A0AA82N7S1_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N7S1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 344 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	43.5	Very low	44.8	Very low	238 Å²	238	141 Å²	141	100%	1.172	69%	0.685	S	S	*	*				0	94.3	0	-75.7	173.5	174	0	0	108.3
2	R	43.4	Very low	46	Very low	218 Å²	218	135.3 Å²	135.3	82%	0.823	67%	0.666	S	S	*	*			trans	-143.6	18.2	-174.5	-106.9	-174.5	174.6	-173.6	-5.7	115
3	Y	43.5	Very low	47.1	Very low	221 Å²	221	130.4 Å²	130.4	87%	0.867	65%	0.647	S	S	*	*	S	Bend	trans	-117.9	6.5	-177.4	-79.9	-80.1	0	0	0	115.4
4	T	46.9	Very low	48	Very low	109 Å²	109	132.9 Å²	132.9	67%	0.669	65%	0.648	S	S	*	*	S	Bend	trans	-96.4	-8.3	-170.5	-15.9	0	0	0	0	115.4
5	L	41.4	Very low	48.6	Very low	149 Å²	149	128.2 Å²	128.2	78%	0.78	63%	0.633	S	S	*	*	H	α-helix	trans	-94.3	-24	-170	-92.8	146.7	0	0	0	115.2	F7	L5-F7 VanDerWaalsContact C-N 3.34Å
6	L	46.1	Very low	49.4	Very low	151 Å²	151	124.4 Å²	124.4	79%	0.791	62%	0.615	S	S	*	*	H	α-helix	trans	-72.4	-29	174.1	-94.1	130.3	0	0	0	112.4	S10	L6-S10 PolarHBondContact O-N 2.99Å
7	F	39.6	Very low	50	Low	150 Å²	150	122.7 Å²	122.7	66%	0.658	61%	0.608	S	S	*	*	H	α-helix	trans	-70	-35.2	-178.6	-128.1	-91.2	0	0	0	112.7	L5 S10 I11	L5-F7 VanDerWaalsContact C-N 3.34Å; F7-S10 PolarHBondContact O-OG 3.29Å; F7-I11 HydrophobicContact CD1-CD1 4.04Å; F7-I11 HydrophobicContact CD1-CG1 4.5Å; F7-I11 VanDerWaalsContact O-CD1 3.32Å; F7-I11 WeakPolarHBondContact O-CD1 3.17Å; F7-I11 WeakPolarHBondContact O-CG1 3.36Å; F7-I11 PolarHBondContact O-N 3.41Å
8	C	40.2	Very low	50.4	Low	80 Å²	80	124.5 Å²	124.5	54%	0.541	61%	0.612	S	S	.	*	H	α-helix	trans	-71.3	-36.1	177.7	-76.3	0	0	0	0	112.9	I11 T12	C8-I11 PolarHBondContact O-N 2.9Å; C8-T12 PolarHBondContact O-N 3.13Å; C8-T12 VanDerWaalsContact O-N 3.08Å; C8-T12 PolarHBondContact O-OG1 2.81Å
9	Q	42.3	Very low	50.7	Low	102 Å²	102	124.4 Å²	124.4	48%	0.477	61%	0.611	S	S	.	*	H	α-helix	trans	-70.4	-38.9	177	-71.7	-164.1	-17.7	0	0	111.8	T12 V13 P322	Q9-T12 WeakPolarHBondContact CA-OG1 3.26Å; Q9-T12 PolarHBondContact O-N 3.37Å; Q9-T12 PolarHBondContact O-OG1 3.28Å; Q9-V13 WeakPolarHBondContact O-CG2 3.44Å; Q9-V13 PolarHBondContact O-N 2.91Å; Q9-V13 VanDerWaalsContact O-N 3.1Å; Q9-P322 VanDerWaalsContact NE2-CB 3.26Å
10	S	49.1	Very low	50.8	Low	43 Å²	43	123 Å²	123	30%	0.301	61%	0.606	S	S	.	*	H	α-helix	trans	-61.9	-45.7	172.7	66.5	0	0	0	0	110.6	L6 F7 T12 V13 Y14	L6-S10 PolarHBondContact O-N 2.99Å; F7-S10 PolarHBondContact O-OG 3.29Å; S10-T12 VanDerWaalsContact C-N 3.35Å; S10-T12 PolarHBondContact O-N 2.67Å; S10-V13 PolarHBondContact O-N 2.86Å; S10-Y14 WeakPolarHBondContact O-CB 3.44Å; S10-Y14 WeakPolarHBondContact O-CD2 3.39Å; S10-Y14 PolarHBondContact O-N 2.65Å
11	I	56.8	Low	50.9	Low	90 Å²	90	120.1 Å²	120.1	46%	0.462	60%	0.598	S	S	.	*	H	α-helix	trans	-55.9	-47.5	177.4	-69.7	162.6	0	0	0	111.1	F7 C8 V13 Y14 S15	F7-I11 HydrophobicContact CD1-CD1 4.04Å; F7-I11 HydrophobicContact CD1-CG1 4.5Å; F7-I11 VanDerWaalsContact O-CD1 3.32Å; F7-I11 WeakPolarHBondContact O-CD1 3.17Å; F7-I11 WeakPolarHBondContact O-CG1 3.36Å; F7-I11 PolarHBondContact O-N 3.41Å; C8-I11 PolarHBondContact O-N 2.9Å; I11-V13 PolarHBondContact O-N 3.48Å; I11-Y14 PolarHBondContact O-N 3.41Å; I11-S15 WeakPolarHBondContact O-CB 3.31Å; I11-S15 PolarHBondContact O-N 2.93Å; I11-S15 PolarHBondContact O-OG 3.18Å
12	T	59.2	Low	51	Low	73 Å²	73	111.3 Å²	111.3	45%	0.448	57%	0.568	S	S	.	*	H	α-helix	trans	-63.9	-39.1	179.7	43.4	0	0	0	0	113.4	C8 Q9 S10 S15 I16	C8-T12 PolarHBondContact O-N 3.13Å; C8-T12 VanDerWaalsContact O-N 3.08Å; C8-T12 PolarHBondContact O-OG1 2.81Å; Q9-T12 WeakPolarHBondContact CA-OG1 3.26Å; Q9-T12 PolarHBondContact O-N 3.37Å; Q9-T12 PolarHBondContact O-OG1 3.28Å; S10-T12 VanDerWaalsContact C-N 3.35Å; S10-T12 PolarHBondContact O-N 2.67Å; T12-S15 PolarHBondContact O-N 3.47Å; T12-I16 WeakPolarHBondContact O-CD1 2.87Å; T12-I16 VanDerWaalsContact O-CG1 3.25Å; T12-I16 WeakPolarHBondContact O-CG1 3.42Å; T12-I16 PolarHBondContact O-N 3.03Å
13	V	59.7	Low	51.1	Low	71 Å²	71	109 Å²	109	43%	0.43	57%	0.565	S	S	.	*	H	α-helix	trans	-69.1	-43.4	177.6	173.7	0	0	0	0	110.3	Q9 S10 I11 S15 I16 I17	Q9-V13 WeakPolarHBondContact O-CG2 3.44Å; Q9-V13 PolarHBondContact O-N 2.91Å; Q9-V13 VanDerWaalsContact O-N 3.1Å; S10-V13 PolarHBondContact O-N 2.86Å; I11-V13 PolarHBondContact O-N 3.48Å; V13-S15 PolarHBondContact O-N 3.3Å; V13-I16 PolarHBondContact O-N 3.37Å; V13-I17 HydrophobicContact CG1-CD1 3.72Å; V13-I17 HydrophobicContact CG1-CG1 4.41Å; V13-I17 WeakPolarHBondContact O-CB 3.45Å; V13-I17 VanDerWaalsContact O-CG1 3.28Å; V13-I17 WeakPolarHBondContact O-CG1 3.41Å; V13-I17 PolarHBondContact O-N 2.96Å
14	Y	59.9	Low	51.6	Low	166 Å²	166	104 Å²	104	65%	0.651	55%	0.551	S	S	*	*	H	α-helix	trans	-62.5	-40.5	174.7	-78.9	-66.2	0	0	0	111.9	S10 I11 I17 F18	S10-Y14 WeakPolarHBondContact O-CB 3.44Å; S10-Y14 WeakPolarHBondContact O-CD2 3.39Å; S10-Y14 PolarHBondContact O-N 2.65Å; I11-Y14 PolarHBondContact O-N 3.41Å; Y14-I17 PolarHBondContact O-N 3.36Å; Y14-F18 WeakPolarHBondContact O-CB 3.41Å; Y14-F18 PolarHBondContact O-N 3.37Å
15	S	57.7	Low	52.3	Low	62 Å²	62	105.5 Å²	105.5	43%	0.434	55%	0.549	S	S	.	.	H	α-helix	trans	-64.8	-39.9	175.9	-63.8	0	0	0	0	112.3	I11 T12 V13 F18 M19	I11-S15 WeakPolarHBondContact O-CB 3.31Å; I11-S15 PolarHBondContact O-N 2.93Å; I11-S15 PolarHBondContact O-OG 3.18Å; T12-S15 PolarHBondContact O-N 3.47Å; V13-S15 PolarHBondContact O-N 3.3Å; S15-F18 PolarHBondContact O-N 3.27Å; S15-M19 WeakPolarHBondContact O-CB 3.42Å; S15-M19 WeakPolarHBondContact O-CG 3.39Å; S15-M19 PolarHBondContact O-N 3.1Å
16	I	60.7	Low	53.7	Low	67 Å²	67	102.6 Å²	102.6	34%	0.344	54%	0.54	S	S	.	.	H	α-helix	trans	-68.4	-44.6	176.8	-67.7	164.7	0	0	0	110.6	T12 V13 F18 M19 I20 V326	T12-I16 WeakPolarHBondContact O-CD1 2.87Å; T12-I16 VanDerWaalsContact O-CG1 3.25Å; T12-I16 WeakPolarHBondContact O-CG1 3.42Å; T12-I16 PolarHBondContact O-N 3.03Å; V13-I16 PolarHBondContact O-N 3.37Å; I16-F18 VanDerWaalsContact C-N 3.33Å; I16-F18 PolarHBondContact O-N 3.32Å; I16-M19 PolarHBondContact O-N 2.84Å; I16-I20 HydrophobicContact CG2-CD1 3.74Å; I16-I20 HydrophobicContact CG2-CG1 4.45Å; I16-I20 VanDerWaalsContact O-CG1 3.24Å; I16-I20 WeakPolarHBondContact O-CG1 3.12Å; I16-I20 PolarHBondContact O-N 3.4Å; I16-V326 HydrophobicContact CD1-CG1 4.44Å
17	I	60.5	Low	55.3	Low	96 Å²	96	97.1 Å²	97.1	49%	0.492	51%	0.511	S	S	.	.	H	α-helix	trans	-62	-43	175.7	-67.5	168.9	0	0	0	110.3	V13 Y14 I20 S21	V13-I17 HydrophobicContact CG1-CD1 3.72Å; V13-I17 HydrophobicContact CG1-CG1 4.41Å; V13-I17 WeakPolarHBondContact O-CB 3.45Å; V13-I17 VanDerWaalsContact O-CG1 3.28Å; V13-I17 WeakPolarHBondContact O-CG1 3.41Å; V13-I17 PolarHBondContact O-N 2.96Å; Y14-I17 PolarHBondContact O-N 3.36Å; I17-I20 PolarHBondContact O-N 2.97Å; I17-S21 WeakPolarHBondContact O-CB 3.44Å; I17-S21 PolarHBondContact O-N 3.35Å; I17-S21 PolarHBondContact O-OG 3.41Å; I17-S21 VanDerWaalsContact O-OG 3.12Å
18	F	57.4	Low	57.5	Low	155 Å²	155	93.9 Å²	93.9	68%	0.68	50%	0.498	S	S	*	.	H	α-helix	trans	-64.4	-40.2	178.4	-170.9	-94.1	0	0	0	112.1	Y14 S15 I16 S21 G22	Y14-F18 WeakPolarHBondContact O-CB 3.41Å; Y14-F18 PolarHBondContact O-N 3.37Å; S15-F18 PolarHBondContact O-N 3.27Å; I16-F18 VanDerWaalsContact C-N 3.33Å; I16-F18 PolarHBondContact O-N 3.32Å; F18-S21 VanDerWaalsContact CA-OG 3.28Å; F18-S21 WeakPolarHBondContact CA-OG 3.48Å; F18-S21 PolarHBondContact O-N 2.88Å; F18-S21 PolarHBondContact O-OG 3.23Å; F18-G22 PolarHBondContact O-N 3.17Å
19	M	54.9	Low	59.8	Low	122 Å²	122	90.2 Å²	90.2	60%	0.601	47%	0.473	S	S	*	.	H	α-helix	trans	-62.4	-49.3	173.2	-71.4	-86.6	-81.3	0	0	110.2	S15 I16 S21 G22 F23	S15-M19 WeakPolarHBondContact O-CB 3.42Å; S15-M19 WeakPolarHBondContact O-CG 3.39Å; S15-M19 PolarHBondContact O-N 3.1Å; I16-M19 PolarHBondContact O-N 2.84Å; M19-S21 PolarHBondContact O-N 2.94Å; M19-G22 PolarHBondContact O-N 3.03Å; M19-F23 WeakPolarHBondContact O-CD2 3.26Å; M19-F23 PolarHBondContact O-N 3.28Å; M19-F23 VanDerWaalsContact O-N 3.16Å
20	I	53.8	Low	62	Low	96 Å²	96	87.2 Å²	87.2	49%	0.492	46%	0.463	S	S	.	.	H	α-helix	trans	-63	-40.6	178.7	-64.6	165.8	0	0	0	111.3	I16 I17 G22 F23 I24	I16-I20 HydrophobicContact CG2-CD1 3.74Å; I16-I20 HydrophobicContact CG2-CG1 4.45Å; I16-I20 VanDerWaalsContact O-CG1 3.24Å; I16-I20 WeakPolarHBondContact O-CG1 3.12Å; I16-I20 PolarHBondContact O-N 3.4Å; I17-I20 PolarHBondContact O-N 2.97Å; I20-G22 VanDerWaalsContact C-N 3.34Å; I20-F23 PolarHBondContact O-N 2.92Å; I20-I24 HydrophobicContact CG2-CD1 4.39Å; I20-I24 PolarHBondContact O-N 3.28Å
21	S	51.7	Low	63.7	Low	63 Å²	63	89.5 Å²	89.5	44%	0.441	48%	0.475	S	S	.	.	H	α-helix	trans	-68.8	-33.8	176.6	62	0	0	0	0	112.3	I17 F18 M19 F23 I24	I17-S21 WeakPolarHBondContact O-CB 3.44Å; I17-S21 PolarHBondContact O-N 3.35Å; I17-S21 PolarHBondContact O-OG 3.41Å; I17-S21 VanDerWaalsContact O-OG 3.12Å; F18-S21 VanDerWaalsContact CA-OG 3.28Å; F18-S21 WeakPolarHBondContact CA-OG 3.48Å; F18-S21 PolarHBondContact O-N 2.88Å; F18-S21 PolarHBondContact O-OG 3.23Å; M19-S21 PolarHBondContact O-N 2.94Å; S21-F23 PolarHBondContact O-N 3.43Å; S21-I24 CarbonylContact O-C 3.56Å; S21-I24 PolarHBondContact O-N 2.81Å; S21-I24 VanDerWaalsContact O-N 3.16Å
22	G	46.6	Very low	65.3	Low	54 Å²	54	89.1 Å²	89.1	56%	0.557	47%	0.47	S	S	*	.	H	α-helix	trans	-63.1	-30.1	173.4	0	0	0	0	0	112.7	F18 M19 I20	F18-G22 PolarHBondContact O-N 3.17Å; M19-G22 PolarHBondContact O-N 3.03Å; I20-G22 VanDerWaalsContact C-N 3.34Å
23	F	46.2	Very low	66.5	Low	170 Å²	170	89.7 Å²	89.7	75%	0.746	48%	0.475	S	S	*	.	H	α-helix	trans	-80	-13.6	175.5	-77.4	-69.1	0	0	0	114.2	M19 I20 S21	M19-F23 WeakPolarHBondContact O-CD2 3.26Å; M19-F23 PolarHBondContact O-N 3.28Å; M19-F23 VanDerWaalsContact O-N 3.16Å; I20-F23 PolarHBondContact O-N 2.92Å; S21-F23 PolarHBondContact O-N 3.43Å
24	I	53.6	Low	67.8	Low	115 Å²	115	92.4 Å²	92.4	59%	0.59	48%	0.483	S	S	*	.			trans	-123.2	71.8	-178.1	-49.8	174	0	0	0	108.7	I20 S21 C26	I20-I24 HydrophobicContact CG2-CD1 4.39Å; I20-I24 PolarHBondContact O-N 3.28Å; S21-I24 CarbonylContact O-C 3.56Å; S21-I24 PolarHBondContact O-N 2.81Å; S21-I24 VanDerWaalsContact O-N 3.16Å; I24-C26 HydrophobicContact CG2-CB 4.24Å; I24-C26 PolarHBondContact O-N 2.94Å
25	K	60.3	Low	69.3	Low	141 Å²	141	85.6 Å²	85.6	61%	0.613	46%	0.458	S	S	*	.			trans	-70.6	85.4	159.7	-76.9	-170.2	179.2	-174.3	0	108	N27	K25-N27 PolarHBondContact O-N 3.34Å
26	C	70.7	Confident	70.7	Confident	87 Å²	87	86.2 Å²	86.2	59%	0.588	45%	0.453	S	S	*	.			trans	-82.3	95.5	172.1	-167.2	0	0	0	0	108.4	I24	I24-C26 HydrophobicContact CG2-CB 4.24Å; I24-C26 PolarHBondContact O-N 2.94Å
27	N	81.6	Confident	71.9	Confident	37 Å²	37	89.6 Å²	89.6	20%	0.198	47%	0.472	C	S	.	.			trans	-68.8	136	174.4	-61.5	-48.4	0	0	0	109.2	K25 I29 C30 F174	K25-N27 PolarHBondContact O-N 3.34Å; N27-I29 HydrophobicContact CB-CG2 4Å; N27-I29 PolarHBondContact O-N 2.94Å; N27-C30 VanDerWaalsContact O-CB 3.27Å; N27-C30 WeakPolarHBondContact O-CB 3.3Å; N27-C30 PolarHBondContact O-N 2.84Å; N27-F174 HydrophobicContact CB-CD1 4Å; N27-F174 HydrophobicContact CB-CG 4.49Å; N27-F174 WeakPolarHBondContact ND2-CD1 3.1Å
28	E	85.8	Confident	73.4	Confident	82 Å²	82	89 Å²	89	38%	0.383	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-58.1	-36.6	-174.1	-168.2	178.3	177	0	0	112.1	C30 T31 K32 L35 Y54	E28-C30 PolarHBondContact O-N 2.81Å; E28-T31 PolarHBondContact O-N 3.18Å; E28-T31 PolarHBondContact O-OG1 2.95Å; E28-K32 HydrophobicContact CG-CD 4.09Å; E28-K32 PolarHBondContact O-N 3.41Å; E28-K32 WeakPolarHBondContact OE1-CE 3.5Å; E28-K32 IonicContact OE1-NZ 2.84Å; E28-K32 PolarHBondContact OE1-NZ 3.36Å; E28-L35 HydrophobicContact CB-CD1 4.06Å; E28-L35 HydrophobicContact CG-CD1 3.6Å; E28-Y54 HydrophobicContact CB-CE2 4.36Å
29	I	87.7	Confident	75.2	Confident	2 Å²	2	85.5 Å²	85.5	1%	0.01	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-54.7	-31.6	175.2	-164.1	165.7	0	0	0	113.5	N27 T31 K32 L35 K36 Y54 F174 A185	N27-I29 HydrophobicContact CB-CG2 4Å; N27-I29 PolarHBondContact O-N 2.94Å; I29-T31 PolarHBondContact O-N 3.23Å; I29-K32 CarbonylContact O-C 3.56Å; I29-K32 PolarHBondContact O-N 3.15Å; I29-L35 HydrophobicContact CG1-CB 4.39Å; I29-K36 HydrophobicContact CD1-CB 4.3Å; I29-Y54 HydrophobicContact CB-CE1 3.88Å; I29-Y54 HydrophobicContact CB-CE2 4.19Å; I29-Y54 HydrophobicContact CD1-CD1 4.08Å; I29-Y54 HydrophobicContact CD1-CE1 4.03Å; I29-Y54 HydrophobicContact CG2-CE1 4.13Å; I29-Y54 PolarHBondContact N-OH 3.11Å; I29-F174 HydrophobicContact CD1-CD2 4.34Å; I29-F174 HydrophobicContact CD1-CE2 4.45Å; I29-F174 HydrophobicContact CG2-CB 4Å; I29-F174 HydrophobicContact CG2-CD1 4.42Å; I29-F174 HydrophobicContact CG2-CD2 3.86Å; I29-F174 HydrophobicContact CG2-CE2 4.45Å; I29-F174 HydrophobicContact CG2-CG 3.83Å; I29-A185 HydrophobicContact CD1-CB 4.01Å
30	C	87.3	Confident	77.1	Confident	39 Å²	39	83.2 Å²	83.2	26%	0.264	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-67.1	-22.9	177.1	-61.8	0	0	0	0	113	N27 E28 C176	N27-C30 VanDerWaalsContact O-CB 3.27Å; N27-C30 WeakPolarHBondContact O-CB 3.3Å; N27-C30 PolarHBondContact O-N 2.84Å; E28-C30 PolarHBondContact O-N 2.81Å; C30-C176 WeakPolarHBondContact CA-SG 3.46Å; C30-C176 HydrophobicContact CB-CB 3.62Å; C30-C176 WeakPolarHBondContact CB-SG 3.43Å; C30-C176 VanDerWaalsContact SG-CA 3.52Å; C30-C176 WeakPolarHBondContact SG-CB 3.36Å; C30-C176 CovalentContact SG-SG 2.04Å; C30-C176 PolarHBondContact SG-SG 2.95Å
31	T	86.7	Confident	79.1	Confident	91 Å²	91	81.9 Å²	81.9	56%	0.558	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-16.1	179.8	61.8	0	0	0	0	113.2	E28 I29	E28-T31 PolarHBondContact O-N 3.18Å; E28-T31 PolarHBondContact O-OG1 2.95Å; I29-T31 PolarHBondContact O-N 3.23Å
32	K	88.7	Confident	81.1	Confident	82 Å²	82	79.4 Å²	79.4	36%	0.357	42%	0.42	S	S	.	.			trans	-134.2	82.3	-175	-68.4	-173.7	-171.7	170.6	0	110.2	E28 I29 E34 L35	E28-K32 HydrophobicContact CG-CD 4.09Å; E28-K32 PolarHBondContact O-N 3.41Å; E28-K32 WeakPolarHBondContact OE1-CE 3.5Å; E28-K32 IonicContact OE1-NZ 2.84Å; E28-K32 PolarHBondContact OE1-NZ 3.36Å; I29-K32 CarbonylContact O-C 3.56Å; I29-K32 PolarHBondContact O-N 3.15Å; K32-E34 WeakPolarHBondContact CA-OE2 3.37Å; K32-E34 WeakPolarHBondContact CB-OE1 3.26Å; K32-E34 PolarHBondContact O-N 3.39Å; K32-E34 VanDerWaalsContact O-N 3.09Å; K32-L35 HydrophobicContact CB-CD1 3.78Å; K32-L35 HydrophobicContact CB-CG 3.86Å; K32-L35 HydrophobicContact CD-CD1 4.14Å; K32-L35 WeakPolarHBondContact O-CB 3.41Å; K32-L35 PolarHBondContact O-N 3.5Å
33	P	84.3	Confident	83.4	Confident	86 Å²	86	77.6 Å²	77.6	56%	0.558	40%	0.397	S	S	*	.	G	3₁₀ helix	trans	-58.4	-24	-177.5	-24.6	34.5	0	0	0	113.7	L35 K36	P33-L35 PolarHBondContact O-N 2.84Å; P33-K36 VanDerWaalsContact O-CB 3.28Å; P33-K36 WeakPolarHBondContact O-CB 3.35Å; P33-K36 PolarHBondContact O-N 2.02Å
34	E	88.9	Confident	85.7	Confident	127 Å²	127	74 Å²	74	59%	0.593	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-61.2	-22.8	175.4	68.3	-85.2	-162.3	0	0	113.4	K32 K36	K32-E34 WeakPolarHBondContact CA-OE2 3.37Å; K32-E34 WeakPolarHBondContact CB-OE1 3.26Å; K32-E34 PolarHBondContact O-N 3.39Å; K32-E34 VanDerWaalsContact O-N 3.09Å; E34-K36 PolarHBondContact O-N 2.03Å
35	L	89.9	Confident	87.6	Confident	24 Å²	24	71.3 Å²	71.3	13%	0.126	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-68.7	-24	179	-66.3	-179.2	0	0	0	112.9	E28 I29 K32 P33 N37 Y38 Y54	E28-L35 HydrophobicContact CB-CD1 4.06Å; E28-L35 HydrophobicContact CG-CD1 3.6Å; I29-L35 HydrophobicContact CG1-CB 4.39Å; K32-L35 HydrophobicContact CB-CD1 3.78Å; K32-L35 HydrophobicContact CB-CG 3.86Å; K32-L35 HydrophobicContact CD-CD1 4.14Å; K32-L35 WeakPolarHBondContact O-CB 3.41Å; K32-L35 PolarHBondContact O-N 3.5Å; P33-L35 PolarHBondContact O-N 2.84Å; L35-N37 PolarHBondContact O-N 2.83Å; L35-Y38 WeakPolarHBondContact O-CB 2.98Å; L35-Y38 PolarHBondContact O-N 3.39Å; L35-Y38 VanDerWaalsContact O-N 3.11Å; L35-Y54 HydrophobicContact CB-CD2 3.71Å; L35-Y54 HydrophobicContact CB-CE2 4.17Å; L35-Y54 HydrophobicContact CB-CG 4.27Å; L35-Y54 HydrophobicContact CD1-CD2 3.86Å; L35-Y54 HydrophobicContact CD1-CE2 3.69Å; L35-Y54 HydrophobicContact CD2-CD2 4.43Å; L35-Y54 HydrophobicContact CG-CD2 4.21Å; L35-Y54 HydrophobicContact CG-CE2 4.49Å; L35-Y54 WeakPolarHBondContact O-CB 3.34Å
36	K	86.7	Confident	89.2	Confident	74 Å²	74	72 Å²	72	32%	0.322	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-54	-40.2	178.1	175.9	159.9	-166.9	169.2	0	113.7	I29 P33 E34 E183 W184	I29-K36 HydrophobicContact CD1-CB 4.3Å; P33-K36 VanDerWaalsContact O-CB 3.28Å; P33-K36 WeakPolarHBondContact O-CB 3.35Å; P33-K36 PolarHBondContact O-N 2.02Å; E34-K36 PolarHBondContact O-N 2.03Å; K36-E183 IonicContact NZ-OE2 3.06Å; K36-E183 PolarHBondContact NZ-OE2 2.73Å; K36-E183 VanDerWaalsContact NZ-OE2 3.17Å; K36-W184 WeakPolarHBondContact CE-O 3.32Å; K36-W184 VanDerWaalsContact CG-O 3.29Å; K36-W184 WeakPolarHBondContact CG-O 3.38Å
37	N	87	Confident	90.3	Very high	138 Å²	138	70.5 Å²	70.5	74%	0.738	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-112.1	19.4	-179.2	-60.8	-38.7	0	0	0	111.6	L35 T39	L35-N37 PolarHBondContact O-N 2.83Å; N37-T39 PolarHBondContact O-N 3.25Å
38	Y	92.6	Very high	90.9	Very high	83 Å²	83	71.7 Å²	71.7	33%	0.325	37%	0.372	S	S	.	.			trans	-67.2	118.9	-179.2	177.5	-94.7	0	0	0	109.5	L35 K40 H52 Y53	L35-Y38 WeakPolarHBondContact O-CB 2.98Å; L35-Y38 PolarHBondContact O-N 3.39Å; L35-Y38 VanDerWaalsContact O-N 3.11Å; Y38-K40 HydrophobicContact CE1-CB 4.47Å; Y38-H52 HydrophobicContact CE1-CB 4.03Å; Y38-Y53 WeakPolarHBondContact O-CA 3.02Å
39	T	94.8	Very high	91.4	Very high	82 Å²	82	68 Å²	68	50%	0.503	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	135.1	169.4	-179.8	0	0	0	0	108.9	N37 H52	N37-T39 PolarHBondContact O-N 3.25Å; T39-H52 CarbonylContact C-O 3.56Å; T39-H52 VanDerWaalsContact CA-O 3.27Å; T39-H52 WeakPolarHBondContact CA-O 3.09Å
40	K	94.8	Very high	91.8	Very high	75 Å²	75	67.9 Å²	67.9	33%	0.326	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	114.5	175	-177	159.5	162.6	-167.8	0	110.8	Y38 I42 S51 H52 S233 I235	Y38-K40 HydrophobicContact CE1-CB 4.47Å; K40-I42 HydrophobicContact CG-CD1 4.26Å; K40-I42 PolarHBondContact O-N 3.4Å; K40-S51 CarbonylContact O-C 3.54Å; K40-S51 VanDerWaalsContact O-CA 3.3Å; K40-S51 WeakPolarHBondContact O-CA 3.45Å; K40-H52 PolarHBondContact N-O 3.34Å; K40-H52 PolarHBondContact O-N 3.3Å; K40-S233 VanDerWaalsContact CE-O 3.28Å; K40-S233 WeakPolarHBondContact CE-O 3.21Å; K40-S233 PolarHBondContact NZ-O 3.29Å; K40-I235 HydrophobicContact CD-CD1 3.45Å; K40-I235 VanDerWaalsContact CD-CD1 3.45Å; K40-I235 HydrophobicContact CG-CD1 4.05Å
41	V	95.4	Very high	92.3	Very high	67 Å²	67	66 Å²	66	41%	0.406	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	123.8	170.9	-178.4	0	0	0	0	108.8	E44 E49	V41-E44 HydrophobicContact CG1-CB 4.01Å; V41-E49 HydrophobicContact CG1-CG 3.96Å; V41-E49 HydrophobicContact CG2-CG 4.49Å
42	I	94.4	Very high	92.7	Very high	11 Å²	11	61.8 Å²	61.8	6%	0.056	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	-51.6	-179.3	-53.6	-54.4	0	0	0	109.4	K40 Y50 C230 S233 I235	K40-I42 HydrophobicContact CG-CD1 4.26Å; K40-I42 PolarHBondContact O-N 3.4Å; I42-Y50 HydrophobicContact CB-CD1 3.85Å; I42-Y50 WeakPolarHBondContact CB-O 2.99Å; I42-Y50 HydrophobicContact CG1-CD1 3.89Å; I42-Y50 HydrophobicContact CG1-CE1 4.18Å; I42-Y50 HydrophobicContact CG2-CD1 4.17Å; I42-Y50 PolarHBondContact N-O 2.75Å; I42-C230 HydrophobicContact CG2-CB 3.72Å; I42-S233 WeakPolarHBondContact CG2-OG 3.1Å; I42-I235 HydrophobicContact CD1-CB 4.13Å; I42-I235 HydrophobicContact CD1-CD1 3.53Å; I42-I235 HydrophobicContact CD1-CG1 4.35Å; I42-I235 HydrophobicContact CD1-CG2 4Å
43	F	93.9	Very high	93	Very high	17 Å²	17	59 Å²	59	8%	0.075	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	151.5	174.4	58.8	-103.4	0	0	0	110.2	Y48 Y50 F247 G251	F43-Y48 HydrophobicContact CD2-CD2 4.05Å; F43-Y48 AromaticContact CD2-CE2 3.71Å; F43-Y48 HydrophobicContact CD2-CE2 3.71Å; F43-Y48 HydrophobicContact CE2-CD2 4.04Å; F43-Y48 AromaticContact CE2-CE2 3.91Å; F43-Y48 HydrophobicContact CE2-CE2 3.91Å; F43-Y50 HydrophobicContact CD1-CD1 4.2Å; F43-Y50 AromaticContact CE1-CD1 3.54Å; F43-Y50 HydrophobicContact CE1-CD1 3.54Å; F43-Y50 AromaticContact CE1-CG 3.87Å; F43-Y50 HydrophobicContact CE1-CG 3.87Å; F43-Y50 HydrophobicContact CE2-CG 4.35Å; F43-Y50 AromaticContact CZ-CD1 3.91Å; F43-Y50 HydrophobicContact CZ-CD1 3.91Å; F43-Y50 AromaticContact CZ-CG 3.74Å; F43-Y50 HydrophobicContact CZ-CG 3.74Å; F43-Y50 PolarHBondContact N-O 3.11Å; F43-Y50 PolarHBondContact O-N 2.98Å; F43-F247 HydrophobicContact CE2-CD1 4.36Å; F43-F247 AromaticContact CE2-CE1 3.49Å; F43-F247 HydrophobicContact CE2-CE1 3.49Å; F43-F247 VanDerWaalsContact CE2-CE1 3.49Å; F43-F247 AromaticContact CE2-CZ 3.99Å; F43-F247 HydrophobicContact CE2-CZ 3.99Å; F43-F247 HydrophobicContact CZ-CD1 4.23Å; F43-F247 AromaticContact CZ-CE1 3.75Å; F43-F247 HydrophobicContact CZ-CE1 3.75Å; F43-G251 WeakPolarHBondContact CD1-O 3.04Å
44	E	94.6	Very high	93.4	Very high	94 Å²	94	56.1 Å²	56.1	44%	0.439	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	147.6	-176.2	-175.5	-176.6	160.3	0	0	109.2	V41 Y48 E49 K192 W193	V41-E44 HydrophobicContact CG1-CB 4.01Å; E44-Y48 WeakPolarHBondContact CA-O 3.37Å; E44-E49 HydrophobicContact CB-CG 4.22Å; E44-E49 HydrophobicContact CG-CB 4.2Å; E44-E49 HydrophobicContact CG-CG 4.11Å; E44-K192 IonicContact OE1-NZ 2.64Å; E44-K192 PolarHBondContact OE1-NZ 3Å; E44-K192 IonicContact OE2-NZ 3.77Å; E44-K192 PolarHBondContact OE2-NZ 3.09Å; E44-K192 VanDerWaalsContact OE2-NZ 3.07Å; E44-W193 HydrophobicContact CG-CZ2 4.01Å
45	N	92.8	Very high	93.6	Very high	59 Å²	59	52 Å²	52	32%	0.316	26%	0.26	S	S	.	.			trans	-141.9	-165.5	161.9	76.7	-1.5	0	0	0	110.2	S47 Y48 W193	N45-S47 PolarHBondContact O-N 3.36Å; N45-S47 WeakPolarHBondContact OD1-CA 3.37Å; N45-S47 PolarHBondContact OD1-N 3.07Å; N45-Y48 HydrophobicContact CB-CE2 4.27Å; N45-Y48 VanDerWaalsContact CG-CZ 3.42Å; N45-Y48 PolarHBondContact N-O 3.24Å; N45-Y48 WeakPolarHBondContact ND2-CD1 3.39Å; N45-Y48 WeakPolarHBondContact ND2-CE1 3.29Å; N45-Y48 PolarHBondContact ND2-OH 3.26Å; N45-Y48 WeakPolarHBondContact OD1-CD1 3.41Å; N45-Y48 WeakPolarHBondContact OD1-CE1 3.49Å; N45-Y48 PolarHBondContact OD1-N 3.01Å; N45-W193 WeakPolarHBondContact O-CH2 3.11Å
46	D	93.9	Very high	93.8	Very high	155 Å²	155	50.9 Å²	50.9	83%	0.829	25%	0.254	S	S	*	.	S	Bend	trans	-68.6	-11.8	-178.5	-60.7	-22.8	0	0	0	114.8
47	S	94.7	Very high	94.2	Very high	55 Å²	55	47.5 Å²	47.5	39%	0.385	24%	0.24	S	C	.	.	S	Bend	trans	-126.3	-8.8	-172.7	-63	0	0	0	0	114.9	N45 L62	N45-S47 PolarHBondContact O-N 3.36Å; N45-S47 WeakPolarHBondContact OD1-CA 3.37Å; N45-S47 PolarHBondContact OD1-N 3.07Å; S47-L62 WeakPolarHBondContact O-CG 3.49Å; S47-L62 PolarHBondContact O-N 2.92Å
