.4	173.4	-175.4	179.2	0	112.8	A21 R22 L23	A21-K25 WeakPolarHBondContact O-CG 3.13Å; R22-K25 WeakPolarHBondContact O-CB 3.28Å; R22-K25 PolarHBondContact O-N 2.84Å; L23-K25 PolarHBondContact O-N 3.32Å; L23-K25 VanDerWaalsContact O-N 3.13Å
26	S	86.7	Confident	86	Confident	53 Å²	53	78.1 Å²	78.1	37%	0.371	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-96.8	2.3	176.4	50.5	0	0	0	0	113.4	L23 R24 V28	L23-S26 PolarHBondContact O-N 3.22Å; L23-S26 PolarHBondContact O-OG 3.48Å; R24-S26 VanDerWaalsContact C-N 3.29Å; R24-S26 PolarHBondContact O-N 3.25Å; S26-V28 WeakPolarHBondContact O-CG1 3.25Å; S26-V28 PolarHBondContact O-N 3.36Å
27	D	90.8	Very high	85.3	Confident	62 Å²	62	83.2 Å²	83.2	33%	0.332	42%	0.422	S	S	.	.			trans	-64.9	125	-176.5	-172.2	16	0	0	0	111.4	L23 R24 G29 R31 S108 H109	L23-D27 PolarHBondContact O-N 2.98Å; R24-D27 PolarHBondContact O-N 3.04Å; D27-G29 PolarHBondContact OD1-N 3.2Å; D27-R31 PolarHBondContact O-NH2 3.06Å; D27-S108 VanDerWaalsContact CA-OG 3.31Å; D27-S108 WeakPolarHBondContact CA-OG 3.44Å; D27-H109 WeakPolarHBondContact CA-O 3.48Å; D27-H109 WeakPolarHBondContact OD1-CB 3.43Å; D27-H109 IonicContact OD1-CG 2.82Å; D27-H109 PolarHBondContact OD1-N 3.31Å; D27-H109 IonicContact OD1-ND1 3.52Å; D27-H109 PolarHBondContact OD1-ND1 3.06Å
28	V	90.2	Very high	84.5	Confident	9 Å²	9	82.6 Å²	82.6	6%	0.055	42%	0.419	C	S	.	.			trans	-99.6	-6.5	177.9	-47.7	0	0	0	0	113.6	S26 T30 R31 Y32 H109 L110 V111	S26-V28 WeakPolarHBondContact O-CG1 3.25Å; S26-V28 PolarHBondContact O-N 3.36Å; V28-T30 PolarHBondContact O-N 2.94Å; V28-R31 VanDerWaalsContact CA-NH2 3.32Å; V28-R31 VanDerWaalsContact O-CB 3.22Å; V28-R31 WeakPolarHBondContact O-CB 3.41Å; V28-R31 WeakPolarHBondContact O-CG 3.42Å; V28-R31 PolarHBondContact O-N 3.11Å; V28-R31 PolarHBondContact O-NE 3.02Å; V28-Y32 HydrophobicContact CB-CD2 3.92Å; V28-Y32 HydrophobicContact CB-CE2 3.81Å; V28-Y32 HydrophobicContact CG1-CD2 4.4Å; V28-Y32 HydrophobicContact CG1-CE2 3.91Å; V28-Y32 HydrophobicContact CG2-CD2 3.62Å; V28-Y32 HydrophobicContact CG2-CE2 4Å; V28-H109 HydrophobicContact CG2-CB 4.03Å; V28-H109 WeakPolarHBondContact CG2-O 3.32Å; V28-H109 PolarHBondContact N-O 2.82Å; V28-L110 WeakPolarHBondContact CG2-O 3.02Å; V28-V111 HydrophobicContact CG1-CG2 3.68Å
29	G	88.6	Confident	84.2	Confident	29 Å²	29	79.7 Å²	79.7	30%	0.299	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	-135.9	-174.1	0	0	0	0	0	111.1	D27 R31	D27-G29 PolarHBondContact OD1-N 3.2Å; G29-R31 VanDerWaalsContact C-N 3.33Å; G29-R31 PolarHBondContact O-N 3.13Å
30	T	86.7	Confident	84.2	Confident	102 Å²	102	81.1 Å²	81.1	63%	0.626	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	7.5	-178.1	59.6	0	0	0	0	114.1	V28 Y32 S33	V28-T30 PolarHBondContact O-N 2.94Å; T30-Y32 PolarHBondContact O-N 2.93Å; T30-S33 VanDerWaalsContact O-CB 3.28Å; T30-S33 WeakPolarHBondContact O-CB 3.36Å; T30-S33 PolarHBondContact O-N 3.01Å; T30-S33 PolarHBondContact O-OG 2.85Å
31	R	85.4	Confident	84.2	Confident	163 Å²	163	80 Å²	80	62%	0.615	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-30.9	-173.3	-74.5	-174	-74.8	176.1	-8.1	114.1	D27 V28 G29	D27-R31 PolarHBondContact O-NH2 3.06Å; V28-R31 VanDerWaalsContact CA-NH2 3.32Å; V28-R31 VanDerWaalsContact O-CB 3.22Å; V28-R31 WeakPolarHBondContact O-CB 3.41Å; V28-R31 WeakPolarHBondContact O-CG 3.42Å; V28-R31 PolarHBondContact O-N 3.11Å; V28-R31 PolarHBondContact O-NE 3.02Å; G29-R31 VanDerWaalsContact C-N 3.33Å; G29-R31 PolarHBondContact O-N 3.13Å
32	Y	84	Confident	84.3	Confident	88 Å²	88	78.5 Å²	78.5	35%	0.345	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	3.7	-177.6	-58.1	-67	0	0	0	114.4	V28 T30 H34 L35 V111 P112	V28-Y32 HydrophobicContact CB-CD2 3.92Å; V28-Y32 HydrophobicContact CB-CE2 3.81Å; V28-Y32 HydrophobicContact CG1-CD2 4.4Å; V28-Y32 HydrophobicContact CG1-CE2 3.91Å; V28-Y32 HydrophobicContact CG2-CD2 3.62Å; V28-Y32 HydrophobicContact CG2-CE2 4Å; T30-Y32 PolarHBondContact O-N 2.93Å; Y32-H34 PolarHBondContact O-N 3.27Å; Y32-H34 VanDerWaalsContact O-N 3.15Å; Y32-L35 HydrophobicContact CD1-CD1 3.64Å; Y32-L35 HydrophobicContact CG-CD1 4.36Å; Y32-L35 PolarHBondContact O-N 2.92Å; Y32-V111 HydrophobicContact CE2-CG1 4.23Å; Y32-V111 HydrophobicContact CE2-CG2 4.24Å; Y32-P112 VanDerWaalsContact CD2-CD 3.44Å; Y32-P112 HydrophobicContact CD2-CG 4.22Å; Y32-P112 HydrophobicContact CG-CG 3.91Å
33	S	79.5	Confident	84.5	Confident	20 Å²	20	69.4 Å²	69.4	14%	0.14	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.1	-176	66.7	0	0	0	0	113.8	T30 K39	T30-S33 VanDerWaalsContact O-CB 3.28Å; T30-S33 WeakPolarHBondContact O-CB 3.36Å; T30-S33 PolarHBondContact O-N 3.01Å; T30-S33 PolarHBondContact O-OG 2.85Å; S33-K39 WeakPolarHBondContact O-CE 3.31Å; S33-K39 PolarHBondContact O-NZ 3.29Å
34	H	80.3	Confident	84.6	Confident	163 Å²	163	68.4 Å²	68.4	76%	0.755	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-4.3	-177.7	-54.1	-59.4	0	0	0	114.4	Y32 S36	Y32-H34 PolarHBondContact O-N 3.27Å; Y32-H34 VanDerWaalsContact O-N 3.15Å; H34-S36 VanDerWaalsContact C-N 3.34Å; H34-S36 PolarHBondContact O-N 2.76Å
35	L	72.9	Confident	84.7	Confident	96 Å²	96	61.7 Å²	61.7	50%	0.503	32%	0.322	S	S	.	.	S	Bend	trans	-80.7	-1.3	-165.7	-64	-174.9	0	0	0	116	Y32 K132	Y32-L35 HydrophobicContact CD1-CD1 3.64Å; Y32-L35 HydrophobicContact CG-CD1 4.36Å; Y32-L35 PolarHBondContact O-N 2.92Å; L35-K132 HydrophobicContact CB-CD 3.76Å; L35-K132 WeakPolarHBondContact O-CE 3.39Å
36	S	68.5	Low	84.6	Confident	31 Å²	31	53.5 Å²	53.5	22%	0.217	29%	0.287	C	S	.	.			trans	-160.5	149.4	174.8	-173.1	0	0	0	0	111.5	H34 N38 S130	H34-S36 VanDerWaalsContact C-N 3.34Å; H34-S36 PolarHBondContact O-N 2.76Å; S36-N38 PolarHBondContact OG-N 3.27Å; S36-S130 PolarHBondContact OG-O 2.6Å
37	S	68.8	Low	84.7	Confident	115 Å²	115	51.9 Å²	51.9	80%	0.804	27%	0.274	S	S	*	.	S	Bend	trans	-82.4	-27.9	170	58.2	0	0	0	0	112.7	K39	S37-K39 PolarHBondContact O-N 3.11Å
38	N	71.8	Confident	84.4	Confident	71 Å²	71	50 Å²	50	38%	0.38	27%	0.267	S	S	.	.	S	Bend	trans	-89.6	87.6	176	-80.5	6	0	0	0	109.2	S36 A129	S36-N38 PolarHBondContact OG-N 3.27Å; N38-A129 HydrophobicContact CB-CB 3.99Å; N38-A129 VanDerWaalsContact ND2-CB 3.26Å; N38-A129 WeakPolarHBondContact ND2-CB 3.41Å
39	K	81.6	Confident	84	Confident	43 Å²	43	55.2 Å²	55.2	19%	0.187	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-89.9	121.1	-177	-67.2	-177.1	160.3	-143.6	0	110.9	S33 S37 R78 D85	S33-K39 WeakPolarHBondContact O-CE 3.31Å; S33-K39 PolarHBondContact O-NZ 3.29Å; S37-K39 PolarHBondContact O-N 3.11Å; K39-R78 HydrophobicContact CB-CB 3.79Å; K39-R78 WeakPolarHBondContact O-CB 3.42Å; K39-R78 PolarHBondContact O-N 2.8Å; K39-D85 WeakPolarHBondContact CD-OD1 3.24Å; K39-D85 IonicContact NZ-OD1 3.26Å; K39-D85 PolarHBondContact NZ-OD1 2.68Å; K39-D85 IonicContact NZ-OD2 3.03Å
40	F	88.5	Confident	83.7	Confident	40 Å²	40	55.6 Å²	55.6	18%	0.175	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	170.4	157.2	-74.1	-101.1	0	0	0	107.5	G76 K77 L126 T131 F133 P134	F40-G76 CarbonylContact C-O 3.38Å; F40-G76 WeakPolarHBondContact CA-O 3.1Å; F40-G76 WeakPolarHBondContact CB-O 3.44Å; F40-G76 WeakPolarHBondContact CD1-O 3.41Å; F40-K77 HydrophobicContact CD1-CB 4.01Å; F40-K77 HydrophobicContact CE1-CB 3.68Å; F40-K77 HydrophobicContact CE1-CG 4.21Å; F40-K77 HydrophobicContact CE2-CG 4.29Å; F40-K77 HydrophobicContact CZ-CB 4.01Å; F40-K77 HydrophobicContact CZ-CD 4.26Å; F40-K77 HydrophobicContact CZ-CG 4.04Å; F40-L126 HydrophobicContact CD1-CD2 4.45Å; F40-L126 HydrophobicContact CD2-CD2 4.07Å; F40-L126 HydrophobicContact CE1-CD2 4.19Å; F40-L126 HydrophobicContact CE2-CD2 3.79Å; F40-L126 HydrophobicContact CG-CD2 4.4Å; F40-L126 HydrophobicContact CZ-CD2 3.85Å; F40-T131 HydrophobicContact CD2-CG2 3.93Å; F40-T131 HydrophobicContact CE2-CG2 3.9Å; F40-F133 HydrophobicContact CB-CD1 4.06Å; F40-F133 HydrophobicContact CB-CE1 4.15Å; F40-P134 WeakPolarHBondContact O-CD 3.34Å; F40-P134 WeakPolarHBondContact O-CG 3.41Å
41	S	90.9	Very high	83.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	141.9	170.6	-55.2	0	0	0	0	109.6	G75 G76 D85 T88 P134	S41-G75 CarbonylContact O-C 3.47Å; S41-G75 WeakPolarHBondContact O-CA 3.3Å; S41-G76 PolarHBondContact N-O 3.01Å; S41-G76 PolarHBondContact O-N 3.46Å; S41-D85 WeakPolarHBondContact CB-O 3.28Å; S41-D85 PolarHBondContact OG-O 3.15Å; S41-D85 VanDerWaalsContact OG-O 3.14Å; S41-T88 WeakPolarHBondContact OG-CB 3.33Å; S41-P134 WeakPolarHBondContact OG-CG 3.26Å
42	V	92.7	Very high	83.5	Confident	15 Å²	15	48.7 Å²	48.7	9%	0.091	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	133.7	-179.4	161.7	0	0	0	0	108.6	V44 F73 P74 F133 P134 N135 T136	V42-V44 HydrophobicContact CG1-CG2 4.32Å; V42-F73 HydrophobicContact CG1-CB 3.37Å; V42-F73 HydrophobicContact CG1-CD2 4.31Å; V42-F73 HydrophobicContact CG1-CG 4.12Å; V42-P74 WeakPolarHBondContact CA-O 3.39Å; V42-F133 HydrophobicContact CB-CB 4.34Å; V42-F133 HydrophobicContact CB-CD1 4.34Å; V42-F133 HydrophobicContact CG2-CB 4.19Å; V42-F133 HydrophobicContact CG2-CD1 3.34Å; V42-F133 HydrophobicContact CG2-CE1 3.93Å; V42-F133 HydrophobicContact CG2-CG 4.02Å; V42-P134 PolarHBondContact N-O 3.01Å; V42-N135 WeakPolarHBondContact O-CA 3.47Å; V42-T136 PolarHBondContact O-N 3.4Å
43	L	93.6	Very high	83.6	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	129	166.4	-174.2	68.3	0	0	0	108.3	P45 F73 P74 A89 L90 A93 L99 V104 T136	L43-P45 HydrophobicContact CD2-CB 4.5Å; L43-P45 HydrophobicContact CD2-CG 4.13Å; L43-P45 HydrophobicContact CG-CG 4.13Å; L43-P45 VanDerWaalsContact O-CD 3.3Å; L43-P45 WeakPolarHBondContact O-CD 3.48Å; L43-F73 WeakPolarHBondContact O-CB 3.11Å; L43-P74 PolarHBondContact N-O 2.83Å; L43-P74 WeakPolarHBondContact O-CD 3.34Å; L43-A89 HydrophobicContact CB-CB 4.17Å; L43-L90 HydrophobicContact CD1-CD2 4.29Å; L43-L90 HydrophobicContact CD2-CD2 4.36Å; L43-A93 HydrophobicContact CB-CB 4.3Å; L43-A93 HydrophobicContact CD2-CB 3.47Å; L43-A93 VanDerWaalsContact CD2-CB 3.47Å; L43-L99 HydrophobicContact CD2-CD2 3.69Å; L43-V104 HydrophobicContact CD1-CG1 4.44Å; L43-T136 CarbonylContact C-O 3.58Å; L43-T136 WeakPolarHBondContact CA-O 3.26Å; L43-T136 HydrophobicContact CD1-CG2 4.25Å
