A0AA82N866_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N866, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 363 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	40.7	Very low	54.3	Low	212 Å²	212	128.5 Å²	128.5	100%	1.044	62%	0.619	S	S	*	*				0	107	0	-76.9	174.7	176.8	0	0	108.7	Y3	M1-Y3 HydrophobicContact CB-CD2 4.24Å; M1-Y3 HydrophobicContact CB-CE2 4.2Å; M1-Y3 PolarHBondContact O-N 3.29Å; M1-Y3 HydrophobicContact SD-CE2 4.17Å
2	R	45.1	Very low	54.8	Low	246 Å²	246	126.9 Å²	126.9	93%	0.928	62%	0.616	S	S	*	*			trans	-84.4	102.2	169.5	-75.3	-177.7	176.1	178.8	-1.3	107.1	N4	R2-N4 PolarHBondContact O-N 3.42Å
3	Y	51.2	Low	55.3	Low	160 Å²	160	121.7 Å²	121.7	63%	0.627	59%	0.592	S	S	*	*			trans	-76.9	108.7	174.8	-92.3	-87.9	0	0	0	109.1	M1 F5	M1-Y3 HydrophobicContact CB-CD2 4.24Å; M1-Y3 HydrophobicContact CB-CE2 4.2Å; M1-Y3 PolarHBondContact O-N 3.29Å; M1-Y3 HydrophobicContact SD-CE2 4.17Å; Y3-F5 PolarHBondContact O-N 3.15Å
4	N	50.3	Low	55.7	Low	159 Å²	159	122.7 Å²	122.7	85%	0.85	59%	0.588	S	S	*	*			trans	-74.4	106.3	168.3	-77.4	-21.5	0	0	0	108.5	R2 S6	R2-N4 PolarHBondContact O-N 3.42Å; N4-S6 PolarHBondContact O-N 3.21Å
5	F	47.6	Very low	56	Low	127 Å²	127	122 Å²	122	56%	0.557	59%	0.587	S	S	*	*			trans	-68.3	125.9	171.3	-86.3	-89.4	0	0	0	110	Y3 L9	Y3-F5 PolarHBondContact O-N 3.15Å; F5-L9 HydrophobicContact CD1-CB 4.36Å; F5-L9 HydrophobicContact CD1-CD2 4.17Å; F5-L9 HydrophobicContact CE1-CD2 4.18Å
6	S	62.9	Low	56.4	Low	55 Å²	55	120 Å²	120	39%	0.385	58%	0.58	S	S	.	*			trans	-58.1	138.9	173.2	170.4	0	0	0	0	110.9	N4 S8 L9	N4-S6 PolarHBondContact O-N 3.21Å; S6-S8 PolarHBondContact O-N 3.49Å; S6-S8 PolarHBondContact OG-N 3.35Å; S6-S8 PolarHBondContact OG-OG 3.3Å; S6-L9 WeakPolarHBondContact O-CB 3.26Å; S6-L9 PolarHBondContact O-N 3.44Å
7	P	61.2	Low	56.5	Low	100 Å²	100	121.4 Å²	121.4	65%	0.649	58%	0.582	S	S	*	*	H	α-helix	trans	-52.5	-28.4	175.4	-25.5	33	0	0	0	114.1	L9 W10 I11	P7-L9 VanDerWaalsContact C-N 3.33Å; P7-L9 PolarHBondContact O-N 3.37Å; P7-W10 PolarHBondContact O-N 3.32Å; P7-I11 PolarHBondContact O-N 3.2Å
8	S	59.5	Low	56.6	Low	70 Å²	70	120.2 Å²	120.2	49%	0.49	58%	0.579	S	S	.	*	H	α-helix	trans	-66.5	-31.2	177.7	60.4	0	0	0	0	113.8	S6 L12	S6-S8 PolarHBondContact O-N 3.49Å; S6-S8 PolarHBondContact OG-N 3.35Å; S6-S8 PolarHBondContact OG-OG 3.3Å; S8-L12 PolarHBondContact O-N 3.07Å
9	L	57.8	Low	56.4	Low	42 Å²	42	124.2 Å²	124.2	22%	0.22	59%	0.588	C	S	.	*	H	α-helix	trans	-71.8	-35.4	177	-110.2	126	0	0	0	111.3	F5 S6 P7 L12 I13	F5-L9 HydrophobicContact CD1-CB 4.36Å; F5-L9 HydrophobicContact CD1-CD2 4.17Å; F5-L9 HydrophobicContact CE1-CD2 4.18Å; S6-L9 WeakPolarHBondContact O-CB 3.26Å; S6-L9 PolarHBondContact O-N 3.44Å; P7-L9 VanDerWaalsContact C-N 3.33Å; P7-L9 PolarHBondContact O-N 3.37Å; L9-L12 PolarHBondContact O-N 3.43Å; L9-I13 WeakPolarHBondContact O-CB 3.45Å; L9-I13 WeakPolarHBondContact O-CD1 3.28Å; L9-I13 VanDerWaalsContact O-CG1 3.24Å; L9-I13 WeakPolarHBondContact O-CG1 3.39Å; L9-I13 PolarHBondContact O-N 3.5Å