48	Y	94.2	Very high	94.7	Very high	62 Å²	62	40.9 Å²	40.9	24%	0.243	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	158.4	178.7	58.5	-110.2	0	0	0	113.2	F43 E44 N45 I60 F247	F43-Y48 HydrophobicContact CD2-CD2 4.05Å; F43-Y48 AromaticContact CD2-CE2 3.71Å; F43-Y48 HydrophobicContact CD2-CE2 3.71Å; F43-Y48 HydrophobicContact CE2-CD2 4.04Å; F43-Y48 AromaticContact CE2-CE2 3.91Å; F43-Y48 HydrophobicContact CE2-CE2 3.91Å; E44-Y48 WeakPolarHBondContact CA-O 3.37Å; N45-Y48 HydrophobicContact CB-CE2 4.27Å; N45-Y48 VanDerWaalsContact CG-CZ 3.42Å; N45-Y48 PolarHBondContact N-O 3.24Å; N45-Y48 WeakPolarHBondContact ND2-CD1 3.39Å; N45-Y48 WeakPolarHBondContact ND2-CE1 3.29Å; N45-Y48 PolarHBondContact ND2-OH 3.26Å; N45-Y48 WeakPolarHBondContact OD1-CD1 3.41Å; N45-Y48 WeakPolarHBondContact OD1-CE1 3.49Å; N45-Y48 PolarHBondContact OD1-N 3.01Å; Y48-I60 WeakPolarHBondContact CA-O 3.49Å; Y48-I60 WeakPolarHBondContact CB-O 3.47Å; Y48-F247 AromaticContact CD1-CE2 3.62Å; Y48-F247 HydrophobicContact CD1-CE2 3.62Å; Y48-F247 AromaticContact CD1-CZ 3.73Å; Y48-F247 HydrophobicContact CD1-CZ 3.73Å; Y48-F247 HydrophobicContact CD2-CE1 4.36Å; Y48-F247 HydrophobicContact CD2-CE2 4.18Å; Y48-F247 AromaticContact CD2-CZ 3.46Å; Y48-F247 HydrophobicContact CD2-CZ 3.46Å; Y48-F247 VanDerWaalsContact CD2-CZ 3.46Å; Y48-F247 AromaticContact CE1-CE2 3.88Å; Y48-F247 HydrophobicContact CE1-CE2 3.88Å; Y48-F247 HydrophobicContact CE1-CZ 4.13Å; Y48-F247 HydrophobicContact CE2-CE2 4.45Å; Y48-F247 AromaticContact CE2-CZ 3.93Å; Y48-F247 HydrophobicContact CE2-CZ 3.93Å; Y48-F247 AromaticContact CG-CE2 3.78Å; Y48-F247 HydrophobicContact CG-CE2 3.78Å; Y48-F247 AromaticContact CG-CZ 3.37Å; Y48-F247 HydrophobicContact CG-CZ 3.37Å
49	E	96.4	Very high	94.9	Very high	5 Å²	5	37 Å²	37	2%	0.023	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	138.1	171.6	-169.5	-175.4	106.6	0	0	109.3	V41 E44 S51 I60 K192 W193	V41-E49 HydrophobicContact CG1-CG 3.96Å; V41-E49 HydrophobicContact CG2-CG 4.49Å; E44-E49 HydrophobicContact CB-CG 4.22Å; E44-E49 HydrophobicContact CG-CB 4.2Å; E44-E49 HydrophobicContact CG-CG 4.11Å; E49-S51 PolarHBondContact OE1-OG 3.17Å; E49-I60 HydrophobicContact CB-CB 4.25Å; E49-I60 HydrophobicContact CB-CD1 4.35Å; E49-I60 PolarHBondContact N-O 3.34Å; E49-I60 VanDerWaalsContact N-O 3.12Å; E49-I60 PolarHBondContact O-N 2.83Å; E49-K192 WeakPolarHBondContact OE2-CE 3.06Å; E49-K192 IonicContact OE2-NZ 3.69Å; E49-K192 PolarHBondContact OE2-NZ 3.21Å; E49-W193 HydrophobicContact CB-CH2 4.47Å; E49-W193 HydrophobicContact CB-CZ2 3.62Å; E49-W193 HydrophobicContact CG-CZ2 4.5Å; E49-W193 PolarHBondContact OE2-NE1 3.29Å
50	Y	96.6	Very high	95	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121	166.6	-172.4	-117.4	0	0	0	109.7	I42 F43 H52 S57 Q58 L59 T237 K248	I42-Y50 HydrophobicContact CB-CD1 3.85Å; I42-Y50 WeakPolarHBondContact CB-O 2.99Å; I42-Y50 HydrophobicContact CG1-CD1 3.89Å; I42-Y50 HydrophobicContact CG1-CE1 4.18Å; I42-Y50 HydrophobicContact CG2-CD1 4.17Å; I42-Y50 PolarHBondContact N-O 2.75Å; F43-Y50 HydrophobicContact CD1-CD1 4.2Å; F43-Y50 AromaticContact CE1-CD1 3.54Å; F43-Y50 HydrophobicContact CE1-CD1 3.54Å; F43-Y50 AromaticContact CE1-CG 3.87Å; F43-Y50 HydrophobicContact CE1-CG 3.87Å; F43-Y50 HydrophobicContact CE2-CG 4.35Å; F43-Y50 AromaticContact CZ-CD1 3.91Å; F43-Y50 HydrophobicContact CZ-CD1 3.91Å; F43-Y50 AromaticContact CZ-CG 3.74Å; F43-Y50 HydrophobicContact CZ-CG 3.74Å; F43-Y50 PolarHBondContact N-O 3.11Å; F43-Y50 PolarHBondContact O-N 2.98Å; Y50-H52 AromaticContact CE1-CD2 3.86Å; Y50-H52 AromaticContact CE1-NE2 3.49Å; Y50-H52 WeakPolarHBondContact CE1-NE2 3.42Å; Y50-H52 AromaticContact CZ-NE2 3.73Å; Y50-H52 PolarHBondContact OH-NE2 3.36Å; Y50-S57 WeakPolarHBondContact OH-CB 3.28Å; Y50-S57 PolarHBondContact OH-OG 2.69Å; Y50-S57 VanDerWaalsContact OH-OG 3.07Å; Y50-Q58 WeakPolarHBondContact CA-O 3.48Å; Y50-Q58 VanDerWaalsContact CD2-O 3.23Å; Y50-Q58 WeakPolarHBondContact CD2-O 3.26Å; Y50-L59 HydrophobicContact CD2-CB 4.03Å; Y50-L59 HydrophobicContact CD2-CD1 4.33Å; Y50-L59 HydrophobicContact CE2-CB 4.46Å; Y50-T237 HydrophobicContact CE1-CG2 4.14Å; Y50-T237 PolarHBondContact OH-OG1 3.06Å; Y50-K248 HydrophobicContact CE2-CD 4.46Å
51	S	96.4	Very high	95.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	153.1	-176.3	41.9	0	0	0	0	112	K40 E49 S57 Q58	K40-S51 CarbonylContact O-C 3.54Å; K40-S51 VanDerWaalsContact O-CA 3.3Å; K40-S51 WeakPolarHBondContact O-CA 3.45Å; E49-S51 PolarHBondContact OE1-OG 3.17Å; S51-S57 CarbonylContact O-C 3.35Å; S51-S57 WeakPolarHBondContact O-CA 3.26Å; S51-Q58 PolarHBondContact N-O 3.25Å; S51-Q58 PolarHBondContact O-N 3.08Å; S51-Q58 PolarHBondContact OG-NE2 3.1Å; S51-Q58 VanDerWaalsContact OG-NE2 3.16Å
52	H	95.6	Very high	95.2	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.009	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.5	174.2	-75.3	-159.6	0	0	0	109.5	Y38 T39 K40 Y50 L205 I235 T237	Y38-H52 HydrophobicContact CE1-CB 4.03Å; T39-H52 CarbonylContact C-O 3.56Å; T39-H52 VanDerWaalsContact CA-O 3.27Å; T39-H52 WeakPolarHBondContact CA-O 3.09Å; K40-H52 PolarHBondContact N-O 3.34Å; K40-H52 PolarHBondContact O-N 3.3Å; Y50-H52 AromaticContact CE1-CD2 3.86Å; Y50-H52 AromaticContact CE1-NE2 3.49Å; Y50-H52 WeakPolarHBondContact CE1-NE2 3.42Å; Y50-H52 AromaticContact CZ-NE2 3.73Å; Y50-H52 PolarHBondContact OH-NE2 3.36Å; H52-L205 HydrophobicContact CB-CD1 4.38Å; H52-L205 VanDerWaalsContact CE1-CD2 3.42Å; H52-L205 WeakPolarHBondContact CE1-CD2 3.31Å; H52-I235 WeakPolarHBondContact CE1-CG2 3.41Å; H52-T237 PolarHBondContact CE1-OG1 3.3Å; H52-T237 VanDerWaalsContact CE1-OG1 3.27Å; H52-T237 WeakPolarHBondContact NE2-CB 3.45Å; H52-T237 PolarHBondContact NE2-OG1 3.16Å
53	Y	95.2	Very high	95.2	Very high	22 Å²	22	35.3 Å²	35.3	9%	0.086	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	177.1	170.4	-70	-107.1	0	0	0	108.8	Y38 Y55 Y56 Q58 V187 E188 L205	Y38-Y53 WeakPolarHBondContact O-CA 3.02Å; Y53-Y55 PolarHBondContact O-N 3.23Å; Y53-Y56 CarbonylContact C-O 3.53Å; Y53-Y56 WeakPolarHBondContact CA-O 3.12Å; Y53-Y56 PolarHBondContact N-O 2.84Å; Y53-Y56 VanDerWaalsContact O-O 3.1Å; Y53-Q58 HydrophobicContact CD2-CB 4.17Å; Y53-Q58 HydrophobicContact CE2-CB 3.89Å; Y53-Q58 PolarHBondContact OH-NE2 3.49Å; Y53-V187 HydrophobicContact CD1-CB 4.16Å; Y53-V187 HydrophobicContact CD1-CG1 3.89Å; Y53-V187 HydrophobicContact CD1-CG2 3.9Å; Y53-V187 HydrophobicContact CD2-CG1 4.02Å; Y53-V187 HydrophobicContact CE1-CB 4.45Å; Y53-V187 HydrophobicContact CE1-CG1 3.94Å; Y53-V187 HydrophobicContact CE2-CG1 4.11Å; Y53-V187 HydrophobicContact CG-CB 4.42Å; Y53-V187 HydrophobicContact CG-CG1 3.92Å; Y53-V187 HydrophobicContact CG-CG2 3.91Å; Y53-E188 PolarHBondContact OH-O 3.18Å; Y53-E188 VanDerWaalsContact OH-O 3.07Å; Y53-L205 WeakPolarHBondContact O-CD1 3.19Å
54	Y	93	Very high	95.3	Very high	27 Å²	27	37.6 Å²	37.6	11%	0.106	19%	0.187	C	C	.	.	S	Bend	trans	-61.9	128.2	167.4	179	-108.4	0	0	0	109.5	E28 I29 L35 Y56 F174 A185	E28-Y54 HydrophobicContact CB-CE2 4.36Å; I29-Y54 HydrophobicContact CB-CE1 3.88Å; I29-Y54 HydrophobicContact CB-CE2 4.19Å; I29-Y54 HydrophobicContact CD1-CD1 4.08Å; I29-Y54 HydrophobicContact CD1-CE1 4.03Å; I29-Y54 HydrophobicContact CG2-CE1 4.13Å; I29-Y54 PolarHBondContact N-OH 3.11Å; L35-Y54 HydrophobicContact CB-CD2 3.71Å; L35-Y54 HydrophobicContact CB-CE2 4.17Å; L35-Y54 HydrophobicContact CB-CG 4.27Å; L35-Y54 HydrophobicContact CD1-CD2 3.86Å; L35-Y54 HydrophobicContact CD1-CE2 3.69Å; L35-Y54 HydrophobicContact CD2-CD2 4.43Å; L35-Y54 HydrophobicContact CG-CD2 4.21Å; L35-Y54 HydrophobicContact CG-CE2 4.49Å; L35-Y54 WeakPolarHBondContact O-CB 3.34Å; Y54-Y56 PolarHBondContact O-N 2.67Å; Y54-F174 HydrophobicContact CD1-CE2 4.44Å; Y54-F174 HydrophobicContact CD1-CZ 4.4Å; Y54-F174 HydrophobicContact CE1-CE1 4.34Å; Y54-F174 AromaticContact CE1-CE2 3.91Å; Y54-F174 HydrophobicContact CE1-CE2 3.91Å; Y54-F174 AromaticContact CE1-CZ 3.69Å; Y54-F174 HydrophobicContact CE1-CZ 3.69Å; Y54-A185 HydrophobicContact CD1-CB 3.63Å; Y54-A185 HydrophobicContact CE1-CB 4.36Å
55	Y	92.4	Very high	95.3	Very high	40 Å²	40	37.8 Å²	37.8	16%	0.157	20%	0.198	C	C	.	.	S	Bend	trans	70.7	-35.5	178.9	-156.2	-83.5	0	0	0	116.6	Y53 Y91 D92 V204 L205	Y53-Y55 PolarHBondContact O-N 3.23Å; Y55-Y91 AromaticContact CD1-CD1 3.72Å; Y55-Y91 HydrophobicContact CD1-CD1 3.72Å; Y55-Y91 HydrophobicContact CD1-CE1 4.32Å; Y55-Y91 HydrophobicContact CD1-CG 4.4Å; Y55-Y91 HydrophobicContact CD2-CD1 4.12Å; Y55-Y91 HydrophobicContact CE1-CD1 4.49Å; Y55-Y91 AromaticContact CG-CD1 3.52Å; Y55-Y91 HydrophobicContact CG-CD1 3.52Å; Y55-Y91 HydrophobicContact CG-CE1 4.08Å; Y55-D92 HydrophobicContact CE2-CB 4.03Å; Y55-D92 WeakPolarHBondContact CE2-OD2 3.39Å; Y55-D92 VanDerWaalsContact CZ-N 3.29Å; Y55-D92 WeakPolarHBondContact OH-CA 3.48Å; Y55-D92 WeakPolarHBondContact OH-CB 3.07Å; Y55-D92 PolarHBondContact OH-N 3.04Å; Y55-D92 PolarHBondContact OH-OD1 3.04Å; Y55-D92 PolarHBondContact OH-OD2 3.46Å; Y55-V204 HydrophobicContact CD1-CG1 4.21Å; Y55-V204 HydrophobicContact CD1-CG2 4.49Å; Y55-V204 HydrophobicContact CE1-CB 4.33Å; Y55-V204 HydrophobicContact CE1-CG1 3.62Å; Y55-V204 HydrophobicContact CE1-CG2 3.88Å; Y55-L205 PolarHBondContact O-N 3.44Å
56	Y	95	Very high	95.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	150.6	-178.1	-68.8	-90.3	0	0	0	113.2	Y53 Y54 F90 Y91 F170 H202 E203 V204 L205	Y53-Y56 CarbonylContact C-O 3.53Å; Y53-Y56 WeakPolarHBondContact CA-O 3.12Å; Y53-Y56 PolarHBondContact N-O 2.84Å; Y53-Y56 VanDerWaalsContact O-O 3.1Å; Y54-Y56 PolarHBondContact O-N 2.67Å; Y56-F90 VanDerWaalsContact OH-CD2 3.24Å; Y56-F90 WeakPolarHBondContact OH-CD2 3.13Å; Y56-Y91 HydrophobicContact CD2-CD1 4.18Å; Y56-Y91 AromaticContact CD2-CE1 3.66Å; Y56-Y91 HydrophobicContact CD2-CE1 3.66Å; Y56-Y91 HydrophobicContact CD2-CE2 4.38Å; Y56-Y91 AromaticContact CD2-CZ 3.78Å; Y56-Y91 AromaticContact CE2-CD1 3.63Å; Y56-Y91 HydrophobicContact CE2-CD1 3.63Å; Y56-Y91 AromaticContact CE2-CD2 3.87Å; Y56-Y91 HydrophobicContact CE2-CD2 3.87Å; Y56-Y91 AromaticContact CE2-CE1 3.48Å; Y56-Y91 HydrophobicContact CE2-CE1 3.48Å; Y56-Y91 VanDerWaalsContact CE2-CE1 3.48Å; Y56-Y91 AromaticContact CE2-CE2 3.69Å; Y56-Y91 HydrophobicContact CE2-CE2 3.69Å; Y56-Y91 AromaticContact CE2-CG 3.87Å; Y56-Y91 HydrophobicContact CE2-CG 3.87Å; Y56-Y91 AromaticContact CE2-CZ 3.52Å; Y56-Y91 PolarHBondContact OH-N 3Å; Y56-F170 HydrophobicContact CD1-CZ 4.25Å; Y56-F170 AromaticContact CD2-CE2 3.57Å; Y56-F170 HydrophobicContact CD2-CE2 3.57Å; Y56-F170 AromaticContact CD2-CZ 3.83Å; Y56-F170 HydrophobicContact CD2-CZ 3.83Å; Y56-F170 HydrophobicContact CE1-CE2 4.5Å; Y56-F170 AromaticContact CE2-CE2 3.55Å; Y56-F170 HydrophobicContact CE2-CE2 3.55Å; Y56-F170 HydrophobicContact CE2-CZ 4.19Å; Y56-F170 HydrophobicContact CG-CE2 4.06Å; Y56-F170 AromaticContact CG-CZ 3.85Å; Y56-F170 HydrophobicContact CG-CZ 3.85Å; Y56-H202 HydrophobicContact CD1-CB 4.08Å; Y56-E203 CarbonylContact C-O 3.54Å; Y56-E203 WeakPolarHBondContact CA-O 3.4Å; Y56-V204 HydrophobicContact CD1-CG2 4.32Å; Y56-V204 HydrophobicContact CE1-CG2 3.84Å; Y56-L205 WeakPolarHBondContact O-CD1 3.44Å
57	S	95.5	Very high	94.9	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.021	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	152	157.7	62.1	0	0	0	0	109.5	Y50 S51 H202 E203	Y50-S57 WeakPolarHBondContact OH-CB 3.28Å; Y50-S57 PolarHBondContact OH-OG 2.69Å; Y50-S57 VanDerWaalsContact OH-OG 3.07Å; S51-S57 CarbonylContact O-C 3.35Å; S51-S57 WeakPolarHBondContact O-CA 3.26Å; S57-H202 CarbonylContact O-C 3.57Å; S57-H202 WeakPolarHBondContact O-CA 3.24Å; S57-E203 PolarHBondContact N-O 3.05Å; S57-E203 PolarHBondContact O-N 3.35Å; S57-E203 PolarHBondContact OG-O 2.89Å
58	Q	97.1	Very high	94.4	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.2	178.6	180	-178.4	-113.3	0	0	108.9	Y50 S51 Y53 I60 V200 E201 H202	Y50-Q58 WeakPolarHBondContact CA-O 3.48Å; Y50-Q58 VanDerWaalsContact CD2-O 3.23Å; Y50-Q58 WeakPolarHBondContact CD2-O 3.26Å; S51-Q58 PolarHBondContact N-O 3.25Å; S51-Q58 PolarHBondContact O-N 3.08Å; S51-Q58 PolarHBondContact OG-NE2 3.1Å; S51-Q58 VanDerWaalsContact OG-NE2 3.16Å; Y53-Q58 HydrophobicContact CD2-CB 4.17Å; Y53-Q58 HydrophobicContact CE2-CB 3.89Å; Y53-Q58 PolarHBondContact OH-NE2 3.49Å; Q58-I60 HydrophobicContact CG-CD1 4.3Å; Q58-I60 HydrophobicContact CG-CG1 3.92Å; Q58-V200 HydrophobicContact CG-CG1 3.66Å; Q58-E201 CarbonylContact C-O 3.53Å; Q58-E201 WeakPolarHBondContact CA-O 3.37Å; Q58-H202 WeakPolarHBondContact CG-NE2 3.09Å; Q58-H202 PolarHBondContact OE1-NE2 2.84Å
59	L	96.7	Very high	93.5	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	119.1	169.7	173.8	58	0	0	0	109.4	Y50 R61 V200 E201 N244 F247	Y50-L59 HydrophobicContact CD2-CB 4.03Å; Y50-L59 HydrophobicContact CD2-CD1 4.33Å; Y50-L59 HydrophobicContact CE2-CB 4.46Å; L59-R61 HydrophobicContact CD1-CG 4.17Å; L59-R61 HydrophobicContact CG-CG 4.19Å; L59-V200 CarbonylContact O-C 2.64Å; L59-V200 WeakPolarHBondContact O-CA 3.28Å; L59-E201 PolarHBondContact N-O 3.36Å; L59-E201 PolarHBondContact O-N 3.07Å; L59-N244 HydrophobicContact CD2-CB 3.87Å; L59-N244 WeakPolarHBondContact CD2-OD1 3.47Å; L59-F247 HydrophobicContact CD1-CD1 3.76Å; L59-F247 HydrophobicContact CD1-CE1 3.14Å; L59-F247 HydrophobicContact CD1-CZ 3.76Å; L59-F247 HydrophobicContact CD2-CD1 4.08Å; L59-F247 HydrophobicContact CD2-CE1 4.3Å; L59-F247 HydrophobicContact CG-CE1 4.36Å
60	I	97.6	Very high	92	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.7	176.9	-57.1	-179.2	0	0	0	108.8	Y48 E49 Q58 P190 W193 T198 V200	Y48-I60 WeakPolarHBondContact CA-O 3.49Å; Y48-I60 WeakPolarHBondContact CB-O 3.47Å; E49-I60 HydrophobicContact CB-CB 4.25Å; E49-I60 HydrophobicContact CB-CD1 4.35Å; E49-I60 PolarHBondContact N-O 3.34Å; E49-I60 VanDerWaalsContact N-O 3.12Å; E49-I60 PolarHBondContact O-N 2.83Å; Q58-I60 HydrophobicContact CG-CD1 4.3Å; Q58-I60 HydrophobicContact CG-CG1 3.92Å; I60-P190 HydrophobicContact CD1-CG 4.31Å; I60-W193 HydrophobicContact CB-CD2 4.41Å; I60-W193 HydrophobicContact CB-CG 4.47Å; I60-W193 HydrophobicContact CD1-CB 3.96Å; I60-W193 HydrophobicContact CD1-CD2 4.23Å; I60-W193 HydrophobicContact CD1-CG 3.57Å; I60-W193 HydrophobicContact CG2-CB 3.79Å; I60-W193 HydrophobicContact CG2-CD2 3.63Å; I60-W193 HydrophobicContact CG2-CE3 3.66Å; I60-W193 HydrophobicContact CG2-CG 3.69Å; I60-W193 HydrophobicContact CG2-CZ3 4.46Å; I60-T198 HydrophobicContact CG2-CG2 3.78Å; I60-V200 HydrophobicContact CG1-CB 4.49Å; I60-V200 HydrophobicContact CG1-CG1 3.95Å; I60-V200 HydrophobicContact CG1-CG2 4.08Å; I60-V200 HydrophobicContact CG2-CG2 4.27Å
61	R	96.6	Very high	90.3	Very high	42 Å²	42	44.5 Å²	44.5	16%	0.158	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	129.7	174.8	-63.8	-178.2	-71.9	173.7	-3	110.5	L59 Q64 T198 L199 E201 N244	L59-R61 HydrophobicContact CD1-CG 4.17Å; L59-R61 HydrophobicContact CG-CG 4.19Å; R61-Q64 HydrophobicContact CB-CG 3.7Å; R61-Q64 WeakPolarHBondContact O-CG 3.23Å; R61-T198 WeakPolarHBondContact O-CA 3.15Å; R61-L199 PolarHBondContact N-O 2.84Å; R61-L199 PolarHBondContact O-N 2.79Å; R61-E201 IonicContact CZ-OE2 3.03Å; R61-E201 IonicContact NE-OE2 2.61Å; R61-E201 IonicContact NH2-OE1 2.69Å; R61-E201 IonicContact NH2-OE2 2.73Å; R61-E201 PolarHBondContact NH2-OE2 3.38Å; R61-N244 VanDerWaalsContact CZ-OD1 3.28Å; R61-N244 PolarHBondContact NH1-OD1 3.49Å; R61-N244 PolarHBondContact NH2-OD1 2.89Å
62	L	96.6	Very high	89	Confident	20 Å²	20	49.4 Å²	49.4	11%	0.105	28%	0.279	C	S	.	.	S	Bend	trans	-82.4	163.3	173.2	-61.4	-171.7	0	0	0	112.1	S47 Q64 W193 Q195 T198	S47-L62 WeakPolarHBondContact O-CG 3.49Å; S47-L62 PolarHBondContact O-N 2.92Å; L62-Q64 PolarHBondContact O-N 2.64Å; L62-Q64 PolarHBondContact O-NE2 2.88Å; L62-W193 HydrophobicContact CD1-CE3 4.31Å; L62-W193 HydrophobicContact CD1-CZ3 3.91Å; L62-W193 HydrophobicContact CD2-CE3 3.76Å; L62-W193 HydrophobicContact CD2-CZ3 4.11Å; L62-W193 HydrophobicContact CG-CE3 4Å; L62-W193 HydrophobicContact CG-CZ3 3.81Å; L62-Q195 HydrophobicContact CD2-CG 4.07Å; L62-T198 HydrophobicContact CD2-CG2 4.06Å; L62-T198 WeakPolarHBondContact CD2-OG1 3.44Å
63	N	95.5	Very high	87.8	Confident	137 Å²	137	53.6 Å²	53.6	73%	0.733	30%	0.297	S	S	*	.	S	Bend	trans	55.6	34.8	173.5	-52.7	-54.5	0	0	0	113.8	G197	N63-G197 PolarHBondContact N-O 2.9Å
64	Q	95.4	Very high	86.6	Confident	64 Å²	64	60.9 Å²	60.9	30%	0.299	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-83.7	151.5	176.6	-59.8	-54.8	-67.6	0	0	110.5	R61 L62 Y153 G197 L199	R61-Q64 HydrophobicContact CB-CG 3.7Å; R61-Q64 WeakPolarHBondContact O-CG 3.23Å; L62-Q64 PolarHBondContact O-N 2.64Å; L62-Q64 PolarHBondContact O-NE2 2.88Å; Q64-Y153 HydrophobicContact CB-CE2 4.44Å; Q64-Y153 PolarHBondContact O-OH 2.96Å; Q64-G197 PolarHBondContact N-O 3.14Å; Q64-L199 HydrophobicContact CB-CB 3.77Å; Q64-L199 HydrophobicContact CB-CD2 4.46Å; Q64-L199 HydrophobicContact CG-CB 3.67Å; Q64-L199 HydrophobicContact CG-CD2 4.37Å
65	S	93.6	Very high	85.5	Confident	98 Å²	98	67.6 Å²	67.6	69%	0.685	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-76.9	154.8	168.7	-62.8	0	0	0	0	110.1
66	P	91	Very high	84.4	Confident	69 Å²	69	68.1 Å²	68.1	45%	0.448	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-55.4	129.3	175.1	-22.4	30.7	0	0	0	110.8	V68 Y153	P66-V68 PolarHBondContact O-N 3.12Å; P66-Y153 HydrophobicContact CB-CD1 4.27Å; P66-Y153 HydrophobicContact CB-CE1 3.72Å; P66-Y153 WeakPolarHBondContact CD-OH 3.47Å; P66-Y153 HydrophobicContact CG-CE1 3.72Å; P66-Y153 WeakPolarHBondContact CG-OH 3.36Å
67	P	87.8	Confident	83.3	Confident	52 Å²	52	73.3 Å²	73.3	34%	0.338	40%	0.397	S	S	.	.	S	Bend	trans	-68.4	-21.3	-178.7	26.5	-35.7	0	0	0	113.1	L143 Y153 L199	P67-L143 HydrophobicContact CB-CD1 3.87Å; P67-L143 HydrophobicContact CG-CD1 3.45Å; P67-L143 VanDerWaalsContact CG-CD1 3.45Å; P67-Y153 VanDerWaalsContact CD-CG 3.47Å; P67-Y153 HydrophobicContact CG-CG 4.28Å; P67-L199 HydrophobicContact CG-CD1 4.3Å
68	V	84.5	Confident	82.5	Confident	49 Å²	49	79.3 Å²	79.3	30%	0.297	43%	0.427	S	S	.	.	S	Bend	trans	-140.4	154.9	179.7	-65.2	0	0	0	0	110.4	P66 F73 T141 L143	P66-V68 PolarHBondContact O-N 3.12Å; V68-F73 HydrophobicContact CG2-CE2 3.88Å; V68-F73 HydrophobicContact CG2-CZ 3.6Å; V68-T141 HydrophobicContact CG2-CG2 4.12Å; V68-L143 HydrophobicContact CG1-CD1 4.41Å; V68-L143 HydrophobicContact CG1-CD2 4.13Å; V68-L143 HydrophobicContact CG2-CD2 4.03Å
69	S	74.6	Confident	82.1	Confident	73 Å²	73	83.2 Å²	83.2	51%	0.51	45%	0.448	S	S	.	.			trans	-74.1	139.4	174.6	55.1	0	0	0	0	111.5	D71 T72	S69-D71 PolarHBondContact O-N 2.79Å; S69-T72 PolarHBondContact O-OG1 3.28Å; S69-T72 PolarHBondContact OG-OG1 2.04Å
70	N	65.5	Low	81.8	Confident	71 Å²	71	85.4 Å²	85.4	38%	0.38	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-64.6	-22.7	179.6	-76.7	-16.6	0	0	0	114.3	T72	N70-T72 PolarHBondContact O-N 2.82Å; N70-T72 VanDerWaalsContact O-N 3.09Å
71	D	61.1	Low	81.5	Confident	164 Å²	164	88.7 Å²	88.7	88%	0.877	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-72	-3.5	-174	-62	-28.3	0	0	0	114.4	S69	S69-D71 PolarHBondContact O-N 2.79Å
72	T	68.3	Low	81.2	Confident	103 Å²	103	89.4 Å²	89.4	63%	0.632	49%	0.493	S	S	*	.	G	3₁₀ helix	trans	-96.4	-4.6	-177.2	28	0	0	0	0	115.2	S69 N70	S69-T72 PolarHBondContact O-OG1 3.28Å; S69-T72 PolarHBondContact OG-OG1 2.04Å; N70-T72 PolarHBondContact O-N 2.82Å; N70-T72 VanDerWaalsContact O-N 3.09Å
73	F	70.8	Confident	81	Confident	89 Å²	89	92.3 Å²	92.3	39%	0.39	52%	0.52	S	S	.	.	P	Polyproline II helix	trans	-90.7	133	-175.3	-64.7	-76.2	0	0	0	113.2	V68 T141	V68-F73 HydrophobicContact CG2-CE2 3.88Å; V68-F73 HydrophobicContact CG2-CZ 3.6Å; F73-T141 HydrophobicContact CE1-CG2 4.37Å; F73-T141 HydrophobicContact CE2-CG2 4.19Å; F73-T141 HydrophobicContact CZ-CG2 3.57Å
74	E	69.9	Low	80.6	Confident	176 Å²	176	87.1 Å²	87.1	82%	0.822	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-79.2	133.8	167.2	-67.9	-174.3	179.4	0	0	109.9	V76	E74-V76 PolarHBondContact O-N 2.78Å
75	K	70.2	Confident	80.2	Confident	168 Å²	168	89.2 Å²	89.2	73%	0.73	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-78.9	123.8	175.6	-165.5	-176.3	-177.1	-130.9	0	110	D77	K75-D77 WeakPolarHBondContact CE-OD1 3.22Å; K75-D77 VanDerWaalsContact NZ-CG 3.25Å; K75-D77 IonicContact NZ-OD1 3.74Å; K75-D77 PolarHBondContact NZ-OD1 2.91Å; K75-D77 IonicContact NZ-OD2 3.67Å; K75-D77 PolarHBondContact NZ-OD2 3.27Å
76	V	68.2	Low	79.9	Confident	50 Å²	50	88.6 Å²	88.6	30%	0.303	51%	0.507	S	S	.	.			trans	-112.3	104.8	179.8	179	0	0	0	0	108.5	E74 I78 V80 I100	E74-V76 PolarHBondContact O-N 2.78Å; V76-I78 WeakPolarHBondContact CG1-O 3.28Å; V76-V80 HydrophobicContact CG1-CG1 3.69Å; V76-V80 HydrophobicContact CG2-CG1 4.35Å; V76-I100 HydrophobicContact CG1-CG2 4.25Å
77	D	73.3	Confident	79.7	Confident	110 Å²	110	89.8 Å²	89.8	59%	0.588	51%	0.509	S	S	*	.			trans	-100.7	1.8	177.3	-69.6	-29.6	0	0	0	112.5	K75	K75-D77 WeakPolarHBondContact CE-OD1 3.22Å; K75-D77 VanDerWaalsContact NZ-CG 3.25Å; K75-D77 IonicContact NZ-OD1 3.74Å; K75-D77 PolarHBondContact NZ-OD1 2.91Å; K75-D77 IonicContact NZ-OD2 3.67Å; K75-D77 PolarHBondContact NZ-OD2 3.27Å
78	I	78.1	Confident	79.7	Confident	129 Å²	129	87.5 Å²	87.5	66%	0.662	49%	0.494	S	S	*	.	S	Bend	trans	-137.9	157.4	179.3	61.3	171.3	0	0	0	110.3	V76 V80	V76-I78 WeakPolarHBondContact CG1-O 3.28Å; I78-V80 PolarHBondContact O-N 3.07Å
79	D	88.4	Confident	80	Confident	81 Å²	81	89.3 Å²	89.3	43%	0.433	50%	0.498	S	S	.	.			trans	-60.3	130.2	173.1	-66.5	10.8	0	0	0	111.6	Y99 I100 E101 G102	D79-Y99 HydrophobicContact CB-CE1 4.18Å; D79-Y99 HydrophobicContact CB-CE2 4.25Å; D79-Y99 WeakPolarHBondContact CB-OH 3.16Å; D79-Y99 VanDerWaalsContact CG-OH 3.32Å; D79-Y99 PolarHBondContact OD2-OH 2.96Å; D79-I100 CarbonylContact C-O 3.57Å; D79-I100 VanDerWaalsContact CA-O 3.29Å; D79-I100 WeakPolarHBondContact CA-O 3.33Å; D79-E101 WeakPolarHBondContact OD1-CA 3.06Å; D79-G102 PolarHBondContact OD1-N 2.79Å
80	V	90.3	Very high	80.9	Confident	49 Å²	49	85.9 Å²	85.9	30%	0.297	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.6	-179.1	65.4	0	0	0	0	111.3	V76 I78 V82 Y99 I100	V76-V80 HydrophobicContact CG1-CG1 3.69Å; V76-V80 HydrophobicContact CG2-CG1 4.35Å; I78-V80 PolarHBondContact O-N 3.07Å; V80-V82 HydrophobicContact CG1-CG2 4.1Å; V80-V82 HydrophobicContact CG2-CG2 4.1Å; V80-Y99 CarbonylContact O-C 3.52Å; V80-Y99 WeakPolarHBondContact O-CA 3.31Å; V80-I100 HydrophobicContact CG1-CB 3.87Å; V80-I100 HydrophobicContact CG1-CD1 4.28Å; V80-I100 HydrophobicContact CG1-CG1 4.46Å; V80-I100 PolarHBondContact N-O 2.81Å; V80-I100 PolarHBondContact O-N 3.43Å
81	S	92.2	Very high	82.1	Confident	69 Å²	69	82.6 Å²	82.6	48%	0.483	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.2	168.6	-168.1	0	0	0	0	110.2	R97 L98	S81-R97 WeakPolarHBondContact OG-CD 3.27Å; S81-R97 WeakPolarHBondContact OG-CG 3.49Å; S81-L98 CarbonylContact C-O 3.58Å; S81-L98 VanDerWaalsContact CA-O 3.29Å; S81-L98 WeakPolarHBondContact CA-O 3.43Å; S81-L98 PolarHBondContact OG-O 2.66Å
82	V	89.5	Confident	83.3	Confident	56 Å²	56	79.6 Å²	79.6	34%	0.339	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.1	-176.2	-178.7	0	0	0	0	109	V80 P84 L98 I100	V80-V82 HydrophobicContact CG1-CG2 4.1Å; V80-V82 HydrophobicContact CG2-CG2 4.1Å; V82-P84 WeakPolarHBondContact O-CD 3.42Å; V82-L98 PolarHBondContact N-O 2.9Å; V82-L98 PolarHBondContact O-N 2.86Å; V82-I100 HydrophobicContact CG2-CD1 4.11Å
83	A	92	Very high	84.3	Confident	81 Å²	81	76.6 Å²	76.6	67%	0.669	42%	0.42	S	S	*	.			trans	-84.7	119.5	165	0	0	0	0	0	108.2