44	V	93.5	Very high	84	Confident	13 Å²	13	46.1 Å²	46.1	8%	0.079	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	101.3	165.8	-177.7	0	0	0	0	105.8	V42 L55 F73 T136 L137 G138	V42-V44 HydrophobicContact CG1-CG2 4.32Å; V44-L55 HydrophobicContact CG1-CD2 3.69Å; V44-F73 HydrophobicContact CB-CD1 4.48Å; V44-F73 HydrophobicContact CB-CE1 4.41Å; V44-F73 HydrophobicContact CG1-CD1 4.29Å; V44-F73 HydrophobicContact CG1-CE1 3.75Å; V44-F73 HydrophobicContact CG1-CZ 3.88Å; V44-F73 HydrophobicContact CG2-CD1 4.4Å; V44-F73 HydrophobicContact CG2-CD2 4.18Å; V44-F73 HydrophobicContact CG2-CE1 4.46Å; V44-F73 HydrophobicContact CG2-CE2 4.23Å; V44-F73 HydrophobicContact CG2-CG 4.26Å; V44-F73 HydrophobicContact CG2-CZ 4.37Å; V44-T136 PolarHBondContact N-O 3.36Å; V44-L137 HydrophobicContact CB-CD1 3.49Å; V44-L137 VanDerWaalsContact CB-CD1 3.49Å; V44-L137 HydrophobicContact CG1-CD1 3.31Å; V44-L137 WeakPolarHBondContact O-CA 3.46Å; V44-L137 WeakPolarHBondContact O-CD1 3.46Å; V44-G138 PolarHBondContact O-N 3.35Å
45	P	92.1	Very high	84.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	126.6	-177.9	-5.1	25.1	0	0	0	109.3	L43 L47 L55 M56 P74 L99	L43-P45 HydrophobicContact CD2-CB 4.5Å; L43-P45 HydrophobicContact CD2-CG 4.13Å; L43-P45 HydrophobicContact CG-CG 4.13Å; L43-P45 VanDerWaalsContact O-CD 3.3Å; L43-P45 WeakPolarHBondContact O-CD 3.48Å; P45-L47 HydrophobicContact CB-CD1 4.3Å; P45-L55 WeakPolarHBondContact O-CA 3.46Å; P45-M56 HydrophobicContact CB-CB 4.05Å; P45-M56 HydrophobicContact CB-CE 3.81Å; P45-M56 VanDerWaalsContact CD-O 3.25Å; P45-M56 WeakPolarHBondContact CD-O 3.43Å; P45-M56 HydrophobicContact CG-CB 4.07Å; P45-M56 HydrophobicContact CG-CE 3.72Å; P45-M56 PolarHBondContact O-N 3.19Å; P45-M56 VanDerWaalsContact O-N 3.13Å; P45-P74 HydrophobicContact CG-CG 3.93Å; P45-L99 HydrophobicContact CB-CD2 4.43Å
46	L	90.5	Very high	85.1	Confident	10 Å²	10	35.3 Å²	35.3	5%	0.052	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	119.2	176.8	-175.4	69.4	0	0	0	109.7	A19 L23 L53 Y54 L55 G138 T139 E140 L155	A19-L46 HydrophobicContact CB-CD2 3.76Å; L23-L46 HydrophobicContact CD1-CD2 4.02Å; L46-L53 HydrophobicContact CD1-CB 4.08Å; L46-L53 HydrophobicContact CD1-CD1 4.38Å; L46-L53 HydrophobicContact CD1-CD2 4.15Å; L46-L53 HydrophobicContact CD1-CG 4.41Å; L46-L53 HydrophobicContact CD2-CD1 4.45Å; L46-L53 HydrophobicContact CD2-CD2 4.23Å; L46-L53 HydrophobicContact CG-CD2 4.08Å; L46-Y54 WeakPolarHBondContact CA-O 3.28Å; L46-L55 HydrophobicContact CD1-CD2 4.07Å; L46-G138 WeakPolarHBondContact CB-O 3.29Å; L46-G138 PolarHBondContact N-O 3.24Å; L46-T139 HydrophobicContact CB-CG2 4.26Å; L46-T139 HydrophobicContact CD2-CG2 4.18Å; L46-T139 WeakPolarHBondContact O-CA 3.36Å; L46-E140 PolarHBondContact O-N 2.81Å; L46-L155 HydrophobicContact CD1-CD1 3.69Å
47	L	87.8	Confident	86.1	Confident	19 Å²	19	35.5 Å²	35.5	10%	0.099	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	147.1	-177.7	-58.8	89.4	0	0	0	109.8	P45 L53 Y54 M56 E140 L144 L152	P45-L47 HydrophobicContact CB-CD1 4.3Å; L47-L53 CarbonylContact O-C 3.5Å; L47-L53 VanDerWaalsContact O-CA 3.29Å; L47-L53 WeakPolarHBondContact O-CA 3.41Å; L47-Y54 PolarHBondContact N-O 2.8Å; L47-Y54 PolarHBondContact O-N 2.86Å; L47-M56 HydrophobicContact CD1-CB 3.56Å; L47-E140 HydrophobicContact CD2-CG 4.25Å; L47-E140 HydrophobicContact CG-CB 4.33Å; L47-E140 HydrophobicContact CG-CG 3.96Å; L47-L144 HydrophobicContact CD2-CD1 3.77Å; L47-L144 HydrophobicContact CD2-CG 4.15Å; L47-L152 HydrophobicContact CD1-CD2 4.14Å; L47-L152 HydrophobicContact CD2-CD2 4.37Å
48	A	84.9	Confident	86.9	Confident	22 Å²	22	30.4 Å²	30.4	18%	0.182	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	121.6	165.9	0	0	0	0	0	110.4	R12 I16 K52 L53	R12-A48 HydrophobicContact CG-CB 4.14Å; I16-A48 HydrophobicContact CD1-CB 3.6Å; I16-A48 HydrophobicContact CG1-CB 3.46Å; I16-A48 VanDerWaalsContact CG1-CB 3.46Å; A48-K52 CarbonylContact C-O 3.59Å; A48-K52 VanDerWaalsContact CA-O 3.28Å; A48-K52 WeakPolarHBondContact CA-O 3.16Å; A48-L53 HydrophobicContact CB-CD2 4.16Å
49	R	81.2	Confident	87.5	Confident	119 Å²	119	27.7 Å²	27.7	45%	0.449	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	133.7	179.1	-167.9	-177.5	-168	-161.2	5.6	109.3	G51 K52 Y54 E143	R49-G51 PolarHBondContact O-N 2.86Å; R49-K52 PolarHBondContact N-O 2.96Å; R49-K52 PolarHBondContact O-N 2.86Å; R49-Y54 HydrophobicContact CB-CD2 3.98Å; R49-Y54 HydrophobicContact CB-CE2 3.82Å; R49-E143 IonicContact CZ-OE1 3.86Å; R49-E143 IonicContact NE-OE1 3.11Å; R49-E143 PolarHBondContact NE-OE1 3.23Å; R49-E143 IonicContact NH2-OE1 2.73Å; R49-E143 PolarHBondContact NH2-OE1 3.03Å
50	G	83.4	Confident	87.4	Confident	38 Å²	38	28.4 Å²	28.4	39%	0.392	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	30.6	176.4	0	0	0	0	0	115.2	K52	G50-K52 VanDerWaalsContact C-N 3.34Å
51	G	82.3	Confident	86.9	Confident	33 Å²	33	29.4 Å²	29.4	34%	0.34	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	14.9	-177.5	0	0	0	0	0	115	L15 R49	L15-G51 WeakPolarHBondContact CD2-O 3.34Å; R49-G51 PolarHBondContact O-N 2.86Å
52	K	84.5	Confident	86.4	Confident	87 Å²	87	35.7 Å²	35.7	38%	0.378	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	155.3	-179.9	-66.3	163.2	159.5	-149.1	0	110.4	A48 R49 G50 Y54 E154	A48-K52 CarbonylContact C-O 3.59Å; A48-K52 VanDerWaalsContact CA-O 3.28Å; A48-K52 WeakPolarHBondContact CA-O 3.16Å; R49-K52 PolarHBondContact N-O 2.96Å; R49-K52 PolarHBondContact O-N 2.86Å; G50-K52 VanDerWaalsContact C-N 3.34Å; K52-Y54 HydrophobicContact CB-CD2 4.46Å; K52-Y54 HydrophobicContact CB-CE2 3.63Å; K52-Y54 WeakPolarHBondContact CD-OH 3.45Å; K52-E154 HydrophobicContact CB-CG 4.38Å; K52-E154 VanDerWaalsContact CD-CD 3.47Å; K52-E154 HydrophobicContact CD-CG 4.41Å; K52-E154 VanDerWaalsContact CD-OE1 3.26Å; K52-E154 WeakPolarHBondContact CD-OE1 3.46Å; K52-E154 WeakPolarHBondContact CD-OE2 3.11Å; K52-E154 WeakPolarHBondContact CE-OE1 3.46Å; K52-E154 IonicContact NZ-OE1 3.5Å; K52-E154 PolarHBondContact NZ-OE1 3.39Å; K52-E154 IonicContact NZ-OE2 2.81Å; K52-E154 PolarHBondContact NZ-OE2 3.3Å
53	L	85.9	Confident	85.7	Confident	26 Å²	26	44.1 Å²	44.1	14%	0.136	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	141.7	173.6	-72	175.6	0	0	0	110.4	L15 A19 L46 L47 A48 L155	L15-L53 HydrophobicContact CD1-CD1 4.13Å; L15-L53 HydrophobicContact CD1-CG 4.09Å; L15-L53 HydrophobicContact CD2-CD2 3.97Å; L15-L53 HydrophobicContact CD2-CG 3.69Å; L15-L53 HydrophobicContact CG-CD1 4.13Å; L15-L53 HydrophobicContact CG-CD2 3.89Å; L15-L53 HydrophobicContact CG-CG 3.68Å; A19-L53 HydrophobicContact CB-CD1 4.01Å; L46-L53 HydrophobicContact CD1-CB 4.08Å; L46-L53 HydrophobicContact CD1-CD1 4.38Å; L46-L53 HydrophobicContact CD1-CD2 4.15Å; L46-L53 HydrophobicContact CD1-CG 4.41Å; L46-L53 HydrophobicContact CD2-CD1 4.45Å; L46-L53 HydrophobicContact CD2-CD2 4.23Å; L46-L53 HydrophobicContact CG-CD2 4.08Å; L47-L53 CarbonylContact O-C 3.5Å; L47-L53 VanDerWaalsContact O-CA 3.29Å; L47-L53 WeakPolarHBondContact O-CA 3.41Å; A48-L53 HydrophobicContact CB-CD2 4.16Å; L53-L155 HydrophobicContact CB-CB 4.1Å; L53-L155 HydrophobicContact CB-CD1 4.16Å; L53-L155 PolarHBondContact O-N 3.27Å
54	Y	87.9	Confident	84.6	Confident	28 Å²	28	47.7 Å²	47.7	11%	0.11	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	142.7	176.5	-64	-96.3	0	0	0	110.6	L46 L47 R49 K52 L152 C153 E154	L46-Y54 WeakPolarHBondContact CA-O 3.28Å; L47-Y54 PolarHBondContact N-O 2.8Å; L47-Y54 PolarHBondContact O-N 2.86Å; R49-Y54 HydrophobicContact CB-CD2 3.98Å; R49-Y54 HydrophobicContact CB-CE2 3.82Å; K52-Y54 HydrophobicContact CB-CD2 4.46Å; K52-Y54 HydrophobicContact CB-CE2 3.63Å; K52-Y54 WeakPolarHBondContact CD-OH 3.45Å; Y54-L152 HydrophobicContact CD1-CB 4.08Å; Y54-C153 CarbonylContact C-O 3.59Å; Y54-C153 WeakPolarHBondContact CA-O 3.22Å; Y54-E154 HydrophobicContact CD1-CB 3.91Å; Y54-E154 HydrophobicContact CD1-CG 4.48Å; Y54-E154 HydrophobicContact CE1-CB 3.52Å; Y54-E154 HydrophobicContact CE1-CG 3.93Å; Y54-E154 PolarHBondContact OH-OE2 3.03Å; Y54-E154 VanDerWaalsContact OH-OE2 3.13Å
55	L	89.5	Confident	83.6	Confident	28 Å²	28	57.3 Å²	57.3	15%	0.147	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	135.7	162.6	-69.5	177	0	0	0	109.1	V44 P45 L46 F57 F73 L152 C153 L155	V44-L55 HydrophobicContact CG1-CD2 3.69Å; P45-L55 WeakPolarHBondContact O-CA 3.46Å; L46-L55 HydrophobicContact CD1-CD2 4.07Å; L55-F57 HydrophobicContact CB-CD2 4.33Å; L55-F57 HydrophobicContact CB-CE2 3.51Å; L55-F57 HydrophobicContact CB-CZ 3.99Å; L55-F57 HydrophobicContact CD1-CE2 4.44Å; L55-F57 HydrophobicContact CD1-CZ 4.15Å; L55-F73 HydrophobicContact CB-CE1 4.33Å; L55-F73 HydrophobicContact CD1-CE1 4.42Å; L55-F73 HydrophobicContact CD1-CZ 4.15Å; L55-L152 WeakPolarHBondContact O-CA 3.34Å; L55-C153 HydrophobicContact CB-CB 4.43Å; L55-C153 PolarHBondContact N-O 3.44Å; L55-C153 PolarHBondContact O-N 2.74Å; L55-L155 HydrophobicContact CD1-CD2 3.77Å; L55-L155 HydrophobicContact CD1-CG 4.4Å; L55-L155 HydrophobicContact CD2-CD1 4.43Å; L55-L155 HydrophobicContact CG-CD1 4.11Å; L55-L155 HydrophobicContact CG-CD2 4Å; L55-L155 HydrophobicContact CG-CG 4.07Å
56	M	87.7	Confident	82.2	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.015	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.9	171.6	-178.8	174.9	65.5	0	0	110.9	P45 L47 F73 V97 L99 L144 V151 L152	P45-M56 HydrophobicContact CB-CB 4.05Å; P45-M56 HydrophobicContact CB-CE 3.81Å; P45-M56 VanDerWaalsContact CD-O 3.25Å; P45-M56 WeakPolarHBondContact CD-O 3.43Å; P45-M56 HydrophobicContact CG-CB 4.07Å; P45-M56 HydrophobicContact CG-CE 3.72Å; P45-M56 PolarHBondContact O-N 3.19Å; P45-M56 VanDerWaalsContact O-N 3.13Å; L47-M56 HydrophobicContact CD1-CB 3.56Å; M56-F73 WeakPolarHBondContact O-CD1 3.46Å; M56-V97 HydrophobicContact CE-CB 4.37Å; M56-V97 HydrophobicContact CE-CG2 3.69Å; M56-V97 HydrophobicContact SD-CG2 4.5Å; M56-L99 HydrophobicContact CE-CD2 3.97Å; M56-L144 HydrophobicContact CE-CD1 3.82Å; M56-L144 HydrophobicContact SD-CD1 3.53Å; M56-L144 VanDerWaalsContact SD-CD1 3.53Å; M56-V151 CarbonylContact C-O 3.52Å; M56-V151 WeakPolarHBondContact CA-O 3.33Å; M56-L152 HydrophobicContact CB-CD2 3.89Å; M56-L152 HydrophobicContact CG-CD2 4.24Å