10	W	58.8	Low	56.3	Low	133 Å²	133	120.5 Å²	120.5	50%	0.504	58%	0.575	S	S	.	*	H	α-helix	trans	-63.8	-41.5	175.1	-79.8	95	0	0	0	112	P7 L12 I13 Y14	P7-W10 PolarHBondContact O-N 3.32Å; W10-L12 VanDerWaalsContact C-N 3.32Å; W10-L12 PolarHBondContact O-N 3.06Å; W10-I13 PolarHBondContact O-N 3.42Å; W10-Y14 HydrophobicContact CE3-CD2 4.38Å; W10-Y14 AromaticContact CE3-CE2 3.85Å; W10-Y14 HydrophobicContact CE3-CE2 3.85Å; W10-Y14 HydrophobicContact CZ3-CE2 4.44Å; W10-Y14 WeakPolarHBondContact O-CB 3.23Å; W10-Y14 WeakPolarHBondContact O-CD2 3.47Å; W10-Y14 PolarHBondContact O-N 3.37Å
11	I	61.9	Low	56.2	Low	109 Å²	109	122.6 Å²	122.6	56%	0.559	58%	0.578	S	S	*	*	H	α-helix	trans	-60.8	-43.1	177	-63.4	168.5	0	0	0	111	P7 Y14 L15	P7-I11 PolarHBondContact O-N 3.2Å; I11-Y14 PolarHBondContact O-N 3.38Å; I11-L15 HydrophobicContact CG2-CD1 4.09Å; I11-L15 VanDerWaalsContact O-CG 3.32Å; I11-L15 WeakPolarHBondContact O-CG 3.37Å; I11-L15 PolarHBondContact O-N 3.29Å
12	L	60.2	Low	56.9	Low	110 Å²	110	119.4 Å²	119.4	58%	0.576	56%	0.558	S	S	*	*	H	α-helix	trans	-65.3	-43.1	178.3	-120.2	139.2	0	0	0	111.6	S8 L9 W10 L15 I16	S8-L12 PolarHBondContact O-N 3.07Å; L9-L12 PolarHBondContact O-N 3.43Å; W10-L12 VanDerWaalsContact C-N 3.32Å; W10-L12 PolarHBondContact O-N 3.06Å; L12-L15 PolarHBondContact O-N 3.16Å; L12-I16 HydrophobicContact CD2-CD1 4.05Å; L12-I16 WeakPolarHBondContact O-CB 3.49Å; L12-I16 WeakPolarHBondContact O-CD1 3.18Å; L12-I16 WeakPolarHBondContact O-CG1 3.32Å; L12-I16 PolarHBondContact O-N 3.49Å
13	I	61.7	Low	57.3	Low	59 Å²	59	113.7 Å²	113.7	30%	0.303	54%	0.537	S	S	.	.	H	α-helix	trans	-59.9	-48.3	173.9	-73.5	168	0	0	0	110.6	L9 W10 L15 I16 F17	L9-I13 WeakPolarHBondContact O-CB 3.45Å; L9-I13 WeakPolarHBondContact O-CD1 3.28Å; L9-I13 VanDerWaalsContact O-CG1 3.24Å; L9-I13 WeakPolarHBondContact O-CG1 3.39Å; L9-I13 PolarHBondContact O-N 3.5Å; W10-I13 PolarHBondContact O-N 3.42Å; I13-L15 VanDerWaalsContact C-N 3.35Å; I13-L15 PolarHBondContact O-N 3.33Å; I13-I16 PolarHBondContact O-N 3.34Å; I13-F17 HydrophobicContact CG2-CD2 3.67Å; I13-F17 HydrophobicContact CG2-CE2 3.74Å; I13-F17 WeakPolarHBondContact O-CD2 3.38Å; I13-F17 PolarHBondContact O-N 3.12Å