84	P	88.1	Confident	85.3	Confident	28 Å²	28	75.2 Å²	75.2	18%	0.182	42%	0.417	C	S	.	.			trans	-55.9	146.2	176.9	-27.8	37.7	0	0	0	112.5	V82 F86 I88 D96 L98	V82-P84 WeakPolarHBondContact O-CD 3.42Å; P84-F86 WeakPolarHBondContact CB-O 3.46Å; P84-F86 PolarHBondContact O-N 2.8Å; P84-I88 HydrophobicContact CB-CD1 3.77Å; P84-I88 HydrophobicContact CB-CG1 4.24Å; P84-I88 HydrophobicContact CG-CD1 3.65Å; P84-I88 HydrophobicContact CG-CG1 4.44Å; P84-D96 VanDerWaalsContact CD-O 3.24Å; P84-D96 WeakPolarHBondContact CD-O 3.41Å; P84-L98 HydrophobicContact CG-CD1 3.95Å; P84-L98 HydrophobicContact CG-CG 3.84Å
85	A	87	Confident	86.4	Confident	108 Å²	108	66.9 Å²	66.9	89%	0.893	38%	0.378	S	S	*	.	S	Bend	trans	-69.2	-12.8	175.9	0	0	0	0	0	113.4
86	F	87.1	Confident	87.4	Confident	85 Å²	85	63 Å²	63	37%	0.373	37%	0.365	S	S	.	.	S	Bend	trans	-145.3	157	-179.5	50.6	-97	0	0	0	109.6	P84 I88 P146	P84-F86 WeakPolarHBondContact CB-O 3.46Å; P84-F86 PolarHBondContact O-N 2.8Å; F86-I88 HydrophobicContact CD2-CG1 3.83Å; F86-I88 HydrophobicContact CE2-CD1 4.26Å; F86-I88 HydrophobicContact CE2-CG1 3.52Å; F86-I88 PolarHBondContact O-N 3.41Å; F86-P146 HydrophobicContact CB-CB 4.44Å; F86-P146 HydrophobicContact CB-CG 4.43Å; F86-P146 HydrophobicContact CD1-CG 4.06Å; F86-P146 VanDerWaalsContact CD2-CA 3.49Å; F86-P146 HydrophobicContact CD2-CB 3.6Å; F86-P146 HydrophobicContact CD2-CG 3.56Å; F86-P146 HydrophobicContact CE1-CG 4.17Å; F86-P146 HydrophobicContact CE2-CB 3.98Å; F86-P146 HydrophobicContact CE2-CG 3.65Å; F86-P146 HydrophobicContact CG-CB 4.07Å; F86-P146 HydrophobicContact CG-CG 3.76Å; F86-P146 HydrophobicContact CZ-CG 3.97Å
87	L	85.9	Confident	88.6	Confident	95 Å²	95	65.3 Å²	65.3	50%	0.497	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-68.7	120	175.8	-166.1	63.2	0	0	0	109.8	D94	L87-D94 HydrophobicContact CD1-CB 3.94Å; L87-D94 HydrophobicContact CD2-CB 4.36Å; L87-D94 WeakPolarHBondContact CD2-OD1 3.3Å; L87-D94 HydrophobicContact CG-CB 4.31Å; L87-D94 WeakPolarHBondContact CG-OD1 3.23Å
88	I	89.2	Confident	89.6	Confident	4 Å²	4	61 Å²	61	2%	0.021	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	125.7	177.9	-66.8	164.9	0	0	0	108.3	P84 F86 F90 V95 L98 I144	P84-I88 HydrophobicContact CB-CD1 3.77Å; P84-I88 HydrophobicContact CB-CG1 4.24Å; P84-I88 HydrophobicContact CG-CD1 3.65Å; P84-I88 HydrophobicContact CG-CG1 4.44Å; F86-I88 HydrophobicContact CD2-CG1 3.83Å; F86-I88 HydrophobicContact CE2-CD1 4.26Å; F86-I88 HydrophobicContact CE2-CG1 3.52Å; F86-I88 PolarHBondContact O-N 3.41Å; I88-F90 HydrophobicContact CG2-CB 4.45Å; I88-V95 HydrophobicContact CB-CB 4.01Å; I88-V95 HydrophobicContact CB-CG1 4.4Å; I88-V95 HydrophobicContact CG2-CB 4.25Å; I88-V95 PolarHBondContact O-N 3.33Å; I88-L98 HydrophobicContact CD1-CD1 4.15Å; I88-L98 HydrophobicContact CD1-CD2 4.4Å; I88-I144 HydrophobicContact CB-CG2 4.46Å; I88-I144 HydrophobicContact CD1-CG2 3.9Å; I88-I144 HydrophobicContact CG1-CG2 4.04Å; I88-I144 HydrophobicContact CG2-CG2 3.57Å
89	K	91	Very high	90.3	Very high	86 Å²	86	58.3 Å²	58.3	37%	0.374	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	116.8	169.5	-66.5	-67.5	-176.1	178.2	0	109.5	N93 D94 G148	K89-N93 WeakPolarHBondContact CA-O 3.22Å; K89-D94 WeakPolarHBondContact CD-OD1 3.35Å; K89-D94 WeakPolarHBondContact CE-OD1 3.28Å; K89-D94 IonicContact NZ-OD1 2.82Å; K89-D94 PolarHBondContact NZ-OD1 2.64Å; K89-D94 IonicContact NZ-OD2 3.07Å; K89-D94 PolarHBondContact NZ-OD2 3.09Å; K89-G148 WeakPolarHBondContact O-CA 3.39Å
90	F	92.4	Very high	90.3	Very high	1 Å²	1	56.4 Å²	56.4	0%	0.004	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	114.8	179.2	-175.9	-112.4	0	0	0	110.5	Y56 I88 D92 N93 V95 M108 V114 E115 I150 F170 S171	Y56-F90 VanDerWaalsContact OH-CD2 3.24Å; Y56-F90 WeakPolarHBondContact OH-CD2 3.13Å; I88-F90 HydrophobicContact CG2-CB 4.45Å; F90-D92 PolarHBondContact O-N 3.4Å; F90-N93 PolarHBondContact N-O 3.42Å; F90-N93 WeakPolarHBondContact O-CB 3.49Å; F90-N93 PolarHBondContact O-N 2.81Å; F90-V95 HydrophobicContact CB-CG2 3.75Å; F90-M108 HydrophobicContact CB-SD 4.02Å; F90-M108 HydrophobicContact CD1-SD 3.9Å; F90-M108 HydrophobicContact CD2-CE 4.36Å; F90-M108 HydrophobicContact CD2-SD 4.02Å; F90-M108 HydrophobicContact CE1-SD 4.36Å; F90-M108 HydrophobicContact CE2-CE 4.44Å; F90-M108 HydrophobicContact CE2-SD 4.46Å; F90-M108 HydrophobicContact CG-SD 3.71Å; F90-V114 HydrophobicContact CD1-CB 4.32Å; F90-V114 HydrophobicContact CD1-CG1 3.69Å; F90-V114 HydrophobicContact CE1-CG1 4.29Å; F90-E115 WeakPolarHBondContact CE1-O 3.24Å; F90-I150 HydrophobicContact CD2-CD1 3.69Å; F90-I150 HydrophobicContact CE2-CD1 3.45Å; F90-I150 VanDerWaalsContact CE2-CD1 3.45Å; F90-F170 AromaticContact CE2-CD2 3.69Å; F90-F170 HydrophobicContact CE2-CD2 3.69Å; F90-F170 HydrophobicContact CE2-CE2 4.27Å; F90-F170 AromaticContact CZ-CD2 3.97Å; F90-F170 HydrophobicContact CZ-CD2 3.97Å; F90-S171 VanDerWaalsContact CE1-O 3.31Å; F90-S171 WeakPolarHBondContact CE1-O 3.49Å; F90-S171 WeakPolarHBondContact CZ-O 3.29Å
91	Y	91.3	Very high	90.2	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.008	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.1	48	-174.2	-72.1	-75	0	0	0	112.9	Y55 Y56 N93 F170 G172 F174 A185	Y55-Y91 AromaticContact CD1-CD1 3.72Å; Y55-Y91 HydrophobicContact CD1-CD1 3.72Å; Y55-Y91 HydrophobicContact CD1-CE1 4.32Å; Y55-Y91 HydrophobicContact CD1-CG 4.4Å; Y55-Y91 HydrophobicContact CD2-CD1 4.12Å; Y55-Y91 HydrophobicContact CE1-CD1 4.49Å; Y55-Y91 AromaticContact CG-CD1 3.52Å; Y55-Y91 HydrophobicContact CG-CD1 3.52Å; Y55-Y91 HydrophobicContact CG-CE1 4.08Å; Y56-Y91 HydrophobicContact CD2-CD1 4.18Å; Y56-Y91 AromaticContact CD2-CE1 3.66Å; Y56-Y91 HydrophobicContact CD2-CE1 3.66Å; Y56-Y91 HydrophobicContact CD2-CE2 4.38Å; Y56-Y91 AromaticContact CD2-CZ 3.78Å; Y56-Y91 AromaticContact CE2-CD1 3.63Å; Y56-Y91 HydrophobicContact CE2-CD1 3.63Å; Y56-Y91 AromaticContact CE2-CD2 3.87Å; Y56-Y91 HydrophobicContact CE2-CD2 3.87Å; Y56-Y91 AromaticContact CE2-CE1 3.48Å; Y56-Y91 HydrophobicContact CE2-CE1 3.48Å; Y56-Y91 VanDerWaalsContact CE2-CE1 3.48Å; Y56-Y91 AromaticContact CE2-CE2 3.69Å; Y56-Y91 HydrophobicContact CE2-CE2 3.69Å; Y56-Y91 AromaticContact CE2-CG 3.87Å; Y56-Y91 HydrophobicContact CE2-CG 3.87Å; Y56-Y91 AromaticContact CE2-CZ 3.52Å; Y56-Y91 PolarHBondContact OH-N 3Å; Y91-N93 PolarHBondContact O-N 2.82Å; Y91-N93 VanDerWaalsContact O-N 3.14Å; Y91-N93 PolarHBondContact O-ND2 3.16Å; Y91-F170 AromaticContact CE2-CD2 3.92Å; Y91-F170 HydrophobicContact CE2-CD2 3.92Å; Y91-F170 AromaticContact CE2-CE2 3.9Å; Y91-F170 HydrophobicContact CE2-CE2 3.9Å; Y91-F170 AromaticContact CZ-CE2 3.93Å; Y91-G172 VanDerWaalsContact CD2-CA 3.46Å; Y91-G172 VanDerWaalsContact CE2-CA 3.45Å; Y91-G172 VanDerWaalsContact CE2-N 3.3Å; Y91-F174 HydrophobicContact CD1-CE1 4.36Å; Y91-F174 HydrophobicContact CD1-CE2 4.29Å; Y91-F174 AromaticContact CD1-CZ 3.48Å; Y91-F174 HydrophobicContact CD1-CZ 3.48Å; Y91-F174 VanDerWaalsContact CD1-CZ 3.48Å; Y91-F174 HydrophobicContact CE1-CZ 4.11Å; Y91-F174 HydrophobicContact CG-CE1 4.47Å; Y91-F174 AromaticContact CG-CZ 3.8Å; Y91-F174 HydrophobicContact CG-CZ 3.8Å; Y91-A185 HydrophobicContact CE1-CB 4.05Å; Y91-A185 PolarHBondContact OH-O 3.44Å
92	D	86.5	Confident	89.5	Confident	102 Å²	102	53.5 Å²	53.5	55%	0.545	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	63	11.3	-177.6	-91.8	-28.3	0	0	0	115.9	Y55 F90	Y55-D92 HydrophobicContact CE2-CB 4.03Å; Y55-D92 WeakPolarHBondContact CE2-OD2 3.39Å; Y55-D92 VanDerWaalsContact CZ-N 3.29Å; Y55-D92 WeakPolarHBondContact OH-CA 3.48Å; Y55-D92 WeakPolarHBondContact OH-CB 3.07Å; Y55-D92 PolarHBondContact OH-N 3.04Å; Y55-D92 PolarHBondContact OH-OD1 3.04Å; Y55-D92 PolarHBondContact OH-OD2 3.46Å; F90-D92 PolarHBondContact O-N 3.4Å
93	N	89.1	Confident	89	Confident	39 Å²	39	52 Å²	52	21%	0.209	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	144.9	171.6	-63.5	-75.5	0	0	0	111.4	K89 F90 Y91 V95 V114	K89-N93 WeakPolarHBondContact CA-O 3.22Å; F90-N93 PolarHBondContact N-O 3.42Å; F90-N93 WeakPolarHBondContact O-CB 3.49Å; F90-N93 PolarHBondContact O-N 2.81Å; Y91-N93 PolarHBondContact O-N 2.82Å; Y91-N93 VanDerWaalsContact O-N 3.14Å; Y91-N93 PolarHBondContact O-ND2 3.16Å; N93-V95 PolarHBondContact O-N 2.68Å; N93-V114 HydrophobicContact CB-CG1 3.65Å; N93-V114 HydrophobicContact CB-CG2 4.04Å; N93-V114 WeakPolarHBondContact ND2-CG1 3.14Å
94	D	91.3	Very high	88.4	Confident	61 Å²	61	49 Å²	49	33%	0.326	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	94.2	175	-84	-40.2	0	0	0	109.1	L87 K89 D96 S110	L87-D94 HydrophobicContact CD1-CB 3.94Å; L87-D94 HydrophobicContact CD2-CB 4.36Å; L87-D94 WeakPolarHBondContact CD2-OD1 3.3Å; L87-D94 HydrophobicContact CG-CB 4.31Å; L87-D94 WeakPolarHBondContact CG-OD1 3.23Å; K89-D94 WeakPolarHBondContact CD-OD1 3.35Å; K89-D94 WeakPolarHBondContact CE-OD1 3.28Å; K89-D94 IonicContact NZ-OD1 2.82Å; K89-D94 PolarHBondContact NZ-OD1 2.64Å; K89-D94 IonicContact NZ-OD2 3.07Å; K89-D94 PolarHBondContact NZ-OD2 3.09Å; D94-D96 PolarHBondContact O-N 2.89Å; D94-S110 WeakPolarHBondContact O-CB 3.42Å; D94-S110 PolarHBondContact O-OG 3.07Å
95	V	92.2	Very high	88.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	119.6	-178.8	169.5	0	0	0	0	109.2	I88 F90 N93 L98 M108 Y109 V114	I88-V95 HydrophobicContact CB-CB 4.01Å; I88-V95 HydrophobicContact CB-CG1 4.4Å; I88-V95 HydrophobicContact CG2-CB 4.25Å; I88-V95 PolarHBondContact O-N 3.33Å; F90-V95 HydrophobicContact CB-CG2 3.75Å; N93-V95 PolarHBondContact O-N 2.68Å; V95-L98 HydrophobicContact CG1-CD2 3.81Å; V95-M108 HydrophobicContact CB-CB 4.45Å; V95-M108 HydrophobicContact CG1-CB 3.77Å; V95-M108 HydrophobicContact CG1-CG 4.33Å; V95-M108 HydrophobicContact CG1-SD 4.31Å; V95-M108 HydrophobicContact CG2-CB 3.78Å; V95-M108 HydrophobicContact CG2-SD 4.12Å; V95-Y109 WeakPolarHBondContact CA-O 3.41Å; V95-V114 HydrophobicContact CG2-CG2 4.48Å
96	D	92.5	Very high	88.6	Confident	87 Å²	87	44.3 Å²	44.3	47%	0.465	23%	0.226	S	C	.	.			trans	-113.4	-11.3	-178.1	69.8	-3.2	0	0	0	113.1	P84 D94 Y109	P84-D96 VanDerWaalsContact CD-O 3.24Å; P84-D96 WeakPolarHBondContact CD-O 3.41Å; D94-D96 PolarHBondContact O-N 2.89Å; D96-Y109 PolarHBondContact N-O 2.92Å; D96-Y109 VanDerWaalsContact N-O 3.09Å
97	R	94.1	Very high	88.9	Confident	99 Å²	99	44.6 Å²	44.6	37%	0.374	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	130.4	-179.1	-179.6	175.7	67.8	-108.2	0.8	111.1	S81 Y109	S81-R97 WeakPolarHBondContact OG-CD 3.27Å; S81-R97 WeakPolarHBondContact OG-CG 3.49Å; R97-Y109 PolarHBondContact N-O 2.78Å; R97-Y109 PolarHBondContact O-N 3.31Å
98	L	92.7	Very high	89.3	Confident	19 Å²	19	40.1 Å²	40.1	10%	0.099	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	144.3	168.8	-57.9	175.5	0	0	0	109.2	S81 V82 P84 I88 V95 I106 R107 M108	S81-L98 CarbonylContact C-O 3.58Å; S81-L98 VanDerWaalsContact CA-O 3.29Å; S81-L98 WeakPolarHBondContact CA-O 3.43Å; S81-L98 PolarHBondContact OG-O 2.66Å; V82-L98 PolarHBondContact N-O 2.9Å; V82-L98 PolarHBondContact O-N 2.86Å; P84-L98 HydrophobicContact CG-CD1 3.95Å; P84-L98 HydrophobicContact CG-CG 3.84Å; I88-L98 HydrophobicContact CD1-CD1 4.15Å; I88-L98 HydrophobicContact CD1-CD2 4.4Å; V95-L98 HydrophobicContact CG1-CD2 3.81Å; L98-I106 HydrophobicContact CD2-CG2 4.16Å; L98-R107 CarbonylContact C-O 3.46Å; L98-R107 WeakPolarHBondContact CA-O 3.31Å; L98-M108 HydrophobicContact CD2-CB 4.19Å; L98-M108 HydrophobicContact CD2-CG 3.69Å; L98-M108 HydrophobicContact CD2-SD 4.23Å
99	Y	92.7	Very high	89.6	Confident	73 Å²	73	42.4 Å²	42.4	29%	0.286	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	110.5	168.1	-174.2	-96.8	0	0	0	107.7	D79 V80 E101 R107	D79-Y99 HydrophobicContact CB-CE1 4.18Å; D79-Y99 HydrophobicContact CB-CE2 4.25Å; D79-Y99 WeakPolarHBondContact CB-OH 3.16Å; D79-Y99 VanDerWaalsContact CG-OH 3.32Å; D79-Y99 PolarHBondContact OD2-OH 2.96Å; V80-Y99 CarbonylContact O-C 3.52Å; V80-Y99 WeakPolarHBondContact O-CA 3.31Å; Y99-E101 HydrophobicContact CD1-CG 4.11Å; Y99-E101 HydrophobicContact CE1-CG 3.95Å; Y99-R107 PolarHBondContact N-O 3.29Å; Y99-R107 PolarHBondContact O-N 3.44Å
100	I	89.4	Confident	89.6	Confident	41 Å²	41	39.3 Å²	39.3	21%	0.21	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	114.5	179.9	-55.6	170.2	0	0	0	105.9	V76 D79 V80 V82 T105	V76-I100 HydrophobicContact CG1-CG2 4.25Å; D79-I100 CarbonylContact C-O 3.57Å; D79-I100 VanDerWaalsContact CA-O 3.29Å; D79-I100 WeakPolarHBondContact CA-O 3.33Å; V80-I100 HydrophobicContact CG1-CB 3.87Å; V80-I100 HydrophobicContact CG1-CD1 4.28Å; V80-I100 HydrophobicContact CG1-CG1 4.46Å; V80-I100 PolarHBondContact N-O 2.81Å; V80-I100 PolarHBondContact O-N 3.43Å; V82-I100 HydrophobicContact CG2-CD1 4.11Å; I100-T105 WeakPolarHBondContact CA-O 3.28Å
101	E	87	Confident	89.3	Confident	34 Å²	34	49.1 Å²	49.1	16%	0.159	25%	0.245	C	C	.	.			trans	-70.1	153.8	173.4	-61.1	-164.4	127.3	0	0	110.2	D79 Y99 S103 G104 T105 R107	D79-E101 WeakPolarHBondContact OD1-CA 3.06Å; Y99-E101 HydrophobicContact CD1-CG 4.11Å; Y99-E101 HydrophobicContact CE1-CG 3.95Å; E101-S103 VanDerWaalsContact CB-OG 3.28Å; E101-S103 WeakPolarHBondContact CB-OG 3.44Å; E101-S103 PolarHBondContact O-N 3.15Å; E101-S103 PolarHBondContact OE2-OG 3.48Å; E101-G104 WeakPolarHBondContact O-CA 3.4Å; E101-G104 PolarHBondContact O-N 2.94Å; E101-T105 PolarHBondContact N-O 2.79Å; E101-T105 WeakPolarHBondContact OE2-CB 3.47Å; E101-T105 PolarHBondContact OE2-OG1 2.82Å; E101-R107 VanDerWaalsContact CD-CZ 3.43Å; E101-R107 IonicContact OE1-CZ 2.66Å; E101-R107 IonicContact OE1-NH1 2.81Å; E101-R107 PolarHBondContact OE1-NH1 3.33Å; E101-R107 IonicContact OE1-NH2 2.67Å; E101-R107 PolarHBondContact OE1-NH2 2.77Å; E101-R107 IonicContact OE2-CZ 3.07Å; E101-R107 IonicContact OE2-NH1 2.58Å; E101-R107 IonicContact OE2-NH2 3.98Å; E101-R107 PolarHBondContact OE2-NH2 3.42Å
102	G	78.1	Confident	89.2	Confident	22 Å²	22	50.4 Å²	50.4	23%	0.227	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-14.1	169.2	0	0	0	0	0	112.9	D79 G104 N128	D79-G102 PolarHBondContact OD1-N 2.79Å; G102-G104 VanDerWaalsContact C-N 3.33Å; G102-N128 PolarHBondContact O-OD1 3.08Å
103	S	78.6	Confident	89.4	Confident	25 Å²	25	50 Å²	50	18%	0.175	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	13.1	167.4	65.8	0	0	0	0	113.2	E101 T105 S127 N128	E101-S103 VanDerWaalsContact CB-OG 3.28Å; E101-S103 WeakPolarHBondContact CB-OG 3.44Å; E101-S103 PolarHBondContact O-N 3.15Å; E101-S103 PolarHBondContact OE2-OG 3.48Å; S103-T105 PolarHBondContact O-N 2.73Å; S103-T105 PolarHBondContact OG-OG1 3.28Å; S103-S127 VanDerWaalsContact C-C 3.43Å; S103-S127 CarbonylContact C-O 3.52Å; S103-S127 WeakPolarHBondContact CA-O 3.42Å; S103-S127 WeakPolarHBondContact CB-O 3.08Å; S103-S127 WeakPolarHBondContact CB-OG 3.39Å; S103-S127 CarbonylContact O-C 3.48Å; S103-S127 VanDerWaalsContact O-CA 3.23Å; S103-S127 WeakPolarHBondContact O-CA 3.36Å; S103-S127 WeakPolarHBondContact O-CB 3.42Å; S103-S127 PolarHBondContact O-OG 3Å; S103-S127 PolarHBondContact OG-OG 2.86Å; S103-S127 VanDerWaalsContact OG-OG 3.06Å; S103-N128 WeakPolarHBondContact CA-OD1 3.43Å; S103-N128 PolarHBondContact O-N 2.86Å; S103-N128 VanDerWaalsContact O-N 3.16Å
104	G	79.9	Confident	89.5	Confident	18 Å²	18	48.4 Å²	48.4	19%	0.186	25%	0.253	C	S	.	.	S	Bend	trans	65.1	1	179.8	0	0	0	0	0	116.5	E101 G102 I106	E101-G104 WeakPolarHBondContact O-CA 3.4Å; E101-G104 PolarHBondContact O-N 2.94Å; G102-G104 VanDerWaalsContact C-N 3.33Å; G104-I106 PolarHBondContact O-N 3.37Å
105	T	88.2	Confident	89.1	Confident	11 Å²	11	47.7 Å²	47.7	7%	0.067	25%	0.248	C	C	.	.			trans	-63.1	131.3	166.3	-53.6	0	0	0	0	108.9	I100 E101 S103 R107 V118 S127	I100-T105 WeakPolarHBondContact CA-O 3.28Å; E101-T105 PolarHBondContact N-O 2.79Å; E101-T105 WeakPolarHBondContact OE2-CB 3.47Å; E101-T105 PolarHBondContact OE2-OG1 2.82Å; S103-T105 PolarHBondContact O-N 2.73Å; S103-T105 PolarHBondContact OG-OG1 3.28Å; T105-R107 HydrophobicContact CG2-CG 4.29Å; T105-V118 HydrophobicContact CG2-CG2 4.09Å; T105-S127 PolarHBondContact OG1-OG 2.94Å
106	I	91.3	Very high	89.1	Confident	27 Å²	27	47.9 Å²	47.9	14%	0.138	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	115.6	176.8	-54.3	174.3	0	0	0	107.9	L98 G104 G116 I117	L98-I106 HydrophobicContact CD2-CG2 4.16Å; G104-I106 PolarHBondContact O-N 3.37Å; I106-G116 CarbonylContact O-C 3.56Å; I106-G116 VanDerWaalsContact O-CA 3.24Å; I106-G116 WeakPolarHBondContact O-CA 3.44Å; I106-I117 HydrophobicContact CB-CB 4.25Å; I106-I117 PolarHBondContact N-O 3.5Å; I106-I117 PolarHBondContact O-N 3.06Å
107	R	93.8	Very high	89.2	Confident	91 Å²	91	43.8 Å²	43.8	34%	0.343	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.7	171	-60.8	-161.2	-176.7	87.4	10.5	110.9	L98 Y99 E101 T105 Y109	L98-R107 CarbonylContact C-O 3.46Å; L98-R107 WeakPolarHBondContact CA-O 3.31Å; Y99-R107 PolarHBondContact N-O 3.29Å; Y99-R107 PolarHBondContact O-N 3.44Å; E101-R107 VanDerWaalsContact CD-CZ 3.43Å; E101-R107 IonicContact OE1-CZ 2.66Å; E101-R107 IonicContact OE1-NH1 2.81Å; E101-R107 PolarHBondContact OE1-NH1 3.33Å; E101-R107 IonicContact OE1-NH2 2.67Å; E101-R107 PolarHBondContact OE1-NH2 2.77Å; E101-R107 IonicContact OE2-CZ 3.07Å; E101-R107 IonicContact OE2-NH1 2.58Å; E101-R107 IonicContact OE2-NH2 3.98Å; E101-R107 PolarHBondContact OE2-NH2 3.42Å; T105-R107 HydrophobicContact CG2-CG 4.29Å; R107-Y109 HydrophobicContact CB-CE2 3.77Å
108	M	94.6	Very high	89	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	143.1	177.9	-46.8	-165	-173	0	0	111.4	F90 V95 L98 V114 E115 I117 I144	F90-M108 HydrophobicContact CB-SD 4.02Å; F90-M108 HydrophobicContact CD1-SD 3.9Å; F90-M108 HydrophobicContact CD2-CE 4.36Å; F90-M108 HydrophobicContact CD2-SD 4.02Å; F90-M108 HydrophobicContact CE1-SD 4.36Å; F90-M108 HydrophobicContact CE2-CE 4.44Å; F90-M108 HydrophobicContact CE2-SD 4.46Å; F90-M108 HydrophobicContact CG-SD 3.71Å; V95-M108 HydrophobicContact CB-CB 4.45Å; V95-M108 HydrophobicContact CG1-CB 3.77Å; V95-M108 HydrophobicContact CG1-CG 4.33Å; V95-M108 HydrophobicContact CG1-SD 4.31Å; V95-M108 HydrophobicContact CG2-CB 3.78Å; V95-M108 HydrophobicContact CG2-SD 4.12Å; L98-M108 HydrophobicContact CD2-CB 4.19Å; L98-M108 HydrophobicContact CD2-CG 3.69Å; L98-M108 HydrophobicContact CD2-SD 4.23Å; M108-V114 PolarHBondContact O-N 3.16Å; M108-E115 WeakPolarHBondContact CB-O 3.21Å; M108-E115 WeakPolarHBondContact CG-O 3.02Å; M108-I117 HydrophobicContact CE-CD1 3.93Å; M108-I117 HydrophobicContact CE-CG1 4Å; M108-I144 HydrophobicContact CE-CD1 3.44Å; M108-I144 VanDerWaalsContact CE-CD1 3.44Å; M108-I144 HydrophobicContact CE-CG1 4.12Å
109	Y	94.4	Very high	88.8	Confident	51 Å²	51	40.1 Å²	40.1	20%	0.2	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	148.2	179.3	-62.5	-95.3	0	0	0	110.7	V95 D96 R97 R107 G112 P113	V95-Y109 WeakPolarHBondContact CA-O 3.41Å; D96-Y109 PolarHBondContact N-O 2.92Å; D96-Y109 VanDerWaalsContact N-O 3.09Å; R97-Y109 PolarHBondContact N-O 2.78Å; R97-Y109 PolarHBondContact O-N 3.31Å; R107-Y109 HydrophobicContact CB-CE2 3.77Å; Y109-G112 WeakPolarHBondContact CA-O 3.33Å; Y109-P113 HydrophobicContact CD1-CB 4.36Å; Y109-P113 HydrophobicContact CD1-CG 4.38Å; Y109-P113 HydrophobicContact CE1-CB 4.17Å; Y109-P113 HydrophobicContact CE1-CG 4.08Å
110	S	91.6	Very high	88.3	Confident	22 Å²	22	37.9 Å²	37.9	15%	0.154	21%	0.209	C	C	.	.	S	Bend	trans	-130.3	-123.6	166.9	-173.2	0	0	0	0	106.7	D94 G112	D94-S110 WeakPolarHBondContact O-CB 3.42Å; D94-S110 PolarHBondContact O-OG 3.07Å; S110-G112 PolarHBondContact N-O 3.05Å; S110-G112 PolarHBondContact O-N 3.34Å
111	E	86.8	Confident	87.7	Confident	207 Å²	207	36 Å²	36	97%	0.967	20%	0.199	S	C	*	.	S	Bend	trans	-58.5	-27.1	169	-63.8	-174.1	178.1	0	0	113
112	G	87.9	Confident	86.9	Confident	29 Å²	29	40.1 Å²	40.1	30%	0.299	22%	0.216	S	C	.	.	S	Bend	trans	-148.9	-170.6	174.3	0	0	0	0	0	111.2	Y109 S110 V114	Y109-G112 WeakPolarHBondContact CA-O 3.33Å; S110-G112 PolarHBondContact N-O 3.05Å; S110-G112 PolarHBondContact O-N 3.34Å; G112-V114 PolarHBondContact O-N 3.23Å
113	P	90.5	Very high	86	Confident	93 Å²	93	43.8 Å²	43.8	60%	0.604	23%	0.228	S	C	*	.	B	Isolated β-bridge	trans	-59	132.6	169.4	-16.4	29.9	0	0	0	110.2	Y109 V173	Y109-P113 HydrophobicContact CD1-CB 4.36Å; Y109-P113 HydrophobicContact CD1-CG 4.38Å; Y109-P113 HydrophobicContact CE1-CB 4.17Å; Y109-P113 HydrophobicContact CE1-CG 4.08Å; P113-V173 WeakPolarHBondContact O-CG1 3.27Å
114	V	91	Very high	85	Confident	5 Å²	5	46 Å²	46	3%	0.03	23%	0.234	C	C	.	.			trans	-110.1	-12.4	174.6	-165.5	0	0	0	0	111.4	F90 N93 V95 M108 G112 G172 V173	F90-V114 HydrophobicContact CD1-CB 4.32Å; F90-V114 HydrophobicContact CD1-CG1 3.69Å; F90-V114 HydrophobicContact CE1-CG1 4.29Å; N93-V114 HydrophobicContact CB-CG1 3.65Å; N93-V114 HydrophobicContact CB-CG2 4.04Å; N93-V114 WeakPolarHBondContact ND2-CG1 3.14Å; V95-V114 HydrophobicContact CG2-CG2 4.48Å; M108-V114 PolarHBondContact O-N 3.16Å; G112-V114 PolarHBondContact O-N 3.23Å; V114-G172 WeakPolarHBondContact O-CA 3.39Å; V114-V173 PolarHBondContact O-N 2.92Å
115	E	83.5	Confident	83.9	Confident	47 Å²	47	51.4 Å²	51.4	22%	0.22	26%	0.259	C	S	.	.			trans	74.6	169.8	-170.1	-164.4	-179.7	-159.9	0	0	113	F90 M108 S171 G172 W184	F90-E115 WeakPolarHBondContact CE1-O 3.24Å; M108-E115 WeakPolarHBondContact CB-O 3.21Å; M108-E115 WeakPolarHBondContact CG-O 3.02Å; E115-S171 CarbonylContact C-O 3.55Å; E115-S171 WeakPolarHBondContact CB-O 3.18Å; E115-S171 VanDerWaalsContact CD-C 3.46Å; E115-S171 VanDerWaalsContact CG-O 3.24Å; E115-S171 WeakPolarHBondContact CG-O 3.41Å; E115-S171 WeakPolarHBondContact CG-OG 3.22Å; E115-S171 WeakPolarHBondContact OE1-CB 3.1Å; E115-S171 PolarHBondContact OE1-OG 2.95Å; E115-S171 WeakPolarHBondContact OE2-CB 3.34Å; E115-S171 PolarHBondContact OE2-OG 3.17Å; E115-G172 PolarHBondContact OE2-N 3.29Å; E115-W184 HydrophobicContact CG-CZ3 4.19Å; E115-W184 VanDerWaalsContact OE1-CE3 3.3Å; E115-W184 VanDerWaalsContact OE1-CZ3 3.32Å; E115-W184 WeakPolarHBondContact OE1-CZ3 3.24Å; E115-W184 WeakPolarHBondContact OE2-CZ3 3.4Å
116	G	93.1	Very high	82.2	Confident	3 Å²	3	53.2 Å²	53.2	3%	0.031	27%	0.27	C	S	.	.			trans	-158	-139.3	-165.5	0	0	0	0	0	113.6	I106 F170 S171	I106-G116 CarbonylContact O-C 3.56Å; I106-G116 VanDerWaalsContact O-CA 3.24Å; I106-G116 WeakPolarHBondContact O-CA 3.44Å; G116-F170 WeakPolarHBondContact O-CA 3.38Å; G116-F170 VanDerWaalsContact O-CB 3.27Å; G116-F170 WeakPolarHBondContact O-CB 3.28Å; G116-S171 PolarHBondContact N-O 2.85Å; G116-S171 PolarHBondContact O-N 2.91Å
117	I	93	Very high	80.5	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.9	-165	-58.6	174.6	0	0	0	110.3	I106 M108 I144 I150 F152 F170	I106-I117 HydrophobicContact CB-CB 4.25Å; I106-I117 PolarHBondContact N-O 3.5Å; I106-I117 PolarHBondContact O-N 3.06Å; M108-I117 HydrophobicContact CE-CD1 3.93Å; M108-I117 HydrophobicContact CE-CG1 4Å; I117-I144 HydrophobicContact CD1-CD1 3.88Å; I117-I144 HydrophobicContact CD1-CG1 3.77Å; I117-I150 HydrophobicContact CD1-CG2 3.9Å; I117-F152 HydrophobicContact CG2-CE1 3.44Å; I117-F152 VanDerWaalsContact CG2-CE1 3.44Å; I117-F152 HydrophobicContact CG2-CZ 3.72Å; I117-F170 HydrophobicContact CG1-CB 3.93Å