57	F	88.8	Confident	81.1	Confident	36 Å²	36	64.8 Å²	64.8	16%	0.158	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	163.7	175.8	-60.3	-97.4	0	0	0	109.7	L55 V71 C72 F73 S150 V151 C153	L55-F57 HydrophobicContact CB-CD2 4.33Å; L55-F57 HydrophobicContact CB-CE2 3.51Å; L55-F57 HydrophobicContact CB-CZ 3.99Å; L55-F57 HydrophobicContact CD1-CE2 4.44Å; L55-F57 HydrophobicContact CD1-CZ 4.15Å; F57-V71 HydrophobicContact CB-CG1 3.47Å; F57-V71 VanDerWaalsContact CB-CG1 3.47Å; F57-V71 HydrophobicContact CD1-CG1 3.94Å; F57-V71 HydrophobicContact CG-CG1 3.79Å; F57-C72 CarbonylContact C-O 3.5Å; F57-C72 VanDerWaalsContact CA-O 3.28Å; F57-C72 WeakPolarHBondContact CA-O 3.01Å; F57-C72 VanDerWaalsContact CB-O 3.31Å; F57-C72 WeakPolarHBondContact CB-O 3.19Å; F57-F73 AromaticContact CD1-CD1 3.83Å; F57-F73 HydrophobicContact CD1-CD1 3.83Å; F57-F73 AromaticContact CD1-CE1 3.74Å; F57-F73 HydrophobicContact CD1-CE1 3.74Å; F57-F73 HydrophobicContact CD1-CE2 4.5Å; F57-F73 HydrophobicContact CD1-CG 4.24Å; F57-F73 HydrophobicContact CD1-CZ 4.1Å; F57-F73 AromaticContact CE1-CD1 3.84Å; F57-F73 HydrophobicContact CE1-CD1 3.84Å; F57-F73 HydrophobicContact CE1-CD2 4.21Å; F57-F73 AromaticContact CE1-CE1 3.3Å; F57-F73 HydrophobicContact CE1-CE1 3.3Å; F57-F73 AromaticContact CE1-CE2 3.74Å; F57-F73 HydrophobicContact CE1-CE2 3.74Å; F57-F73 HydrophobicContact CE1-CG 4.25Å; F57-F73 AromaticContact CE1-CZ 3.25Å; F57-F73 HydrophobicContact CE1-CZ 3.25Å; F57-F73 HydrophobicContact CE2-CE1 4.17Å; F57-F73 HydrophobicContact CG-CD1 4.45Å; F57-F73 HydrophobicContact CG-CE1 4.35Å; F57-F73 HydrophobicContact CZ-CD1 4.44Å; F57-F73 AromaticContact CZ-CE1 3.55Å; F57-F73 HydrophobicContact CZ-CE1 3.55Å; F57-F73 HydrophobicContact CZ-CE2 4.38Å; F57-F73 AromaticContact CZ-CZ 3.51Å; F57-F73 HydrophobicContact CZ-CZ 3.51Å; F57-S150 CarbonylContact O-C 3.51Å; F57-S150 VanDerWaalsContact O-CA 3.22Å; F57-S150 WeakPolarHBondContact O-CA 2.71Å; F57-V151 HydrophobicContact CB-CB 4.12Å; F57-V151 HydrophobicContact CB-CG1 4.49Å; F57-V151 HydrophobicContact CD2-CG1 4.35Å; F57-V151 PolarHBondContact N-O 3Å; F57-V151 PolarHBondContact O-N 3.06Å; F57-C153 HydrophobicContact CD2-CB 4.21Å; F57-C153 HydrophobicContact CE2-CB 3.59Å
58	T	85.9	Confident	80.6	Confident	8 Å²	8	67.2 Å²	67.2	5%	0.049	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	148.9	169.4	63.6	0	0	0	0	110	V71 C72 P74 E96 V97 D149	T58-V71 CarbonylContact O-C 3.51Å; T58-V71 WeakPolarHBondContact O-CA 3.26Å; T58-C72 PolarHBondContact N-O 3.02Å; T58-C72 PolarHBondContact O-N 2.87Å; T58-C72 PolarHBondContact OG1-O 2.77Å; T58-C72 PolarHBondContact OG1-SG 3.13Å; T58-P74 HydrophobicContact CG2-CB 3.99Å; T58-P74 HydrophobicContact CG2-CG 3.71Å; T58-E96 HydrophobicContact CG2-CB 4.3Å; T58-V97 HydrophobicContact CG2-CG1 3.39Å; T58-D149 CarbonylContact C-O 3.45Å; T58-D149 WeakPolarHBondContact CA-O 3.24Å
59	V	84.7	Confident	80.3	Confident	14 Å²	14	67.3 Å²	67.3	9%	0.085	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	122.3	168.4	-179.7	0	0	0	0	107.7	E70 V71 D149 V151 R166	V59-E70 WeakPolarHBondContact CA-O 3.36Å; V59-V71 HydrophobicContact CG2-CG2 4.43Å; V59-D149 PolarHBondContact N-O 3.18Å; V59-V151 HydrophobicContact CG2-CG2 3.83Å; V59-R166 VanDerWaalsContact CG1-NH2 3.3Å
60	R	80.1	Confident	80.3	Confident	57 Å²	57	65.8 Å²	65.8	22%	0.215	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-65.9	137.4	176	-73.6	179	57.8	97.6	-11.9	110.9	D62 L64 R66 E67 G69 E70 E125	R60-D62 PolarHBondContact O-N 3.43Å; R60-L64 HydrophobicContact CB-CD1 4.2Å; R60-R66 PolarHBondContact NH2-O 2.96Å; R60-R66 VanDerWaalsContact NH2-O 3.13Å; R60-E67 PolarHBondContact NE-O 3.44Å; R60-G69 VanDerWaalsContact O-CA 3.28Å; R60-G69 WeakPolarHBondContact O-CA 3.46Å; R60-G69 PolarHBondContact O-N 3.13Å; R60-E70 PolarHBondContact N-O 3.42Å; R60-E125 IonicContact CZ-OE2 3.85Å; R60-E125 IonicContact NH1-OE2 3.46Å; R60-E125 IonicContact NH2-OE2 3.27Å; R60-E125 PolarHBondContact NH2-OE2 2.99Å
61	S	78	Confident	80.3	Confident	62 Å²	62	67.1 Å²	67.1	43%	0.434	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-56.8	134.7	179.4	-176.8	0	0	0	0	112	K63 L64	S61-K63 PolarHBondContact O-N 2.86Å; S61-K63 PolarHBondContact OG-N 2.91Å; S61-L64 WeakPolarHBondContact O-CB 3.22Å; S61-L64 PolarHBondContact O-N 2.99Å
62	D	78.7	Confident	80.5	Confident	131 Å²	131	67.5 Å²	67.5	70%	0.701	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.5	174.6	-67.3	-34.7	0	0	0	113.7	R60 L64	R60-D62 PolarHBondContact O-N 3.43Å; D62-L64 VanDerWaalsContact C-N 3.31Å
63	K	78.3	Confident	80.8	Confident	193 Å²	193	66.1 Å²	66.1	84%	0.839	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-10.4	179.4	-62.2	177.8	-177.4	171.5	0	113.1	S61	S61-K63 PolarHBondContact O-N 2.86Å; S61-K63 PolarHBondContact OG-N 2.91Å
64	L	71.1	Confident	81.1	Confident	74 Å²	74	64.9 Å²	64.9	39%	0.387	32%	0.323	S	S	.	.	S	Bend	trans	-71.7	139.6	178.8	-66.8	175.1	0	0	0	110.4	R60 S61 D62 R66	R60-L64 HydrophobicContact CB-CD1 4.2Å; S61-L64 WeakPolarHBondContact O-CB 3.22Å; S61-L64 PolarHBondContact O-N 2.99Å; D62-L64 VanDerWaalsContact C-N 3.31Å; L64-R66 PolarHBondContact O-N 2.82Å
65	K	71.7	Confident	81.2	Confident	215 Å²	215	64.3 Å²	64.3	94%	0.935	33%	0.326	S	S	*	.	S	Bend	trans	-67	-17.1	-179.6	-67.4	-177.4	-179.9	178	0	113.2
66	R	63.7	Low	81.2	Confident	122 Å²	122	63.7 Å²	63.7	46%	0.46	33%	0.326	S	S	.	.	S	Bend	trans	-137.9	136.2	-174.4	-70.5	174.8	174.5	-177.9	-2.7	109.2	R60 L64 P68 P124 E125	R60-R66 PolarHBondContact NH2-O 2.96Å; R60-R66 VanDerWaalsContact NH2-O 3.13Å; L64-R66 PolarHBondContact O-N 2.82Å; R66-P68 VanDerWaalsContact C-CD 3.43Å; R66-P124 PolarHBondContact NH1-O 3.35Å; R66-E125 WeakPolarHBondContact CD-OE1 3.41Å; R66-E125 IonicContact NH1-OE1 2.68Å
67	E	67.3	Low	81.4	Confident	46 Å²	46	69.3 Å²	69.3	22%	0.215	35%	0.35	C	S	.	.	S	Bend	trans	51.7	48.2	176.5	-65.9	177.7	166.8	0	0	113	R60 E70 P124	R60-E67 PolarHBondContact NE-O 3.44Å; E67-E70 HydrophobicContact CB-CB 4.4Å; E67-E70 HydrophobicContact CB-CG 3.81Å; E67-E70 WeakPolarHBondContact CB-OE2 3.32Å; E67-E70 VanDerWaalsContact CG-CD 3.49Å; E67-E70 HydrophobicContact CG-CG 4.41Å; E67-E70 WeakPolarHBondContact CG-OE1 3.46Å; E67-P124 WeakPolarHBondContact OE1-CD 3.47Å
68	P	76.3	Confident	81.5	Confident	69 Å²	69	71.2 Å²	71.2	45%	0.448	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	139.6	175.4	28.9	-34	0	0	0	110.6	R66 E70	R66-P68 VanDerWaalsContact C-CD 3.43Å; P68-E70 PolarHBondContact O-N 3.07Å
69	G	79.8	Confident	81.8	Confident	25 Å²	25	74.2 Å²	74.2	26%	0.258	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	1.8	176.9	0	0	0	0	0	115	R60	R60-G69 VanDerWaalsContact O-CA 3.28Å; R60-G69 WeakPolarHBondContact O-CA 3.46Å; R60-G69 PolarHBondContact O-N 3.13Å
70	E	80.1	Confident	82.2	Confident	86 Å²	86	79.8 Å²	79.8	40%	0.402	41%	0.409	S	S	.	.			trans	-66.1	142.9	177.4	-74.9	-161.8	172.3	0	0	112	V59 R60 E67 P68	V59-E70 WeakPolarHBondContact CA-O 3.36Å; R60-E70 PolarHBondContact N-O 3.42Å; E67-E70 HydrophobicContact CB-CB 4.4Å; E67-E70 HydrophobicContact CB-CG 3.81Å; E67-E70 WeakPolarHBondContact CB-OE2 3.32Å; E67-E70 VanDerWaalsContact CG-CD 3.49Å; E67-E70 HydrophobicContact CG-CG 4.41Å; E67-E70 WeakPolarHBondContact CG-OE1 3.46Å; P68-E70 PolarHBondContact O-N 3.07Å
71	V	84.9	Confident	82.9	Confident	67 Å²	67	82.3 Å²	82.3	41%	0.406	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	114.9	175.2	-179	0	0	0	0	108.2	F57 T58 V59	F57-V71 HydrophobicContact CB-CG1 3.47Å; F57-V71 VanDerWaalsContact CB-CG1 3.47Å; F57-V71 HydrophobicContact CD1-CG1 3.94Å; F57-V71 HydrophobicContact CG-CG1 3.79Å; T58-V71 CarbonylContact O-C 3.51Å; T58-V71 WeakPolarHBondContact O-CA 3.26Å; V59-V71 HydrophobicContact CG2-CG2 4.43Å
72	C	86.5	Confident	83.7	Confident	40 Å²	40	79.9 Å²	79.9	27%	0.27	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	167.9	178.3	56.5	0	0	0	0	111.2	F57 T58	F57-C72 CarbonylContact C-O 3.5Å; F57-C72 VanDerWaalsContact CA-O 3.28Å; F57-C72 WeakPolarHBondContact CA-O 3.01Å; F57-C72 VanDerWaalsContact CB-O 3.31Å; F57-C72 WeakPolarHBondContact CB-O 3.19Å; T58-C72 PolarHBondContact N-O 3.02Å; T58-C72 PolarHBondContact O-N 2.87Å; T58-C72 PolarHBondContact OG1-O 2.77Å; T58-C72 PolarHBondContact OG1-SG 3.13Å
73	F	90.8	Very high	84.4	Confident	59 Å²	59	79.2 Å²	79.2	26%	0.259	41%	0.413	S	S	.	.			trans	-75.5	152.5	167.5	-74.6	-63.4	0	0	0	110.5	V42 L43 V44 L55 M56 F57 G75	V42-F73 HydrophobicContact CG1-CB 3.37Å; V42-F73 HydrophobicContact CG1-CD2 4.31Å; V42-F73 HydrophobicContact CG1-CG 4.12Å; L43-F73 WeakPolarHBondContact O-CB 3.11Å; V44-F73 HydrophobicContact CB-CD1 4.48Å; V44-F73 HydrophobicContact CB-CE1 4.41Å; V44-F73 HydrophobicContact CG1-CD1 4.29Å; V44-F73 HydrophobicContact CG1-CE1 3.75Å; V44-F73 HydrophobicContact CG1-CZ 3.88Å; V44-F73 HydrophobicContact CG2-CD1 4.4Å; V44-F73 HydrophobicContact CG2-CD2 4.18Å; V44-F73 HydrophobicContact CG2-CE1 4.46Å; V44-F73 HydrophobicContact CG2-CE2 4.23Å; V44-F73 HydrophobicContact CG2-CG 4.26Å; V44-F73 HydrophobicContact CG2-CZ 4.37Å; L55-F73 HydrophobicContact CB-CE1 4.33Å; L55-F73 HydrophobicContact CD1-CE1 4.42Å; L55-F73 HydrophobicContact CD1-CZ 4.15Å; M56-F73 WeakPolarHBondContact O-CD1 3.46Å; F57-F73 AromaticContact CD1-CD1 3.83Å; F57-F73 HydrophobicContact CD1-CD1 3.83Å; F57-F73 AromaticContact CD1-CE1 3.74Å; F57-F73 HydrophobicContact CD1-CE1 3.74Å; F57-F73 HydrophobicContact CD1-CE2 4.5Å; F57-F73 HydrophobicContact CD1-CG 4.24Å; F57-F73 HydrophobicContact CD1-CZ 4.1Å; F57-F73 AromaticContact CE1-CD1 3.84Å; F57-F73 HydrophobicContact CE1-CD1 3.84Å; F57-F73 HydrophobicContact CE1-CD2 4.21Å; F57-F73 AromaticContact CE1-CE1 3.3Å; F57-F73 HydrophobicContact CE1-CE1 3.3Å; F57-F73 AromaticContact CE1-CE2 3.74Å; F57-F73 HydrophobicContact CE1-CE2 3.74Å; F57-F73 HydrophobicContact CE1-CG 4.25Å; F57-F73 AromaticContact CE1-CZ 3.25Å; F57-F73 HydrophobicContact CE1-CZ 3.25Å; F57-F73 HydrophobicContact CE2-CE1 4.17Å; F57-F73 HydrophobicContact CG-CD1 4.45Å; F57-F73 HydrophobicContact CG-CE1 4.35Å; F57-F73 HydrophobicContact CZ-CD1 4.44Å; F57-F73 AromaticContact CZ-CE1 3.55Å; F57-F73 HydrophobicContact CZ-CE1 3.55Å; F57-F73 HydrophobicContact CZ-CE2 4.38Å; F57-F73 AromaticContact CZ-CZ 3.51Å; F57-F73 HydrophobicContact CZ-CZ 3.51Å; F73-G75 PolarHBondContact O-N 2.98Å
74	P	90.7	Very high	84.9	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.392	C	S	.	.	S	Bend	trans	-56.6	135.4	172.7	-15.3	22.4	0	0	0	111.4	V42 L43 P45 T58 A93 E96 V97	V42-P74 WeakPolarHBondContact CA-O 3.39Å; L43-P74 PolarHBondContact N-O 2.83Å; L43-P74 WeakPolarHBondContact O-CD 3.34Å; P45-P74 HydrophobicContact CG-CG 3.93Å; T58-P74 HydrophobicContact CG2-CB 3.99Å; T58-P74 HydrophobicContact CG2-CG 3.71Å; P74-A93 HydrophobicContact CB-CB 3.98Å; P74-E96 WeakPolarHBondContact CA-OE2 3.44Å; P74-V97 HydrophobicContact CG-CG2 4.23Å
75	G	91	Very high	85.8	Confident	16 Å²	16	71 Å²	71	17%	0.165	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.2	168.2	-179.2	0	0	0	0	0	114.5	S41 F73 E96	S41-G75 CarbonylContact O-C 3.47Å; S41-G75 WeakPolarHBondContact O-CA 3.3Å; F73-G75 PolarHBondContact O-N 2.98Å; G75-E96 PolarHBondContact N-OE2 2.72Å
76	G	89.6	Confident	86.9	Confident	14 Å²	14	61.9 Å²	61.9	14%	0.144	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	-165.4	-171.9	0	0	0	0	0	112.9	F40 S41	F40-G76 CarbonylContact C-O 3.38Å; F40-G76 WeakPolarHBondContact CA-O 3.1Å; F40-G76 WeakPolarHBondContact CB-O 3.44Å; F40-G76 WeakPolarHBondContact CD1-O 3.41Å; S41-G76 PolarHBondContact N-O 3.01Å; S41-G76 PolarHBondContact O-N 3.46Å
77	K	91.2	Very high	88.4	Confident	121 Å²	121	57.4 Å²	57.4	53%	0.526	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	143.8	-175.4	-170.2	-179.4	174.7	-174.2	0	109.5	F40 D79 R91 E92	F40-K77 HydrophobicContact CD1-CB 4.01Å; F40-K77 HydrophobicContact CE1-CB 3.68Å; F40-K77 HydrophobicContact CE1-CG 4.21Å; F40-K77 HydrophobicContact CE2-CG 4.29Å; F40-K77 HydrophobicContact CZ-CB 4.01Å; F40-K77 HydrophobicContact CZ-CD 4.26Å; F40-K77 HydrophobicContact CZ-CG 4.04Å; K77-D79 PolarHBondContact O-N 2.73Å; K77-R91 PolarHBondContact O-NH2 3.13Å; K77-E92 PolarHBondContact N-OE1 3.1Å
78	R	91.2	Very high	89.6	Confident	77 Å²	77	55.2 Å²	55.2	29%	0.291	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-60.1	129.5	171.7	-178.3	166.8	-179.5	161.4	-1	111.7	K39 D82 T83 D85 T88	K39-R78 HydrophobicContact CB-CB 3.79Å; K39-R78 WeakPolarHBondContact O-CB 3.42Å; K39-R78 PolarHBondContact O-N 2.8Å; R78-D82 HydrophobicContact CG-CB 4.04Å; R78-D82 PolarHBondContact NE-O 3.06Å; R78-D82 PolarHBondContact NH2-O 3.36Å; R78-T83 VanDerWaalsContact NH2-C 3.28Å; R78-T83 PolarHBondContact NH2-O 2.94Å; R78-D85 IonicContact NH1-OD1 3.84Å; R78-T88 HydrophobicContact CB-CG2 4.21Å; R78-T88 WeakPolarHBondContact CG-OG1 3.03Å
79	D	92.6	Very high	90.5	Very high	70 Å²	70	51.9 Å²	51.9	37%	0.374	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-89.6	150.2	170.3	-170.3	-83.1	0	0	0	110.7	K77 V81 D82	K77-D79 PolarHBondContact O-N 2.73Å; D79-V81 HydrophobicContact CB-CG1 4.29Å; D79-V81 PolarHBondContact O-N 2.92Å; D79-V81 VanDerWaalsContact O-N 3.13Å; D79-V81 VanDerWaalsContact OD1-CG1 3.26Å; D79-V81 WeakPolarHBondContact OD1-CG1 3.49Å; D79-V81 PolarHBondContact OD1-N 2.95Å; D79-D82 PolarHBondContact N-OD2 3.35Å; D79-D82 WeakPolarHBondContact O-CB 3.25Å; D79-D82 PolarHBondContact O-N 2.84Å
80	P	93	Very high	91.2	Very high	131 Å²	131	51.8 Å²	51.8	85%	0.851	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	-27.5	172.4	-30.3	37	0	0	0	115.8
81	V	94.7	Very high	92	Very high	111 Å²	111	50 Å²	50	67%	0.673	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-19.9	178.7	78.9	0	0	0	0	113.3	D79 T83	D79-V81 HydrophobicContact CB-CG1 4.29Å; D79-V81 PolarHBondContact O-N 2.92Å; D79-V81 VanDerWaalsContact O-N 3.13Å; D79-V81 VanDerWaalsContact OD1-CG1 3.26Å; D79-V81 WeakPolarHBondContact OD1-CG1 3.49Å; D79-V81 PolarHBondContact OD1-N 2.95Å; V81-T83 PolarHBondContact O-N 2.73Å
82	D	94.2	Very high	92.4	Very high	11 Å²	11	48 Å²	48	6%	0.059	27%	0.268	C	S	.	.			trans	-69.4	126.4	-177.7	-62.8	-27.4	0	0	0	110.4	R78 D79 A87 T88 R91	R78-D82 HydrophobicContact CG-CB 4.04Å; R78-D82 PolarHBondContact NE-O 3.06Å; R78-D82 PolarHBondContact NH2-O 3.36Å; D79-D82 PolarHBondContact N-OD2 3.35Å; D79-D82 WeakPolarHBondContact O-CB 3.25Å; D79-D82 PolarHBondContact O-N 2.84Å; D82-A87 HydrophobicContact CB-CB 4.39Å; D82-T88 VanDerWaalsContact CB-OG1 3.27Å; D82-T88 WeakPolarHBondContact CB-OG1 3.4Å; D82-T88 VanDerWaalsContact CG-OG1 3.24Å; D82-T88 WeakPolarHBondContact OD2-CA 3.22Å; D82-T88 WeakPolarHBondContact OD2-CB 3.25Å; D82-T88 PolarHBondContact OD2-OG1 2.86Å; D82-R91 IonicContact OD1-NE 3.69Å; D82-R91 PolarHBondContact OD1-NE 2.94Å; D82-R91 IonicContact OD2-CZ 3.01Å; D82-R91 IonicContact OD2-NE 2.88Å; D82-R91 PolarHBondContact OD2-NE 3.16Å; D82-R91 IonicContact OD2-NH2 3.23Å; D82-R91 PolarHBondContact OD2-NH2 3.26Å
83	T	93	Very high	92.6	Very high	116 Å²	116	46.1 Å²	46.1	71%	0.712	26%	0.255	S	S	*	.			trans	-72.2	-39	-177.9	51.2	0	0	0	0	112.4	R78 V81	R78-T83 VanDerWaalsContact NH2-C 3.28Å; R78-T83 PolarHBondContact NH2-O 2.94Å; V81-T83 PolarHBondContact O-N 2.73Å
84	D	90.2	Very high	92.7	Very high	75 Å²	75	47 Å²	47	40%	0.401	26%	0.26	S	S	.	.	S	Bend	trans	-151.9	-177.1	-179.6	58.1	36.3	0	0	0	111.4	T86 A87 T88	D84-T86 PolarHBondContact O-N 3.41Å; D84-T86 WeakPolarHBondContact OD1-CA 3.5Å; D84-T86 VanDerWaalsContact OD1-CB 3.31Å; D84-T86 WeakPolarHBondContact OD1-CB 3.31Å; D84-T86 PolarHBondContact OD1-N 3.29Å; D84-A87 PolarHBondContact O-N 3.12Å; D84-A87 PolarHBondContact OD1-N 3.3Å; D84-T88 PolarHBondContact O-N 3.03Å; D84-T88 VanDerWaalsContact O-N 3.17Å; D84-T88 PolarHBondContact O-OG1 2.96Å
85	D	90.4	Very high	92.8	Very high	20 Å²	20	53 Å²	53	11%	0.107	29%	0.288	C	S	.	.	H	α-helix	trans	-68.8	-26.4	-176.6	-58.6	-9.5	0	0	0	111.6	K39 S41 R78 A89 P134	K39-D85 WeakPolarHBondContact CD-OD1 3.24Å; K39-D85 IonicContact NZ-OD1 3.26Å; K39-D85 PolarHBondContact NZ-OD1 2.68Å; K39-D85 IonicContact NZ-OD2 3.03Å; S41-D85 WeakPolarHBondContact CB-O 3.28Å; S41-D85 PolarHBondContact OG-O 3.15Å; S41-D85 VanDerWaalsContact OG-O 3.14Å; R78-D85 IonicContact NH1-OD1 3.84Å; D85-A89 PolarHBondContact O-N 2.77Å; D85-A89 VanDerWaalsContact O-N 3.14Å; D85-P134 HydrophobicContact CB-CB 3.72Å; D85-P134 HydrophobicContact CB-CG 3.58Å
86	T	93.6	Very high	92.7	Very high	24 Å²	24	55.8 Å²	55.8	15%	0.147	30%	0.296	C	S	.	.	H	α-helix	trans	-70.4	-45.4	173.9	-55.8	0	0	0	0	110.9	D84 T88 A89 L90 V106 H109 T136	D84-T86 PolarHBondContact O-N 3.41Å; D84-T86 WeakPolarHBondContact OD1-CA 3.5Å; D84-T86 VanDerWaalsContact OD1-CB 3.31Å; D84-T86 WeakPolarHBondContact OD1-CB 3.31Å; D84-T86 PolarHBondContact OD1-N 3.29Å; T86-T88 VanDerWaalsContact C-N 3.31Å; T86-T88 PolarHBondContact O-N 3.05Å; T86-A89 PolarHBondContact O-N 3.14Å; T86-L90 HydrophobicContact CG2-CD1 3.84Å; T86-L90 HydrophobicContact CG2-CG 4.31Å; T86-L90 WeakPolarHBondContact O-CG 3.21Å; T86-L90 PolarHBondContact O-N 3.14Å; T86-V106 HydrophobicContact CG2-CG1 4.37Å; T86-V106 HydrophobicContact CG2-CG2 3.79Å; T86-H109 PolarHBondContact OG1-NE2 3.25Å; T86-T136 HydrophobicContact CG2-CG2 4.26Å
87	A	94.5	Very high	92.5	Very high	27 Å²	27	55.4 Å²	55.4	22%	0.223	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-43.4	176.4	0	0	0	0	0	111.4	D82 D84 L90 R91	D82-A87 HydrophobicContact CB-CB 4.39Å; D84-A87 PolarHBondContact O-N 3.12Å; D84-A87 PolarHBondContact OD1-N 3.3Å; A87-L90 PolarHBondContact O-N 3.37Å; A87-R91 WeakPolarHBondContact O-CB 3.47Å; A87-R91 PolarHBondContact O-N 2.85Å
88	T	94	Very high	92.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.4	-52	173.6	-60.1	0	0	0	0	111.5	S41 R78 D82 D84 T86 L90 R91 E92	S41-T88 WeakPolarHBondContact OG-CB 3.33Å; R78-T88 HydrophobicContact CB-CG2 4.21Å; R78-T88 WeakPolarHBondContact CG-OG1 3.03Å; D82-T88 VanDerWaalsContact CB-OG1 3.27Å; D82-T88 WeakPolarHBondContact CB-OG1 3.4Å; D82-T88 VanDerWaalsContact CG-OG1 3.24Å; D82-T88 WeakPolarHBondContact OD2-CA 3.22Å; D82-T88 WeakPolarHBondContact OD2-CB 3.25Å; D82-T88 PolarHBondContact OD2-OG1 2.86Å; D84-T88 PolarHBondContact O-N 3.03Å; D84-T88 VanDerWaalsContact O-N 3.17Å; D84-T88 PolarHBondContact O-OG1 2.96Å; T86-T88 VanDerWaalsContact C-N 3.31Å; T86-T88 PolarHBondContact O-N 3.05Å; T88-L90 VanDerWaalsContact C-N 3.32Å; T88-L90 PolarHBondContact O-N 3.42Å; T88-R91 PolarHBondContact O-N 2.92Å; T88-E92 HydrophobicContact CG2-CG 4.41Å; T88-E92 VanDerWaalsContact O-CG 3.26Å; T88-E92 WeakPolarHBondContact O-CG 3.28Å; T88-E92 PolarHBondContact O-N 2.74Å
89	A	94.3	Very high	92.4	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.4	-40.2	-178.5	0	0	0	0	0	112.8	L43 D85 T86 A93	L43-A89 HydrophobicContact CB-CB 4.17Å; D85-A89 PolarHBondContact O-N 2.77Å; D85-A89 VanDerWaalsContact O-N 3.14Å; T86-A89 PolarHBondContact O-N 3.14Å; A89-A93 WeakPolarHBondContact O-CB 3.23Å; A89-A93 PolarHBondContact O-N 3.16Å
90	L	94.8	Very high	92.3	Very high	22 Å²	22	48.3 Å²	48.3	12%	0.115	27%	0.272	C	S	.	.	H	α-helix	trans	-72.5	-37.7	179.7	-67.8	174.4	0	0	0	112.6	L43 T86 A87 T88 Q94 P101 V104 V106	L43-L90 HydrophobicContact CD1-CD2 4.29Å; L43-L90 HydrophobicContact CD2-CD2 4.36Å; T86-L90 HydrophobicContact CG2-CD1 3.84Å; T86-L90 HydrophobicContact CG2-CG 4.31Å; T86-L90 WeakPolarHBondContact O-CG 3.21Å; T86-L90 PolarHBondContact O-N 3.14Å; A87-L90 PolarHBondContact O-N 3.37Å; T88-L90 VanDerWaalsContact C-N 3.32Å; T88-L90 PolarHBondContact O-N 3.42Å; L90-Q94 WeakPolarHBondContact O-CB 2.79Å; L90-Q94 PolarHBondContact O-N 3.17Å; L90-P101 HydrophobicContact CB-CB 4.43Å; L90-P101 HydrophobicContact CB-CG 4.19Å; L90-P101 HydrophobicContact CD1-CB 4.26Å; L90-V104 HydrophobicContact CD2-CB 3.76Å; L90-V104 HydrophobicContact CD2-CG1 3.88Å; L90-V104 HydrophobicContact CD2-CG2 3.73Å; L90-V106 HydrophobicContact CD1-CG2 4.32Å; L90-V106 HydrophobicContact CD2-CG2 4.48Å