118	V	91.4	Very high	78.6	Confident	33 Å²	33	50.7 Å²	50.7	20%	0.2	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	127	175.9	-176	0	0	0	0	109.2	T105 F120 Y167 S168 L169	T105-V118 HydrophobicContact CG2-CG2 4.09Å; V118-F120 HydrophobicContact CG1-CB 4.32Å; V118-Y167 HydrophobicContact CG1-CE2 3.93Å; V118-S168 WeakPolarHBondContact O-CA 3.29Å; V118-L169 HydrophobicContact CB-CD1 4Å; V118-L169 HydrophobicContact CB-CG 4.24Å; V118-L169 HydrophobicContact CG2-CD1 4.13Å; V118-L169 PolarHBondContact N-O 3.42Å; V118-L169 PolarHBondContact O-N 3.3Å
119	N	87.2	Confident	76.8	Confident	8 Å²	8	54.7 Å²	54.7	4%	0.043	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.5	164.2	-65.3	-67.1	0	0	0	107.4	S127 F138 V140 S142 F152 S168	N119-S127 WeakPolarHBondContact O-CA 3.49Å; N119-S127 WeakPolarHBondContact O-CB 3.16Å; N119-F138 HydrophobicContact CB-CE1 4.34Å; N119-V140 HydrophobicContact CB-CG1 3.61Å; N119-V140 VanDerWaalsContact CG-CG1 3.46Å; N119-S142 PolarHBondContact ND2-OG 2.82Å; N119-F152 WeakPolarHBondContact OD1-CD1 3.24Å; N119-S168 VanDerWaalsContact OD1-CB 3.25Å; N119-S168 WeakPolarHBondContact OD1-CB 3.32Å; N119-S168 PolarHBondContact OD1-OG 2.93Å
120	F	82.8	Confident	75	Confident	27 Å²	27	57.7 Å²	57.7	12%	0.118	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	142	-170	-177.9	-94	0	0	0	112.1	V118 K122 D125 V166 Y167	V118-F120 HydrophobicContact CG1-CB 4.32Å; F120-K122 HydrophobicContact CD1-CB 4.44Å; F120-K122 HydrophobicContact CE1-CB 3.78Å; F120-K122 HydrophobicContact CE1-CG 4.31Å; F120-D125 WeakPolarHBondContact CE2-OD1 3.34Å; F120-D125 VanDerWaalsContact CZ-OD1 3.31Å; F120-D125 WeakPolarHBondContact CZ-OD1 3.42Å; F120-V166 WeakPolarHBondContact O-CA 3.12Å; F120-Y167 HydrophobicContact CB-CD1 3.98Å; F120-Y167 HydrophobicContact CB-CD2 3.98Å; F120-Y167 HydrophobicContact CB-CE1 3.5Å; F120-Y167 HydrophobicContact CB-CE2 3.48Å; F120-Y167 VanDerWaalsContact CB-CE2 3.48Å; F120-Y167 HydrophobicContact CB-CG 4.2Å; F120-Y167 WeakPolarHBondContact CB-OH 3.47Å; F120-Y167 AromaticContact CD1-CD1 3.74Å; F120-Y167 HydrophobicContact CD1-CD1 3.74Å; F120-Y167 AromaticContact CD1-CE1 3.02Å; F120-Y167 HydrophobicContact CD1-CE1 3.02Å; F120-Y167 AromaticContact CD1-CZ 3.51Å; F120-Y167 HydrophobicContact CD2-CE1 4.46Å; F120-Y167 AromaticContact CE1-CE1 3.73Å; F120-Y167 HydrophobicContact CE1-CE1 3.73Å; F120-Y167 HydrophobicContact CG-CD1 4.24Å; F120-Y167 AromaticContact CG-CE1 3.44Å; F120-Y167 HydrophobicContact CG-CE1 3.44Å; F120-Y167 VanDerWaalsContact CG-CE1 3.44Å; F120-Y167 HydrophobicContact CG-CE2 4.17Å; F120-Y167 AromaticContact CG-CZ 3.36Å; F120-Y167 WeakPolarHBondContact CG-OH 3.42Å; F120-Y167 PolarHBondContact N-O 2.64Å; F120-Y167 PolarHBondContact O-N 2.88Å; F120-Y167 VanDerWaalsContact O-N 3.17Å
121	L	76.2	Confident	73.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113.5	170.4	177	61.5	0	0	0	109.7	E123 F124 D125 V126 I131 F138 F161 D165 V166	L121-E123 VanDerWaalsContact C-N 3.35Å; L121-E123 PolarHBondContact O-N 3.15Å; L121-F124 HydrophobicContact CD2-CD2 3.62Å; L121-F124 HydrophobicContact CD2-CE2 3.81Å; L121-F124 HydrophobicContact CG-CD2 4.07Å; L121-F124 PolarHBondContact O-N 3.48Å; L121-D125 PolarHBondContact O-N 2.76Å; L121-V126 PolarHBondContact N-O 3.39Å; L121-I131 HydrophobicContact CB-CD1 3.59Å; L121-I131 HydrophobicContact CD2-CB 4.01Å; L121-I131 HydrophobicContact CD2-CD1 3.77Å; L121-I131 HydrophobicContact CD2-CG2 3.78Å; L121-I131 HydrophobicContact CG-CD1 4.27Å; L121-F138 HydrophobicContact CB-CD1 4.27Å; L121-F138 HydrophobicContact CD2-CB 4.06Å; L121-F161 HydrophobicContact CD1-CD1 3.96Å; L121-F161 HydrophobicContact CD1-CE1 3.37Å; L121-F161 HydrophobicContact CD1-CZ 3.85Å; L121-F161 HydrophobicContact CD2-CE1 4.36Å; L121-F161 HydrophobicContact CD2-CZ 4.38Å; L121-D165 CarbonylContact C-O 3.56Å; L121-D165 WeakPolarHBondContact CA-O 3.34Å; L121-V166 HydrophobicContact CD1-CG1 3.52Å
122	K	70	Confident	71.6	Confident	121 Å²	121	51.4 Å²	51.4	53%	0.526	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-34.8	-172.9	-172.8	178.6	177	-177.2	0	114.3	F120 F124 D125 D164 D165	F120-K122 HydrophobicContact CD1-CB 4.44Å; F120-K122 HydrophobicContact CE1-CB 3.78Å; F120-K122 HydrophobicContact CE1-CG 4.31Å; K122-F124 PolarHBondContact O-N 3.09Å; K122-D125 PolarHBondContact O-N 2.81Å; K122-D125 VanDerWaalsContact O-N 3.16Å; K122-D164 VanDerWaalsContact CD-O 3.29Å; K122-D164 WeakPolarHBondContact CD-O 3.45Å; K122-D165 WeakPolarHBondContact CB-O 3.22Å; K122-D165 PolarHBondContact N-O 3.21Å
123	E	60.5	Low	69.4	Low	100 Å²	100	54.8 Å²	54.8	47%	0.467	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-29.4	-176.3	-174.2	170.6	-169.8	0	0	112.2	L121 F136	L121-E123 VanDerWaalsContact C-N 3.35Å; L121-E123 PolarHBondContact O-N 3.15Å; E123-F136 WeakPolarHBondContact OE1-CE2 3.49Å; E123-F136 WeakPolarHBondContact OE2-CD2 3.4Å; E123-F136 WeakPolarHBondContact OE2-CE2 3.3Å; E123-F136 WeakPolarHBondContact OE2-CG 3.42Å
124	F	56.6	Low	67.6	Low	70 Å²	70	54.9 Å²	54.9	31%	0.307	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-9.4	-178.4	-56.7	-76.9	0	0	0	113.7	L121 K122 V126 I131 N133	L121-F124 HydrophobicContact CD2-CD2 3.62Å; L121-F124 HydrophobicContact CD2-CE2 3.81Å; L121-F124 HydrophobicContact CG-CD2 4.07Å; L121-F124 PolarHBondContact O-N 3.48Å; K122-F124 PolarHBondContact O-N 3.09Å; F124-V126 HydrophobicContact CB-CB 4.26Å; F124-V126 HydrophobicContact CB-CG2 3.47Å; F124-V126 VanDerWaalsContact CB-CG2 3.47Å; F124-V126 WeakPolarHBondContact O-CG2 3.42Å; F124-V126 PolarHBondContact O-N 2.78Å; F124-I131 HydrophobicContact CD2-CG2 3.78Å; F124-I131 HydrophobicContact CE2-CG2 3.83Å; F124-N133 HydrophobicContact CZ-CB 4.03Å
125	D	56.9	Low	66.1	Low	133 Å²	133	58.3 Å²	58.3	71%	0.711	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	37	-167	-157.6	20	0	0	0	111.5	F120 L121 K122	F120-D125 WeakPolarHBondContact CE2-OD1 3.34Å; F120-D125 VanDerWaalsContact CZ-OD1 3.31Å; F120-D125 WeakPolarHBondContact CZ-OD1 3.42Å; L121-D125 PolarHBondContact O-N 2.76Å; K122-D125 PolarHBondContact O-N 2.81Å; K122-D125 VanDerWaalsContact O-N 3.16Å
126	V	52.7	Low	65.3	Low	49 Å²	49	58.2 Å²	58.2	30%	0.297	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-128.5	126.3	-179	-144.4	0	0	0	0	107.4	L121 F124 N128	L121-V126 PolarHBondContact N-O 3.39Å; F124-V126 HydrophobicContact CB-CB 4.26Å; F124-V126 HydrophobicContact CB-CG2 3.47Å; F124-V126 VanDerWaalsContact CB-CG2 3.47Å; F124-V126 WeakPolarHBondContact O-CG2 3.42Å; F124-V126 PolarHBondContact O-N 2.78Å; V126-N128 WeakPolarHBondContact CG1-ND2 3.49Å
127	S	56.6	Low	64.7	Low	12 Å²	12	59.3 Å²	59.3	8%	0.084	34%	0.337	C	S	.	.			trans	-72.7	139.5	152.5	38.8	0	0	0	0	106.6	S103 T105 N119	S103-S127 VanDerWaalsContact C-C 3.43Å; S103-S127 CarbonylContact C-O 3.52Å; S103-S127 WeakPolarHBondContact CA-O 3.42Å; S103-S127 WeakPolarHBondContact CB-O 3.08Å; S103-S127 WeakPolarHBondContact CB-OG 3.39Å; S103-S127 CarbonylContact O-C 3.48Å; S103-S127 VanDerWaalsContact O-CA 3.23Å; S103-S127 WeakPolarHBondContact O-CA 3.36Å; S103-S127 WeakPolarHBondContact O-CB 3.42Å; S103-S127 PolarHBondContact O-OG 3Å; S103-S127 PolarHBondContact OG-OG 2.86Å; S103-S127 VanDerWaalsContact OG-OG 3.06Å; T105-S127 PolarHBondContact OG1-OG 2.94Å; N119-S127 WeakPolarHBondContact O-CA 3.49Å; N119-S127 WeakPolarHBondContact O-CB 3.16Å
128	N	52.7	Low	64.3	Low	53 Å²	53	59.3 Å²	59.3	28%	0.283	34%	0.337	S	S	.	.			trans	-163.4	145.9	170.9	-95.8	-29.5	0	0	0	107.5	G102 S103 V126 E130 I131	G102-N128 PolarHBondContact O-OD1 3.08Å; S103-N128 WeakPolarHBondContact CA-OD1 3.43Å; S103-N128 PolarHBondContact O-N 2.86Å; S103-N128 VanDerWaalsContact O-N 3.16Å; V126-N128 WeakPolarHBondContact CG1-ND2 3.49Å; N128-E130 PolarHBondContact O-N 3.05Å; N128-I131 HydrophobicContact CB-CD1 3.84Å; N128-I131 HydrophobicContact CB-CG1 3.38Å
129	L	57.4	Low	64.1	Low	85 Å²	85	59.7 Å²	59.7	45%	0.445	34%	0.336	S	S	.	.	S	Bend	trans	-65.5	-29.1	-177.7	-169.1	70.9	0	0	0	112.5	V140	L129-V140 WeakPolarHBondContact CD1-O 3.46Å
130	E	56.6	Low	64.2	Low	113 Å²	113	59.3 Å²	59.3	53%	0.528	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	112	175.2	-174.8	168.2	-140.2	0	0	108.5	N128 K139	N128-E130 PolarHBondContact O-N 3.05Å; E130-K139 HydrophobicContact CG-CD 4.46Å; E130-K139 HydrophobicContact CG-CG 4.45Å; E130-K139 IonicContact OE1-NZ 3.83Å; E130-K139 PolarHBondContact OE1-NZ 2.87Å
131	I	54.6	Low	64.5	Low	15 Å²	15	58.4 Å²	58.4	8%	0.077	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	111.2	171.7	-55.4	168.2	0	0	0	107.2	L121 F124 N128 T137 F138	L121-I131 HydrophobicContact CB-CD1 3.59Å; L121-I131 HydrophobicContact CD2-CB 4.01Å; L121-I131 HydrophobicContact CD2-CD1 3.77Å; L121-I131 HydrophobicContact CD2-CG2 3.78Å; L121-I131 HydrophobicContact CG-CD1 4.27Å; F124-I131 HydrophobicContact CD2-CG2 3.78Å; F124-I131 HydrophobicContact CE2-CG2 3.83Å; N128-I131 HydrophobicContact CB-CD1 3.84Å; N128-I131 HydrophobicContact CB-CG1 3.38Å; I131-T137 VanDerWaalsContact O-CA 3.3Å; I131-T137 WeakPolarHBondContact O-CA 3.33Å; I131-F138 PolarHBondContact N-O 3.01Å; I131-F138 PolarHBondContact O-N 2.91Å
132	S	51.8	Low	65.2	Low	82 Å²	82	59.3 Å²	59.3	57%	0.573	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.7	119	171.4	71.1	0	0	0	0	109.4	F136	S132-F136 WeakPolarHBondContact CA-O 3.38Å
133	N	41.9	Very low	66.2	Low	101 Å²	101	54.7 Å²	54.7	54%	0.54	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	74.7	169.3	-177.2	20.4	0	0	0	110.3	F124 S135 F136	F124-N133 HydrophobicContact CZ-CB 4.03Å; N133-S135 PolarHBondContact O-N 3.19Å; N133-S135 PolarHBondContact O-OG 2.99Å; N133-F136 PolarHBondContact N-O 3.3Å
134	G	53.1	Low	67.6	Low	95 Å²	95	51.5 Å²	51.5	98%	0.979	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	-33	166.4	0	0	0	0	0	118.5
135	S	58.9	Low	69.2	Low	77 Å²	77	51.9 Å²	51.9	54%	0.538	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-23	-179.5	56.6	0	0	0	0	113.1	N133	N133-S135 PolarHBondContact O-N 3.19Å; N133-S135 PolarHBondContact O-OG 2.99Å
136	F	67.7	Low	70.5	Confident	45 Å²	45	48.8 Å²	48.8	20%	0.197	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.7	-179.8	-59.2	-76.3	0	0	0	110.6	E123 S132 N133 A158 E160 F161	E123-F136 WeakPolarHBondContact OE1-CE2 3.49Å; E123-F136 WeakPolarHBondContact OE2-CD2 3.4Å; E123-F136 WeakPolarHBondContact OE2-CE2 3.3Å; E123-F136 WeakPolarHBondContact OE2-CG 3.42Å; S132-F136 WeakPolarHBondContact CA-O 3.38Å; N133-F136 PolarHBondContact N-O 3.3Å; F136-A158 HydrophobicContact CD1-CB 4.39Å; F136-E160 HydrophobicContact CD1-CB 4.37Å; F136-E160 HydrophobicContact CE1-CB 3.71Å; F136-F161 HydrophobicContact CB-CE1 4.09Å; F136-F161 HydrophobicContact CB-CZ 4.22Å; F136-F161 HydrophobicContact CD1-CD1 4.27Å; F136-F161 AromaticContact CD1-CE1 3.85Å; F136-F161 HydrophobicContact CD1-CE1 3.85Å; F136-F161 HydrophobicContact CD1-CZ 4.47Å; F136-F161 HydrophobicContact CG-CE1 4.3Å
137	T	79.2	Confident	71.9	Confident	26 Å²	26	51.7 Å²	51.7	16%	0.16	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	124	171.8	-45.6	0	0	0	0	108.8	I131 K139 E156 A158 F161	I131-T137 VanDerWaalsContact O-CA 3.3Å; I131-T137 WeakPolarHBondContact O-CA 3.33Å; T137-K139 HydrophobicContact CG2-CB 4.38Å; T137-E156 WeakPolarHBondContact CB-OE1 3.44Å; T137-E156 HydrophobicContact CG2-CB 3.96Å; T137-E156 VanDerWaalsContact CG2-CD 3.47Å; T137-E156 HydrophobicContact CG2-CG 3.87Å; T137-E156 PolarHBondContact OG1-OE1 2.67Å; T137-A158 PolarHBondContact O-N 3.28Å; T137-F161 WeakPolarHBondContact O-CE2 3.34Å
138	F	85.1	Confident	73.4	Confident	1 Å²	1	51.1 Å²	51.1	0%	0.004	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	103.6	165.3	-177.3	-120.8	0	0	0	107.5	N119 L121 I131 V140 Y154 E156 V157 F161 V166 I194	N119-F138 HydrophobicContact CB-CE1 4.34Å; L121-F138 HydrophobicContact CB-CD1 4.27Å; L121-F138 HydrophobicContact CD2-CB 4.06Å; I131-F138 PolarHBondContact N-O 3.01Å; I131-F138 PolarHBondContact O-N 2.91Å; F138-V140 HydrophobicContact CD1-CG1 4.46Å; F138-V140 HydrophobicContact CE1-CG1 3.86Å; F138-V140 HydrophobicContact CZ-CB 4.26Å; F138-V140 HydrophobicContact CZ-CG1 4.04Å; F138-Y154 AromaticContact CE2-CD1 3.98Å; F138-Y154 HydrophobicContact CE2-CD1 3.98Å; F138-Y154 HydrophobicContact CE2-CE1 4.01Å; F138-Y154 HydrophobicContact CZ-CD1 4.44Å; F138-Y154 HydrophobicContact CZ-CE1 4.1Å; F138-E156 WeakPolarHBondContact CA-O 3.38Å; F138-V157 HydrophobicContact CD2-CG1 4.5Å; F138-V157 HydrophobicContact CD2-CG2 4.14Å; F138-V157 HydrophobicContact CE2-CG2 4.27Å; F138-F161 HydrophobicContact CB-CE2 4.13Å; F138-F161 HydrophobicContact CB-CZ 3.97Å; F138-F161 HydrophobicContact CD2-CE2 4.5Å; F138-V166 HydrophobicContact CD1-CG1 4.32Å; F138-V166 HydrophobicContact CD2-CB 4.35Å; F138-V166 HydrophobicContact CD2-CG1 3.79Å; F138-V166 HydrophobicContact CE1-CG1 4.47Å; F138-V166 HydrophobicContact CE2-CB 4.03Å; F138-V166 HydrophobicContact CE2-CG1 3.98Å; F138-V166 HydrophobicContact CG-CG1 3.97Å; F138-V166 HydrophobicContact CZ-CB 4.17Å; F138-V166 HydrophobicContact CZ-CG1 4.32Å; F138-I194 HydrophobicContact CE2-CG2 4.03Å
139	K	87.2	Confident	75.3	Confident	40 Å²	40	49.2 Å²	49.2	17%	0.174	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	117.1	179.9	-173.1	176.3	-176.8	148.5	0	108.6	E130 T137 D155 E156	E130-K139 HydrophobicContact CG-CD 4.46Å; E130-K139 HydrophobicContact CG-CG 4.45Å; E130-K139 IonicContact OE1-NZ 3.83Å; E130-K139 PolarHBondContact OE1-NZ 2.87Å; T137-K139 HydrophobicContact CG2-CB 4.38Å; K139-D155 HydrophobicContact CB-CB 4.03Å; K139-D155 HydrophobicContact CD-CB 3.78Å; K139-D155 HydrophobicContact CG-CB 3.76Å; K139-D155 PolarHBondContact O-N 2.94Å; K139-E156 HydrophobicContact CB-CB 4.19Å; K139-E156 PolarHBondContact N-O 2.73Å; K139-E156 PolarHBondContact O-N 3.4Å
140	V	89	Confident	77	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130	-177	58.9	0	0	0	0	109.7	N119 L129 F138 F152 Y153 Y154	N119-V140 HydrophobicContact CB-CG1 3.61Å; N119-V140 VanDerWaalsContact CG-CG1 3.46Å; L129-V140 WeakPolarHBondContact CD1-O 3.46Å; F138-V140 HydrophobicContact CD1-CG1 4.46Å; F138-V140 HydrophobicContact CE1-CG1 3.86Å; F138-V140 HydrophobicContact CZ-CB 4.26Å; F138-V140 HydrophobicContact CZ-CG1 4.04Å; V140-F152 HydrophobicContact CG2-CB 4.4Å; V140-F152 HydrophobicContact CG2-CD1 4.3Å; V140-Y153 CarbonylContact C-O 3.53Å; V140-Y153 WeakPolarHBondContact CA-O 3.27Å; V140-Y154 HydrophobicContact CB-CD1 4.16Å; V140-Y154 HydrophobicContact CB-CE1 4.34Å; V140-Y154 HydrophobicContact CG2-CD1 3.9Å; V140-Y154 HydrophobicContact CG2-CE1 3.79Å
141	T	89.9	Confident	78.8	Confident	8 Å²	8	39.9 Å²	39.9	5%	0.049	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	115	176.5	-62.8	0	0	0	0	109	V68 F73 L143 F152 Y153 D155	V68-T141 HydrophobicContact CG2-CG2 4.12Å; F73-T141 HydrophobicContact CE1-CG2 4.37Å; F73-T141 HydrophobicContact CE2-CG2 4.19Å; F73-T141 HydrophobicContact CZ-CG2 3.57Å; T141-L143 HydrophobicContact CG2-CD2 4.18Å; T141-L143 HydrophobicContact CG2-CG 4.21Å; T141-F152 WeakPolarHBondContact O-CA 3.5Å; T141-Y153 PolarHBondContact N-O 3.07Å; T141-Y153 PolarHBondContact O-N 2.95Å; T141-D155 PolarHBondContact OG1-OD2 2.82Å
142	S	90.6	Very high	80.8	Confident	20 Å²	20	39.1 Å²	39.1	14%	0.14	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.2	172.8	-68.2	0	0	0	0	110.9	N119 A151 F152	N119-S142 PolarHBondContact ND2-OG 2.82Å; S142-A151 CarbonylContact C-O 3.58Å; S142-A151 WeakPolarHBondContact CA-O 3.14Å; S142-F152 VanDerWaalsContact OG-CD1 3.28Å; S142-F152 WeakPolarHBondContact OG-CD1 3.22Å; S142-F152 WeakPolarHBondContact OG-CE1 3.11Å
143	L	90.5	Very high	82.8	Confident	23 Å²	23	36 Å²	36	12%	0.12	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.9	-179.2	-62.1	168.9	0	0	0	110.2	P67 V68 T141 Y145 I150 A151	P67-L143 HydrophobicContact CB-CD1 3.87Å; P67-L143 HydrophobicContact CG-CD1 3.45Å; P67-L143 VanDerWaalsContact CG-CD1 3.45Å; V68-L143 HydrophobicContact CG1-CD1 4.41Å; V68-L143 HydrophobicContact CG1-CD2 4.13Å; V68-L143 HydrophobicContact CG2-CD2 4.03Å; T141-L143 HydrophobicContact CG2-CD2 4.18Å; T141-L143 HydrophobicContact CG2-CG 4.21Å; L143-Y145 HydrophobicContact CB-CE2 3.83Å; L143-Y145 HydrophobicContact CD1-CE2 4.47Å; L143-I150 CarbonylContact O-C 3.42Å; L143-I150 WeakPolarHBondContact O-CA 3.28Å; L143-A151 HydrophobicContact CB-CB 4.25Å; L143-A151 PolarHBondContact N-O 2.91Å; L143-A151 PolarHBondContact O-N 2.81Å
144	I	90.8	Very high	85.3	Confident	34 Å²	34	31.2 Å²	31.2	17%	0.174	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.4	174.3	-55.4	160.2	0	0	0	107.8	I88 M108 I117	I88-I144 HydrophobicContact CB-CG2 4.46Å; I88-I144 HydrophobicContact CD1-CG2 3.9Å; I88-I144 HydrophobicContact CG1-CG2 4.04Å; I88-I144 HydrophobicContact CG2-CG2 3.57Å; M108-I144 HydrophobicContact CE-CD1 3.44Å; M108-I144 VanDerWaalsContact CE-CD1 3.44Å; M108-I144 HydrophobicContact CE-CG1 4.12Å; I117-I144 HydrophobicContact CD1-CD1 3.88Å; I117-I144 HydrophobicContact CD1-CG1 3.77Å
145	Y	89.3	Confident	87	Confident	77 Å²	77	28.1 Å²	28.1	30%	0.302	15%	0.152	S	C	.	.			trans	-102.8	156.6	-177.9	-65.2	-95.3	0	0	0	111.5	L143 N147 G148 K149 A151	L143-Y145 HydrophobicContact CB-CE2 3.83Å; L143-Y145 HydrophobicContact CD1-CE2 4.47Å; Y145-N147 VanDerWaalsContact CB-OD1 3.24Å; Y145-N147 WeakPolarHBondContact CB-OD1 3.49Å; Y145-N147 PolarHBondContact O-N 2.86Å; Y145-G148 PolarHBondContact O-N 3.03Å; Y145-K149 HydrophobicContact CD2-CB 3.93Å; Y145-K149 HydrophobicContact CD2-CD 4.13Å; Y145-K149 HydrophobicContact CD2-CG 3.92Å; Y145-K149 WeakPolarHBondContact CD2-O 3.45Å; Y145-K149 HydrophobicContact CE2-CD 4.3Å; Y145-K149 HydrophobicContact CE2-CG 4.36Å; Y145-K149 HydrophobicContact CG-CB 4.24Å; Y145-K149 PolarHBondContact N-O 2.89Å; Y145-A151 HydrophobicContact CE2-CB 4.22Å
146	P	84.8	Confident	88.4	Confident	69 Å²	69	29 Å²	29	45%	0.448	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.6	-179.3	-21.8	29.7	0	0	0	114.5	F86 G148	F86-P146 HydrophobicContact CB-CB 4.44Å; F86-P146 HydrophobicContact CB-CG 4.43Å; F86-P146 HydrophobicContact CD1-CG 4.06Å; F86-P146 VanDerWaalsContact CD2-CA 3.49Å; F86-P146 HydrophobicContact CD2-CB 3.6Å; F86-P146 HydrophobicContact CD2-CG 3.56Å; F86-P146 HydrophobicContact CE1-CG 4.17Å; F86-P146 HydrophobicContact CE2-CB 3.98Å; F86-P146 HydrophobicContact CE2-CG 3.65Å; F86-P146 HydrophobicContact CG-CB 4.07Å; F86-P146 HydrophobicContact CG-CG 3.76Å; F86-P146 HydrophobicContact CZ-CG 3.97Å; P146-G148 PolarHBondContact O-N 2.83Å
147	N	83	Confident	89.4	Confident	109 Å²	109	27.5 Å²	27.5	58%	0.583	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	2.7	178.6	66.4	-10.2	0	0	0	113.7	Y145 K149	Y145-N147 VanDerWaalsContact CB-OD1 3.24Å; Y145-N147 WeakPolarHBondContact CB-OD1 3.49Å; Y145-N147 PolarHBondContact O-N 2.86Å; N147-K149 VanDerWaalsContact OD1-CB 3.24Å; N147-K149 WeakPolarHBondContact OD1-CB 3.36Å; N147-K149 PolarHBondContact OD1-N 3.4Å
148	G	87.9	Confident	89.8	Confident	1 Å²	1	27 Å²	27	1%	0.01	14%	0.14	C	C	.	.	S	Bend	trans	84.3	5.2	-177.2	0	0	0	0	0	114.7	K89 Y145 P146	K89-G148 WeakPolarHBondContact O-CA 3.39Å; Y145-G148 PolarHBondContact O-N 3.03Å; P146-G148 PolarHBondContact O-N 2.83Å
149	K	91.6	Very high	89.5	Confident	12 Å²	12	36.4 Å²	36.4	5%	0.052	18%	0.181	C	C	.	.			trans	-64.5	136.2	169.5	-179.4	-179.3	-178.8	176.6	0	109.3	Y145 N147 E201 H202 E203 D241	Y145-K149 HydrophobicContact CD2-CB 3.93Å; Y145-K149 HydrophobicContact CD2-CD 4.13Å; Y145-K149 HydrophobicContact CD2-CG 3.92Å; Y145-K149 WeakPolarHBondContact CD2-O 3.45Å; Y145-K149 HydrophobicContact CE2-CD 4.3Å; Y145-K149 HydrophobicContact CE2-CG 4.36Å; Y145-K149 HydrophobicContact CG-CB 4.24Å; Y145-K149 PolarHBondContact N-O 2.89Å; N147-K149 VanDerWaalsContact OD1-CB 3.24Å; N147-K149 WeakPolarHBondContact OD1-CB 3.36Å; N147-K149 PolarHBondContact OD1-N 3.4Å; K149-E201 WeakPolarHBondContact CE-OE1 3.16Å; K149-E201 IonicContact NZ-OE1 3.17Å; K149-E201 PolarHBondContact NZ-OE1 2.76Å; K149-H202 CarbonylContact C-O 3.54Å; K149-H202 WeakPolarHBondContact CA-O 3.47Å; K149-H202 WeakPolarHBondContact CG-O 3Å; K149-E203 HydrophobicContact CD-CG 4.36Å; K149-E203 HydrophobicContact CG-CG 4.23Å; K149-D241 IonicContact NZ-OD2 2.7Å; K149-D241 PolarHBondContact NZ-OD2 2.86Å
150	I	94	Very high	88.9	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.9	175	-62.3	170.4	0	0	0	107.8	F90 I117 L143 F152 F170 H202	F90-I150 HydrophobicContact CD2-CD1 3.69Å; F90-I150 HydrophobicContact CE2-CD1 3.45Å; F90-I150 VanDerWaalsContact CE2-CD1 3.45Å; I117-I150 HydrophobicContact CD1-CG2 3.9Å; L143-I150 CarbonylContact O-C 3.42Å; L143-I150 WeakPolarHBondContact O-CA 3.28Å; I150-F152 HydrophobicContact CG2-CE2 4.11Å; I150-F152 HydrophobicContact CG2-CZ 4.35Å; I150-F170 HydrophobicContact CD1-CD2 3.99Å; I150-F170 HydrophobicContact CD1-CE2 4.17Å; I150-F170 HydrophobicContact CD1-CG 4.15Å; I150-F170 HydrophobicContact CD1-CZ 4.49Å; I150-F170 HydrophobicContact CG2-CD1 4.47Å; I150-H202 HydrophobicContact CB-CB 4.29Å; I150-H202 PolarHBondContact N-O 2.73Å; I150-H202 WeakPolarHBondContact O-CA 3.08Å; I150-H202 WeakPolarHBondContact O-CB 3.48Å; I150-H202 PolarHBondContact O-N 3.39Å; I150-H202 PolarHBondContact O-ND1 2.91Å
151	A	94.6	Very high	88	Confident	1 Å²	1	42 Å²	42	1%	0.008	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	145.7	176.3	0	0	0	0	0	112.5	S142 L143 Y145 L199 V200 E201	S142-A151 CarbonylContact C-O 3.58Å; S142-A151 WeakPolarHBondContact CA-O 3.14Å; L143-A151 HydrophobicContact CB-CB 4.25Å; L143-A151 PolarHBondContact N-O 2.91Å; L143-A151 PolarHBondContact O-N 2.81Å; Y145-A151 HydrophobicContact CE2-CB 4.22Å; A151-L199 HydrophobicContact CB-CD1 4.32Å; A151-V200 CarbonylContact C-O 3.46Å; A151-V200 WeakPolarHBondContact CA-O 3.34Å; A151-V200 WeakPolarHBondContact CB-O 3.47Å; A151-E201 HydrophobicContact CB-CG 4.09Å
152	F	95	Very high	87	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127.4	167.5	-58.9	-88.2	0	0	0	108.2	I117 N119 V140 T141 S142 I150 Y154 F170 V189 V200 H202	I117-F152 HydrophobicContact CG2-CE1 3.44Å; I117-F152 VanDerWaalsContact CG2-CE1 3.44Å; I117-F152 HydrophobicContact CG2-CZ 3.72Å; N119-F152 WeakPolarHBondContact OD1-CD1 3.24Å; V140-F152 HydrophobicContact CG2-CB 4.4Å; V140-F152 HydrophobicContact CG2-CD1 4.3Å; T141-F152 WeakPolarHBondContact O-CA 3.5Å; S142-F152 VanDerWaalsContact OG-CD1 3.28Å; S142-F152 WeakPolarHBondContact OG-CD1 3.22Å; S142-F152 WeakPolarHBondContact OG-CE1 3.11Å; I150-F152 HydrophobicContact CG2-CE2 4.11Å; I150-F152 HydrophobicContact CG2-CZ 4.35Å; F152-Y154 HydrophobicContact CB-CE2 4.29Å; F152-F170 AromaticContact CE2-CD1 3.96Å; F152-F170 HydrophobicContact CE2-CD1 3.96Å; F152-F170 HydrophobicContact CZ-CD1 4.22Å; F152-V189 HydrophobicContact CD2-CG2 4.08Å; F152-V189 HydrophobicContact CE2-CG2 4.4Å; F152-V200 HydrophobicContact CB-CB 4.35Å; F152-V200 PolarHBondContact N-O 2.8Å; F152-V200 PolarHBondContact O-N 3.13Å; F152-H202 AromaticContact CD2-CE1 3.76Å; F152-H202 AromaticContact CD2-ND1 4Å; F152-H202 AromaticContact CE2-CE1 3.71Å; F152-H202 AromaticContact CE2-ND1 3.92Å