91	R	96.1	Very high	92.2	Very high	50 Å²	50	44.7 Å²	44.7	19%	0.189	25%	0.248	C	C	.	.	H	α-helix	trans	-61.5	-49.8	174.1	179.3	-173.6	55.4	66	5.6	110.6	K77 D82 A87 T88 A93 Q94 E95	K77-R91 PolarHBondContact O-NH2 3.13Å; D82-R91 IonicContact OD1-NE 3.69Å; D82-R91 PolarHBondContact OD1-NE 2.94Å; D82-R91 IonicContact OD2-CZ 3.01Å; D82-R91 IonicContact OD2-NE 2.88Å; D82-R91 PolarHBondContact OD2-NE 3.16Å; D82-R91 IonicContact OD2-NH2 3.23Å; D82-R91 PolarHBondContact OD2-NH2 3.26Å; A87-R91 WeakPolarHBondContact O-CB 3.47Å; A87-R91 PolarHBondContact O-N 2.85Å; T88-R91 PolarHBondContact O-N 2.92Å; R91-A93 PolarHBondContact O-N 2.96Å; R91-Q94 WeakPolarHBondContact O-CB 3.34Å; R91-Q94 PolarHBondContact O-N 3.05Å; R91-Q94 VanDerWaalsContact O-N 3.14Å; R91-E95 WeakPolarHBondContact CD-OE1 3.44Å; R91-E95 VanDerWaalsContact CG-OE1 3.23Å; R91-E95 WeakPolarHBondContact CG-OE1 3.31Å; R91-E95 IonicContact CZ-OE1 3.83Å; R91-E95 IonicContact NH1-OE1 3.51Å; R91-E95 PolarHBondContact NH1-OE1 2.95Å; R91-E95 IonicContact NH1-OE2 2.98Å; R91-E95 WeakPolarHBondContact O-CG 3.38Å; R91-E95 PolarHBondContact O-N 3.4Å
92	E	93.6	Very high	92.1	Very high	24 Å²	24	46.8 Å²	46.8	11%	0.112	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-42.9	179.5	-63.7	-73.2	-179.8	0	0	111.3	K77 T88 Q94 E95 E96	K77-E92 PolarHBondContact N-OE1 3.1Å; T88-E92 HydrophobicContact CG2-CG 4.41Å; T88-E92 VanDerWaalsContact O-CG 3.26Å; T88-E92 WeakPolarHBondContact O-CG 3.28Å; T88-E92 PolarHBondContact O-N 2.74Å; E92-Q94 VanDerWaalsContact C-N 3.28Å; E92-Q94 PolarHBondContact O-N 2.85Å; E92-E95 PolarHBondContact O-N 3.12Å; E92-E95 VanDerWaalsContact O-N 3.16Å; E92-E96 WeakPolarHBondContact O-CB 3.48Å; E92-E96 WeakPolarHBondContact O-CG 3.46Å; E92-E96 PolarHBondContact O-N 3.24Å
93	A	92.2	Very high	91.9	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-61.8	-35.9	174.5	0	0	0	0	0	112.9	L43 P74 A89 R91 V97 G98 L99	L43-A93 HydrophobicContact CB-CB 4.3Å; L43-A93 HydrophobicContact CD2-CB 3.47Å; L43-A93 VanDerWaalsContact CD2-CB 3.47Å; P74-A93 HydrophobicContact CB-CB 3.98Å; A89-A93 WeakPolarHBondContact O-CB 3.23Å; A89-A93 PolarHBondContact O-N 3.16Å; R91-A93 PolarHBondContact O-N 2.96Å; A93-V97 HydrophobicContact CB-CG2 4.48Å; A93-V97 WeakPolarHBondContact O-CG2 3.19Å; A93-V97 PolarHBondContact O-N 2.92Å; A93-G98 PolarHBondContact O-N 3.36Å; A93-L99 HydrophobicContact CB-CB 4.37Å; A93-L99 HydrophobicContact CB-CD2 4.36Å; A93-L99 PolarHBondContact O-N 3.29Å
94	Q	92.7	Very high	91.9	Very high	78 Å²	78	44.2 Å²	44.2	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-66	-43.2	173.7	-171.8	-176	-28.7	0	0	111.7	L90 R91 E92 G98 L99 H100 P101	L90-Q94 WeakPolarHBondContact O-CB 2.79Å; L90-Q94 PolarHBondContact O-N 3.17Å; R91-Q94 WeakPolarHBondContact O-CB 3.34Å; R91-Q94 PolarHBondContact O-N 3.05Å; R91-Q94 VanDerWaalsContact O-N 3.14Å; E92-Q94 VanDerWaalsContact C-N 3.28Å; E92-Q94 PolarHBondContact O-N 2.85Å; Q94-G98 WeakPolarHBondContact O-CA 3.06Å; Q94-G98 PolarHBondContact O-N 2.78Å; Q94-L99 WeakPolarHBondContact CA-O 3.36Å; Q94-L99 WeakPolarHBondContact CB-O 2.99Å; Q94-L99 PolarHBondContact N-O 2.81Å; Q94-H100 PolarHBondContact NE2-CE1 3.22Å; Q94-H100 PolarHBondContact NE2-ND1 3.42Å; Q94-P101 VanDerWaalsContact OE1-CD 3.23Å
95	E	91.6	Very high	92	Very high	126 Å²	126	44.2 Å²	44.2	59%	0.589	23%	0.229	S	C	*	.	H	α-helix	trans	-67.9	-43.6	-179.9	-71.1	177.9	-148.2	0	0	112.3	R91 E92	R91-E95 WeakPolarHBondContact CD-OE1 3.44Å; R91-E95 VanDerWaalsContact CG-OE1 3.23Å; R91-E95 WeakPolarHBondContact CG-OE1 3.31Å; R91-E95 IonicContact CZ-OE1 3.83Å; R91-E95 IonicContact NH1-OE1 3.51Å; R91-E95 PolarHBondContact NH1-OE1 2.95Å; R91-E95 IonicContact NH1-OE2 2.98Å; R91-E95 WeakPolarHBondContact O-CG 3.38Å; R91-E95 PolarHBondContact O-N 3.4Å; E92-E95 PolarHBondContact O-N 3.12Å; E92-E95 VanDerWaalsContact O-N 3.16Å
96	E	88.9	Confident	92.2	Very high	74 Å²	74	45.6 Å²	45.6	35%	0.346	24%	0.238	S	C	.	.	H	α-helix	trans	-83.3	-37	-172.9	-66.6	-173	149.4	0	0	113.4	T58 P74 G75 E92	T58-E96 HydrophobicContact CG2-CB 4.3Å; P74-E96 WeakPolarHBondContact CA-OE2 3.44Å; G75-E96 PolarHBondContact N-OE2 2.72Å; E92-E96 WeakPolarHBondContact O-CB 3.48Å; E92-E96 WeakPolarHBondContact O-CG 3.46Å; E92-E96 PolarHBondContact O-N 3.24Å
97	V	86.5	Confident	92.2	Very high	7 Å²	7	44.8 Å²	44.8	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-128.5	6.9	-174.6	-65.4	0	0	0	0	114.8	M56 T58 P74 A93 L99 C147	M56-V97 HydrophobicContact CE-CB 4.37Å; M56-V97 HydrophobicContact CE-CG2 3.69Å; M56-V97 HydrophobicContact SD-CG2 4.5Å; T58-V97 HydrophobicContact CG2-CG1 3.39Å; P74-V97 HydrophobicContact CG-CG2 4.23Å; A93-V97 HydrophobicContact CB-CG2 4.48Å; A93-V97 WeakPolarHBondContact O-CG2 3.19Å; A93-V97 PolarHBondContact O-N 2.92Å; V97-L99 HydrophobicContact CG2-CB 3.82Å; V97-L99 PolarHBondContact O-N 2.86Å; V97-C147 HydrophobicContact CB-CB 4.46Å
98	G	89.3	Confident	92.2	Very high	41 Å²	41	43.5 Å²	43.5	42%	0.423	22%	0.222	S	C	.	.			trans	70.1	13.8	-179.5	0	0	0	0	0	113.6	A93 Q94 H100	A93-G98 PolarHBondContact O-N 3.36Å; Q94-G98 WeakPolarHBondContact O-CA 3.06Å; Q94-G98 PolarHBondContact O-N 2.78Å; G98-H100 PolarHBondContact O-CD2 3.17Å; G98-H100 PolarHBondContact O-N 3.05Å
99	L	89.3	Confident	92.2	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.			trans	-79.9	103.8	-177.4	176	58.2	0	0	0	110.5	L43 P45 M56 A93 Q94 V97 Q103 V104 E140 L144	L43-L99 HydrophobicContact CD2-CD2 3.69Å; P45-L99 HydrophobicContact CB-CD2 4.43Å; M56-L99 HydrophobicContact CE-CD2 3.97Å; A93-L99 HydrophobicContact CB-CB 4.37Å; A93-L99 HydrophobicContact CB-CD2 4.36Å; A93-L99 PolarHBondContact O-N 3.29Å; Q94-L99 WeakPolarHBondContact CA-O 3.36Å; Q94-L99 WeakPolarHBondContact CB-O 2.99Å; Q94-L99 PolarHBondContact N-O 2.81Å; V97-L99 HydrophobicContact CG2-CB 3.82Å; V97-L99 PolarHBondContact O-N 2.86Å; L99-Q103 HydrophobicContact CD1-CB 3.94Å; L99-V104 HydrophobicContact CD1-CG2 3.9Å; L99-V104 HydrophobicContact CD2-CG2 3.8Å; L99-V104 HydrophobicContact CG-CG2 3.68Å; L99-E140 HydrophobicContact CD1-CG 4.43Å; L99-E140 VanDerWaalsContact CD1-OE1 3.26Å; L99-E140 WeakPolarHBondContact CD1-OE1 3.37Å; L99-E140 WeakPolarHBondContact CD1-OE2 3.37Å; L99-E140 WeakPolarHBondContact CD2-OE1 3.17Å; L99-L144 HydrophobicContact CD1-CD2 3.73Å
100	H	91.1	Very high	92	Very high	78 Å²	78	47.6 Å²	47.6	36%	0.361	24%	0.242	S	C	.	.			trans	-75.6	144.3	-177	-72.9	-85	0	0	0	112.4	Q94 G98 H102 Q103	Q94-H100 PolarHBondContact NE2-CE1 3.22Å; Q94-H100 PolarHBondContact NE2-ND1 3.42Å; G98-H100 PolarHBondContact O-CD2 3.17Å; G98-H100 PolarHBondContact O-N 3.05Å; H100-H102 WeakPolarHBondContact CB-CE1 3.33Å; H100-H102 WeakPolarHBondContact CB-ND1 3.4Å; H100-H102 AromaticContact CG-CE1 3.72Å; H100-H102 PolarHBondContact O-N 2.82Å; H100-Q103 HydrophobicContact CB-CG 4.25Å; H100-Q103 WeakPolarHBondContact O-CA 3.14Å; H100-Q103 VanDerWaalsContact O-CB 3.31Å; H100-Q103 WeakPolarHBondContact O-CB 3.45Å; H100-Q103 PolarHBondContact O-N 2.93Å
101	P	92	Very high	91.5	Very high	54 Å²	54	50.7 Å²	50.7	35%	0.351	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-52.5	-32.9	-180	-29.1	32.9	0	0	0	115.4	L90 Q94 Q103 V104	L90-P101 HydrophobicContact CB-CB 4.43Å; L90-P101 HydrophobicContact CB-CG 4.19Å; L90-P101 HydrophobicContact CD1-CB 4.26Å; Q94-P101 VanDerWaalsContact OE1-CD 3.23Å; P101-Q103 PolarHBondContact O-N 3.34Å; P101-V104 PolarHBondContact O-N 3.35Å; P101-V104 VanDerWaalsContact O-N 3.12Å
102	H	91.2	Very high	90.9	Very high	156 Å²	156	49 Å²	49	72%	0.722	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-74.3	-13.5	179.2	67	-91.4	0	0	0	113.6	H100 V104	H100-H102 WeakPolarHBondContact CB-CE1 3.33Å; H100-H102 WeakPolarHBondContact CB-ND1 3.4Å; H100-H102 AromaticContact CG-CE1 3.72Å; H100-H102 PolarHBondContact O-N 2.82Å; H102-V104 VanDerWaalsContact C-N 3.34Å
103	Q	90.4	Very high	90	Very high	54 Å²	54	54.8 Å²	54.8	25%	0.252	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-86.7	-8.8	171.4	-55.3	176.1	-89.3	0	0	110.9	L99 H100 P101 E140 P141	L99-Q103 HydrophobicContact CD1-CB 3.94Å; H100-Q103 HydrophobicContact CB-CG 4.25Å; H100-Q103 WeakPolarHBondContact O-CA 3.14Å; H100-Q103 VanDerWaalsContact O-CB 3.31Å; H100-Q103 WeakPolarHBondContact O-CB 3.45Å; H100-Q103 PolarHBondContact O-N 2.93Å; P101-Q103 PolarHBondContact O-N 3.34Å; Q103-E140 WeakPolarHBondContact CB-OE2 3.16Å; Q103-P141 WeakPolarHBondContact O-CD 3.18Å
104	V	92.2	Very high	88.9	Confident	18 Å²	18	58 Å²	58	11%	0.109	30%	0.299	C	S	.	.			trans	-108.3	123.2	-175.6	-165.4	0	0	0	0	110.7	L43 L90 L99 P101 H102 V106 E140	L43-V104 HydrophobicContact CD1-CG1 4.44Å; L90-V104 HydrophobicContact CD2-CB 3.76Å; L90-V104 HydrophobicContact CD2-CG1 3.88Å; L90-V104 HydrophobicContact CD2-CG2 3.73Å; L99-V104 HydrophobicContact CD1-CG2 3.9Å; L99-V104 HydrophobicContact CD2-CG2 3.8Å; L99-V104 HydrophobicContact CG-CG2 3.68Å; P101-V104 PolarHBondContact O-N 3.35Å; P101-V104 VanDerWaalsContact O-N 3.12Å; H102-V104 VanDerWaalsContact C-N 3.34Å; V104-V106 HydrophobicContact CG1-CG2 4.43Å; V104-E140 WeakPolarHBondContact CG2-OE1 3Å
105	E	93.8	Very high	87.6	Confident	75 Å²	75	56.7 Å²	56.7	35%	0.35	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	114.5	158.8	-176.5	-173.1	151.8	0	0	108.8	K20 R24 V107 G138 T139	K20-E105 VanDerWaalsContact CE-OE2 3.24Å; K20-E105 WeakPolarHBondContact CE-OE2 3.32Å; K20-E105 IonicContact NZ-OE1 3.59Å; K20-E105 IonicContact NZ-OE2 3.54Å; K20-E105 PolarHBondContact NZ-OE2 2.95Å; R24-E105 IonicContact NH2-OE1 3.95Å; R24-E105 PolarHBondContact NH2-OE1 3.45Å; R24-E105 VanDerWaalsContact NH2-OE1 3.11Å; E105-V107 HydrophobicContact CB-CG1 4.45Å; E105-V107 HydrophobicContact CG-CG1 3.91Å; E105-V107 PolarHBondContact O-N 3.22Å; E105-G138 CarbonylContact O-C 3.6Å; E105-G138 WeakPolarHBondContact O-CA 3.14Å; E105-T139 PolarHBondContact N-O 2.91Å; E105-T139 PolarHBondContact O-N 3.29Å