153	Y	94.7	Very high	85.8	Confident	16 Å²	16	54.9 Å²	54.9	6%	0.063	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	127.2	169.7	179.5	-101.9	0	0	0	109.2	Q64 P66 P67 V140 T141 D155 L199	Q64-Y153 HydrophobicContact CB-CE2 4.44Å; Q64-Y153 PolarHBondContact O-OH 2.96Å; P66-Y153 HydrophobicContact CB-CD1 4.27Å; P66-Y153 HydrophobicContact CB-CE1 3.72Å; P66-Y153 WeakPolarHBondContact CD-OH 3.47Å; P66-Y153 HydrophobicContact CG-CE1 3.72Å; P66-Y153 WeakPolarHBondContact CG-OH 3.36Å; P67-Y153 VanDerWaalsContact CD-CG 3.47Å; P67-Y153 HydrophobicContact CG-CG 4.28Å; V140-Y153 CarbonylContact C-O 3.53Å; V140-Y153 WeakPolarHBondContact CA-O 3.27Å; T141-Y153 PolarHBondContact N-O 3.07Å; T141-Y153 PolarHBondContact O-N 2.95Å; Y153-D155 HydrophobicContact CD1-CB 4.42Å; Y153-D155 WeakPolarHBondContact CD1-OD2 3.25Å; Y153-D155 HydrophobicContact CE1-CB 4.17Å; Y153-D155 VanDerWaalsContact CE1-OD1 3.29Å; Y153-D155 WeakPolarHBondContact CE1-OD1 3.4Å; Y153-D155 PolarHBondContact O-N 2.89Å; Y153-L199 HydrophobicContact CD2-CB 4.23Å; Y153-L199 HydrophobicContact CD2-CD1 4.29Å
154	Y	93.4	Very high	84.9	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	93.9	-179.3	-64.9	-76.3	0	0	0	109.2	F138 V140 F152 V157 S168 V189 I194 Q195 S196 G197 T198 V200	F138-Y154 AromaticContact CE2-CD1 3.98Å; F138-Y154 HydrophobicContact CE2-CD1 3.98Å; F138-Y154 HydrophobicContact CE2-CE1 4.01Å; F138-Y154 HydrophobicContact CZ-CD1 4.44Å; F138-Y154 HydrophobicContact CZ-CE1 4.1Å; V140-Y154 HydrophobicContact CB-CD1 4.16Å; V140-Y154 HydrophobicContact CB-CE1 4.34Å; V140-Y154 HydrophobicContact CG2-CD1 3.9Å; V140-Y154 HydrophobicContact CG2-CE1 3.79Å; F152-Y154 HydrophobicContact CB-CE2 4.29Å; Y154-V157 HydrophobicContact CD1-CG2 4.08Å; Y154-V157 HydrophobicContact CG-CG2 4.3Å; Y154-S168 WeakPolarHBondContact CE1-OG 3.36Å; Y154-S168 WeakPolarHBondContact OH-CB 3.37Å; Y154-S168 PolarHBondContact OH-OG 3.01Å; Y154-V189 HydrophobicContact CE2-CG1 4.33Å; Y154-I194 HydrophobicContact CD1-CG2 3.89Å; Y154-I194 HydrophobicContact CE1-CB 4.43Å; Y154-I194 HydrophobicContact CE1-CG1 4.31Å; Y154-I194 HydrophobicContact CE1-CG2 3.64Å; Y154-I194 HydrophobicContact CE2-CG1 4.37Å; Y154-Q195 VanDerWaalsContact CB-O 3.23Å; Y154-Q195 WeakPolarHBondContact CB-O 3.31Å; Y154-S196 CarbonylContact O-C 2.99Å; Y154-S196 WeakPolarHBondContact O-CA 2.93Å; Y154-G197 PolarHBondContact O-N 2.87Å; Y154-T198 HydrophobicContact CD2-CG2 4.12Å; Y154-T198 HydrophobicContact CE2-CG2 4.48Å; Y154-T198 PolarHBondContact N-O 3.22Å; Y154-V200 HydrophobicContact CE2-CG2 3.88Å
155	D	90.3	Very high	84.4	Confident	30 Å²	30	58.2 Å²	58.2	16%	0.16	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	-52.8	-178.7	-69.1	-92.2	0	0	0	111.7	K139 T141 Y153	K139-D155 HydrophobicContact CB-CB 4.03Å; K139-D155 HydrophobicContact CD-CB 3.78Å; K139-D155 HydrophobicContact CG-CB 3.76Å; K139-D155 PolarHBondContact O-N 2.94Å; T141-D155 PolarHBondContact OG1-OD2 2.82Å; Y153-D155 HydrophobicContact CD1-CB 4.42Å; Y153-D155 WeakPolarHBondContact CD1-OD2 3.25Å; Y153-D155 HydrophobicContact CE1-CB 4.17Å; Y153-D155 VanDerWaalsContact CE1-OD1 3.29Å; Y153-D155 WeakPolarHBondContact CE1-OD1 3.4Å; Y153-D155 PolarHBondContact O-N 2.89Å
156	E	88.5	Confident	84.3	Confident	96 Å²	96	55 Å²	55	45%	0.449	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	120.7	-178.2	-167.7	178.7	149.2	0	0	109.9	T137 F138 K139	T137-E156 WeakPolarHBondContact CB-OE1 3.44Å; T137-E156 HydrophobicContact CG2-CB 3.96Å; T137-E156 VanDerWaalsContact CG2-CD 3.47Å; T137-E156 HydrophobicContact CG2-CG 3.87Å; T137-E156 PolarHBondContact OG1-OE1 2.67Å; F138-E156 WeakPolarHBondContact CA-O 3.38Å; K139-E156 HydrophobicContact CB-CB 4.19Å; K139-E156 PolarHBondContact N-O 2.73Å; K139-E156 PolarHBondContact O-N 3.4Å
157	V	89	Confident	84.6	Confident	13 Å²	13	55 Å²	55	8%	0.079	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	112.4	177.2	-176.9	0	0	0	0	107.1	F138 Y154 F161 I194 S196	F138-V157 HydrophobicContact CD2-CG1 4.5Å; F138-V157 HydrophobicContact CD2-CG2 4.14Å; F138-V157 HydrophobicContact CE2-CG2 4.27Å; Y154-V157 HydrophobicContact CD1-CG2 4.08Å; Y154-V157 HydrophobicContact CG-CG2 4.3Å; V157-F161 HydrophobicContact CG1-CD2 3.69Å; V157-F161 HydrophobicContact CG1-CE2 3.98Å; V157-I194 HydrophobicContact CG1-CG2 4.35Å; V157-I194 HydrophobicContact CG2-CG2 4.41Å; V157-S196 PolarHBondContact N-OG 2.92Å; V157-S196 PolarHBondContact O-OG 3.46Å
158	A	85.9	Confident	85.1	Confident	15 Å²	15	49.8 Å²	49.8	12%	0.124	23%	0.233	C	C	.	.			trans	-56.2	140.8	176.1	0	0	0	0	0	111.3	F136 T137 E160 F161	F136-A158 HydrophobicContact CD1-CB 4.39Å; T137-A158 PolarHBondContact O-N 3.28Å; A158-E160 PolarHBondContact O-N 3.17Å; A158-F161 HydrophobicContact CB-CD2 4.01Å; A158-F161 HydrophobicContact CB-CE2 3.63Å; A158-F161 HydrophobicContact CB-CZ 3.93Å; A158-F161 WeakPolarHBondContact O-CD2 3.48Å
159	K	80.2	Confident	85.4	Confident	200 Å²	200	50.5 Å²	50.5	87%	0.87	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-16.8	-177.3	-69.4	-174.9	178.1	-178.5	0	112.6	F161	K159-F161 VanDerWaalsContact C-N 3.28Å; K159-F161 PolarHBondContact O-N 2.7Å
160	E	73.1	Confident	85.6	Confident	127 Å²	127	50 Å²	50	59%	0.593	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-10.5	-175.2	-64.7	74.3	-164.3	0	0	112.8	F136 A158 Q162	F136-E160 HydrophobicContact CD1-CB 4.37Å; F136-E160 HydrophobicContact CE1-CB 3.71Å; A158-E160 PolarHBondContact O-N 3.17Å; E160-Q162 PolarHBondContact O-N 3.11Å
161	F	71.4	Confident	85.7	Confident	29 Å²	29	50.1 Å²	50.1	13%	0.127	24%	0.235	C	C	.	.			trans	-61.5	130.8	176.5	-67.8	-49.2	0	0	0	111.3	L121 F136 T137 F138 V157 A158 K159 D165 V166	L121-F161 HydrophobicContact CD1-CD1 3.96Å; L121-F161 HydrophobicContact CD1-CE1 3.37Å; L121-F161 HydrophobicContact CD1-CZ 3.85Å; L121-F161 HydrophobicContact CD2-CE1 4.36Å; L121-F161 HydrophobicContact CD2-CZ 4.38Å; F136-F161 HydrophobicContact CB-CE1 4.09Å; F136-F161 HydrophobicContact CB-CZ 4.22Å; F136-F161 HydrophobicContact CD1-CD1 4.27Å; F136-F161 AromaticContact CD1-CE1 3.85Å; F136-F161 HydrophobicContact CD1-CE1 3.85Å; F136-F161 HydrophobicContact CD1-CZ 4.47Å; F136-F161 HydrophobicContact CG-CE1 4.3Å; T137-F161 WeakPolarHBondContact O-CE2 3.34Å; F138-F161 HydrophobicContact CB-CE2 4.13Å; F138-F161 HydrophobicContact CB-CZ 3.97Å; F138-F161 HydrophobicContact CD2-CE2 4.5Å; V157-F161 HydrophobicContact CG1-CD2 3.69Å; V157-F161 HydrophobicContact CG1-CE2 3.98Å; A158-F161 HydrophobicContact CB-CD2 4.01Å; A158-F161 HydrophobicContact CB-CE2 3.63Å; A158-F161 HydrophobicContact CB-CZ 3.93Å; A158-F161 WeakPolarHBondContact O-CD2 3.48Å; K159-F161 VanDerWaalsContact C-N 3.28Å; K159-F161 PolarHBondContact O-N 2.7Å; F161-D165 HydrophobicContact CB-CB 4.19Å; F161-D165 HydrophobicContact CD1-CB 3.94Å; F161-D165 HydrophobicContact CG-CB 4.4Å; F161-V166 HydrophobicContact CD1-CG1 4.33Å; F161-V166 HydrophobicContact CD2-CG1 4.08Å; F161-V166 HydrophobicContact CE1-CG1 4.45Å; F161-V166 HydrophobicContact CE2-CG1 4.17Å; F161-V166 HydrophobicContact CG-CG1 4.18Å; F161-V166 HydrophobicContact CZ-CG1 4.37Å
162	Q	67.8	Low	85.6	Confident	146 Å²	146	50.1 Å²	50.1	68%	0.682	24%	0.235	S	C	*	.			trans	-72.3	156.6	163.1	-57.6	-165.5	25.8	0	0	109.5	E160 D164 D165	E160-Q162 PolarHBondContact O-N 3.11Å; Q162-D164 PolarHBondContact O-N 3.17Å; Q162-D165 WeakPolarHBondContact CA-OD2 3.48Å; Q162-D165 WeakPolarHBondContact CB-OD2 3.36Å; Q162-D165 PolarHBondContact N-OD2 3.34Å; Q162-D165 WeakPolarHBondContact O-CB 3.32Å; Q162-D165 PolarHBondContact O-N 3.04Å
163	K	65.3	Low	85.5	Confident	154 Å²	154	51 Å²	51	67%	0.67	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-21.6	-176.6	-172	172.1	-178.8	-176.6	0	113.8	K191	K163-K191 HydrophobicContact CG-CB 4.07Å; K163-K191 HydrophobicContact CG-CD 4Å; K163-K191 WeakPolarHBondContact O-CD 3.4Å; K163-K191 VanDerWaalsContact O-CE 3.22Å; K163-K191 WeakPolarHBondContact O-CE 3.21Å
164	D	72.7	Confident	85.2	Confident	94 Å²	94	50.4 Å²	50.4	50%	0.503	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	10.7	-178.2	-61	-36.6	0	0	0	114.1	K122 Q162 K191	K122-D164 VanDerWaalsContact CD-O 3.29Å; K122-D164 WeakPolarHBondContact CD-O 3.45Å; Q162-D164 PolarHBondContact O-N 3.17Å; D164-K191 IonicContact OD1-NZ 2.64Å; D164-K191 PolarHBondContact OD1-NZ 3.37Å
165	D	80.7	Confident	84.9	Confident	32 Å²	32	54.1 Å²	54.1	17%	0.171	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-29	-178	-66	-18.3	0	0	0	112.4	L121 K122 F161 Q162	L121-D165 CarbonylContact C-O 3.56Å; L121-D165 WeakPolarHBondContact CA-O 3.34Å; K122-D165 WeakPolarHBondContact CB-O 3.22Å; K122-D165 PolarHBondContact N-O 3.21Å; F161-D165 HydrophobicContact CB-CB 4.19Å; F161-D165 HydrophobicContact CD1-CB 3.94Å; F161-D165 HydrophobicContact CG-CB 4.4Å; Q162-D165 WeakPolarHBondContact CA-OD2 3.48Å; Q162-D165 WeakPolarHBondContact CB-OD2 3.36Å; Q162-D165 PolarHBondContact N-OD2 3.34Å; Q162-D165 WeakPolarHBondContact O-CB 3.32Å; Q162-D165 PolarHBondContact O-N 3.04Å
166	V	86.8	Confident	84.7	Confident	10 Å²	10	53.3 Å²	53.3	6%	0.061	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.1	-177.3	-65.6	0	0	0	0	111.7	F120 L121 F138 F161 I194	F120-V166 WeakPolarHBondContact O-CA 3.12Å; L121-V166 HydrophobicContact CD1-CG1 3.52Å; F138-V166 HydrophobicContact CD1-CG1 4.32Å; F138-V166 HydrophobicContact CD2-CB 4.35Å; F138-V166 HydrophobicContact CD2-CG1 3.79Å; F138-V166 HydrophobicContact CE1-CG1 4.47Å; F138-V166 HydrophobicContact CE2-CB 4.03Å; F138-V166 HydrophobicContact CE2-CG1 3.98Å; F138-V166 HydrophobicContact CG-CG1 3.97Å; F138-V166 HydrophobicContact CZ-CB 4.17Å; F138-V166 HydrophobicContact CZ-CG1 4.32Å; F161-V166 HydrophobicContact CD1-CG1 4.33Å; F161-V166 HydrophobicContact CD2-CG1 4.08Å; F161-V166 HydrophobicContact CE1-CG1 4.45Å; F161-V166 HydrophobicContact CE2-CG1 4.17Å; F161-V166 HydrophobicContact CG-CG1 4.18Å; F161-V166 HydrophobicContact CZ-CG1 4.37Å; V166-I194 HydrophobicContact CG2-CB 4.47Å; V166-I194 HydrophobicContact CG2-CG2 3.76Å
167	Y	90.4	Very high	84.1	Confident	68 Å²	68	52 Å²	52	27%	0.267	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	150.8	164.9	62.2	-96	0	0	0	111	V118 F120 L169	V118-Y167 HydrophobicContact CG1-CE2 3.93Å; F120-Y167 HydrophobicContact CB-CD1 3.98Å; F120-Y167 HydrophobicContact CB-CD2 3.98Å; F120-Y167 HydrophobicContact CB-CE1 3.5Å; F120-Y167 HydrophobicContact CB-CE2 3.48Å; F120-Y167 VanDerWaalsContact CB-CE2 3.48Å; F120-Y167 HydrophobicContact CB-CG 4.2Å; F120-Y167 WeakPolarHBondContact CB-OH 3.47Å; F120-Y167 AromaticContact CD1-CD1 3.74Å; F120-Y167 HydrophobicContact CD1-CD1 3.74Å; F120-Y167 AromaticContact CD1-CE1 3.02Å; F120-Y167 HydrophobicContact CD1-CE1 3.02Å; F120-Y167 AromaticContact CD1-CZ 3.51Å; F120-Y167 HydrophobicContact CD2-CE1 4.46Å; F120-Y167 AromaticContact CE1-CE1 3.73Å; F120-Y167 HydrophobicContact CE1-CE1 3.73Å; F120-Y167 HydrophobicContact CG-CD1 4.24Å; F120-Y167 AromaticContact CG-CE1 3.44Å; F120-Y167 HydrophobicContact CG-CE1 3.44Å; F120-Y167 VanDerWaalsContact CG-CE1 3.44Å; F120-Y167 HydrophobicContact CG-CE2 4.17Å; F120-Y167 AromaticContact CG-CZ 3.36Å; F120-Y167 WeakPolarHBondContact CG-OH 3.42Å; F120-Y167 PolarHBondContact N-O 2.64Å; F120-Y167 PolarHBondContact O-N 2.88Å; F120-Y167 VanDerWaalsContact O-N 3.17Å; Y167-L169 HydrophobicContact CD2-CD2 3.69Å; Y167-L169 HydrophobicContact CD2-CG 4.16Å; Y167-L169 HydrophobicContact CE2-CD2 3.78Å; Y167-L169 HydrophobicContact CE2-CG 4.33Å
168	S	93.6	Very high	83	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.6	167.7	-61.4	0	0	0	0	107.7	V118 N119 Y154 V189	V118-S168 WeakPolarHBondContact O-CA 3.29Å; N119-S168 VanDerWaalsContact OD1-CB 3.25Å; N119-S168 WeakPolarHBondContact OD1-CB 3.32Å; N119-S168 PolarHBondContact OD1-OG 2.93Å; Y154-S168 WeakPolarHBondContact CE1-OG 3.36Å; Y154-S168 WeakPolarHBondContact OH-CB 3.37Å; Y154-S168 PolarHBondContact OH-OG 3.01Å; S168-V189 PolarHBondContact O-N 3.06Å
169	L	94.8	Very high	82.4	Confident	17 Å²	17	62.4 Å²	62.4	9%	0.089	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	161.5	177	64.1	83.6	0	0	0	110.9	V118 Y167 E186 V187 E188	V118-L169 HydrophobicContact CB-CD1 4Å; V118-L169 HydrophobicContact CB-CG 4.24Å; V118-L169 HydrophobicContact CG2-CD1 4.13Å; V118-L169 PolarHBondContact N-O 3.42Å; V118-L169 PolarHBondContact O-N 3.3Å; Y167-L169 HydrophobicContact CD2-CD2 3.69Å; Y167-L169 HydrophobicContact CD2-CG 4.16Å; Y167-L169 HydrophobicContact CE2-CD2 3.78Å; Y167-L169 HydrophobicContact CE2-CG 4.33Å; L169-E186 HydrophobicContact CB-CG 4.31Å; L169-E186 HydrophobicContact CD1-CG 4.33Å; L169-E186 HydrophobicContact CD2-CG 4.41Å; L169-V187 WeakPolarHBondContact CA-O 3.14Å; L169-V187 WeakPolarHBondContact CB-O 3.36Å; L169-E188 HydrophobicContact CB-CB 4.21Å; L169-E188 HydrophobicContact CB-CG 4.39Å
170	F	95.3	Very high	82.2	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	155.3	160.1	69.6	-85.9	0	0	0	109.5	Y56 F90 Y91 G116 I117 I150 F152 V187 H202	Y56-F170 HydrophobicContact CD1-CZ 4.25Å; Y56-F170 AromaticContact CD2-CE2 3.57Å; Y56-F170 HydrophobicContact CD2-CE2 3.57Å; Y56-F170 AromaticContact CD2-CZ 3.83Å; Y56-F170 HydrophobicContact CD2-CZ 3.83Å; Y56-F170 HydrophobicContact CE1-CE2 4.5Å; Y56-F170 AromaticContact CE2-CE2 3.55Å; Y56-F170 HydrophobicContact CE2-CE2 3.55Å; Y56-F170 HydrophobicContact CE2-CZ 4.19Å; Y56-F170 HydrophobicContact CG-CE2 4.06Å; Y56-F170 AromaticContact CG-CZ 3.85Å; Y56-F170 HydrophobicContact CG-CZ 3.85Å; F90-F170 AromaticContact CE2-CD2 3.69Å; F90-F170 HydrophobicContact CE2-CD2 3.69Å; F90-F170 HydrophobicContact CE2-CE2 4.27Å; F90-F170 AromaticContact CZ-CD2 3.97Å; F90-F170 HydrophobicContact CZ-CD2 3.97Å; Y91-F170 AromaticContact CE2-CD2 3.92Å; Y91-F170 HydrophobicContact CE2-CD2 3.92Å; Y91-F170 AromaticContact CE2-CE2 3.9Å; Y91-F170 HydrophobicContact CE2-CE2 3.9Å; Y91-F170 AromaticContact CZ-CE2 3.93Å; G116-F170 WeakPolarHBondContact O-CA 3.38Å; G116-F170 VanDerWaalsContact O-CB 3.27Å; G116-F170 WeakPolarHBondContact O-CB 3.28Å; I117-F170 HydrophobicContact CG1-CB 3.93Å; I150-F170 HydrophobicContact CD1-CD2 3.99Å; I150-F170 HydrophobicContact CD1-CE2 4.17Å; I150-F170 HydrophobicContact CD1-CG 4.15Å; I150-F170 HydrophobicContact CD1-CZ 4.49Å; I150-F170 HydrophobicContact CG2-CD1 4.47Å; F152-F170 AromaticContact CE2-CD1 3.96Å; F152-F170 HydrophobicContact CE2-CD1 3.96Å; F152-F170 HydrophobicContact CZ-CD1 4.22Å; F170-V187 HydrophobicContact CD1-CB 4.04Å; F170-V187 HydrophobicContact CD1-CG1 4.45Å; F170-V187 HydrophobicContact CE1-CB 3.47Å; F170-V187 VanDerWaalsContact CE1-CB 3.47Å; F170-V187 HydrophobicContact CE1-CG1 3.61Å; F170-V187 HydrophobicContact CE1-CG2 4.09Å; F170-V187 HydrophobicContact CE2-CB 4.04Å; F170-V187 HydrophobicContact CE2-CG2 3.87Å; F170-V187 HydrophobicContact CZ-CB 3.48Å; F170-V187 VanDerWaalsContact CZ-CB 3.48Å; F170-V187 HydrophobicContact CZ-CG1 3.85Å; F170-V187 HydrophobicContact CZ-CG2 3.54Å; F170-V187 PolarHBondContact N-O 2.85Å; F170-V187 VanDerWaalsContact N-O 3.09Å; F170-V187 PolarHBondContact O-N 3.03Å; F170-H202 HydrophobicContact CE1-CB 4Å; F170-H202 AromaticContact CE1-CD2 3.54Å; F170-H202 AromaticContact CE1-CE1 3.71Å; F170-H202 AromaticContact CE1-CG 3.44Å; F170-H202 VanDerWaalsContact CE1-CG 3.44Å; F170-H202 AromaticContact CE1-ND1 3.58Å; F170-H202 AromaticContact CE1-NE2 3.7Å; F170-H202 HydrophobicContact CZ-CB 4.02Å; F170-H202 AromaticContact CZ-CD2 3.94Å; F170-H202 AromaticContact CZ-CG 3.88Å
171	S	95.4	Very high	82.7	Confident	4 Å²	4	60.8 Å²	60.8	3%	0.028	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	151.5	-171	38.8	0	0	0	0	110.7	F90 E115 G116 A185	F90-S171 VanDerWaalsContact CE1-O 3.31Å; F90-S171 WeakPolarHBondContact CE1-O 3.49Å; F90-S171 WeakPolarHBondContact CZ-O 3.29Å; E115-S171 CarbonylContact C-O 3.55Å; E115-S171 WeakPolarHBondContact CB-O 3.18Å; E115-S171 VanDerWaalsContact CD-C 3.46Å; E115-S171 VanDerWaalsContact CG-O 3.24Å; E115-S171 WeakPolarHBondContact CG-O 3.41Å; E115-S171 WeakPolarHBondContact CG-OG 3.22Å; E115-S171 WeakPolarHBondContact OE1-CB 3.1Å; E115-S171 PolarHBondContact OE1-OG 2.95Å; E115-S171 WeakPolarHBondContact OE2-CB 3.34Å; E115-S171 PolarHBondContact OE2-OG 3.17Å; G116-S171 PolarHBondContact N-O 2.85Å; G116-S171 PolarHBondContact O-N 2.91Å; S171-A185 CarbonylContact C-O 3.47Å; S171-A185 WeakPolarHBondContact CA-O 3.36Å; S171-A185 WeakPolarHBondContact CB-O 3.17Å
172	G	94	Very high	83.5	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	135.8	-178.5	0	0	0	0	0	110.9	Y91 V114 E115 F174 W184 A185	Y91-G172 VanDerWaalsContact CD2-CA 3.46Å; Y91-G172 VanDerWaalsContact CE2-CA 3.45Å; Y91-G172 VanDerWaalsContact CE2-N 3.3Å; V114-G172 WeakPolarHBondContact O-CA 3.39Å; E115-G172 PolarHBondContact OE2-N 3.29Å; G172-F174 WeakPolarHBondContact O-CE2 3.49Å; G172-W184 CarbonylContact O-C 3.55Å; G172-W184 WeakPolarHBondContact O-CA 3.23Å; G172-A185 PolarHBondContact N-O 2.89Å; G172-A185 PolarHBondContact O-N 2.94Å
173	V	91.9	Very high	84.5	Confident	18 Å²	18	58.9 Å²	58.9	11%	0.109	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	138	175.6	70.7	0	0	0	0	111.8	P113 V114 D182 E183 W184	P113-V173 WeakPolarHBondContact O-CG1 3.27Å; V114-V173 PolarHBondContact O-N 2.92Å; V173-D182 HydrophobicContact CG2-CB 3.77Å; V173-E183 CarbonylContact C-O 3.59Å; V173-E183 WeakPolarHBondContact CA-O 2.88Å; V173-W184 HydrophobicContact CB-CD2 4.42Å; V173-W184 HydrophobicContact CB-CE3 4.3Å; V173-W184 HydrophobicContact CB-CH2 4.44Å; V173-W184 HydrophobicContact CB-CZ3 4.31Å; V173-W184 HydrophobicContact CG2-CD2 4.15Å; V173-W184 HydrophobicContact CG2-CE3 4.46Å; V173-W184 HydrophobicContact CG2-CH2 4.2Å; V173-W184 HydrophobicContact CG2-CZ2 3.9Å; V173-W184 HydrophobicContact CG2-CZ3 4.48Å
174	F	89	Confident	85.6	Confident	5 Å²	5	57 Å²	57	2%	0.022	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	115.1	-179.5	-53.9	-87.5	0	0	0	109.6	N27 I29 Y54 Y91 G172 C176 E183 A185	N27-F174 HydrophobicContact CB-CD1 4Å; N27-F174 HydrophobicContact CB-CG 4.49Å; N27-F174 WeakPolarHBondContact ND2-CD1 3.1Å; I29-F174 HydrophobicContact CD1-CD2 4.34Å; I29-F174 HydrophobicContact CD1-CE2 4.45Å; I29-F174 HydrophobicContact CG2-CB 4Å; I29-F174 HydrophobicContact CG2-CD1 4.42Å; I29-F174 HydrophobicContact CG2-CD2 3.86Å; I29-F174 HydrophobicContact CG2-CE2 4.45Å; I29-F174 HydrophobicContact CG2-CG 3.83Å; Y54-F174 HydrophobicContact CD1-CE2 4.44Å; Y54-F174 HydrophobicContact CD1-CZ 4.4Å; Y54-F174 HydrophobicContact CE1-CE1 4.34Å; Y54-F174 AromaticContact CE1-CE2 3.91Å; Y54-F174 HydrophobicContact CE1-CE2 3.91Å; Y54-F174 AromaticContact CE1-CZ 3.69Å; Y54-F174 HydrophobicContact CE1-CZ 3.69Å; Y91-F174 HydrophobicContact CD1-CE1 4.36Å; Y91-F174 HydrophobicContact CD1-CE2 4.29Å; Y91-F174 AromaticContact CD1-CZ 3.48Å; Y91-F174 HydrophobicContact CD1-CZ 3.48Å; Y91-F174 VanDerWaalsContact CD1-CZ 3.48Å; Y91-F174 HydrophobicContact CE1-CZ 4.11Å; Y91-F174 HydrophobicContact CG-CE1 4.47Å; Y91-F174 AromaticContact CG-CZ 3.8Å; Y91-F174 HydrophobicContact CG-CZ 3.8Å; G172-F174 WeakPolarHBondContact O-CE2 3.49Å; F174-C176 PolarHBondContact O-N 3.17Å; F174-E183 PolarHBondContact N-O 2.9Å; F174-E183 PolarHBondContact O-N 3.29Å; F174-A185 HydrophobicContact CE2-CB 3.76Å
175	T	86.9	Confident	86.6	Confident	78 Å²	78	52.6 Å²	52.6	48%	0.479	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	120.8	174.6	-56.1	0	0	0	0	110.4	R180 D182	T175-R180 HydrophobicContact CG2-CB 3.56Å; T175-R180 HydrophobicContact CG2-CG 3.93Å; T175-D182 PolarHBondContact OG1-OD1 3.29Å
176	C	85.2	Confident	87.3	Confident	12 Å²	12	55.8 Å²	55.8	8%	0.081	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.2	-176.3	-60.9	0	0	0	0	112.1	C30 F174 R180 D181	C30-C176 WeakPolarHBondContact CA-SG 3.46Å; C30-C176 HydrophobicContact CB-CB 3.62Å; C30-C176 WeakPolarHBondContact CB-SG 3.43Å; C30-C176 VanDerWaalsContact SG-CA 3.52Å; C30-C176 WeakPolarHBondContact SG-CB 3.36Å; C30-C176 CovalentContact SG-SG 2.04Å; C30-C176 PolarHBondContact SG-SG 2.95Å; F174-C176 PolarHBondContact O-N 3.17Å; C176-R180 PolarHBondContact O-N 2.81Å; C176-D181 WeakPolarHBondContact CA-O 3.19Å; C176-D181 WeakPolarHBondContact CB-O 2.97Å; C176-D181 PolarHBondContact N-O 3.09Å; C176-D181 PolarHBondContact O-N 2.87Å
177	G	75.9	Confident	87.7	Confident	68 Å²	68	55.4 Å²	55.4	70%	0.701	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	-176.9	173.3	0	0	0	0	0	115.3
178	E	67.8	Low	88	Confident	113 Å²	113	55.3 Å²	55.3	53%	0.528	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-29.2	179.2	-62.5	-166.1	164.2	0	0	112.6	R180 Y341	E178-R180 PolarHBondContact O-N 3.34Å; E178-Y341 WeakPolarHBondContact OE2-CD2 3.42Å; E178-Y341 WeakPolarHBondContact OE2-CE2 3.42Å
179	N	72.9	Confident	88.1	Confident	135 Å²	135	55.3 Å²	55.3	72%	0.722	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-10.2	176.4	-67.9	-29.4	0	0	0	113.3	D181	N179-D181 VanDerWaalsContact C-N 3.34Å
180	R	76.3	Confident	88.1	Confident	195 Å²	195	56 Å²	56	74%	0.736	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	47.5	-173.7	-54.9	-175.5	-177.5	-145.4	-1.9	111.8	T175 C176 E178 D182	T175-R180 HydrophobicContact CG2-CB 3.56Å; T175-R180 HydrophobicContact CG2-CG 3.93Å; C176-R180 PolarHBondContact O-N 2.81Å; E178-R180 PolarHBondContact O-N 3.34Å; R180-D182 PolarHBondContact O-N 2.86Å
181	D	82.8	Confident	87.9	Confident	98 Å²	98	59.1 Å²	59.1	52%	0.524	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	119.8	172.7	-66	-44.3	0	0	0	107.8	C176 N179	C176-D181 WeakPolarHBondContact CA-O 3.19Å; C176-D181 WeakPolarHBondContact CB-O 2.97Å; C176-D181 PolarHBondContact N-O 3.09Å; C176-D181 PolarHBondContact O-N 2.87Å; N179-D181 VanDerWaalsContact C-N 3.34Å
182	D	87.2	Confident	87.7	Confident	80 Å²	80	64.2 Å²	64.2	43%	0.428	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.5	-178.5	-72	-30.5	0	0	0	110.3	V173 T175 R180 W184	V173-D182 HydrophobicContact CG2-CB 3.77Å; T175-D182 PolarHBondContact OG1-OD1 3.29Å; R180-D182 PolarHBondContact O-N 2.86Å; D182-W184 VanDerWaalsContact O-CD1 3.26Å; D182-W184 PolarHBondContact O-NE1 3.18Å
183	E	89	Confident	87.8	Confident	55 Å²	55	64.6 Å²	64.6	26%	0.257	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	152.2	167.6	-72.1	-61.6	170.7	0	0	111.2	K36 V173 F174	K36-E183 IonicContact NZ-OE2 3.06Å; K36-E183 PolarHBondContact NZ-OE2 2.73Å; K36-E183 VanDerWaalsContact NZ-OE2 3.17Å; V173-E183 CarbonylContact C-O 3.59Å; V173-E183 WeakPolarHBondContact CA-O 2.88Å; F174-E183 PolarHBondContact N-O 2.9Å; F174-E183 PolarHBondContact O-N 3.29Å
184	W	90.1	Very high	87.8	Confident	114 Å²	114	64.5 Å²	64.5	43%	0.432	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.1	-172	-54.2	66.6	0	0	0	107.9	K36 E115 G172 V173 D182	K36-W184 WeakPolarHBondContact CE-O 3.32Å; K36-W184 VanDerWaalsContact CG-O 3.29Å; K36-W184 WeakPolarHBondContact CG-O 3.38Å; E115-W184 HydrophobicContact CG-CZ3 4.19Å; E115-W184 VanDerWaalsContact OE1-CE3 3.3Å; E115-W184 VanDerWaalsContact OE1-CZ3 3.32Å; E115-W184 WeakPolarHBondContact OE1-CZ3 3.24Å; E115-W184 WeakPolarHBondContact OE2-CZ3 3.4Å; G172-W184 CarbonylContact O-C 3.55Å; G172-W184 WeakPolarHBondContact O-CA 3.23Å; V173-W184 HydrophobicContact CB-CD2 4.42Å; V173-W184 HydrophobicContact CB-CE3 4.3Å; V173-W184 HydrophobicContact CB-CH2 4.44Å; V173-W184 HydrophobicContact CB-CZ3 4.31Å; V173-W184 HydrophobicContact CG2-CD2 4.15Å; V173-W184 HydrophobicContact CG2-CE3 4.46Å; V173-W184 HydrophobicContact CG2-CH2 4.2Å; V173-W184 HydrophobicContact CG2-CZ2 3.9Å; V173-W184 HydrophobicContact CG2-CZ3 4.48Å; D182-W184 VanDerWaalsContact O-CD1 3.26Å; D182-W184 PolarHBondContact O-NE1 3.18Å