106	V	94.5	Very high	86.1	Confident	50 Å²	50	54.1 Å²	54.1	30%	0.303	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	118.1	172.8	173.8	0	0	0	0	109.6	T86 L90 V104 T136	T86-V106 HydrophobicContact CG2-CG1 4.37Å; T86-V106 HydrophobicContact CG2-CG2 3.79Å; L90-V106 HydrophobicContact CD1-CG2 4.32Å; L90-V106 HydrophobicContact CD2-CG2 4.48Å; V104-V106 HydrophobicContact CG1-CG2 4.43Å; V106-T136 HydrophobicContact CB-CG2 4.22Å; V106-T136 HydrophobicContact CG1-CG2 3.37Å; V106-T136 HydrophobicContact CG2-CG2 3.86Å
107	V	93.7	Very high	84.5	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.042	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-19.8	-169.4	-62.8	0	0	0	0	113.6	K20 L23 R24 E105 L137 T139	K20-V107 HydrophobicContact CD-CG1 4.11Å; K20-V107 HydrophobicContact CG-CB 4.32Å; K20-V107 HydrophobicContact CG-CG1 3.68Å; L23-V107 HydrophobicContact CB-CG2 4.32Å; L23-V107 HydrophobicContact CD1-CG2 4.03Å; R24-V107 WeakPolarHBondContact CG-O 3.49Å; E105-V107 HydrophobicContact CB-CG1 4.45Å; E105-V107 HydrophobicContact CG-CG1 3.91Å; E105-V107 PolarHBondContact O-N 3.22Å; V107-L137 HydrophobicContact CG2-CB 4.38Å; V107-L137 HydrophobicContact CG2-CD2 4.23Å; V107-L137 HydrophobicContact CG2-CG 4.23Å; V107-L137 WeakPolarHBondContact CG2-O 3.41Å; V107-L137 PolarHBondContact N-O 2.86Å; V107-T139 HydrophobicContact CG1-CG2 4.1Å; V107-T139 HydrophobicContact CG2-CG2 4.18Å
108	S	93.4	Very high	83	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	144.4	179.5	-173.7	0	0	0	0	111.2	L23 D27 L137	L23-S108 PolarHBondContact O-OG 3.05Å; D27-S108 VanDerWaalsContact CA-OG 3.31Å; D27-S108 WeakPolarHBondContact CA-OG 3.44Å; S108-L137 PolarHBondContact O-N 3.35Å
109	H	93.4	Very high	81.4	Confident	42 Å²	42	64.3 Å²	64.3	19%	0.194	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	125.4	157.3	-53.9	80.6	0	0	0	107.1	D27 V28 T86	D27-H109 WeakPolarHBondContact CA-O 3.48Å; D27-H109 WeakPolarHBondContact OD1-CB 3.43Å; D27-H109 IonicContact OD1-CG 2.82Å; D27-H109 PolarHBondContact OD1-N 3.31Å; D27-H109 IonicContact OD1-ND1 3.52Å; D27-H109 PolarHBondContact OD1-ND1 3.06Å; V28-H109 HydrophobicContact CG2-CB 4.03Å; V28-H109 WeakPolarHBondContact CG2-O 3.32Å; V28-H109 PolarHBondContact N-O 2.82Å; T86-H109 PolarHBondContact OG1-NE2 3.25Å
110	L	90.4	Very high	79.6	Confident	43 Å²	43	67.5 Å²	67.5	23%	0.225	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	161.5	178.6	-49.3	173.7	0	0	0	110	V28 N135	V28-L110 WeakPolarHBondContact CG2-O 3.02Å; L110-N135 HydrophobicContact CB-CB 3.91Å; L110-N135 HydrophobicContact CD1-CB 4.11Å; L110-N135 HydrophobicContact CG-CB 4.31Å; L110-N135 PolarHBondContact N-O 3.25Å
111	V	86	Confident	77.6	Confident	88 Å²	88	71.1 Å²	71.1	53%	0.533	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	126.2	173.4	-178.8	0	0	0	0	108.5	V28 Y32 Y113	V28-V111 HydrophobicContact CG1-CG2 3.68Å; Y32-V111 HydrophobicContact CE2-CG1 4.23Å; Y32-V111 HydrophobicContact CE2-CG2 4.24Å; V111-Y113 PolarHBondContact O-N 2.83Å
112	P	81.5	Confident	75.8	Confident	14 Å²	14	69.7 Å²	69.7	9%	0.091	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	136.4	178	26.4	-32.5	0	0	0	110.4	Y32 K132 F133	Y32-P112 VanDerWaalsContact CD2-CD 3.44Å; Y32-P112 HydrophobicContact CD2-CG 4.22Å; Y32-P112 HydrophobicContact CG-CG 3.91Å; P112-K132 HydrophobicContact CB-CB 4.08Å; P112-F133 VanDerWaalsContact CA-O 3.22Å; P112-F133 WeakPolarHBondContact CA-O 3.45Å; P112-F133 VanDerWaalsContact CB-O 3.24Å; P112-F133 WeakPolarHBondContact CB-O 3.43Å
113	Y	75.3	Confident	74	Confident	146 Å²	146	64 Å²	64	57%	0.573	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	132.3	166.5	-161.9	-86.3	0	0	0	109.2	V111 F115	V111-Y113 PolarHBondContact O-N 2.83Å; Y113-F115 AromaticContact CD1-CD1 3.89Å; Y113-F115 HydrophobicContact CD1-CD1 3.89Å; Y113-F115 AromaticContact CD1-CD2 3.67Å; Y113-F115 HydrophobicContact CD1-CD2 3.67Å; Y113-F115 AromaticContact CD1-CE1 3.58Å; Y113-F115 HydrophobicContact CD1-CE1 3.58Å; Y113-F115 AromaticContact CD1-CE2 3.33Å; Y113-F115 HydrophobicContact CD1-CE2 3.33Å; Y113-F115 AromaticContact CD1-CG 3.93Å; Y113-F115 HydrophobicContact CD1-CG 3.93Å; Y113-F115 AromaticContact CD1-CZ 3.28Å; Y113-F115 HydrophobicContact CD1-CZ 3.28Å; Y113-F115 AromaticContact CE1-CD1 3.47Å; Y113-F115 HydrophobicContact CE1-CD1 3.47Å; Y113-F115 VanDerWaalsContact CE1-CD1 3.47Å; Y113-F115 HydrophobicContact CE1-CD2 4.14Å; Y113-F115 AromaticContact CE1-CE1 3.2Å; Y113-F115 HydrophobicContact CE1-CE1 3.2Å; Y113-F115 AromaticContact CE1-CE2 3.91Å; Y113-F115 HydrophobicContact CE1-CE2 3.91Å; Y113-F115 AromaticContact CE1-CG 3.94Å; Y113-F115 HydrophobicContact CE1-CG 3.94Å; Y113-F115 AromaticContact CE1-CZ 3.44Å; Y113-F115 HydrophobicContact CE1-CZ 3.44Å; Y113-F115 VanDerWaalsContact CE1-CZ 3.44Å; Y113-F115 HydrophobicContact CG-CE2 4.27Å; Y113-F115 HydrophobicContact CG-CZ 4.25Å
114	V	70.2	Confident	72.1	Confident	66 Å²	66	64 Å²	64	40%	0.4	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	113.7	-178.8	-171.8	0	0	0	0	107.9	S130 K132	V114-S130 WeakPolarHBondContact CG1-OG 3.45Å; V114-K132 HydrophobicContact CG1-CG 4.46Å; V114-K132 HydrophobicContact CG2-CD 4.07Å; V114-K132 HydrophobicContact CG2-CG 4.07Å; V114-K132 VanDerWaalsContact CG2-NZ 3.32Å
115	F	65.3	Low	70.3	Confident	52 Å²	52	67.3 Å²	67.3	23%	0.228	36%	0.359	C	S	.	.			trans	-89.7	134.8	170.5	-61.8	-87.1	0	0	0	109.4	Y113 V117 M121 S130 F133	Y113-F115 AromaticContact CD1-CD1 3.89Å; Y113-F115 HydrophobicContact CD1-CD1 3.89Å; Y113-F115 AromaticContact CD1-CD2 3.67Å; Y113-F115 HydrophobicContact CD1-CD2 3.67Å; Y113-F115 AromaticContact CD1-CE1 3.58Å; Y113-F115 HydrophobicContact CD1-CE1 3.58Å; Y113-F115 AromaticContact CD1-CE2 3.33Å; Y113-F115 HydrophobicContact CD1-CE2 3.33Å; Y113-F115 AromaticContact CD1-CG 3.93Å; Y113-F115 HydrophobicContact CD1-CG 3.93Å; Y113-F115 AromaticContact CD1-CZ 3.28Å; Y113-F115 HydrophobicContact CD1-CZ 3.28Å; Y113-F115 AromaticContact CE1-CD1 3.47Å; Y113-F115 HydrophobicContact CE1-CD1 3.47Å; Y113-F115 VanDerWaalsContact CE1-CD1 3.47Å; Y113-F115 HydrophobicContact CE1-CD2 4.14Å; Y113-F115 AromaticContact CE1-CE1 3.2Å; Y113-F115 HydrophobicContact CE1-CE1 3.2Å; Y113-F115 AromaticContact CE1-CE2 3.91Å; Y113-F115 HydrophobicContact CE1-CE2 3.91Å; Y113-F115 AromaticContact CE1-CG 3.94Å; Y113-F115 HydrophobicContact CE1-CG 3.94Å; Y113-F115 AromaticContact CE1-CZ 3.44Å; Y113-F115 HydrophobicContact CE1-CZ 3.44Å; Y113-F115 VanDerWaalsContact CE1-CZ 3.44Å; Y113-F115 HydrophobicContact CG-CE2 4.27Å; Y113-F115 HydrophobicContact CG-CZ 4.25Å; F115-V117 HydrophobicContact CB-CG1 4.42Å; F115-V117 PolarHBondContact O-N 2.86Å; F115-M121 WeakPolarHBondContact CD1-O 3.32Å; F115-S130 PolarHBondContact O-OG 2.84Å; F115-F133 HydrophobicContact CD2-CE2 4.17Å; F115-F133 HydrophobicContact CE2-CD2 4.01Å; F115-F133 AromaticContact CE2-CE2 3.74Å; F115-F133 HydrophobicContact CE2-CE2 3.74Å
116	D	59.5	Low	68.2	Low	72 Å²	72	64.2 Å²	64.2	39%	0.385	35%	0.345	S	S	.	.			trans	-89.1	91	163	-169.3	-1	0	0	0	109.2	R118 T119	D116-R118 PolarHBondContact O-N 2.68Å; D116-R118 VanDerWaalsContact O-N 3.1Å; D116-R118 WeakPolarHBondContact OD1-CB 3.31Å; D116-R118 PolarHBondContact OD1-N 2.96Å; D116-R118 VanDerWaalsContact OD1-N 3.13Å; D116-R118 IonicContact OD1-NE 3.64Å; D116-T119 HydrophobicContact CB-CG2 4.44Å; D116-T119 PolarHBondContact O-N 3.05Å; D116-T119 PolarHBondContact O-OG1 3.48Å
117	V	55.4	Low	65.8	Low	23 Å²	23	66.6 Å²	66.6	14%	0.139	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-64.7	-12.5	-179.6	-58.9	0	0	0	0	113.1	F115 T119 G120 L126 A129	F115-V117 HydrophobicContact CB-CG1 4.42Å; F115-V117 PolarHBondContact O-N 2.86Å; V117-T119 PolarHBondContact O-N 3.14Å; V117-G120 PolarHBondContact O-N 3.34Å; V117-L126 HydrophobicContact CG1-CB 3.85Å; V117-L126 WeakPolarHBondContact CG2-O 3.28Å; V117-A129 WeakPolarHBondContact CG2-O 3.39Å
118	R	53.9	Low	63.4	Low	219 Å²	219	69.9 Å²	69.9	83%	0.826	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-67.6	-22.3	172.4	-66.6	-176	-84.3	-148.6	-3.5	112.5	D116	D116-R118 PolarHBondContact O-N 2.68Å; D116-R118 VanDerWaalsContact O-N 3.1Å; D116-R118 WeakPolarHBondContact OD1-CB 3.31Å; D116-R118 PolarHBondContact OD1-N 2.96Å; D116-R118 VanDerWaalsContact OD1-N 3.13Å; D116-R118 IonicContact OD1-NE 3.64Å
119	T	55.8	Low	61	Low	94 Å²	94	70.9 Å²	70.9	58%	0.577	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-88.2	-0.6	177.8	63.9	0	0	0	0	113.7	D116 V117 M121	D116-T119 HydrophobicContact CB-CG2 4.44Å; D116-T119 PolarHBondContact O-N 3.05Å; D116-T119 PolarHBondContact O-OG1 3.48Å; V117-T119 PolarHBondContact O-N 3.14Å; T119-M121 PolarHBondContact O-N 3.36Å
120	G	51.7	Low	58.6	Low	66 Å²	66	71.2 Å²	71.2	68%	0.68	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	7.6	-179	0	0	0	0	0	115	V117	V117-G120 PolarHBondContact O-N 3.34Å
121	M	50.7	Low	56.6	Low	155 Å²	155	69.3 Å²	69.3	76%	0.764	41%	0.405	S	S	*	.			trans	-101.3	40.6	-178.3	-69.3	-165.6	64.6	0	0	113.9	F115 T119	F115-M121 WeakPolarHBondContact CD1-O 3.32Å; T119-M121 PolarHBondContact O-N 3.36Å
122	G	52.7	Low	55.3	Low	24 Å²	24	66.5 Å²	66.5	25%	0.247	39%	0.386	C	S	.	.	S	Bend	trans	-142.8	166.2	173.5	0	0	0	0	0	111.4
123	P	53.3	Low	54.1	Low	37 Å²	37	68 Å²	68	24%	0.24	39%	0.391	C	S	.	.			trans	-53.1	137.4	177.8	-23.2	31	0	0	0	111	E125 L126	P123-E125 PolarHBondContact O-N 3.02Å; P123-E125 VanDerWaalsContact O-N 3.17Å; P123-L126 HydrophobicContact CB-CD1 4.14Å; P123-L126 HydrophobicContact CB-CG 4.28Å; P123-L126 HydrophobicContact CG-CD1 3.86Å; P123-L126 WeakPolarHBondContact O-CB 3.35Å; P123-L126 PolarHBondContact O-N 3.34Å
124	P	52.1	Low	53.3	Low	52 Å²	52	62 Å²	62	34%	0.338	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-65.3	-19.6	-175.3	25.5	-30.1	0	0	0	113.1	R66 E67 L126 S127	R66-P124 PolarHBondContact NH1-O 3.35Å; E67-P124 WeakPolarHBondContact OE1-CD 3.47Å; P124-L126 PolarHBondContact O-N 3.28Å; P124-S127 WeakPolarHBondContact O-CB 3.24Å; P124-S127 PolarHBondContact O-N 3.48Å
125	E	52.8	Low	53.4	Low	88 Å²	88	60.6 Å²	60.6	41%	0.411	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-60.1	-23.4	168.5	-113.4	87.6	-107.9	0	0	113	R60 R66 P123	R60-E125 IonicContact CZ-OE2 3.85Å; R60-E125 IonicContact NH1-OE2 3.46Å; R60-E125 IonicContact NH2-OE2 3.27Å; R60-E125 PolarHBondContact NH2-OE2 2.99Å; R66-E125 WeakPolarHBondContact CD-OE1 3.41Å; R66-E125 IonicContact NH1-OE1 2.68Å; P123-E125 PolarHBondContact O-N 3.02Å; P123-E125 VanDerWaalsContact O-N 3.17Å
126	L	51.2	Low	54	Low	10 Å²	10	58.1 Å²	58.1	5%	0.052	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-97.9	3.9	-175.8	-50.9	174.6	0	0	0	112.8	F40 V117 P123 P124 G128 A129 T131 F133	F40-L126 HydrophobicContact CD1-CD2 4.45Å; F40-L126 HydrophobicContact CD2-CD2 4.07Å; F40-L126 HydrophobicContact CE1-CD2 4.19Å; F40-L126 HydrophobicContact CE2-CD2 3.79Å; F40-L126 HydrophobicContact CG-CD2 4.4Å; F40-L126 HydrophobicContact CZ-CD2 3.85Å; V117-L126 HydrophobicContact CG1-CB 3.85Å; V117-L126 WeakPolarHBondContact CG2-O 3.28Å; P123-L126 HydrophobicContact CB-CD1 4.14Å; P123-L126 HydrophobicContact CB-CG 4.28Å; P123-L126 HydrophobicContact CG-CD1 3.86Å; P123-L126 WeakPolarHBondContact O-CB 3.35Å; P123-L126 PolarHBondContact O-N 3.34Å; P124-L126 PolarHBondContact O-N 3.28Å; L126-G128 PolarHBondContact O-N 3.24Å; L126-A129 PolarHBondContact O-N 3.48Å; L126-T131 HydrophobicContact CB-CG2 3.99Å; L126-T131 WeakPolarHBondContact CB-OG1 3.46Å; L126-T131 WeakPolarHBondContact CD1-OG1 3.35Å; L126-T131 HydrophobicContact CD2-CG2 3.66Å; L126-T131 HydrophobicContact CG-CG2 4.24Å; L126-T131 WeakPolarHBondContact CG-OG1 3.5Å; L126-F133 HydrophobicContact CD1-CE2 4.09Å; L126-F133 HydrophobicContact CD1-CZ 3.88Å
127	S	43.3	Very low	55	Low	101 Å²	101	55.1 Å²	55.1	71%	0.706	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	96.5	-179.7	176.4	0	0	0	0	111.8	P124	P124-S127 WeakPolarHBondContact O-CB 3.24Å; P124-S127 PolarHBondContact O-N 3.48Å
128	G	44.3	Very low	56.2	Low	75 Å²	75	54 Å²	54	77%	0.773	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	140.4	-13.8	173.4	0	0	0	0	0	115.6	L126	L126-G128 PolarHBondContact O-N 3.24Å
129	A	42.2	Very low	57.5	Low	22 Å²	22	43.8 Å²	43.8	18%	0.182	29%	0.288	C	S	.	.	S	Bend	trans	-141.9	143.7	175.6	0	0	0	0	0	110.9	N38 V117 L126 T131	N38-A129 HydrophobicContact CB-CB 3.99Å; N38-A129 VanDerWaalsContact ND2-CB 3.26Å; N38-A129 WeakPolarHBondContact ND2-CB 3.41Å; V117-A129 WeakPolarHBondContact CG2-O 3.39Å; L126-A129 PolarHBondContact O-N 3.48Å; A129-T131 HydrophobicContact CB-CG2 4.28Å; A129-T131 PolarHBondContact O-N 3.16Å
130	S	42.6	Very low	58.3	Low	49 Å²	49	39.6 Å²	39.6	34%	0.343	26%	0.262	S	S	.	.			trans	-63	104.2	162.4	-175.4	0	0	0	0	107.3	S36 V114 F115	S36-S130 PolarHBondContact OG-O 2.6Å; V114-S130 WeakPolarHBondContact CG1-OG 3.45Å; F115-S130 PolarHBondContact O-OG 2.84Å
131	T	48.7	Very low	58.8	Low	2 Å²	2	40.6 Å²	40.6	1%	0.012	26%	0.257	C	S	.	.			trans	-95.7	145.4	-179.7	49.5	0	0	0	0	109.2	F40 L126 A129	F40-T131 HydrophobicContact CD2-CG2 3.93Å; F40-T131 HydrophobicContact CE2-CG2 3.9Å; L126-T131 HydrophobicContact CB-CG2 3.99Å; L126-T131 WeakPolarHBondContact CB-OG1 3.46Å; L126-T131 WeakPolarHBondContact CD1-OG1 3.35Å; L126-T131 HydrophobicContact CD2-CG2 3.66Å; L126-T131 HydrophobicContact CG-CG2 4.24Å; L126-T131 WeakPolarHBondContact CG-OG1 3.5Å; A129-T131 HydrophobicContact CB-CG2 4.28Å; A129-T131 PolarHBondContact O-N 3.16Å
132	K	58.2	Low	59.4	Low	30 Å²	30	35.6 Å²	35.6	13%	0.13	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.4	179.4	-59	-171.2	-175.7	-126.8	0	106.8	L35 P112 V114 P134	L35-K132 HydrophobicContact CB-CD 3.76Å; L35-K132 WeakPolarHBondContact O-CE 3.39Å; P112-K132 HydrophobicContact CB-CB 4.08Å; V114-K132 HydrophobicContact CG1-CG 4.46Å; V114-K132 HydrophobicContact CG2-CD 4.07Å; V114-K132 HydrophobicContact CG2-CG 4.07Å; V114-K132 VanDerWaalsContact CG2-NZ 3.32Å; K132-P134 VanDerWaalsContact O-CD 3.23Å; K132-P134 WeakPolarHBondContact O-CD 3.21Å
133	F	57.4	Low	59.8	Low	45 Å²	45	41.4 Å²	41.4	20%	0.197	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	102.9	163.9	-59.8	-77	0	0	0	107	F40 V42 P112 F115 L126 N135	F40-F133 HydrophobicContact CB-CD1 4.06Å; F40-F133 HydrophobicContact CB-CE1 4.15Å; V42-F133 HydrophobicContact CB-CB 4.34Å; V42-F133 HydrophobicContact CB-CD1 4.34Å; V42-F133 HydrophobicContact CG2-CB 4.19Å; V42-F133 HydrophobicContact CG2-CD1 3.34Å; V42-F133 HydrophobicContact CG2-CE1 3.93Å; V42-F133 HydrophobicContact CG2-CG 4.02Å; P112-F133 VanDerWaalsContact CA-O 3.22Å; P112-F133 WeakPolarHBondContact CA-O 3.45Å; P112-F133 VanDerWaalsContact CB-O 3.24Å; P112-F133 WeakPolarHBondContact CB-O 3.43Å; F115-F133 HydrophobicContact CD2-CE2 4.17Å; F115-F133 HydrophobicContact CE2-CD2 4.01Å; F115-F133 AromaticContact CE2-CE2 3.74Å; F115-F133 HydrophobicContact CE2-CE2 3.74Å; L126-F133 HydrophobicContact CD1-CE2 4.09Å; L126-F133 HydrophobicContact CD1-CZ 3.88Å; F133-N135 VanDerWaalsContact C-N 3.34Å; F133-N135 WeakPolarHBondContact CB-OD1 3.11Å; F133-N135 PolarHBondContact O-N 3.29Å; F133-N135 PolarHBondContact O-OD1 3.02Å; F133-N135 VanDerWaalsContact O-OD1 3.13Å
134	P	58.5	Low	60.2	Low	20 Å²	20	41.4 Å²	41.4	13%	0.13	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	108.5	154.9	28.1	-30.3	0	0	0	105.5	F40 S41 V42 D85 K132 T136	F40-P134 WeakPolarHBondContact O-CD 3.34Å; F40-P134 WeakPolarHBondContact O-CG 3.41Å; S41-P134 WeakPolarHBondContact OG-CG 3.26Å; V42-P134 PolarHBondContact N-O 3.01Å; D85-P134 HydrophobicContact CB-CB 3.72Å; D85-P134 HydrophobicContact CB-CG 3.58Å; K132-P134 VanDerWaalsContact O-CD 3.23Å; K132-P134 WeakPolarHBondContact O-CD 3.21Å; P134-T136 PolarHBondContact O-N 3.27Å
135	N	71.1	Confident	60.3	Low	36 Å²	36	43.5 Å²	43.5	19%	0.193	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	105.5	179.6	-70.4	-2.4	0	0	0	105.8	V42 L110 F133	V42-N135 WeakPolarHBondContact O-CA 3.47Å; L110-N135 HydrophobicContact CB-CB 3.91Å; L110-N135 HydrophobicContact CD1-CB 4.11Å; L110-N135 HydrophobicContact CG-CB 4.31Å; L110-N135 PolarHBondContact N-O 3.25Å; F133-N135 VanDerWaalsContact C-N 3.34Å; F133-N135 WeakPolarHBondContact CB-OD1 3.11Å; F133-N135 PolarHBondContact O-N 3.29Å; F133-N135 PolarHBondContact O-OD1 3.02Å; F133-N135 VanDerWaalsContact O-OD1 3.13Å
136	T	78.2	Confident	60.3	Low	0 Å²	0	44.5 Å²	44.5	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	130.6	169.9	-59.6	0	0	0	0	107.5	V42 L43 V44 T86 V106 P134	V42-T136 PolarHBondContact O-N 3.4Å; L43-T136 CarbonylContact C-O 3.58Å; L43-T136 WeakPolarHBondContact CA-O 3.26Å; L43-T136 HydrophobicContact CD1-CG2 4.25Å; V44-T136 PolarHBondContact N-O 3.36Å; T86-T136 HydrophobicContact CG2-CG2 4.26Å; V106-T136 HydrophobicContact CB-CG2 4.22Å; V106-T136 HydrophobicContact CG1-CG2 3.37Å; V106-T136 HydrophobicContact CG2-CG2 3.86Å; P134-T136 PolarHBondContact O-N 3.27Å
137	L	81.3	Confident	60.6	Low	10 Å²	10	45.6 Å²	45.6	5%	0.052	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.7	175.5	-171	77.6	0	0	0	108.6	L23 V44 V107 S108	L23-L137 HydrophobicContact CB-CD2 3.91Å; L23-L137 HydrophobicContact CD1-CD2 3.13Å; L23-L137 HydrophobicContact CD1-CG 4.17Å; L23-L137 HydrophobicContact CD2-CD2 3.04Å; L23-L137 HydrophobicContact CG-CD2 3.41Å; L23-L137 VanDerWaalsContact CG-CD2 3.41Å; V44-L137 HydrophobicContact CB-CD1 3.49Å; V44-L137 VanDerWaalsContact CB-CD1 3.49Å; V44-L137 HydrophobicContact CG1-CD1 3.31Å; V44-L137 WeakPolarHBondContact O-CA 3.46Å; V44-L137 WeakPolarHBondContact O-CD1 3.46Å; V107-L137 HydrophobicContact CG2-CB 4.38Å; V107-L137 HydrophobicContact CG2-CD2 4.23Å; V107-L137 HydrophobicContact CG2-CG 4.23Å; V107-L137 WeakPolarHBondContact CG2-O 3.41Å; V107-L137 PolarHBondContact N-O 2.86Å; S108-L137 PolarHBondContact O-N 3.35Å
138	G	80.4	Confident	61.3	Low	0 Å²	0	43.4 Å²	43.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	145.7	179.7	0	0	0	0	0	111.3	V44 L46 E105	V44-G138 PolarHBondContact O-N 3.35Å; L46-G138 WeakPolarHBondContact CB-O 3.29Å; L46-G138 PolarHBondContact N-O 3.24Å; E105-G138 CarbonylContact O-C 3.6Å; E105-G138 WeakPolarHBondContact O-CA 3.14Å
139	T	80.9	Confident	62.5	Low	3 Å²	3	43.7 Å²	43.7	2%	0.018	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.6	166.6	58.4	0	0	0	0	111	I16 K20 L46 E105 V107	I16-T139 HydrophobicContact CG2-CG2 4.48Å; K20-T139 WeakPolarHBondContact CE-OG1 3.44Å; K20-T139 HydrophobicContact CG-CG2 4.28Å; L46-T139 HydrophobicContact CB-CG2 4.26Å; L46-T139 HydrophobicContact CD2-CG2 4.18Å; L46-T139 WeakPolarHBondContact O-CA 3.36Å; E105-T139 PolarHBondContact N-O 2.91Å; E105-T139 PolarHBondContact O-N 3.29Å; V107-T139 HydrophobicContact CG1-CG2 4.1Å; V107-T139 HydrophobicContact CG2-CG2 4.18Å
140	E	73.1	Confident	64.1	Low	6 Å²	6	43.2 Å²	43.2	3%	0.028	26%	0.262	C	S	.	.			trans	-89.7	132.5	176.1	-62.4	-55.5	124.9	0	0	111.7	L46 L47 L99 Q103 V104	L46-E140 PolarHBondContact O-N 2.81Å; L47-E140 HydrophobicContact CD2-CG 4.25Å; L47-E140 HydrophobicContact CG-CB 4.33Å; L47-E140 HydrophobicContact CG-CG 3.96Å; L99-E140 HydrophobicContact CD1-CG 4.43Å; L99-E140 VanDerWaalsContact CD1-OE1 3.26Å; L99-E140 WeakPolarHBondContact CD1-OE1 3.37Å; L99-E140 WeakPolarHBondContact CD1-OE2 3.37Å; L99-E140 WeakPolarHBondContact CD2-OE1 3.17Å; Q103-E140 WeakPolarHBondContact CB-OE2 3.16Å; V104-E140 WeakPolarHBondContact CG2-OE1 3Å
141	P	62.5	Low	65.9	Low	88 Å²	88	41 Å²	41	57%	0.571	25%	0.247	S	C	*	.	S	Bend	trans	-83	-12.2	174.4	33.1	-31.8	0	0	0	112.9	Q103	Q103-P141 WeakPolarHBondContact O-CD 3.18Å
142	G	63.3	Low	67.5	Low	49 Å²	49	42.5 Å²	42.5	51%	0.505	26%	0.255	S	S	.	.	S	Bend	trans	-138.9	179.4	-172	0	0	0	0	0	115.3