185	A	93.4	Very high	88	Confident	2 Å²	2	68.3 Å²	68.3	2%	0.017	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	130.3	166.7	0	0	0	0	0	108.7	I29 Y54 Y91 S171 G172 F174	I29-A185 HydrophobicContact CD1-CB 4.01Å; Y54-A185 HydrophobicContact CD1-CB 3.63Å; Y54-A185 HydrophobicContact CE1-CB 4.36Å; Y91-A185 HydrophobicContact CE1-CB 4.05Å; Y91-A185 PolarHBondContact OH-O 3.44Å; S171-A185 CarbonylContact C-O 3.47Å; S171-A185 WeakPolarHBondContact CA-O 3.36Å; S171-A185 WeakPolarHBondContact CB-O 3.17Å; G172-A185 PolarHBondContact N-O 2.89Å; G172-A185 PolarHBondContact O-N 2.94Å; F174-A185 HydrophobicContact CE2-CB 3.76Å
186	E	94.5	Very high	88.4	Confident	99 Å²	99	67.3 Å²	67.3	46%	0.463	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	138.9	-178.1	-173.8	177.7	109.3	0	0	110.2	L169	L169-E186 HydrophobicContact CB-CG 4.31Å; L169-E186 HydrophobicContact CD1-CG 4.33Å; L169-E186 HydrophobicContact CD2-CG 4.41Å
187	V	96	Very high	88.8	Confident	1 Å²	1	67.3 Å²	67.3	1%	0.006	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	100.6	171	-177.3	0	0	0	0	107.5	Y53 L169 F170 H202	Y53-V187 HydrophobicContact CD1-CB 4.16Å; Y53-V187 HydrophobicContact CD1-CG1 3.89Å; Y53-V187 HydrophobicContact CD1-CG2 3.9Å; Y53-V187 HydrophobicContact CD2-CG1 4.02Å; Y53-V187 HydrophobicContact CE1-CB 4.45Å; Y53-V187 HydrophobicContact CE1-CG1 3.94Å; Y53-V187 HydrophobicContact CE2-CG1 4.11Å; Y53-V187 HydrophobicContact CG-CB 4.42Å; Y53-V187 HydrophobicContact CG-CG1 3.92Å; Y53-V187 HydrophobicContact CG-CG2 3.91Å; L169-V187 WeakPolarHBondContact CA-O 3.14Å; L169-V187 WeakPolarHBondContact CB-O 3.36Å; F170-V187 HydrophobicContact CD1-CB 4.04Å; F170-V187 HydrophobicContact CD1-CG1 4.45Å; F170-V187 HydrophobicContact CE1-CB 3.47Å; F170-V187 VanDerWaalsContact CE1-CB 3.47Å; F170-V187 HydrophobicContact CE1-CG1 3.61Å; F170-V187 HydrophobicContact CE1-CG2 4.09Å; F170-V187 HydrophobicContact CE2-CB 4.04Å; F170-V187 HydrophobicContact CE2-CG2 3.87Å; F170-V187 HydrophobicContact CZ-CB 3.48Å; F170-V187 VanDerWaalsContact CZ-CB 3.48Å; F170-V187 HydrophobicContact CZ-CG1 3.85Å; F170-V187 HydrophobicContact CZ-CG2 3.54Å; F170-V187 PolarHBondContact N-O 2.85Å; F170-V187 VanDerWaalsContact N-O 3.09Å; F170-V187 PolarHBondContact O-N 3.03Å; V187-H202 WeakPolarHBondContact CG1-NE2 3.07Å
188	E	95.4	Very high	89.8	Confident	67 Å²	67	64 Å²	64	31%	0.313	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	130.6	173.2	-171.1	-172	170.4	0	0	109.9	Y53 L169 P190	Y53-E188 PolarHBondContact OH-O 3.18Å; Y53-E188 VanDerWaalsContact OH-O 3.07Å; L169-E188 HydrophobicContact CB-CB 4.21Å; L169-E188 HydrophobicContact CB-CG 4.39Å; E188-P190 WeakPolarHBondContact O-CD 3.24Å
189	V	95.8	Very high	91.2	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-66.3	123.1	172.4	178.9	0	0	0	0	108.8	F152 Y154 S168 K191 I194 V200	F152-V189 HydrophobicContact CD2-CG2 4.08Å; F152-V189 HydrophobicContact CE2-CG2 4.4Å; Y154-V189 HydrophobicContact CE2-CG1 4.33Å; S168-V189 PolarHBondContact O-N 3.06Å; V189-K191 PolarHBondContact O-N 3.24Å; V189-K191 VanDerWaalsContact O-N 3.13Å; V189-I194 HydrophobicContact CB-CD1 4.47Å; V189-I194 HydrophobicContact CB-CG1 4.46Å; V189-I194 HydrophobicContact CG1-CD1 4.45Å; V189-I194 HydrophobicContact CG1-CG1 3.92Å; V189-V200 HydrophobicContact CG1-CG2 3.84Å; V189-V200 HydrophobicContact CG2-CB 4.47Å; V189-V200 HydrophobicContact CG2-CG1 4.07Å; V189-V200 HydrophobicContact CG2-CG2 4.41Å
190	P	94.6	Very high	92.4	Very high	32 Å²	32	52.8 Å²	52.8	21%	0.208	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-61.9	123.3	-178.1	-16.2	25.7	0	0	0	110.8	I60 E188 K192 W193	I60-P190 HydrophobicContact CD1-CG 4.31Å; E188-P190 WeakPolarHBondContact O-CD 3.24Å; P190-K192 PolarHBondContact O-N 3.22Å; P190-W193 WeakPolarHBondContact O-CB 3.16Å; P190-W193 PolarHBondContact O-N 3.22Å
191	K	91.8	Very high	93.3	Very high	64 Å²	64	44 Å²	44	28%	0.278	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-47.1	-31.7	-174.8	-69.8	158.3	163.2	-173.2	0	115.6	K163 D164 V189 W193 I194	K163-K191 HydrophobicContact CG-CB 4.07Å; K163-K191 HydrophobicContact CG-CD 4Å; K163-K191 WeakPolarHBondContact O-CD 3.4Å; K163-K191 VanDerWaalsContact O-CE 3.22Å; K163-K191 WeakPolarHBondContact O-CE 3.21Å; D164-K191 IonicContact OD1-NZ 2.64Å; D164-K191 PolarHBondContact OD1-NZ 3.37Å; V189-K191 PolarHBondContact O-N 3.24Å; V189-K191 VanDerWaalsContact O-N 3.13Å; K191-W193 PolarHBondContact O-N 3.5Å; K191-I194 PolarHBondContact O-N 3.4Å
192	K	92.1	Very high	94	Very high	111 Å²	111	39.3 Å²	39.3	48%	0.483	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-61.8	-20.8	177.5	71.3	-177.6	-174.6	-175.6	0	113.3	E44 E49 P190	E44-K192 IonicContact OE1-NZ 2.64Å; E44-K192 PolarHBondContact OE1-NZ 3Å; E44-K192 IonicContact OE2-NZ 3.77Å; E44-K192 PolarHBondContact OE2-NZ 3.09Å; E44-K192 VanDerWaalsContact OE2-NZ 3.07Å; E49-K192 WeakPolarHBondContact OE2-CE 3.06Å; E49-K192 IonicContact OE2-NZ 3.69Å; E49-K192 PolarHBondContact OE2-NZ 3.21Å; P190-K192 PolarHBondContact O-N 3.22Å
193	W	94.8	Very high	94.3	Very high	10 Å²	10	36.3 Å²	36.3	4%	0.038	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-98.1	-13.3	-178.8	-63.3	117.9	0	0	0	113.7	E44 N45 E49 I60 L62 P190 K191 Q195 T198	E44-W193 HydrophobicContact CG-CZ2 4.01Å; N45-W193 WeakPolarHBondContact O-CH2 3.11Å; E49-W193 HydrophobicContact CB-CH2 4.47Å; E49-W193 HydrophobicContact CB-CZ2 3.62Å; E49-W193 HydrophobicContact CG-CZ2 4.5Å; E49-W193 PolarHBondContact OE2-NE1 3.29Å; I60-W193 HydrophobicContact CB-CD2 4.41Å; I60-W193 HydrophobicContact CB-CG 4.47Å; I60-W193 HydrophobicContact CD1-CB 3.96Å; I60-W193 HydrophobicContact CD1-CD2 4.23Å; I60-W193 HydrophobicContact CD1-CG 3.57Å; I60-W193 HydrophobicContact CG2-CB 3.79Å; I60-W193 HydrophobicContact CG2-CD2 3.63Å; I60-W193 HydrophobicContact CG2-CE3 3.66Å; I60-W193 HydrophobicContact CG2-CG 3.69Å; I60-W193 HydrophobicContact CG2-CZ3 4.46Å; L62-W193 HydrophobicContact CD1-CE3 4.31Å; L62-W193 HydrophobicContact CD1-CZ3 3.91Å; L62-W193 HydrophobicContact CD2-CE3 3.76Å; L62-W193 HydrophobicContact CD2-CZ3 4.11Å; L62-W193 HydrophobicContact CG-CE3 4Å; L62-W193 HydrophobicContact CG-CZ3 3.81Å; P190-W193 WeakPolarHBondContact O-CB 3.16Å; P190-W193 PolarHBondContact O-N 3.22Å; K191-W193 PolarHBondContact O-N 3.5Å; W193-Q195 PolarHBondContact O-N 2.88Å; W193-T198 WeakPolarHBondContact O-CB 3.43Å; W193-T198 VanDerWaalsContact O-CG2 3.28Å; W193-T198 WeakPolarHBondContact O-CG2 3.03Å; W193-T198 PolarHBondContact O-OG1 3.34Å
194	I	93.1	Very high	94.5	Very high	15 Å²	15	35.8 Å²	35.8	8%	0.077	18%	0.175	C	C	.	.			trans	-75.5	90.1	-179.8	-57.9	-177.9	0	0	0	108.9	F138 Y154 V157 V166 V189 K191	F138-I194 HydrophobicContact CE2-CG2 4.03Å; Y154-I194 HydrophobicContact CD1-CG2 3.89Å; Y154-I194 HydrophobicContact CE1-CB 4.43Å; Y154-I194 HydrophobicContact CE1-CG1 4.31Å; Y154-I194 HydrophobicContact CE1-CG2 3.64Å; Y154-I194 HydrophobicContact CE2-CG1 4.37Å; V157-I194 HydrophobicContact CG1-CG2 4.35Å; V157-I194 HydrophobicContact CG2-CG2 4.41Å; V166-I194 HydrophobicContact CG2-CB 4.47Å; V166-I194 HydrophobicContact CG2-CG2 3.76Å; V189-I194 HydrophobicContact CB-CD1 4.47Å; V189-I194 HydrophobicContact CB-CG1 4.46Å; V189-I194 HydrophobicContact CG1-CD1 4.45Å; V189-I194 HydrophobicContact CG1-CG1 3.92Å; K191-I194 PolarHBondContact O-N 3.4Å
195	Q	93.4	Very high	94.5	Very high	86 Å²	86	30.7 Å²	30.7	40%	0.402	16%	0.157	S	C	.	.	S	Bend	trans	-150.4	161.6	176.4	63.1	-178.4	-24.8	0	0	110.6	L62 Y154 W193 G197 T198	L62-Q195 HydrophobicContact CD2-CG 4.07Å; Y154-Q195 VanDerWaalsContact CB-O 3.23Å; Y154-Q195 WeakPolarHBondContact CB-O 3.31Å; W193-Q195 PolarHBondContact O-N 2.88Å; Q195-G197 PolarHBondContact O-N 3.16Å; Q195-T198 VanDerWaalsContact CG-OG1 3.31Å; Q195-T198 WeakPolarHBondContact CG-OG1 3.14Å; Q195-T198 WeakPolarHBondContact O-CB 3.15Å; Q195-T198 PolarHBondContact O-N 2.9Å; Q195-T198 VanDerWaalsContact O-N 3.15Å; Q195-T198 PolarHBondContact O-OG1 2.61Å; Q195-T198 VanDerWaalsContact O-OG1 3.08Å
196	S	94.1	Very high	94.2	Very high	56 Å²	56	32.7 Å²	32.7	39%	0.392	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	134.1	-179.5	-53.2	0	0	0	0	111.6	Y154 V157 T198	Y154-S196 CarbonylContact O-C 2.99Å; Y154-S196 WeakPolarHBondContact O-CA 2.93Å; V157-S196 PolarHBondContact N-OG 2.92Å; V157-S196 PolarHBondContact O-OG 3.46Å; S196-T198 VanDerWaalsContact C-N 3.35Å
197	G	94.8	Very high	94	Very high	12 Å²	12	31.7 Å²	31.7	12%	0.124	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	80	9.2	-178.5	0	0	0	0	0	114.7	N63 Q64 Y154 Q195	N63-G197 PolarHBondContact N-O 2.9Å; Q64-G197 PolarHBondContact N-O 3.14Å; Y154-G197 PolarHBondContact O-N 2.87Å; Q195-G197 PolarHBondContact O-N 3.16Å
198	T	96.8	Very high	93.8	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	131.7	171.7	-59.4	0	0	0	0	110.8	I60 R61 L62 Y154 W193 Q195 S196 V200	I60-T198 HydrophobicContact CG2-CG2 3.78Å; R61-T198 WeakPolarHBondContact O-CA 3.15Å; L62-T198 HydrophobicContact CD2-CG2 4.06Å; L62-T198 WeakPolarHBondContact CD2-OG1 3.44Å; Y154-T198 HydrophobicContact CD2-CG2 4.12Å; Y154-T198 HydrophobicContact CE2-CG2 4.48Å; Y154-T198 PolarHBondContact N-O 3.22Å; W193-T198 WeakPolarHBondContact O-CB 3.43Å; W193-T198 VanDerWaalsContact O-CG2 3.28Å; W193-T198 WeakPolarHBondContact O-CG2 3.03Å; W193-T198 PolarHBondContact O-OG1 3.34Å; Q195-T198 VanDerWaalsContact CG-OG1 3.31Å; Q195-T198 WeakPolarHBondContact CG-OG1 3.14Å; Q195-T198 WeakPolarHBondContact O-CB 3.15Å; Q195-T198 PolarHBondContact O-N 2.9Å; Q195-T198 VanDerWaalsContact O-N 3.15Å; Q195-T198 PolarHBondContact O-OG1 2.61Å; Q195-T198 VanDerWaalsContact O-OG1 3.08Å; S196-T198 VanDerWaalsContact C-N 3.35Å; T198-V200 HydrophobicContact CG2-CG2 3.87Å
199	L	96.6	Very high	93.5	Very high	11 Å²	11	31.2 Å²	31.2	6%	0.058	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	128.1	165.8	-179.7	63.2	0	0	0	109.2	R61 Q64 P67 A151 Y153 E201	R61-L199 PolarHBondContact N-O 2.84Å; R61-L199 PolarHBondContact O-N 2.79Å; Q64-L199 HydrophobicContact CB-CB 3.77Å; Q64-L199 HydrophobicContact CB-CD2 4.46Å; Q64-L199 HydrophobicContact CG-CB 3.67Å; Q64-L199 HydrophobicContact CG-CD2 4.37Å; P67-L199 HydrophobicContact CG-CD1 4.3Å; A151-L199 HydrophobicContact CB-CD1 4.32Å; Y153-L199 HydrophobicContact CD2-CB 4.23Å; Y153-L199 HydrophobicContact CD2-CD1 4.29Å; L199-E201 HydrophobicContact CD1-CG 4.24Å; L199-E201 HydrophobicContact CD2-CG 4.14Å; L199-E201 HydrophobicContact CG-CG 3.91Å
200	V	97.4	Very high	93.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	122.5	174.5	-174.8	0	0	0	0	108.6	Q58 L59 I60 A151 F152 Y154 V189 T198 H202	Q58-V200 HydrophobicContact CG-CG1 3.66Å; L59-V200 CarbonylContact O-C 2.64Å; L59-V200 WeakPolarHBondContact O-CA 3.28Å; I60-V200 HydrophobicContact CG1-CB 4.49Å; I60-V200 HydrophobicContact CG1-CG1 3.95Å; I60-V200 HydrophobicContact CG1-CG2 4.08Å; I60-V200 HydrophobicContact CG2-CG2 4.27Å; A151-V200 CarbonylContact C-O 3.46Å; A151-V200 WeakPolarHBondContact CA-O 3.34Å; A151-V200 WeakPolarHBondContact CB-O 3.47Å; F152-V200 HydrophobicContact CB-CB 4.35Å; F152-V200 PolarHBondContact N-O 2.8Å; F152-V200 PolarHBondContact O-N 3.13Å; Y154-V200 HydrophobicContact CE2-CG2 3.88Å; V189-V200 HydrophobicContact CG1-CG2 3.84Å; V189-V200 HydrophobicContact CG2-CB 4.47Å; V189-V200 HydrophobicContact CG2-CG1 4.07Å; V189-V200 HydrophobicContact CG2-CG2 4.41Å; T198-V200 HydrophobicContact CG2-CG2 3.87Å; V200-H202 VanDerWaalsContact CG1-CE1 3.41Å; V200-H202 WeakPolarHBondContact CG1-CE1 3.36Å
201	E	96.5	Very high	93.1	Very high	11 Å²	11	38.6 Å²	38.6	5%	0.051	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128	-177.5	-65.4	175.1	114.9	0	0	110.5	Q58 L59 R61 K149 A151 L199 N244	Q58-E201 CarbonylContact C-O 3.53Å; Q58-E201 WeakPolarHBondContact CA-O 3.37Å; L59-E201 PolarHBondContact N-O 3.36Å; L59-E201 PolarHBondContact O-N 3.07Å; R61-E201 IonicContact CZ-OE2 3.03Å; R61-E201 IonicContact NE-OE2 2.61Å; R61-E201 IonicContact NH2-OE1 2.69Å; R61-E201 IonicContact NH2-OE2 2.73Å; R61-E201 PolarHBondContact NH2-OE2 3.38Å; K149-E201 WeakPolarHBondContact CE-OE1 3.16Å; K149-E201 IonicContact NZ-OE1 3.17Å; K149-E201 PolarHBondContact NZ-OE1 2.76Å; A151-E201 HydrophobicContact CB-CG 4.09Å; L199-E201 HydrophobicContact CD1-CG 4.24Å; L199-E201 HydrophobicContact CD2-CG 4.14Å; L199-E201 HydrophobicContact CG-CG 3.91Å; E201-N244 PolarHBondContact OE2-ND2 2.81Å; E201-N244 VanDerWaalsContact OE2-ND2 3.11Å
202	H	95.9	Very high	93.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.4	177.9	-58.2	92.5	0	0	0	109.9	Y56 S57 Q58 K149 I150 F152 F170 V187 V200	Y56-H202 HydrophobicContact CD1-CB 4.08Å; S57-H202 CarbonylContact O-C 3.57Å; S57-H202 WeakPolarHBondContact O-CA 3.24Å; Q58-H202 WeakPolarHBondContact CG-NE2 3.09Å; Q58-H202 PolarHBondContact OE1-NE2 2.84Å; K149-H202 CarbonylContact C-O 3.54Å; K149-H202 WeakPolarHBondContact CA-O 3.47Å; K149-H202 WeakPolarHBondContact CG-O 3Å; I150-H202 HydrophobicContact CB-CB 4.29Å; I150-H202 PolarHBondContact N-O 2.73Å; I150-H202 WeakPolarHBondContact O-CA 3.08Å; I150-H202 WeakPolarHBondContact O-CB 3.48Å; I150-H202 PolarHBondContact O-N 3.39Å; I150-H202 PolarHBondContact O-ND1 2.91Å; F152-H202 AromaticContact CD2-CE1 3.76Å; F152-H202 AromaticContact CD2-ND1 4Å; F152-H202 AromaticContact CE2-CE1 3.71Å; F152-H202 AromaticContact CE2-ND1 3.92Å; F170-H202 HydrophobicContact CE1-CB 4Å; F170-H202 AromaticContact CE1-CD2 3.54Å; F170-H202 AromaticContact CE1-CE1 3.71Å; F170-H202 AromaticContact CE1-CG 3.44Å; F170-H202 VanDerWaalsContact CE1-CG 3.44Å; F170-H202 AromaticContact CE1-ND1 3.58Å; F170-H202 AromaticContact CE1-NE2 3.7Å; F170-H202 HydrophobicContact CZ-CB 4.02Å; F170-H202 AromaticContact CZ-CD2 3.94Å; F170-H202 AromaticContact CZ-CG 3.88Å; V187-H202 WeakPolarHBondContact CG1-NE2 3.07Å; V200-H202 VanDerWaalsContact CG1-CE1 3.41Å; V200-H202 WeakPolarHBondContact CG1-CE1 3.36Å
203	E	94.1	Very high	93.2	Very high	17 Å²	17	38.9 Å²	38.9	8%	0.079	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	141.2	179.7	-70.5	172.7	-153.2	0	0	110	Y56 S57 K149 L205 D241 N244 K248	Y56-E203 CarbonylContact C-O 3.54Å; Y56-E203 WeakPolarHBondContact CA-O 3.4Å; S57-E203 PolarHBondContact N-O 3.05Å; S57-E203 PolarHBondContact O-N 3.35Å; S57-E203 PolarHBondContact OG-O 2.89Å; K149-E203 HydrophobicContact CD-CG 4.36Å; K149-E203 HydrophobicContact CG-CG 4.23Å; E203-L205 PolarHBondContact O-N 3.19Å; E203-D241 VanDerWaalsContact OE1-CB 3.29Å; E203-D241 WeakPolarHBondContact OE1-CB 3.09Å; E203-N244 PolarHBondContact OE1-ND2 3.31Å; E203-K248 IonicContact OE1-NZ 2.67Å; E203-K248 IonicContact OE2-NZ 3.51Å; E203-K248 PolarHBondContact OE2-NZ 3.38Å
204	V	92.4	Very high	93.1	Very high	43 Å²	43	42.1 Å²	42.1	26%	0.261	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	126.8	175.7	-179.7	0	0	0	0	109.9	Y55 Y56 G206	Y55-V204 HydrophobicContact CD1-CG1 4.21Å; Y55-V204 HydrophobicContact CD1-CG2 4.49Å; Y55-V204 HydrophobicContact CE1-CB 4.33Å; Y55-V204 HydrophobicContact CE1-CG1 3.62Å; Y55-V204 HydrophobicContact CE1-CG2 3.88Å; Y56-V204 HydrophobicContact CD1-CG2 4.32Å; Y56-V204 HydrophobicContact CE1-CG2 3.84Å; V204-G206 VanDerWaalsContact C-N 3.3Å; V204-G206 PolarHBondContact O-N 3.04Å
205	L	90.9	Very high	93.1	Very high	8 Å²	8	46.4 Å²	46.4	4%	0.042	26%	0.262	C	S	.	.			trans	-66.6	-32.8	179.7	-79.7	169.3	0	0	0	112.7	H52 Y53 Y55 Y56 E203 A238	H52-L205 HydrophobicContact CB-CD1 4.38Å; H52-L205 VanDerWaalsContact CE1-CD2 3.42Å; H52-L205 WeakPolarHBondContact CE1-CD2 3.31Å; Y53-L205 WeakPolarHBondContact O-CD1 3.19Å; Y55-L205 PolarHBondContact O-N 3.44Å; Y56-L205 WeakPolarHBondContact O-CD1 3.44Å; E203-L205 PolarHBondContact O-N 3.19Å; L205-A238 WeakPolarHBondContact O-CB 3.06Å
206	G	88.1	Confident	93.2	Very high	43 Å²	43	44.8 Å²	44.8	44%	0.443	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	-146	-173.4	0	0	0	0	0	111.9	V204	V204-G206 VanDerWaalsContact C-N 3.3Å; V204-G206 PolarHBondContact O-N 3.04Å
207	D	89.4	Confident	93.2	Very high	79 Å²	79	42.1 Å²	42.1	42%	0.422	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-7.6	-175.3	-63.7	-40.8	0	0	0	114.6	S209 K210 H211	D207-S209 VanDerWaalsContact C-N 3.26Å; D207-S209 PolarHBondContact O-N 3.36Å; D207-K210 HydrophobicContact CB-CD 4.21Å; D207-K210 VanDerWaalsContact O-CB 3.31Å; D207-K210 WeakPolarHBondContact O-CB 3.33Å; D207-K210 PolarHBondContact O-N 3.2Å; D207-K210 WeakPolarHBondContact OD1-CE 3.32Å; D207-K210 IonicContact OD1-NZ 2.89Å; D207-K210 PolarHBondContact OD1-NZ 2.79Å; D207-H211 PolarHBondContact O-CD2 2.99Å
208	C	91.9	Very high	93	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-58	-42.6	-176.8	-67.8	0	0	0	0	110.9	K210 H211 C227 C236 A238	C208-K210 PolarHBondContact O-N 2.84Å; C208-H211 PolarHBondContact O-CD2 3.03Å; C208-H211 PolarHBondContact O-N 3.45Å; C208-C227 HydrophobicContact CB-CB 3.81Å; C208-C227 WeakPolarHBondContact CB-SG 3.29Å; C208-C227 WeakPolarHBondContact SG-CB 3.24Å; C208-C227 CovalentContact SG-SG 2.04Å; C208-C227 PolarHBondContact SG-SG 2.87Å; C208-C236 WeakPolarHBondContact O-CB 3.49Å; C208-C236 PolarHBondContact O-SG 2.93Å; C208-A238 HydrophobicContact CB-CB 4.25Å
209	S	89.8	Confident	92.8	Very high	57 Å²	57	53.5 Å²	53.5	40%	0.399	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-63.2	-12.4	179.6	56.3	0	0	0	0	114.8	D207 H211 C236	D207-S209 VanDerWaalsContact C-N 3.26Å; D207-S209 PolarHBondContact O-N 3.36Å; S209-H211 VanDerWaalsContact C-N 3.31Å; S209-C236 VanDerWaalsContact CA-O 3.28Å; S209-C236 WeakPolarHBondContact CA-O 3.4Å; S209-C236 PolarHBondContact N-O 3.02Å
210	K	89.4	Confident	92.6	Very high	137 Å²	137	53.6 Å²	53.6	60%	0.596	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-77.4	-18	175.1	-60.2	177.3	178.1	168.5	0	112.6	D207 C208	D207-K210 HydrophobicContact CB-CD 4.21Å; D207-K210 VanDerWaalsContact O-CB 3.31Å; D207-K210 WeakPolarHBondContact O-CB 3.33Å; D207-K210 PolarHBondContact O-N 3.2Å; D207-K210 WeakPolarHBondContact OD1-CE 3.32Å; D207-K210 IonicContact OD1-NZ 2.89Å; D207-K210 PolarHBondContact OD1-NZ 2.79Å; C208-K210 PolarHBondContact O-N 2.84Å
211	H	92.5	Very high	92.1	Very high	51 Å²	51	59.6 Å²	59.6	24%	0.236	32%	0.322	C	S	.	.			trans	-85.6	122.6	179	-60.1	-77.9	0	0	0	110.5	D207 C208 S209 T216 C217 A220 C236	D207-H211 PolarHBondContact O-CD2 2.99Å; C208-H211 PolarHBondContact O-CD2 3.03Å; C208-H211 PolarHBondContact O-N 3.45Å; S209-H211 VanDerWaalsContact C-N 3.31Å; H211-T216 PolarHBondContact ND1-O 2.9Å; H211-T216 VanDerWaalsContact ND1-O 3.09Å; H211-C217 HydrophobicContact CB-CB 4.2Å; H211-A220 WeakPolarHBondContact NE2-CB 3.33Å; H211-C236 HydrophobicContact CB-CB 4.12Å; H211-C236 VanDerWaalsContact O-CB 3.31Å; H211-C236 WeakPolarHBondContact O-CB 3.28Å
212	N	91.9	Very high	91.7	Very high	140 Å²	140	62.1 Å²	62.1	75%	0.749	34%	0.338	S	S	*	.			trans	-107.7	15	-172.4	66.1	-10.7	0	0	0	113.9
213	S	92.8	Very high	91.2	Very high	40 Å²	40	68.5 Å²	68.5	28%	0.28	38%	0.38	S	S	.	.	S	Bend	trans	-145.4	154.5	175.3	76.4	0	0	0	0	110.3	N215 T216 C217	S213-N215 PolarHBondContact O-N 2.52Å; S213-T216 PolarHBondContact N-OG1 2.04Å; S213-T216 PolarHBondContact O-N 3.48Å; S213-T216 PolarHBondContact O-OG1 3.05Å; S213-T216 VanDerWaalsContact O-OG1 3.11Å; S213-T216 WeakPolarHBondContact OG-CB 3.21Å; S213-T216 WeakPolarHBondContact OG-CG2 3.42Å; S213-T216 PolarHBondContact OG-N 2.95Å; S213-T216 PolarHBondContact OG-OG1 2.86Å; S213-C217 WeakPolarHBondContact O-CB 3.31Å; S213-C217 PolarHBondContact O-N 2.95Å
214	I	93	Very high	90.7	Very high	78 Å²	78	74.9 Å²	74.9	40%	0.4	41%	0.414	S	S	.	.	H	α-helix	trans	-51.9	-52.7	176.9	-172.6	169.3	0	0	0	112	T216 C217 E218 W229	I214-T216 PolarHBondContact O-N 3.28Å; I214-C217 WeakPolarHBondContact O-CB 3.37Å; I214-C217 PolarHBondContact O-N 3.4Å; I214-C217 VanDerWaalsContact O-N 3.15Å; I214-E218 HydrophobicContact CG1-CG 4.39Å; I214-E218 WeakPolarHBondContact O-CG 3.44Å; I214-E218 PolarHBondContact O-N 2.84Å; I214-W229 HydrophobicContact CB-CD2 4.2Å; I214-W229 HydrophobicContact CB-CG 4.01Å; I214-W229 HydrophobicContact CG1-CB 4.19Å; I214-W229 HydrophobicContact CG1-CG 4.02Å
215	N	93.5	Very high	90.5	Very high	105 Å²	105	74.9 Å²	74.9	56%	0.561	41%	0.411	S	S	*	.	H	α-helix	trans	-60.1	-47.5	-177.9	-62.2	-18.2	0	0	0	111.4	S213 C217 E218 D219	S213-N215 PolarHBondContact O-N 2.52Å; N215-C217 VanDerWaalsContact C-N 3.27Å; N215-C217 PolarHBondContact O-N 3.1Å; N215-E218 PolarHBondContact O-N 3.12Å; N215-D219 VanDerWaalsContact O-CB 3.26Å; N215-D219 WeakPolarHBondContact O-CB 3.37Å; N215-D219 PolarHBondContact O-N 3.28Å
216	T	95.4	Very high	90.5	Very high	52 Å²	52	75.9 Å²	75.9	32%	0.319	42%	0.417	S	S	.	.	H	α-helix	trans	-68.2	-28.1	-179.2	56.9	0	0	0	0	112.8	H211 S213 I214 A220	H211-T216 PolarHBondContact ND1-O 2.9Å; H211-T216 VanDerWaalsContact ND1-O 3.09Å; S213-T216 PolarHBondContact N-OG1 2.04Å; S213-T216 PolarHBondContact O-N 3.48Å; S213-T216 PolarHBondContact O-OG1 3.05Å; S213-T216 VanDerWaalsContact O-OG1 3.11Å; S213-T216 WeakPolarHBondContact OG-CB 3.21Å; S213-T216 WeakPolarHBondContact OG-CG2 3.42Å; S213-T216 PolarHBondContact OG-N 2.95Å; S213-T216 PolarHBondContact OG-OG1 2.86Å; I214-T216 PolarHBondContact O-N 3.28Å; T216-A220 WeakPolarHBondContact O-CB 3.06Å; T216-A220 PolarHBondContact O-N 2.84Å
217	C	94.8	Very high	90.7	Very high	0 Å²	0	74.3 Å²	74.3	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-72	-47.8	175	-176.5	0	0	0	0	111.9	H211 S213 I214 N215 A220 C227 I228 W229 C236	H211-C217 HydrophobicContact CB-CB 4.2Å; S213-C217 WeakPolarHBondContact O-CB 3.31Å; S213-C217 PolarHBondContact O-N 2.95Å; I214-C217 WeakPolarHBondContact O-CB 3.37Å; I214-C217 PolarHBondContact O-N 3.4Å; I214-C217 VanDerWaalsContact O-N 3.15Å; N215-C217 VanDerWaalsContact C-N 3.27Å; N215-C217 PolarHBondContact O-N 3.1Å; C217-A220 WeakPolarHBondContact O-CB 3.48Å; C217-A220 PolarHBondContact O-N 3.27Å; C217-C227 WeakPolarHBondContact O-CB 3.5Å; C217-I228 PolarHBondContact SG-O 2.88Å; C217-W229 HydrophobicContact CB-CB 4.4Å; C217-W229 HydrophobicContact CB-CE3 3.7Å; C217-W229 HydrophobicContact CB-CZ3 4.44Å; C217-C236 VanDerWaalsContact CA-SG 3.5Å; C217-C236 HydrophobicContact CB-CB 3.61Å; C217-C236 WeakPolarHBondContact CB-SG 3.28Å; C217-C236 VanDerWaalsContact SG-CA 3.57Å; C217-C236 WeakPolarHBondContact SG-CB 3.4Å; C217-C236 CovalentContact SG-SG 2.02Å; C217-C236 PolarHBondContact SG-SG 3.17Å
218	E	90.8	Very high	90.9	Very high	114 Å²	114	71.5 Å²	71.5	53%	0.533	38%	0.384	S	S	.	.	H	α-helix	trans	-65.8	-39.8	179.6	-69.2	-179.3	165.3	0	0	111.7	I214 N215 A220 K221	I214-E218 HydrophobicContact CG1-CG 4.39Å; I214-E218 WeakPolarHBondContact O-CG 3.44Å; I214-E218 PolarHBondContact O-N 2.84Å; N215-E218 PolarHBondContact O-N 3.12Å; E218-A220 PolarHBondContact O-N 2.82Å; E218-K221 PolarHBondContact O-N 2.86Å
219	D	92.6	Very high	91	Very high	137 Å²	137	73.4 Å²	73.4	73%	0.733	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-17.9	176.8	-72	-21.7	0	0	0	113.1	N215 K221	N215-D219 VanDerWaalsContact O-CB 3.26Å; N215-D219 WeakPolarHBondContact O-CB 3.37Å; N215-D219 PolarHBondContact O-N 3.28Å; D219-K221 PolarHBondContact O-N 2.89Å
220	A	91.4	Very high	91.2	Very high	13 Å²	13	70.8 Å²	70.8	11%	0.107	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.2	-179.2	0	0	0	0	0	114.1	H211 T216 C217 E218 T222 K225	H211-A220 WeakPolarHBondContact NE2-CB 3.33Å; T216-A220 WeakPolarHBondContact O-CB 3.06Å; T216-A220 PolarHBondContact O-N 2.84Å; C217-A220 WeakPolarHBondContact O-CB 3.48Å; C217-A220 PolarHBondContact O-N 3.27Å; E218-A220 PolarHBondContact O-N 2.82Å; A220-T222 PolarHBondContact O-N 2.95Å; A220-K225 WeakPolarHBondContact O-CE 3.27Å
221	K	87.9	Confident	91.3	Very high	126 Å²	126	70.2 Å²	70.2	55%	0.548	37%	0.373	S	S	.	.			trans	-66	130.1	179.7	-168.4	166.4	-174.5	170.9	0	110.9	E218 D219 K225 T226	E218-K221 PolarHBondContact O-N 2.86Å; D219-K221 PolarHBondContact O-N 2.89Å; K221-K225 WeakPolarHBondContact CA-O 3.29Å; K221-T226 HydrophobicContact CD-CG2 4.26Å; K221-T226 WeakPolarHBondContact CE-OG1 3.5Å
222	T	87.5	Confident	91.2	Very high	64 Å²	64	76.4 Å²	76.4	39%	0.393	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-126.8	166.7	174.9	70.3	0	0	0	0	109.1	A220 D224 K225	A220-T222 PolarHBondContact O-N 2.95Å; T222-D224 PolarHBondContact O-N 3.09Å; T222-D224 VanDerWaalsContact O-N 3.08Å; T222-K225 PolarHBondContact N-O 2.72Å; T222-K225 CarbonylContact O-C 3.6Å; T222-K225 PolarHBondContact O-N 3.42Å; T222-K225 VanDerWaalsContact O-N 3.1Å; T222-K225 VanDerWaalsContact OG1-CB 3.26Å; T222-K225 WeakPolarHBondContact OG1-CB 3.01Å; T222-K225 PolarHBondContact OG1-N 3.37Å
223	P	84.5	Confident	91.2	Very high	135 Å²	135	70.3 Å²	70.3	88%	0.877	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	-32.4	177.6	-28.9	37.1	0	0	0	114.3
224	D	83.7	Confident	91.2	Very high	150 Å²	150	74 Å²	74	80%	0.802	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	1.4	-176.7	-51.4	-46.5	0	0	0	113.4	T222	T222-D224 PolarHBondContact O-N 3.09Å; T222-D224 VanDerWaalsContact O-N 3.08Å
225	K	88.2	Confident	91.2	Very high	44 Å²	44	71 Å²	71	19%	0.191	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-144.6	120.1	-174.9	-173.4	-179.3	65.4	176.1	0	111.4	A220 K221 T222 N240	A220-K225 WeakPolarHBondContact O-CE 3.27Å; K221-K225 WeakPolarHBondContact CA-O 3.29Å; T222-K225 PolarHBondContact N-O 2.72Å; T222-K225 CarbonylContact O-C 3.6Å; T222-K225 PolarHBondContact O-N 3.42Å; T222-K225 VanDerWaalsContact O-N 3.1Å; T222-K225 VanDerWaalsContact OG1-CB 3.26Å; T222-K225 WeakPolarHBondContact OG1-CB 3.01Å; T222-K225 PolarHBondContact OG1-N 3.37Å; K225-N240 VanDerWaalsContact CA-OD1 3.28Å; K225-N240 WeakPolarHBondContact CA-OD1 3.39Å
226	T	91.7	Very high	91.2	Very high	29 Å²	29	66 Å²	66	18%	0.178	34%	0.342	C	S	.	.			trans	-107.3	126.2	170	-60.6	0	0	0	0	109.7	K221 S239 N240	K221-T226 HydrophobicContact CD-CG2 4.26Å; K221-T226 WeakPolarHBondContact CE-OG1 3.5Å; T226-S239 PolarHBondContact O-N 3.2Å; T226-N240 PolarHBondContact N-OD1 2.83Å; T226-N240 PolarHBondContact O-OD1 3.08Å
227	C	93.3	Very high	91.2	Very high	10 Å²	10	63.6 Å²	63.6	7%	0.068	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	145.6	171.2	-55.1	0	0	0	0	109.9	C208 C217 T237	C208-C227 HydrophobicContact CB-CB 3.81Å; C208-C227 WeakPolarHBondContact CB-SG 3.29Å; C208-C227 WeakPolarHBondContact SG-CB 3.24Å; C208-C227 CovalentContact SG-SG 2.04Å; C208-C227 PolarHBondContact SG-SG 2.87Å; C217-C227 WeakPolarHBondContact O-CB 3.5Å; C227-T237 CarbonylContact C-O 3.49Å; C227-T237 VanDerWaalsContact CA-O 3.26Å; C227-T237 WeakPolarHBondContact CA-O 3.13Å
228	I	93	Very high	91	Very high	20 Å²	20	63.7 Å²	63.7	10%	0.103	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.4	178	-58.6	174.9	0	0	0	108.5	C217 C236 T237 S239 K248 I249 C252	C217-I228 PolarHBondContact SG-O 2.88Å; I228-C236 CarbonylContact O-C 3.49Å; I228-C236 WeakPolarHBondContact O-CA 3.29Å; I228-T237 HydrophobicContact CB-CG2 4.29Å; I228-T237 PolarHBondContact N-O 2.8Å; I228-T237 PolarHBondContact O-N 2.75Å; I228-S239 VanDerWaalsContact CD1-OG 3.26Å; I228-S239 WeakPolarHBondContact CD1-OG 3.37Å; I228-K248 HydrophobicContact CD1-CB 4.23Å; I228-I249 HydrophobicContact CD1-CB 4.44Å; I228-I249 HydrophobicContact CD1-CD1 4.41Å; I228-I249 HydrophobicContact CD1-CG1 3.41Å; I228-I249 VanDerWaalsContact CD1-CG1 3.41Å; I228-I249 HydrophobicContact CG1-CG1 4.4Å; I228-C252 HydrophobicContact CG2-CB 4.15Å
229	W	94.5	Very high	91.1	Very high	39 Å²	39	58.3 Å²	58.3	15%	0.148	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130	171.5	-172.9	-103.8	0	0	0	111	I214 C217 D234 C236	I214-W229 HydrophobicContact CB-CD2 4.2Å; I214-W229 HydrophobicContact CB-CG 4.01Å; I214-W229 HydrophobicContact CG1-CB 4.19Å; I214-W229 HydrophobicContact CG1-CG 4.02Å; C217-W229 HydrophobicContact CB-CB 4.4Å; C217-W229 HydrophobicContact CB-CE3 3.7Å; C217-W229 HydrophobicContact CB-CZ3 4.44Å; W229-D234 HydrophobicContact CZ2-CB 4.37Å; W229-C236 HydrophobicContact CE3-CB 3.84Å; W229-C236 HydrophobicContact CZ3-CB 4.01Å
230	C	94	Very high	90.6	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.014	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	90.5	179.8	-54	0	0	0	0	109.7	I42 K232 S233 D234 I235 C252	I42-C230 HydrophobicContact CG2-CB 3.72Å; C230-K232 PolarHBondContact O-N 3.38Å; C230-S233 WeakPolarHBondContact CB-OG 2.98Å; C230-S233 PolarHBondContact O-N 2.76Å; C230-S233 PolarHBondContact O-OG 3.26Å; C230-D234 PolarHBondContact O-N 3.45Å; C230-D234 VanDerWaalsContact O-N 3.07Å; C230-I235 PolarHBondContact N-O 2.91Å; C230-C252 HydrophobicContact CB-CB 3.63Å; C230-C252 WeakPolarHBondContact CB-SG 3.47Å; C230-C252 WeakPolarHBondContact SG-CB 3.43Å; C230-C252 CovalentContact SG-SG 2.03Å; C230-C252 PolarHBondContact SG-SG 3.36Å
231	E	91.5	Very high	90.3	Very high	126 Å²	126	56.2 Å²	56.2	59%	0.589	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-55.4	-46.2	-165.8	-171.1	173	-168	0	0	113.2	S233 D234	E231-S233 PolarHBondContact O-N 3.05Å; E231-S233 VanDerWaalsContact O-N 3.1Å; E231-D234 PolarHBondContact O-N 3.06Å
232	K	90.1	Very high	90.2	Very high	180 Å²	180	58.7 Å²	58.7	78%	0.783	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-58.3	-29.4	179.6	-174.7	179.2	179.2	-177.1	0	113.8	C230	C230-K232 PolarHBondContact O-N 3.38Å
233	S	91.2	Very high	90	Very high	12 Å²	12	61.9 Å²	61.9	8%	0.084	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-106.7	-5.1	-173.3	69.1	0	0	0	0	113.4	K40 I42 C230 E231 I235	K40-S233 VanDerWaalsContact CE-O 3.28Å; K40-S233 WeakPolarHBondContact CE-O 3.21Å; K40-S233 PolarHBondContact NZ-O 3.29Å; I42-S233 WeakPolarHBondContact CG2-OG 3.1Å; C230-S233 WeakPolarHBondContact CB-OG 2.98Å; C230-S233 PolarHBondContact O-N 2.76Å; C230-S233 PolarHBondContact O-OG 3.26Å; E231-S233 PolarHBondContact O-N 3.05Å; E231-S233 VanDerWaalsContact O-N 3.1Å; S233-I235 VanDerWaalsContact C-N 3.29Å; S233-I235 PolarHBondContact O-N 2.98Å
234	D	93.1	Very high	90.2	Very high	117 Å²	117	55.5 Å²	55.5	63%	0.626	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	46.6	-172.6	-63.7	-48.8	0	0	0	113.2	W229 C230 E231	W229-D234 HydrophobicContact CZ2-CB 4.37Å; C230-D234 PolarHBondContact O-N 3.45Å; C230-D234 VanDerWaalsContact O-N 3.07Å; E231-D234 PolarHBondContact O-N 3.06Å
235	I	92.9	Very high	90.4	Very high	16 Å²	16	51.1 Å²	51.1	8%	0.082	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	139.4	-178.5	-81.3	-177.8	0	0	0	111.1	K40 I42 H52 C230 S233	K40-I235 HydrophobicContact CD-CD1 3.45Å; K40-I235 VanDerWaalsContact CD-CD1 3.45Å; K40-I235 HydrophobicContact CG-CD1 4.05Å; I42-I235 HydrophobicContact CD1-CB 4.13Å; I42-I235 HydrophobicContact CD1-CD1 3.53Å; I42-I235 HydrophobicContact CD1-CG1 4.35Å; I42-I235 HydrophobicContact CD1-CG2 4Å; H52-I235 WeakPolarHBondContact CE1-CG2 3.41Å; C230-I235 PolarHBondContact N-O 2.91Å; S233-I235 VanDerWaalsContact C-N 3.29Å; S233-I235 PolarHBondContact O-N 2.98Å
236	C	94.3	Very high	90.4	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.007	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.3	165.7	-174.2	0	0	0	0	110.1	C208 S209 H211 C217 I228 W229	C208-C236 WeakPolarHBondContact O-CB 3.49Å; C208-C236 PolarHBondContact O-SG 2.93Å; S209-C236 VanDerWaalsContact CA-O 3.28Å; S209-C236 WeakPolarHBondContact CA-O 3.4Å; S209-C236 PolarHBondContact N-O 3.02Å; H211-C236 HydrophobicContact CB-CB 4.12Å; H211-C236 VanDerWaalsContact O-CB 3.31Å; H211-C236 WeakPolarHBondContact O-CB 3.28Å; C217-C236 VanDerWaalsContact CA-SG 3.5Å; C217-C236 HydrophobicContact CB-CB 3.61Å; C217-C236 WeakPolarHBondContact CB-SG 3.28Å; C217-C236 VanDerWaalsContact SG-CA 3.57Å; C217-C236 WeakPolarHBondContact SG-CB 3.4Å; C217-C236 CovalentContact SG-SG 2.02Å; C217-C236 PolarHBondContact SG-SG 3.17Å; I228-C236 CarbonylContact O-C 3.49Å; I228-C236 WeakPolarHBondContact O-CA 3.29Å; W229-C236 HydrophobicContact CE3-CB 3.84Å; W229-C236 HydrophobicContact CZ3-CB 4.01Å
237	T	93.5	Very high	90.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152	-176.6	-165.6	0	0	0	0	112.9	Y50 H52 C227 I228	Y50-T237 HydrophobicContact CE1-CG2 4.14Å; Y50-T237 PolarHBondContact OH-OG1 3.06Å; H52-T237 PolarHBondContact CE1-OG1 3.3Å; H52-T237 VanDerWaalsContact CE1-OG1 3.27Å; H52-T237 WeakPolarHBondContact NE2-CB 3.45Å; H52-T237 PolarHBondContact NE2-OG1 3.16Å; C227-T237 CarbonylContact C-O 3.49Å; C227-T237 VanDerWaalsContact CA-O 3.26Å; C227-T237 WeakPolarHBondContact CA-O 3.13Å; I228-T237 HydrophobicContact CB-CG2 4.29Å; I228-T237 PolarHBondContact N-O 2.8Å; I228-T237 PolarHBondContact O-N 2.75Å
238	A	92.4	Very high	90.2	Very high	2 Å²	2	56 Å²	56	2%	0.017	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	138.7	175.3	0	0	0	0	0	111.2	L205 C208 K248	L205-A238 WeakPolarHBondContact O-CB 3.06Å; C208-A238 HydrophobicContact CB-CB 4.25Å; A238-K248 PolarHBondContact O-NZ 3.24Å
239	S	91.4	Very high	90.1	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.014	28%	0.276	C	S	.	.			trans	-135.8	58.7	179.5	-165.3	0	0	0	0	109.8	T226 I228 H245	T226-S239 PolarHBondContact O-N 3.2Å; I228-S239 VanDerWaalsContact CD1-OG 3.26Å; I228-S239 WeakPolarHBondContact CD1-OG 3.37Å; S239-H245 PolarHBondContact O-ND1 2.9Å; S239-H245 VanDerWaalsContact O-ND1 3.17Å; S239-H245 WeakPolarHBondContact OG-CA 3.25Å; S239-H245 PolarHBondContact OG-ND1 3.45Å
240	N	83.4	Confident	89.8	Confident	78 Å²	78	59.2 Å²	59.2	42%	0.417	29%	0.291	S	S	.	.			trans	-90.8	-20.4	-175.3	-56.8	-30.8	0	0	0	112.7	K225 T226	K225-N240 VanDerWaalsContact CA-OD1 3.28Å; K225-N240 WeakPolarHBondContact CA-OD1 3.39Å; T226-N240 PolarHBondContact N-OD1 2.83Å; T226-N240 PolarHBondContact O-OD1 3.08Å
241	D	84.5	Confident	89.7	Confident	27 Å²	27	59.5 Å²	59.5	14%	0.144	29%	0.294	C	S	.	.			trans	-80.8	115.2	175.3	-168.8	-27.6	0	0	0	109.4	K149 E203 D243 N244 H245	K149-D241 IonicContact NZ-OD2 2.7Å; K149-D241 PolarHBondContact NZ-OD2 2.86Å; E203-D241 VanDerWaalsContact OE1-CB 3.29Å; E203-D241 WeakPolarHBondContact OE1-CB 3.09Å; D241-D243 VanDerWaalsContact C-N 3.25Å; D241-D243 PolarHBondContact O-N 3.47Å; D241-D243 WeakPolarHBondContact OD1-CB 2.94Å; D241-D243 PolarHBondContact OD1-N 3.4Å; D241-N244 HydrophobicContact CB-CB 4.34Å; D241-N244 PolarHBondContact O-N 3.42Å; D241-H245 WeakPolarHBondContact O-CB 3.4Å; D241-H245 PolarHBondContact O-N 3.49Å
242	E	84.9	Confident	89.6	Confident	178 Å²	178	54 Å²	54	83%	0.832	27%	0.269	S	S	*	.	H	α-helix	trans	-60.1	-35.6	-179.5	-66.3	-173.2	173.1	0	0	111.9	N244 H245	E242-N244 PolarHBondContact O-N 3.01Å; E242-H245 PolarHBondContact O-N 3.35Å
243	D	84.5	Confident	89.4	Confident	132 Å²	132	51.6 Å²	51.6	71%	0.706	26%	0.261	S	S	*	.	H	α-helix	trans	-67.9	-28.1	-177.2	-67.1	-27.1	0	0	0	112	D241	D241-D243 VanDerWaalsContact C-N 3.25Å; D241-D243 PolarHBondContact O-N 3.47Å; D241-D243 WeakPolarHBondContact OD1-CB 2.94Å; D241-D243 PolarHBondContact OD1-N 3.4Å
244	N	87.4	Confident	88.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-108.8	-1.3	-176.7	-65.9	-29	0	0	0	112.6	L59 R61 E201 E203 D241 E242 F247 K248	L59-N244 HydrophobicContact CD2-CB 3.87Å; L59-N244 WeakPolarHBondContact CD2-OD1 3.47Å; R61-N244 VanDerWaalsContact CZ-OD1 3.28Å; R61-N244 PolarHBondContact NH1-OD1 3.49Å; R61-N244 PolarHBondContact NH2-OD1 2.89Å; E201-N244 PolarHBondContact OE2-ND2 2.81Å; E201-N244 VanDerWaalsContact OE2-ND2 3.11Å; E203-N244 PolarHBondContact OE1-ND2 3.31Å; D241-N244 HydrophobicContact CB-CB 4.34Å; D241-N244 PolarHBondContact O-N 3.42Å; E242-N244 PolarHBondContact O-N 3.01Å; N244-F247 WeakPolarHBondContact O-CB 3.44Å; N244-F247 PolarHBondContact O-N 3.35Å; N244-K248 WeakPolarHBondContact O-CG 3.2Å; N244-K248 PolarHBondContact O-N 3.01Å
245	H	88.1	Confident	86.3	Confident	59 Å²	59	56.3 Å²	56.3	27%	0.273	28%	0.283	S	S	.	.	H	α-helix	trans	-62	-55.5	-170.6	-178.6	66.6	0	0	0	112.7	S239 D241 E242 F247 K248 I249	S239-H245 PolarHBondContact O-ND1 2.9Å; S239-H245 VanDerWaalsContact O-ND1 3.17Å; S239-H245 WeakPolarHBondContact OG-CA 3.25Å; S239-H245 PolarHBondContact OG-ND1 3.45Å; D241-H245 WeakPolarHBondContact O-CB 3.4Å; D241-H245 PolarHBondContact O-N 3.49Å; E242-H245 PolarHBondContact O-N 3.35Å; H245-F247 VanDerWaalsContact C-N 3.27Å; H245-F247 PolarHBondContact O-N 3.49Å; H245-K248 PolarHBondContact O-N 2.94Å; H245-I249 VanDerWaalsContact NE2-CD1 3.26Å; H245-I249 WeakPolarHBondContact NE2-CD1 3.21Å; H245-I249 WeakPolarHBondContact O-CG1 2.99Å; H245-I249 PolarHBondContact O-N 2.84Å
246	E	88.5	Confident	83.5	Confident	139 Å²	139	61.4 Å²	61.4	65%	0.65	32%	0.321	S	S	*	.	H	α-helix	trans	-62.3	-38.3	179.1	-176.1	-180	174.3	0	0	111.2	K248 I249 N250	E246-K248 PolarHBondContact O-N 2.77Å; E246-I249 PolarHBondContact O-N 3.28Å; E246-N250 WeakPolarHBondContact O-CB 3.06Å; E246-N250 VanDerWaalsContact O-CG 3.25Å; E246-N250 PolarHBondContact O-N 2.92Å; E246-N250 PolarHBondContact O-ND2 3.16Å
247	F	89.3	Confident	80.8	Confident	46 Å²	46	66.4 Å²	66.4	20%	0.202	36%	0.355	C	S	.	.	H	α-helix	trans	-60.3	-47	177.2	179.8	-83.6	0	0	0	111.7	F43 Y48 L59 N244 H245 N250 G251	F43-F247 HydrophobicContact CE2-CD1 4.36Å; F43-F247 AromaticContact CE2-CE1 3.49Å; F43-F247 HydrophobicContact CE2-CE1 3.49Å; F43-F247 VanDerWaalsContact CE2-CE1 3.49Å; F43-F247 AromaticContact CE2-CZ 3.99Å; F43-F247 HydrophobicContact CE2-CZ 3.99Å; F43-F247 HydrophobicContact CZ-CD1 4.23Å; F43-F247 AromaticContact CZ-CE1 3.75Å; F43-F247 HydrophobicContact CZ-CE1 3.75Å; Y48-F247 AromaticContact CD1-CE2 3.62Å; Y48-F247 HydrophobicContact CD1-CE2 3.62Å; Y48-F247 AromaticContact CD1-CZ 3.73Å; Y48-F247 HydrophobicContact CD1-CZ 3.73Å; Y48-F247 HydrophobicContact CD2-CE1 4.36Å; Y48-F247 HydrophobicContact CD2-CE2 4.18Å; Y48-F247 AromaticContact CD2-CZ 3.46Å; Y48-F247 HydrophobicContact CD2-CZ 3.46Å; Y48-F247 VanDerWaalsContact CD2-CZ 3.46Å; Y48-F247 AromaticContact CE1-CE2 3.88Å; Y48-F247 HydrophobicContact CE1-CE2 3.88Å; Y48-F247 HydrophobicContact CE1-CZ 4.13Å; Y48-F247 HydrophobicContact CE2-CE2 4.45Å; Y48-F247 AromaticContact CE2-CZ 3.93Å; Y48-F247 HydrophobicContact CE2-CZ 3.93Å; Y48-F247 AromaticContact CG-CE2 3.78Å; Y48-F247 HydrophobicContact CG-CE2 3.78Å; Y48-F247 AromaticContact CG-CZ 3.37Å; Y48-F247 HydrophobicContact CG-CZ 3.37Å; L59-F247 HydrophobicContact CD1-CD1 3.76Å; L59-F247 HydrophobicContact CD1-CE1 3.14Å; L59-F247 HydrophobicContact CD1-CZ 3.76Å; L59-F247 HydrophobicContact CD2-CD1 4.08Å; L59-F247 HydrophobicContact CD2-CE1 4.3Å; L59-F247 HydrophobicContact CG-CE1 4.36Å; N244-F247 WeakPolarHBondContact O-CB 3.44Å; N244-F247 PolarHBondContact O-N 3.35Å; H245-F247 VanDerWaalsContact C-N 3.27Å; H245-F247 PolarHBondContact O-N 3.49Å; F247-N250 PolarHBondContact O-N 3.21Å; F247-G251 PolarHBondContact O-N 3.16Å
248	K	91.3	Very high	78	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-64.9	-40.2	176.7	-72.7	177.9	178.6	179.6	0	111.9	Y50 E203 I228 A238 N244 H245 E246 C252	Y50-K248 HydrophobicContact CE2-CD 4.46Å; E203-K248 IonicContact OE1-NZ 2.67Å; E203-K248 IonicContact OE2-NZ 3.51Å; E203-K248 PolarHBondContact OE2-NZ 3.38Å; I228-K248 HydrophobicContact CD1-CB 4.23Å; A238-K248 PolarHBondContact O-NZ 3.24Å; N244-K248 WeakPolarHBondContact O-CG 3.2Å; N244-K248 PolarHBondContact O-N 3.01Å; H245-K248 PolarHBondContact O-N 2.94Å; E246-K248 PolarHBondContact O-N 2.77Å; K248-C252 VanDerWaalsContact O-CB 3.3Å; K248-C252 WeakPolarHBondContact O-CB 3.36Å; K248-C252 PolarHBondContact O-N 2.78Å; K248-C252 PolarHBondContact O-SG 3.41Å; K248-C252 VanDerWaalsContact O-SG 3.34Å
249	I	90.8	Very high	75.1	Confident	43 Å²	43	77.9 Å²	77.9	22%	0.221	42%	0.421	C	S	.	.	H	α-helix	trans	-56.8	-56.3	173.7	-70.9	175	0	0	0	109.8	I228 H245 E246 G251 C252 Q253	I228-I249 HydrophobicContact CD1-CB 4.44Å; I228-I249 HydrophobicContact CD1-CD1 4.41Å; I228-I249 HydrophobicContact CD1-CG1 3.41Å; I228-I249 VanDerWaalsContact CD1-CG1 3.41Å; I228-I249 HydrophobicContact CG1-CG1 4.4Å; H245-I249 VanDerWaalsContact NE2-CD1 3.26Å; H245-I249 WeakPolarHBondContact NE2-CD1 3.21Å; H245-I249 WeakPolarHBondContact O-CG1 2.99Å; H245-I249 PolarHBondContact O-N 2.84Å; E246-I249 PolarHBondContact O-N 3.28Å; I249-G251 VanDerWaalsContact C-N 3.33Å; I249-G251 PolarHBondContact O-N 3.25Å; I249-C252 PolarHBondContact O-N 3.4Å; I249-Q253 HydrophobicContact CG2-CG 4.25Å; I249-Q253 WeakPolarHBondContact O-CB 3.35Å; I249-Q253 VanDerWaalsContact O-CG 3.31Å; I249-Q253 WeakPolarHBondContact O-CG 3.37Å; I249-Q253 PolarHBondContact O-N 2.84Å
250	N	89.8	Confident	72.5	Confident	84 Å²	84	83 Å²	83	45%	0.449	45%	0.452	S	S	.	.	H	α-helix	trans	-61.3	-42.5	-175.5	-69.5	-18.2	0	0	0	111.6	E246 F247 C252 Q253 V254	E246-N250 WeakPolarHBondContact O-CB 3.06Å; E246-N250 VanDerWaalsContact O-CG 3.25Å; E246-N250 PolarHBondContact O-N 2.92Å; E246-N250 PolarHBondContact O-ND2 3.16Å; F247-N250 PolarHBondContact O-N 3.21Å; N250-C252 VanDerWaalsContact C-N 3.35Å; N250-C252 PolarHBondContact O-N 2.85Å; N250-Q253 PolarHBondContact O-N 2.75Å; N250-V254 WeakPolarHBondContact O-CG2 3.24Å; N250-V254 PolarHBondContact O-N 3.18Å
251	G	90.5	Very high	70	Confident	7 Å²	7	86.5 Å²	86.5	7%	0.072	47%	0.471	C	S	.	.	H	α-helix	trans	-64.6	-35.9	177.6	0	0	0	0	0	113.7	F43 F247 I249	F43-G251 WeakPolarHBondContact CD1-O 3.04Å; F247-G251 PolarHBondContact O-N 3.16Å; I249-G251 VanDerWaalsContact C-N 3.33Å; I249-G251 PolarHBondContact O-N 3.25Å
252	C	90.8	Very high	67.7	Low	11 Å²	11	88.7 Å²	88.7	7%	0.074	49%	0.493	C	S	.	.	H	α-helix	trans	-79.5	-24.7	177.8	-72.3	0	0	0	0	113.5	I228 C230 K248 I249 N250	I228-C252 HydrophobicContact CG2-CB 4.15Å; C230-C252 HydrophobicContact CB-CB 3.63Å; C230-C252 WeakPolarHBondContact CB-SG 3.47Å; C230-C252 WeakPolarHBondContact SG-CB 3.43Å; C230-C252 CovalentContact SG-SG 2.03Å; C230-C252 PolarHBondContact SG-SG 3.36Å; K248-C252 VanDerWaalsContact O-CB 3.3Å; K248-C252 WeakPolarHBondContact O-CB 3.36Å; K248-C252 PolarHBondContact O-N 2.78Å; K248-C252 PolarHBondContact O-SG 3.41Å; K248-C252 VanDerWaalsContact O-SG 3.34Å; I249-C252 PolarHBondContact O-N 3.4Å; N250-C252 VanDerWaalsContact C-N 3.35Å; N250-C252 PolarHBondContact O-N 2.85Å
253	Q	85.2	Confident	65.2	Low	129 Å²	129	86 Å²	86	60%	0.603	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	6.3	177.6	-70.9	-177.9	-3.9	0	0	114.3	I249 N250 E255	I249-Q253 HydrophobicContact CG2-CG 4.25Å; I249-Q253 WeakPolarHBondContact O-CB 3.35Å; I249-Q253 VanDerWaalsContact O-CG 3.31Å; I249-Q253 WeakPolarHBondContact O-CG 3.37Å; I249-Q253 PolarHBondContact O-N 2.84Å; N250-Q253 PolarHBondContact O-N 2.75Å; Q253-E255 PolarHBondContact O-N 2.64Å
254	V	68.6	Low	63.2	Low	88 Å²	88	86.7 Å²	86.7	53%	0.533	50%	0.496	S	S	.	.			trans	-66.8	80.2	174.4	-171.9	0	0	0	0	109.2	N250	N250-V254 WeakPolarHBondContact O-CG2 3.24Å; N250-V254 PolarHBondContact O-N 3.18Å
255	E	49.4	Very low	60.7	Low	140 Å²	140	94.5 Å²	94.5	65%	0.654	53%	0.532	S	S	*	.			trans	-58.5	151.2	162.1	-77.2	-168.9	169.8	0	0	108	Q253 S257	Q253-E255 PolarHBondContact O-N 2.64Å; E255-S257 PolarHBondContact O-N 2.58Å
256	S	35	Very low	58.2	Low	124 Å²	124	97.8 Å²	97.8	87%	0.867	56%	0.559	S	S	*	*			trans	-58.5	74.4	163.7	161	0	0	0	0	109.9	S258	S256-S258 PolarHBondContact O-N 3.2Å
257	S	36.7	Very low	55.7	Low	105 Å²	105	97 Å²	97	73%	0.734	56%	0.563	S	S	*	*			trans	-76.3	83.7	172.1	49	0	0	0	0	108.8	E255	E255-S257 PolarHBondContact O-N 2.58Å
258	S	35.8	Very low	52.9	Low	82 Å²	82	102.3 Å²	102.3	57%	0.573	59%	0.593	S	S	*	*			trans	68.9	98.6	141	72.3	0	0	0	0	119.1	S256 V260	S256-S258 PolarHBondContact O-N 3.2Å; S258-V260 PolarHBondContact O-N 2.74Å
259	I	31.2	Very low	50.4	Low	162 Å²	162	109.4 Å²	109.4	83%	0.831	63%	0.63	S	S	*	*				-55.5	91.9	128.2	-60.2	169.4	0	0	0	106.5
260	V	36.6	Very low	47.5	Very low	108 Å²	108	114.2 Å²	114.2	66%	0.655	66%	0.656	S	S	*	*			trans	-96.9	110.6	148.3	-177.9	0	0	0	0	105.1	S258 A262	S258-V260 PolarHBondContact O-N 2.74Å; V260-A262 PolarHBondContact O-N 3.46Å
261	D	31.6	Very low	45	Very low	153 Å²	153	119.1 Å²	119.1	82%	0.818	68%	0.676	S	S	*	*			trans	-52.4	92	155.8	-87.7	-44.9	0	0	0	108.4
262	A	35.7	Very low	42.3	Very low	73 Å²	73	128.6 Å²	128.6	60%	0.603	71%	0.71	S	S	*	*			trans	-108	78	161.4	0	0	0	0	0	106.9	V260 I264	V260-A262 PolarHBondContact O-N 3.46Å; A262-I264 VanDerWaalsContact C-N 3.27Å; A262-I264 PolarHBondContact O-N 3.25Å
263	S	32.3	Very low	39.6	Very low	121 Å²	121	134.8 Å²	134.8	85%	0.846	74%	0.737	S	S	*	*			trans	-55.4	96.9	155	178.3	0	0	0	0	107.7
264	I	42.1	Very low	37.1	Very low	147 Å²	147	134 Å²	134	75%	0.754	74%	0.741	S	S	*	*			trans	-134	100.7	162.9	-56.3	-177.1	0	0	0	107.4	A262	A262-I264 VanDerWaalsContact C-N 3.27Å; A262-I264 PolarHBondContact O-N 3.25Å
265	E	36.2	Very low	35.3	Very low	163 Å²	163	136.6 Å²	136.6	76%	0.762	75%	0.751	S	S	*	*			trans	-49.2	131.7	165.5	-170	174.8	-168.2	0	0	111.1	T267	E265-T267 PolarHBondContact O-N 3.41Å; E265-T267 VanDerWaalsContact O-N 3.13Å
266	P	35.8	Very low	34.4	Very low	128 Å²	128	136.5 Å²	136.5	83%	0.831	76%	0.76	S	S	*	*			trans	-79.5	103.9	-175.3	30	-30.5	0	0	0	110.4
267	T	35	Very low	34.2	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	75%	0.75	S	S	*	*			trans	-93	114.2	164.6	-53.4	0	0	0	0	109.9	E265 I269	E265-T267 PolarHBondContact O-N 3.41Å; E265-T267 VanDerWaalsContact O-N 3.13Å; T267-I269 PolarHBondContact O-N 3.04Å
268	L	31.8	Very low	34.2	Very low	159 Å²	159	136.7 Å²	136.7	83%	0.832	76%	0.756	S	S	*	*			trans	-62.4	109.9	175.6	-122.6	157.6	0	0	0	111.7
269	I	38.4	Very low	34.3	Very low	149 Å²	149	138.7 Å²	138.7	76%	0.764	77%	0.765	S	S	*	*			trans	-142.8	117.3	158.5	-58.2	-177.1	0	0	0	110.6	T267	T267-I269 PolarHBondContact O-N 3.04Å
270	N	29.8	Very low	34.4	Very low	143 Å²	143	139.1 Å²	139.1	77%	0.765	76%	0.763	S	S	*	*			trans	-64.7	130	166.4	-83.4	-46.2	0	0	0	111.4
271	Q	37.1	Very low	34.6	Very low	188 Å²	188	139.2 Å²	139.2	88%	0.879	77%	0.766	S	S	*	*			trans	-171.7	100	139.1	-110.1	171.4	-19.7	0	0	113.9
272	R	33	Very low	34.7	Very low	206 Å²	206	138 Å²	138	78%	0.777	76%	0.76	S	S	*	*				21.5	122.2	123.1	-158.2	168.9	-166.9	167.4	6.1	120.4
273	E	35.5	Very low	34.8	Very low	140 Å²	140	143 Å²	143	65%	0.654	78%	0.776	S	S	*	*			trans	82.5	115.7	138.2	-79.5	170.5	-159.8	0	0	122.9
274	T	30.9	Very low	35	Very low	112 Å²	112	142 Å²	142	69%	0.687	76%	0.764	S	S	*	*				96.9	101.5	120	-53.6	0	0	0	0	121.5
275	I	31	Very low	34.9	Very low	143 Å²	143	142.7 Å²	142.7	73%	0.733	77%	0.77	S	S	*	*				41.7	142.2	125.1	-43.3	176	0	0	0	121.1