143	E	59.7	Low	68.6	Low	146 Å²	146	41.7 Å²	41.7	68%	0.682	25%	0.252	S	S	*	.	P	Polyproline II helix	trans	-85.7	126.1	176.3	-162.2	158.4	-166.9	0	0	109.5	R49	R49-E143 IonicContact CZ-OE1 3.86Å; R49-E143 IonicContact NE-OE1 3.11Å; R49-E143 PolarHBondContact NE-OE1 3.23Å; R49-E143 IonicContact NH2-OE1 2.73Å; R49-E143 PolarHBondContact NH2-OE1 3.03Å
144	L	61.7	Low	69.7	Low	38 Å²	38	40.5 Å²	40.5	20%	0.199	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-74.8	149.1	176.2	-62.9	178.7	0	0	0	110.3	L47 M56 L99	L47-L144 HydrophobicContact CD2-CD1 3.77Å; L47-L144 HydrophobicContact CD2-CG 4.15Å; M56-L144 HydrophobicContact CE-CD1 3.82Å; M56-L144 HydrophobicContact SD-CD1 3.53Å; M56-L144 VanDerWaalsContact SD-CD1 3.53Å; L99-L144 HydrophobicContact CD1-CD2 3.73Å
145	S	55.8	Low	70.5	Confident	95 Å²	95	43.4 Å²	43.4	66%	0.664	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-59.2	134.7	157.8	51.2	0	0	0	0	108.2	C147	S145-C147 PolarHBondContact O-N 2.73Å
146	P	52.7	Low	70.3	Confident	110 Å²	110	43.6 Å²	43.6	71%	0.714	27%	0.265	S	S	*	.			trans	-57.3	113.5	176.6	22.8	-31.3	0	0	0	108.7
147	C	57.3	Low	69.3	Low	33 Å²	33	46 Å²	46	22%	0.223	29%	0.29	C	S	.	.			trans	-86.3	136	171.8	-151.2	0	0	0	0	108.2	V97 S145 D149 S150	V97-C147 HydrophobicContact CB-CB 4.46Å; S145-C147 PolarHBondContact O-N 2.73Å; C147-D149 PolarHBondContact O-N 3.13Å; C147-S150 PolarHBondContact O-N 3.2Å; C147-S150 VanDerWaalsContact O-N 3.12Å; C147-S150 PolarHBondContact O-OG 3.39Å
148	V	58.2	Low	67.9	Low	54 Å²	54	51.3 Å²	51.3	33%	0.327	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-27.4	-166.1	-48.2	0	0	0	0	112.5	P169 P170	V148-P169 HydrophobicContact CB-CB 4.39Å; V148-P170 HydrophobicContact CG1-CG 3.94Å
149	D	68.8	Low	66.5	Low	82 Å²	82	57 Å²	57	44%	0.439	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	17.8	-178.3	-61.9	-44.6	0	0	0	111.8	T58 V59 C147	T58-D149 CarbonylContact C-O 3.45Å; T58-D149 WeakPolarHBondContact CA-O 3.24Å; V59-D149 PolarHBondContact N-O 3.18Å; C147-D149 PolarHBondContact O-N 3.13Å
150	S	75.6	Confident	64.9	Low	11 Å²	11	63.8 Å²	63.8	8%	0.077	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	141.7	178.9	68.1	0	0	0	0	113.1	F57 C147 G167	F57-S150 CarbonylContact O-C 3.51Å; F57-S150 VanDerWaalsContact O-CA 3.22Å; F57-S150 WeakPolarHBondContact O-CA 2.71Å; C147-S150 PolarHBondContact O-N 3.2Å; C147-S150 VanDerWaalsContact O-N 3.12Å; C147-S150 PolarHBondContact O-OG 3.39Å; S150-G167 PolarHBondContact O-N 2.87Å; S150-G167 VanDerWaalsContact O-N 3.16Å
151	V	81.4	Confident	63.5	Low	4 Å²	4	67.3 Å²	67.3	2%	0.024	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.5	172.8	161.3	0	0	0	0	108.6	M56 F57 V59 E164 E165 R166	M56-V151 CarbonylContact C-O 3.52Å; M56-V151 WeakPolarHBondContact CA-O 3.33Å; F57-V151 HydrophobicContact CB-CB 4.12Å; F57-V151 HydrophobicContact CB-CG1 4.49Å; F57-V151 HydrophobicContact CD2-CG1 4.35Å; F57-V151 PolarHBondContact N-O 3Å; F57-V151 PolarHBondContact O-N 3.06Å; V59-V151 HydrophobicContact CG2-CG2 3.83Å; V151-E164 HydrophobicContact CG1-CB 4.33Å; V151-E164 HydrophobicContact CG1-CG 3.6Å; V151-E164 HydrophobicContact CG2-CG 4.39Å; V151-E164 VanDerWaalsContact CG2-OE1 3.25Å; V151-E164 WeakPolarHBondContact CG2-OE1 3.26Å; V151-E165 WeakPolarHBondContact CA-O 3.46Å; V151-R166 HydrophobicContact CG2-CG 3.71Å
152	L	81	Confident	63	Low	33 Å²	33	69.7 Å²	69.7	17%	0.173	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.7	170.1	-67.3	-178.8	0	0	0	109.9	L47 Y54 L55 M56 E164 E165	L47-L152 HydrophobicContact CD1-CD2 4.14Å; L47-L152 HydrophobicContact CD2-CD2 4.37Å; Y54-L152 HydrophobicContact CD1-CB 4.08Å; L55-L152 WeakPolarHBondContact O-CA 3.34Å; M56-L152 HydrophobicContact CB-CD2 3.89Å; M56-L152 HydrophobicContact CG-CD2 4.24Å; L152-E164 WeakPolarHBondContact O-CA 3.43Å; L152-E165 PolarHBondContact N-O 3.13Å; L152-E165 PolarHBondContact O-N 3.05Å
153	C	81.2	Confident	62.8	Low	12 Å²	12	72.7 Å²	72.7	8%	0.081	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	118.7	172.8	178	0	0	0	0	110.2	Y54 L55 F57 L155 I162 Q163	Y54-C153 CarbonylContact C-O 3.59Å; Y54-C153 WeakPolarHBondContact CA-O 3.22Å; L55-C153 HydrophobicContact CB-CB 4.43Å; L55-C153 PolarHBondContact N-O 3.44Å; L55-C153 PolarHBondContact O-N 2.74Å; F57-C153 HydrophobicContact CD2-CB 4.21Å; F57-C153 HydrophobicContact CE2-CB 3.59Å; C153-L155 PolarHBondContact O-N 3Å; C153-I162 VanDerWaalsContact SG-CG2 3.58Å; C153-Q163 WeakPolarHBondContact CA-O 3.27Å
154	E	80.5	Confident	62.8	Low	21 Å²	21	70.9 Å²	70.9	10%	0.098	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	124.5	172.6	-170.6	172.9	146.8	0	0	111.2	K52 Y54 C156 Q163	K52-E154 HydrophobicContact CB-CG 4.38Å; K52-E154 VanDerWaalsContact CD-CD 3.47Å; K52-E154 HydrophobicContact CD-CG 4.41Å; K52-E154 VanDerWaalsContact CD-OE1 3.26Å; K52-E154 WeakPolarHBondContact CD-OE1 3.46Å; K52-E154 WeakPolarHBondContact CD-OE2 3.11Å; K52-E154 WeakPolarHBondContact CE-OE1 3.46Å; K52-E154 IonicContact NZ-OE1 3.5Å; K52-E154 PolarHBondContact NZ-OE1 3.39Å; K52-E154 IonicContact NZ-OE2 2.81Å; K52-E154 PolarHBondContact NZ-OE2 3.3Å; Y54-E154 HydrophobicContact CD1-CB 3.91Å; Y54-E154 HydrophobicContact CD1-CG 4.48Å; Y54-E154 HydrophobicContact CE1-CB 3.52Å; Y54-E154 HydrophobicContact CE1-CG 3.93Å; Y54-E154 PolarHBondContact OH-OE2 3.03Å; Y54-E154 VanDerWaalsContact OH-OE2 3.13Å; E154-C156 VanDerWaalsContact C-N 3.28Å; E154-C156 PolarHBondContact O-N 2.85Å; E154-Q163 HydrophobicContact CB-CB 4.5Å; E154-Q163 PolarHBondContact N-O 3.37Å; E154-Q163 VanDerWaalsContact N-O 3.11Å
155	L	75.2	Confident	62.9	Low	80 Å²	80	74.7 Å²	74.7	42%	0.419	44%	0.437	S	S	.	.			trans	-76.7	82.9	166.4	-68	-178.5	0	0	0	109.3	L46 L53 L55 C153	L46-L155 HydrophobicContact CD1-CD1 3.69Å; L53-L155 HydrophobicContact CB-CB 4.1Å; L53-L155 HydrophobicContact CB-CD1 4.16Å; L53-L155 PolarHBondContact O-N 3.27Å; L55-L155 HydrophobicContact CD1-CD2 3.77Å; L55-L155 HydrophobicContact CD1-CG 4.4Å; L55-L155 HydrophobicContact CD2-CD1 4.43Å; L55-L155 HydrophobicContact CG-CD1 4.11Å; L55-L155 HydrophobicContact CG-CD2 4Å; L55-L155 HydrophobicContact CG-CG 4.07Å; C153-L155 PolarHBondContact O-N 3Å
156	C	67.5	Low	63.2	Low	41 Å²	41	77.5 Å²	77.5	28%	0.277	43%	0.433	S	S	.	.			trans	-64.2	144.6	164.6	-72.5	0	0	0	0	109	E154 S161	E154-C156 VanDerWaalsContact C-N 3.28Å; E154-C156 PolarHBondContact O-N 2.85Å; C156-S161 WeakPolarHBondContact CB-O 3.23Å; C156-S161 PolarHBondContact SG-O 3.36Å
157	G	57.1	Low	63.5	Low	50 Å²	50	73.2 Å²	73.2	52%	0.515	41%	0.408	S	S	.	.			trans	-53.8	-170.2	178.9	0	0	0	0	0	114.4	S159 H160	G157-S159 PolarHBondContact O-N 2.88Å; G157-H160 PolarHBondContact O-N 3.36Å
158	P	52.9	Low	62.9	Low	122 Å²	122	80 Å²	80	79%	0.792	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-0.5	-164	22.1	-33.1	0	0	0	117.5	H160	P158-H160 PolarHBondContact O-CD2 3.46Å; P158-H160 PolarHBondContact O-NE2 3.37Å
159	S	49.5	Very low	62.1	Low	119 Å²	119	81.6 Å²	81.6	83%	0.832	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	8.2	173.7	-56	0	0	0	0	114.6	G157	G157-S159 PolarHBondContact O-N 2.88Å
160	H	48.9	Very low	60.7	Low	145 Å²	145	82.9 Å²	82.9	67%	0.671	46%	0.461	S	S	*	.			trans	39.6	75.8	158.4	-55.8	-68.8	0	0	0	117.7	G157 P158	G157-H160 PolarHBondContact O-N 3.36Å; P158-H160 PolarHBondContact O-CD2 3.46Å; P158-H160 PolarHBondContact O-NE2 3.37Å
161	S	43.9	Very low	59	Low	80 Å²	80	95 Å²	95	56%	0.559	52%	0.516	S	S	*	.			trans	-100.3	124.7	149	-70.5	0	0	0	0	108.4	C156	C156-S161 WeakPolarHBondContact CB-O 3.23Å; C156-S161 PolarHBondContact SG-O 3.36Å
162	I	51.8	Low	57.9	Low	138 Å²	138	99.5 Å²	99.5	71%	0.708	54%	0.541	S	S	*	.			trans	-82.5	120.5	170.8	-70.6	173.2	0	0	0	106.5	C153	C153-I162 VanDerWaalsContact SG-CG2 3.58Å
163	Q	59.2	Low	56.7	Low	112 Å²	112	103 Å²	103	52%	0.523	56%	0.56	S	S	.	*			trans	-111.3	121.4	169.4	-66.3	-175.5	-15.6	0	0	107.7	C153 E154	C153-Q163 WeakPolarHBondContact CA-O 3.27Å; E154-Q163 HydrophobicContact CB-CB 4.5Å; E154-Q163 PolarHBondContact N-O 3.37Å; E154-Q163 VanDerWaalsContact N-O 3.11Å
164	E	58.9	Low	55.3	Low	108 Å²	108	108.1 Å²	108.1	51%	0.505	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.2	127.7	179.9	162.5	167	-172.9	0	0	109.6	V151 L152	V151-E164 HydrophobicContact CG1-CB 4.33Å; V151-E164 HydrophobicContact CG1-CG 3.6Å; V151-E164 HydrophobicContact CG2-CG 4.39Å; V151-E164 VanDerWaalsContact CG2-OE1 3.25Å; V151-E164 WeakPolarHBondContact CG2-OE1 3.26Å; L152-E164 WeakPolarHBondContact O-CA 3.43Å
165	E	64.7	Low	53.8	Low	118 Å²	118	113.2 Å²	113.2	55%	0.551	62%	0.616	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.3	123.2	164.3	-62.2	-160.7	166.5	0	0	109.2	V151 L152	V151-E165 WeakPolarHBondContact CA-O 3.46Å; L152-E165 PolarHBondContact N-O 3.13Å; L152-E165 PolarHBondContact O-N 3.05Å
166	R	62.1	Low	52.5	Low	155 Å²	155	115.3 Å²	115.3	59%	0.585	63%	0.628	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.4	138.2	168.8	-98.8	-173.9	178	-140.7	3.4	110.2	V59 V151	V59-R166 VanDerWaalsContact CG1-NH2 3.3Å; V151-R166 HydrophobicContact CG2-CG 3.71Å
167	G	57.1	Low	51.5	Low	19 Å²	19	120.2 Å²	120.2	20%	0.196	65%	0.651	C	S	.	*	P	Polyproline II helix	trans	-60.5	138	162.6	0	0	0	0	0	110.8	S150	S150-G167 PolarHBondContact O-N 2.87Å; S150-G167 VanDerWaalsContact O-N 3.16Å
168	E	45.7	Very low	51.1	Low	176 Å²	176	125.2 Å²	125.2	82%	0.822	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-81.7	132.6	172.7	-155.1	171.1	179.4	0	0	108.8
169	P	41.7	Very low	50.9	Low	87 Å²	87	125.5 Å²	125.5	57%	0.565	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-66.4	152.7	177.1	26.6	-33	0	0	0	111.2	V148	V148-P169 HydrophobicContact CB-CB 4.39Å
170	P	38.3	Very low	51.1	Low	109 Å²	109	126 Å²	126	71%	0.708	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-67.6	141.8	175.5	-5.7	23.2	0	0	0	108.8	V148	V148-P170 HydrophobicContact CG1-CG 3.94Å
171	Q	40.5	Very low	51.3	Low	265 Å²	265	124.3 Å²	124.3	100%	1.238	63%	0.633	S	S	*	*			trans	-69.5	0	176.2	-65.4	-157.7	-26.4	0	0	113.1

Retrieved 171 of 171 residues in 297.8 ms (Link to these results)

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