276	T	32	Very low	34.9	Very low	139 Å²	139	138.3 Å²	138.3	85%	0.853	77%	0.768	S	S	*	*			trans	104.7	117	155.8	56.7	0	0	0	0	113
277	G	29.8	Very low	34.8	Very low	62 Å²	62	140.5 Å²	140.5	64%	0.639	77%	0.772	S	S	*	*			cis	115.9	145.8	44.9	0	0	0	0	0	107.2
278	I	37.6	Very low	34.9	Very low	171 Å²	171	139.3 Å²	139.3	88%	0.877	77%	0.769	S	S	*	*			trans	120.4	131.2	176.4	-65.3	156.6	0	0	0	110.5
279	T	36.5	Very low	34.9	Very low	124 Å²	124	141 Å²	141	76%	0.761	77%	0.77	S	S	*	*			cis	-174.8	143	-6.1	-81.6	0	0	0	0	107.6
280	E	34.3	Very low	34.6	Very low	170 Å²	170	140.7 Å²	140.7	79%	0.794	77%	0.774	S	S	*	*			trans	-69.4	172.7	168.5	-126.3	-170.9	154.7	0	0	112.2
281	P	40.4	Very low	34.8	Very low	110 Å²	110	139.2 Å²	139.2	71%	0.714	77%	0.771	S	S	*	*				-161	170	58.3	42.3	-18.4	0	0	0	120.3
282	D	34.4	Very low	34.7	Very low	129 Å²	129	139.6 Å²	139.6	69%	0.69	77%	0.772	S	S	*	*			trans	63.8	125.5	138.8	-97.4	-37.7	0	0	0	125.2
283	L	36.9	Very low	34.7	Very low	178 Å²	178	136 Å²	136	93%	0.932	77%	0.773	S	S	*	*			trans	-155.6	138.1	133.3	-141.3	83.7	0	0	0	113
284	T	36	Very low	34.6	Very low	99 Å²	99	134.2 Å²	134.2	61%	0.607	78%	0.783	S	S	*	*			trans	-116.5	162.7	-158.2	-6.9	0	0	0	0	114.6
285	N	39.7	Very low	34.7	Very low	162 Å²	162	137.9 Å²	137.9	87%	0.866	79%	0.792	S	S	*	*			trans	79.6	145	154	-60.5	-23.7	0	0	0	120
286	G	36.8	Very low	34.9	Very low	71 Å²	71	135.8 Å²	135.8	73%	0.732	79%	0.79	S	S	*	*			cis	175	135.9	1.8	0	0	0	0	0	109.4
287	L	33.9	Very low	35.2	Very low	174 Å²	174	137.9 Å²	137.9	91%	0.911	79%	0.79	S	S	*	*				90.7	121.2	98.3	-154	82.4	0	0	0	119.8
288	S	36.4	Very low	35.5	Very low	96 Å²	96	138.9 Å²	138.9	67%	0.671	79%	0.787	S	S	*	*			trans	74.6	115.5	140.7	59.9	0	0	0	0	127
289	K	33.3	Very low	35.3	Very low	196 Å²	196	137.8 Å²	137.8	85%	0.852	78%	0.783	S	S	*	*				55.2	134.2	109	-120.6	174.9	-173.4	176.1	0	122.6
290	T	32.2	Very low	35.3	Very low	141 Å²	141	140.2 Å²	140.2	87%	0.865	78%	0.783	S	S	*	*			trans	-173.7	144.3	132.8	-70.6	0	0	0	0	113
291	T	32.3	Very low	35.3	Very low	112 Å²	112	138.3 Å²	138.3	69%	0.687	78%	0.783	S	S	*	*			trans	-116.6	152.8	-179.2	-47.1	0	0	0	0	109.9
292	Q	37.1	Very low	34.9	Very low	196 Å²	196	139.2 Å²	139.2	92%	0.916	79%	0.787	S	S	*	*			trans	176.4	154.5	139.2	-98.9	170.6	40.7	0	0	115.8
293	T	31.2	Very low	34.9	Very low	130 Å²	130	136.4 Å²	136.4	80%	0.798	79%	0.788	S	S	*	*			trans	-110	161	-163	-44.7	0	0	0	0	112.5
294	A	34.8	Very low	34.8	Very low	103 Å²	103	133.8 Å²	133.8	85%	0.851	78%	0.78	S	S	*	*			trans	-159.2	130.5	155.4	0	0	0	0	0	115
295	E	32.6	Very low	35	Very low	190 Å²	190	135.1 Å²	135.1	89%	0.888	79%	0.788	S	S	*	*			trans	-95.6	164.5	169.6	-71.9	176.8	132.6	0	0	112.2
296	S	36.1	Very low	35.1	Very low	99 Å²	99	136.2 Å²	136.2	69%	0.692	79%	0.788	S	S	*	*			trans	178	118.1	146.6	157	0	0	0	0	115.9
297	H	37.3	Very low	35.6	Very low	182 Å²	182	137.2 Å²	137.2	84%	0.843	78%	0.777	S	S	*	*				47.4	155.6	124.9	-62.5	-67.2	0	0	0	122.9
298	S	35.6	Very low	35.9	Very low	83 Å²	83	137.7 Å²	137.7	58%	0.58	77%	0.766	S	S	*	*			cis	175.9	150.8	-7.6	174.1	0	0	0	0	110.4
299	N	34.8	Very low	36.3	Very low	149 Å²	149	141.4 Å²	141.4	80%	0.797	77%	0.773	S	S	*	*			trans	56.8	160.6	147.5	-71.8	-16.9	0	0	0	122.2
300	K	34.6	Very low	36.7	Very low	175 Å²	175	138.3 Å²	138.3	76%	0.761	76%	0.762	S	S	*	*			cis	179.8	152.8	-17.6	175.4	177.6	-179	177.3	0	105.8
301	T	34.6	Very low	37.1	Very low	129 Å²	129	139 Å²	139	79%	0.791	75%	0.749	S	S	*	*			trans	156.1	104.5	146.8	-63.9	0	0	0	0	110.3
302	T	32.5	Very low	37.7	Very low	129 Å²	129	139.1 Å²	139.1	79%	0.791	74%	0.741	S	S	*	*				59.7	127.6	84.9	7.3	0	0	0	0	119.7
303	G	34	Very low	38.1	Very low	70 Å²	70	133.8 Å²	133.8	72%	0.722	73%	0.726	S	S	*	*			trans	125.3	127.8	-179.9	0	0	0	0	0	110
304	T	36.1	Very low	39	Very low	123 Å²	123	134.5 Å²	134.5	76%	0.755	72%	0.718	S	S	*	*			cis	-163.8	143	24.2	-49.7	0	0	0	0	107.7	E306	T304-E306 PolarHBondContact O-N 3.47Å
305	T	39.2	Very low	39.8	Very low	128 Å²	128	132.7 Å²	132.7	79%	0.785	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.5	35.9	-162.1	-44.5	0	0	0	0	115.1
306	E	42.8	Very low	40.9	Very low	185 Å²	185	126.9 Å²	126.9	86%	0.864	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	3	178.8	-90.2	-179.2	154.9	0	0	114.6	T304	T304-E306 PolarHBondContact O-N 3.47Å
307	N	46.4	Very low	42.1	Very low	92 Å²	92	127.4 Å²	127.4	49%	0.492	67%	0.673	S	S	.	*			trans	-99.8	0.4	-175	-94.8	-56.7	0	0	0	115.2	E309 R311	N307-E309 PolarHBondContact O-N 2.94Å; N307-R311 WeakPolarHBondContact O-CB 3.44Å; N307-R311 PolarHBondContact O-N 3.09Å
308	R	40.3	Very low	43.5	Very low	183 Å²	183	127.7 Å²	127.7	69%	0.691	67%	0.669	S	S	*	*	H	α-helix	trans	-67.3	-43.8	-160.1	-156.4	170.6	-177.8	151.5	-1.1	113.9	E312	R308-E312 IonicContact NE-OE1 2.74Å; R308-E312 WeakPolarHBondContact O-CG 3.43Å; R308-E312 PolarHBondContact O-N 3.17Å
309	E	45	Very low	45.2	Very low	174 Å²	174	128.4 Å²	128.4	81%	0.813	67%	0.665	S	S	*	*	H	α-helix	trans	-75.4	-39.7	-178.3	-70.3	-177.2	159	0	0	113.4	N307 R311 E312 S313	N307-E309 PolarHBondContact O-N 2.94Å; E309-R311 VanDerWaalsContact C-N 3.32Å; E309-R311 PolarHBondContact O-N 3.35Å; E309-E312 PolarHBondContact O-N 3.2Å; E309-S313 PolarHBondContact O-N 3.24Å
310	Q	40.5	Very low	47	Very low	132 Å²	132	126 Å²	126	62%	0.617	65%	0.651	S	S	*	*	H	α-helix	trans	-73.1	-26.8	176.7	-163.1	172.8	0	0	0	112.3	K314	Q310-K314 PolarHBondContact O-N 3.21Å; Q310-K314 VanDerWaalsContact O-N 3.17Å
311	R	41.2	Very low	48.9	Very low	156 Å²	156	122.1 Å²	122.1	59%	0.589	64%	0.637	S	S	*	*	H	α-helix	trans	-77	-31.7	174.8	-163.2	179.8	-139.4	173.8	6.4	111.9	N307 E309 S315	N307-R311 WeakPolarHBondContact O-CB 3.44Å; N307-R311 PolarHBondContact O-N 3.09Å; E309-R311 VanDerWaalsContact C-N 3.32Å; E309-R311 PolarHBondContact O-N 3.35Å; R311-S315 WeakPolarHBondContact O-CB 3.2Å; R311-S315 PolarHBondContact O-N 2.85Å
312	E	45	Very low	51.1	Low	114 Å²	114	117.4 Å²	117.4	53%	0.533	61%	0.609	S	S	.	*	H	α-helix	trans	-66.8	-42.2	172.4	-78.2	179	-168.2	0	0	111.5	R308 E309 S315 S316	R308-E312 IonicContact NE-OE1 2.74Å; R308-E312 WeakPolarHBondContact O-CG 3.43Å; R308-E312 PolarHBondContact O-N 3.17Å; E309-E312 PolarHBondContact O-N 3.2Å; E312-S315 PolarHBondContact O-N 3.5Å; E312-S316 PolarHBondContact O-N 3.32Å; E312-S316 VanDerWaalsContact O-N 3.09Å; E312-S316 PolarHBondContact O-OG 3.4Å
313	S	45.6	Very low	53.2	Low	84 Å²	84	116.7 Å²	116.7	59%	0.587	60%	0.6	S	S	*	*	H	α-helix	trans	-61.8	-46.8	173.3	170.5	0	0	0	0	113.1	E309 L317	E309-S313 PolarHBondContact O-N 3.24Å; S313-L317 PolarHBondContact O-N 3.33Å
314	K	49.2	Very low	55.3	Low	144 Å²	144	116.4 Å²	116.4	63%	0.626	58%	0.584	S	S	*	*	H	α-helix	trans	-69.1	-31.6	177	-82.9	-178.7	175	176.6	0	113	Q310 L317 Y318	Q310-K314 PolarHBondContact O-N 3.21Å; Q310-K314 VanDerWaalsContact O-N 3.17Å; K314-L317 PolarHBondContact O-N 3.38Å; K314-Y318 PolarHBondContact O-N 3.31Å
315	S	53.1	Low	57.5	Low	65 Å²	65	114.5 Å²	114.5	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-68.2	-41.5	178.2	-170.2	0	0	0	0	111.4	R311 E312 Y318 I319	R311-S315 WeakPolarHBondContact O-CB 3.2Å; R311-S315 PolarHBondContact O-N 2.85Å; E312-S315 PolarHBondContact O-N 3.5Å; S315-Y318 PolarHBondContact O-N 3.4Å; S315-I319 WeakPolarHBondContact O-CG1 3.46Å; S315-I319 PolarHBondContact O-N 2.9Å
316	S	54.9	Low	59.6	Low	68 Å²	68	111.2 Å²	111.2	48%	0.476	55%	0.552	S	S	.	*	H	α-helix	trans	-63.9	-40.7	176.2	-61.9	0	0	0	0	111.8	E312 Y318 I319 I320	E312-S316 PolarHBondContact O-N 3.32Å; E312-S316 VanDerWaalsContact O-N 3.09Å; E312-S316 PolarHBondContact O-OG 3.4Å; S316-Y318 VanDerWaalsContact C-N 3.3Å; S316-Y318 PolarHBondContact O-N 3.49Å; S316-I319 PolarHBondContact O-N 3.42Å; S316-I320 WeakPolarHBondContact O-CD1 3.1Å; S316-I320 VanDerWaalsContact O-CG1 3.24Å; S316-I320 WeakPolarHBondContact O-CG1 3.35Å; S316-I320 PolarHBondContact O-N 3.16Å
317	L	61.3	Low	61.4	Low	110 Å²	110	108.9 Å²	108.9	58%	0.576	54%	0.539	S	S	*	.	H	α-helix	trans	-61.9	-38.3	177.1	-151.1	96.3	0	0	0	112.3	S313 K314 I319 I321	S313-L317 PolarHBondContact O-N 3.33Å; K314-L317 PolarHBondContact O-N 3.38Å; L317-I319 VanDerWaalsContact C-N 3.28Å; L317-I319 PolarHBondContact O-N 3.3Å; L317-I321 HydrophobicContact CD2-CD1 3.8Å; L317-I321 HydrophobicContact CG-CD1 3.93Å; L317-I321 WeakPolarHBondContact O-CD1 3.47Å; L317-I321 VanDerWaalsContact O-CG1 3.28Å; L317-I321 WeakPolarHBondContact O-CG1 3.46Å; L317-I321 PolarHBondContact O-N 3.03Å; L317-I321 VanDerWaalsContact O-N 3.16Å
318	Y	66.6	Low	63.1	Low	189 Å²	189	110.1 Å²	110.1	74%	0.741	54%	0.54	S	S	*	.	H	α-helix	trans	-72.2	-18.8	-179.4	-134	-90.4	0	0	0	113.7	K314 S315 S316 P322	K314-Y318 PolarHBondContact O-N 3.31Å; S315-Y318 PolarHBondContact O-N 3.4Å; S316-Y318 VanDerWaalsContact C-N 3.3Å; S316-Y318 PolarHBondContact O-N 3.49Å; Y318-P322 WeakPolarHBondContact O-CD 3.47Å; Y318-P322 WeakPolarHBondContact O-CG 3.28Å
319	I	70.7	Confident	65.4	Low	98 Å²	98	105.9 Å²	105.9	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-91.7	-39.8	175.8	-64.1	169.4	0	0	0	110.5	S315 S316 L317 P322 L323	S315-I319 WeakPolarHBondContact O-CG1 3.46Å; S315-I319 PolarHBondContact O-N 2.9Å; S316-I319 PolarHBondContact O-N 3.42Å; L317-I319 VanDerWaalsContact C-N 3.28Å; L317-I319 PolarHBondContact O-N 3.3Å; I319-P322 WeakPolarHBondContact O-CD 3.32Å; I319-L323 HydrophobicContact CG2-CD1 3.93Å; I319-L323 WeakPolarHBondContact O-CG 3.24Å; I319-L323 PolarHBondContact O-N 2.85Å
320	I	72.7	Confident	67.2	Low	99 Å²	99	100.4 Å²	100.4	51%	0.508	51%	0.513	S	S	.	.	H	α-helix	trans	-68.2	-42.5	-178	-65.5	165.6	0	0	0	111	S316 L323 V324	S316-I320 WeakPolarHBondContact O-CD1 3.1Å; S316-I320 VanDerWaalsContact O-CG1 3.24Å; S316-I320 WeakPolarHBondContact O-CG1 3.35Å; S316-I320 PolarHBondContact O-N 3.16Å; I320-L323 PolarHBondContact O-N 2.84Å; I320-V324 HydrophobicContact CG2-CG2 3.98Å; I320-V324 WeakPolarHBondContact O-CB 3.4Å; I320-V324 VanDerWaalsContact O-CG2 3.23Å; I320-V324 WeakPolarHBondContact O-CG2 3.25Å; I320-V324 PolarHBondContact O-N 2.95Å
321	I	76.1	Confident	69.2	Low	92 Å²	92	96.5 Å²	96.5	47%	0.472	50%	0.5	S	S	.	.	H	α-helix	trans	-60.7	-50.8	-176.5	-66.7	165.8	0	0	0	112	L317 L323 V324 V325	L317-I321 HydrophobicContact CD2-CD1 3.8Å; L317-I321 HydrophobicContact CG-CD1 3.93Å; L317-I321 WeakPolarHBondContact O-CD1 3.47Å; L317-I321 VanDerWaalsContact O-CG1 3.28Å; L317-I321 WeakPolarHBondContact O-CG1 3.46Å; L317-I321 PolarHBondContact O-N 3.03Å; L317-I321 VanDerWaalsContact O-N 3.16Å; I321-L323 VanDerWaalsContact C-N 3.35Å; I321-L323 PolarHBondContact O-N 3.25Å; I321-V324 PolarHBondContact O-N 3.3Å; I321-V325 HydrophobicContact CG2-CG2 4.41Å; I321-V325 VanDerWaalsContact O-CG2 3.32Å; I321-V325 WeakPolarHBondContact O-CG2 3.44Å; I321-V325 PolarHBondContact O-N 2.94Å
322	P	79.2	Confident	71.4	Confident	30 Å²	30	93.8 Å²	93.8	20%	0.195	50%	0.495	C	S	.	.	H	α-helix	trans	-62.5	-38.3	177.2	-23.8	34.2	0	0	0	113.4	Q9 Y318 I319 V324 V325 V326	Q9-P322 VanDerWaalsContact NE2-CB 3.26Å; Y318-P322 WeakPolarHBondContact O-CD 3.47Å; Y318-P322 WeakPolarHBondContact O-CG 3.28Å; I319-P322 WeakPolarHBondContact O-CD 3.32Å; P322-V324 VanDerWaalsContact C-N 3.33Å; P322-V324 PolarHBondContact O-N 3.3Å; P322-V325 PolarHBondContact O-N 3.48Å; P322-V326 WeakPolarHBondContact O-CB 3.33Å; P322-V326 VanDerWaalsContact O-CG2 3.25Å; P322-V326 WeakPolarHBondContact O-CG2 3.31Å; P322-V326 PolarHBondContact O-N 3.45Å
323	L	76.8	Confident	73.3	Confident	114 Å²	114	90.2 Å²	90.2	60%	0.597	49%	0.489	S	S	*	.	H	α-helix	trans	-63	-41.7	177.3	-76.9	171.6	0	0	0	111.8	I319 I320 I321 V326 F327	I319-L323 HydrophobicContact CG2-CD1 3.93Å; I319-L323 WeakPolarHBondContact O-CG 3.24Å; I319-L323 PolarHBondContact O-N 2.85Å; I320-L323 PolarHBondContact O-N 2.84Å; I321-L323 VanDerWaalsContact C-N 3.35Å; I321-L323 PolarHBondContact O-N 3.25Å; L323-V326 PolarHBondContact O-N 2.9Å; L323-F327 VanDerWaalsContact O-CB 3.32Å; L323-F327 WeakPolarHBondContact O-CB 3.32Å; L323-F327 PolarHBondContact O-N 3.47Å
324	V	79.6	Confident	75.1	Confident	65 Å²	65	91.1 Å²	91.1	39%	0.394	49%	0.487	S	S	.	.	H	α-helix	trans	-66	-42.8	176.3	172.5	0	0	0	0	110.7	I320 I321 P322 F327 F328	I320-V324 HydrophobicContact CG2-CG2 3.98Å; I320-V324 WeakPolarHBondContact O-CB 3.4Å; I320-V324 VanDerWaalsContact O-CG2 3.23Å; I320-V324 WeakPolarHBondContact O-CG2 3.25Å; I320-V324 PolarHBondContact O-N 2.95Å; I321-V324 PolarHBondContact O-N 3.3Å; P322-V324 VanDerWaalsContact C-N 3.33Å; P322-V324 PolarHBondContact O-N 3.3Å; V324-F327 PolarHBondContact O-N 2.95Å; V324-F328 HydrophobicContact CG1-CD2 3.62Å; V324-F328 HydrophobicContact CG1-CE2 3.36Å; V324-F328 WeakPolarHBondContact O-CD2 3.23Å; V324-F328 PolarHBondContact O-N 3.34Å
325	V	82.4	Confident	76.5	Confident	82 Å²	82	86.9 Å²	86.9	50%	0.497	48%	0.479	S	S	.	.	H	α-helix	trans	-63.1	-45.6	176.4	173.2	0	0	0	0	111.4	I321 P322 F327 F328 V329	I321-V325 HydrophobicContact CG2-CG2 4.41Å; I321-V325 VanDerWaalsContact O-CG2 3.32Å; I321-V325 WeakPolarHBondContact O-CG2 3.44Å; I321-V325 PolarHBondContact O-N 2.94Å; P322-V325 PolarHBondContact O-N 3.48Å; V325-F327 VanDerWaalsContact C-N 3.33Å; V325-F327 PolarHBondContact O-N 2.91Å; V325-F328 PolarHBondContact O-N 3.4Å; V325-V329 HydrophobicContact CG1-CG2 4.4Å; V325-V329 WeakPolarHBondContact O-CG2 3.46Å; V325-V329 PolarHBondContact O-N 3.28Å
326	V	81.7	Confident	77.9	Confident	60 Å²	60	88.2 Å²	88.2	36%	0.364	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-43.5	176.1	170.8	0	0	0	0	110.7	I16 P322 L323 F328 V329 V330	I16-V326 HydrophobicContact CD1-CG1 4.44Å; P322-V326 WeakPolarHBondContact O-CB 3.33Å; P322-V326 VanDerWaalsContact O-CG2 3.25Å; P322-V326 WeakPolarHBondContact O-CG2 3.31Å; P322-V326 PolarHBondContact O-N 3.45Å; L323-V326 PolarHBondContact O-N 2.9Å; V326-F328 PolarHBondContact O-N 2.97Å; V326-V329 PolarHBondContact O-N 3.24Å; V326-V330 HydrophobicContact CG1-CG2 4.35Å; V326-V330 VanDerWaalsContact O-CG2 3.31Å; V326-V330 WeakPolarHBondContact O-CG2 3.09Å; V326-V330 PolarHBondContact O-N 3.47Å
327	F	80.8	Confident	79.1	Confident	135 Å²	135	89 Å²	89	59%	0.592	49%	0.485	S	S	*	.	H	α-helix	trans	-58.4	-46	175.5	-178.6	-98.2	0	0	0	111.6	L323 V324 V325 V330 C331	L323-F327 VanDerWaalsContact O-CB 3.32Å; L323-F327 WeakPolarHBondContact O-CB 3.32Å; L323-F327 PolarHBondContact O-N 3.47Å; V324-F327 PolarHBondContact O-N 2.95Å; V325-F327 VanDerWaalsContact C-N 3.33Å; V325-F327 PolarHBondContact O-N 2.91Å; F327-V330 PolarHBondContact O-N 2.85Å; F327-C331 WeakPolarHBondContact O-CB 3.43Å; F327-C331 PolarHBondContact O-N 3.49Å; F327-C331 PolarHBondContact O-SG 3.4Å
328	F	83.5	Confident	79.9	Confident	118 Å²	118	89 Å²	89	52%	0.518	49%	0.485	S	S	.	.	H	α-helix	trans	-65.2	-40.8	176.5	-78.7	-64.5	0	0	0	113	V324 V325 V326 C331 I332	V324-F328 HydrophobicContact CG1-CD2 3.62Å; V324-F328 HydrophobicContact CG1-CE2 3.36Å; V324-F328 WeakPolarHBondContact O-CD2 3.23Å; V324-F328 PolarHBondContact O-N 3.34Å; V325-F328 PolarHBondContact O-N 3.4Å; V326-F328 PolarHBondContact O-N 2.97Å; F328-C331 PolarHBondContact O-N 2.86Å; F328-I332 WeakPolarHBondContact O-CB 3.16Å; F328-I332 WeakPolarHBondContact O-CD1 3.31Å; F328-I332 WeakPolarHBondContact O-CG1 3.37Å; F328-I332 PolarHBondContact O-N 3.34Å
329	V	86.7	Confident	80.4	Confident	95 Å²	95	86.9 Å²	86.9	58%	0.576	48%	0.476	S	S	*	.	H	α-helix	trans	-63.3	-42.3	176.9	172.3	0	0	0	0	111	V325 V326 I332 G333	V325-V329 HydrophobicContact CG1-CG2 4.4Å; V325-V329 WeakPolarHBondContact O-CG2 3.46Å; V325-V329 PolarHBondContact O-N 3.28Å; V326-V329 PolarHBondContact O-N 3.24Å; V329-I332 PolarHBondContact O-N 2.82Å; V329-G333 PolarHBondContact O-N 3.25Å
330	V	83.6	Confident	80.7	Confident	59 Å²	59	86.1 Å²	86.1	36%	0.358	47%	0.472	S	S	.	.	H	α-helix	trans	-65	-45.1	175.1	172.7	0	0	0	0	110.9	V326 F327 I332 G333 L334	V326-V330 HydrophobicContact CG1-CG2 4.35Å; V326-V330 VanDerWaalsContact O-CG2 3.31Å; V326-V330 WeakPolarHBondContact O-CG2 3.09Å; V326-V330 PolarHBondContact O-N 3.47Å; F327-V330 PolarHBondContact O-N 2.85Å; V330-I332 PolarHBondContact O-N 2.83Å; V330-G333 PolarHBondContact O-N 3.22Å; V330-L334 HydrophobicContact CG1-CD1 3.98Å; V330-L334 HydrophobicContact CG1-CG 4.36Å; V330-L334 WeakPolarHBondContact O-CB 3.35Å; V330-L334 VanDerWaalsContact O-CG 3.29Å; V330-L334 WeakPolarHBondContact O-CG 3.48Å; V330-L334 PolarHBondContact O-N 3.45Å
331	C	83	Confident	80.6	Confident	50 Å²	50	88.3 Å²	88.3	34%	0.338	48%	0.475	S	S	.	.	H	α-helix	trans	-63.1	-39.5	176.8	-72.2	0	0	0	0	112.7	F327 F328 A335	F327-C331 WeakPolarHBondContact O-CB 3.43Å; F327-C331 PolarHBondContact O-N 3.49Å; F327-C331 PolarHBondContact O-SG 3.4Å; F328-C331 PolarHBondContact O-N 2.86Å; C331-A335 VanDerWaalsContact O-CB 3.23Å; C331-A335 WeakPolarHBondContact O-CB 3.39Å; C331-A335 PolarHBondContact O-N 3.41Å
332	I	87.7	Confident	80.4	Confident	98 Å²	98	94.4 Å²	94.4	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-67.2	-44.6	175.6	-68.9	163.9	0	0	0	109.9	F328 V329 V330 L334 A335 I336	F328-I332 WeakPolarHBondContact O-CB 3.16Å; F328-I332 WeakPolarHBondContact O-CD1 3.31Å; F328-I332 WeakPolarHBondContact O-CG1 3.37Å; F328-I332 PolarHBondContact O-N 3.34Å; V329-I332 PolarHBondContact O-N 2.82Å; V330-I332 PolarHBondContact O-N 2.83Å; I332-L334 PolarHBondContact O-N 3.34Å; I332-A335 PolarHBondContact O-N 3.18Å; I332-I336 HydrophobicContact CG2-CD1 3.65Å; I332-I336 HydrophobicContact CG2-CG1 4.28Å; I332-I336 WeakPolarHBondContact O-CB 3.26Å; I332-I336 VanDerWaalsContact O-CG1 3.26Å; I332-I336 WeakPolarHBondContact O-CG1 3.46Å; I332-I336 PolarHBondContact O-N 2.86Å
333	G	83.6	Confident	79.8	Confident	39 Å²	39	101.7 Å²	101.7	40%	0.402	52%	0.516	S	S	.	.	H	α-helix	trans	-57.7	-47.1	175	0	0	0	0	0	112	V329 V330 I336 C337	V329-G333 PolarHBondContact O-N 3.25Å; V330-G333 PolarHBondContact O-N 3.22Å; G333-I336 PolarHBondContact O-N 2.87Å; G333-C337 WeakPolarHBondContact O-CB 3.23Å; G333-C337 PolarHBondContact O-N 3.3Å
334	L	83.4	Confident	78.2	Confident	103 Å²	103	105.9 Å²	105.9	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-64	-40.4	174.9	-71.3	173.4	0	0	0	112.4	V330 I332 C337 L338	V330-L334 HydrophobicContact CG1-CD1 3.98Å; V330-L334 HydrophobicContact CG1-CG 4.36Å; V330-L334 WeakPolarHBondContact O-CB 3.35Å; V330-L334 VanDerWaalsContact O-CG 3.29Å; V330-L334 WeakPolarHBondContact O-CG 3.48Å; V330-L334 PolarHBondContact O-N 3.45Å; I332-L334 PolarHBondContact O-N 3.34Å; L334-C337 PolarHBondContact O-N 2.84Å; L334-L338 VanDerWaalsContact O-CB 3.29Å; L334-L338 WeakPolarHBondContact O-CB 3.21Å; L334-L338 WeakPolarHBondContact O-CG 3.22Å; L334-L338 PolarHBondContact O-N 2.88Å
335	A	79.2	Confident	78.2	Confident	56 Å²	56	108 Å²	108	46%	0.463	54%	0.539	S	S	.	.	H	α-helix	trans	-67.3	-39.2	177.7	0	0	0	0	0	112	C331 I332 W339	C331-A335 VanDerWaalsContact O-CB 3.23Å; C331-A335 WeakPolarHBondContact O-CB 3.39Å; C331-A335 PolarHBondContact O-N 3.41Å; I332-A335 PolarHBondContact O-N 3.18Å; A335-W339 WeakPolarHBondContact O-CB 3.48Å; A335-W339 PolarHBondContact O-N 3.4Å
336	I	83.4	Confident	77.9	Confident	92 Å²	92	109.3 Å²	109.3	47%	0.472	54%	0.541	S	S	.	.	H	α-helix	trans	-65.7	-46.1	173.6	-67.7	167.8	0	0	0	109.5	I332 G333 L338 W339 L340	I332-I336 HydrophobicContact CG2-CD1 3.65Å; I332-I336 HydrophobicContact CG2-CG1 4.28Å; I332-I336 WeakPolarHBondContact O-CB 3.26Å; I332-I336 VanDerWaalsContact O-CG1 3.26Å; I332-I336 WeakPolarHBondContact O-CG1 3.46Å; I332-I336 PolarHBondContact O-N 2.86Å; G333-I336 PolarHBondContact O-N 2.87Å; I336-L338 PolarHBondContact O-N 3.4Å; I336-W339 PolarHBondContact O-N 3.46Å; I336-L340 HydrophobicContact CG2-CD1 3.91Å; I336-L340 HydrophobicContact CG2-CG 4.32Å; I336-L340 WeakPolarHBondContact O-CB 3.29Å; I336-L340 VanDerWaalsContact O-CG 3.31Å; I336-L340 WeakPolarHBondContact O-CG 3.41Å; I336-L340 PolarHBondContact O-N 2.84Å
337	C	79.1	Confident	77.7	Confident	85 Å²	85	112.1 Å²	112.1	57%	0.574	55%	0.551	S	S	*	*	H	α-helix	trans	-56.5	-49.4	174.6	-124.1	0	0	0	0	111.4	G333 L334 W339 L340 Y341	G333-C337 WeakPolarHBondContact O-CB 3.23Å; G333-C337 PolarHBondContact O-N 3.3Å; L334-C337 PolarHBondContact O-N 2.84Å; C337-W339 VanDerWaalsContact C-N 3.3Å; C337-W339 PolarHBondContact O-N 2.81Å; C337-L340 PolarHBondContact O-N 3.46Å; C337-Y341 WeakPolarHBondContact O-CB 3.17Å; C337-Y341 PolarHBondContact O-N 3.34Å
338	L	77.5	Confident	77.5	Confident	111 Å²	111	110.7 Å²	110.7	58%	0.581	55%	0.549	S	S	*	.	H	α-helix	trans	-66.2	-30	178.3	-74.4	171.6	0	0	0	113.2	L334 I336 R342	L334-L338 VanDerWaalsContact O-CB 3.29Å; L334-L338 WeakPolarHBondContact O-CB 3.21Å; L334-L338 WeakPolarHBondContact O-CG 3.22Å; L334-L338 PolarHBondContact O-N 2.88Å; I336-L338 PolarHBondContact O-N 3.4Å; L338-R342 WeakPolarHBondContact O-CB 3.29Å; L338-R342 PolarHBondContact O-N 3.22Å
339	W	77.7	Confident	77.2	Confident	144 Å²	144	110.3 Å²	110.3	55%	0.545	55%	0.551	S	S	.	*	H	α-helix	trans	-77.4	-38.9	177.6	-177.3	81.6	0	0	0	111.9	A335 I336 C337 R342 R343	A335-W339 WeakPolarHBondContact O-CB 3.48Å; A335-W339 PolarHBondContact O-N 3.4Å; I336-W339 PolarHBondContact O-N 3.46Å; C337-W339 VanDerWaalsContact C-N 3.3Å; C337-W339 PolarHBondContact O-N 2.81Å; W339-R342 PolarHBondContact O-N 3.07Å; W339-R343 WeakPolarHBondContact O-CB 3.2Å; W339-R343 PolarHBondContact O-N 2.86Å
340	L	76.8	Confident	76.5	Confident	82 Å²	82	111.3 Å²	111.3	43%	0.429	55%	0.549	S	S	.	.	H	α-helix	trans	-63.7	-47.3	170.9	-67.6	173.4	0	0	0	110.2	I336 C337 R342 R343 E344	I336-L340 HydrophobicContact CG2-CD1 3.91Å; I336-L340 HydrophobicContact CG2-CG 4.32Å; I336-L340 WeakPolarHBondContact O-CB 3.29Å; I336-L340 VanDerWaalsContact O-CG 3.31Å; I336-L340 WeakPolarHBondContact O-CG 3.41Å; I336-L340 PolarHBondContact O-N 2.84Å; C337-L340 PolarHBondContact O-N 3.46Å; L340-R342 PolarHBondContact O-N 3.27Å; L340-R342 VanDerWaalsContact O-N 3.07Å; L340-R343 PolarHBondContact O-N 3.37Å; L340-E344 PolarHBondContact O-N 3.04Å
341	Y	71.7	Confident	76	Confident	144 Å²	144	115 Å²	115	57%	0.565	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-22.3	174.6	-174.4	-99.6	0	0	0	114.6	E178 C337	E178-Y341 WeakPolarHBondContact OE2-CD2 3.42Å; E178-Y341 WeakPolarHBondContact OE2-CE2 3.42Å; C337-Y341 WeakPolarHBondContact O-CB 3.17Å; C337-Y341 PolarHBondContact O-N 3.34Å
342	R	71	Confident	75.5	Confident	221 Å²	221	120 Å²	120	83%	0.834	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	-10.3	178.7	-91.6	-173.9	167	179.6	-1.9	114.1	L338 W339 L340	L338-R342 WeakPolarHBondContact O-CB 3.29Å; L338-R342 PolarHBondContact O-N 3.22Å; W339-R342 PolarHBondContact O-N 3.07Å; L340-R342 PolarHBondContact O-N 3.27Å; L340-R342 VanDerWaalsContact O-N 3.07Å
343	R	66.2	Low	74.5	Confident	183 Å²	183	121.8 Å²	121.8	69%	0.691	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	-21.6	-173.1	-164	172.9	-176.6	-175	-2.3	112.8	W339 L340	W339-R343 WeakPolarHBondContact O-CB 3.2Å; W339-R343 PolarHBondContact O-N 2.86Å; L340-R343 PolarHBondContact O-N 3.37Å
344	E	44.1	Very low	73.6	Confident	202 Å²	202	129.4 Å²	129.4	94%	0.944	60%	0.603	S	S	*	*			trans	-93.2	0	162.9	-73.1	163.1	-173.7	0	0	109.6	L340	L340-E344 PolarHBondContact O-N 3.04Å

Retrieved 344 of 344 residues in 201.5 ms (Link to these results)

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