14	Y	60.3	Low	57.2	Low	136 Å²	136	112.6 Å²	112.6	53%	0.533	54%	0.536	S	S	.	.	H	α-helix	trans	-60.3	-41.6	177.1	-90.3	-73.4	0	0	0	112.3	W10 I11 F17 L18	W10-Y14 HydrophobicContact CE3-CD2 4.38Å; W10-Y14 AromaticContact CE3-CE2 3.85Å; W10-Y14 HydrophobicContact CE3-CE2 3.85Å; W10-Y14 HydrophobicContact CZ3-CE2 4.44Å; W10-Y14 WeakPolarHBondContact O-CB 3.23Å; W10-Y14 WeakPolarHBondContact O-CD2 3.47Å; W10-Y14 PolarHBondContact O-N 3.37Å; I11-Y14 PolarHBondContact O-N 3.38Å; Y14-F17 PolarHBondContact O-N 3.33Å; Y14-L18 HydrophobicContact CD1-CD1 4.01Å; Y14-L18 HydrophobicContact CD1-CG 4.5Å; Y14-L18 WeakPolarHBondContact O-CB 3.31Å; Y14-L18 WeakPolarHBondContact O-CD1 3.32Å; Y14-L18 VanDerWaalsContact O-CG 3.24Å; Y14-L18 WeakPolarHBondContact O-CG 3.42Å; Y14-L18 PolarHBondContact O-N 3.03Å
15	L	60.6	Low	57.3	Low	112 Å²	112	109 Å²	109	59%	0.586	51%	0.512	S	S	*	.	H	α-helix	trans	-64.5	-40.9	176.1	-73.2	168.7	0	0	0	112.1	I11 L12 I13 F17 W19	I11-L15 HydrophobicContact CG2-CD1 4.09Å; I11-L15 VanDerWaalsContact O-CG 3.32Å; I11-L15 WeakPolarHBondContact O-CG 3.37Å; I11-L15 PolarHBondContact O-N 3.29Å; L12-L15 PolarHBondContact O-N 3.16Å; I13-L15 VanDerWaalsContact C-N 3.35Å; I13-L15 PolarHBondContact O-N 3.33Å; L15-F17 VanDerWaalsContact C-N 3.34Å; L15-F17 PolarHBondContact O-N 3.39Å; L15-W19 WeakPolarHBondContact O-CB 3.43Å; L15-W19 PolarHBondContact O-N 3.43Å
16	I	62.8	Low	57.7	Low	90 Å²	90	106.3 Å²	106.3	46%	0.462	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-35.7	177.9	-69.6	164.5	0	0	0	111.4	L12 I13 P20	L12-I16 HydrophobicContact CD2-CD1 4.05Å; L12-I16 WeakPolarHBondContact O-CB 3.49Å; L12-I16 WeakPolarHBondContact O-CD1 3.18Å; L12-I16 WeakPolarHBondContact O-CG1 3.32Å; L12-I16 PolarHBondContact O-N 3.49Å; I13-I16 PolarHBondContact O-N 3.34Å; I16-P20 WeakPolarHBondContact O-CD 3.45Å; I16-P20 WeakPolarHBondContact O-CG 3.21Å
17	F	57.7	Low	57.4	Low	143 Å²	143	105.4 Å²	105.4	63%	0.627	50%	0.499	S	S	*	.	H	α-helix	trans	-88.2	-37.9	-179.7	-74.5	-68.5	0	0	0	114	I13 Y14 L15 P20 Y21	I13-F17 HydrophobicContact CG2-CD2 3.67Å; I13-F17 HydrophobicContact CG2-CE2 3.74Å; I13-F17 WeakPolarHBondContact O-CD2 3.38Å; I13-F17 PolarHBondContact O-N 3.12Å; Y14-F17 PolarHBondContact O-N 3.33Å; L15-F17 VanDerWaalsContact C-N 3.34Å; L15-F17 PolarHBondContact O-N 3.39Å; F17-P20 WeakPolarHBondContact O-CD 3.24Å; F17-P20 WeakPolarHBondContact O-CG 3.48Å; F17-Y21 WeakPolarHBondContact O-CB 3.37Å; F17-Y21 PolarHBondContact O-N 2.84Å
18	L	59.6	Low	57.2	Low	101 Å²	101	103.2 Å²	103.2	53%	0.529	48%	0.484	S	S	.	.	H	α-helix	trans	-72.7	-35.6	-176.9	-74.6	165.8	0	0	0	112.9	Y14 Y21 K22	Y14-L18 HydrophobicContact CD1-CD1 4.01Å; Y14-L18 HydrophobicContact CD1-CG 4.5Å; Y14-L18 WeakPolarHBondContact O-CB 3.31Å; Y14-L18 WeakPolarHBondContact O-CD1 3.32Å; Y14-L18 VanDerWaalsContact O-CG 3.24Å; Y14-L18 WeakPolarHBondContact O-CG 3.42Å; Y14-L18 PolarHBondContact O-N 3.03Å; L18-Y21 PolarHBondContact O-N 3.45Å; L18-K22 PolarHBondContact O-N 3.22Å; L18-K22 VanDerWaalsContact O-N 3.09Å
19	W	51.4	Low	57.3	Low	195 Å²	195	101.1 Å²	101.1	74%	0.739	47%	0.468	S	S	*	.	H	α-helix	trans	-65.1	-50.4	-179	-167.7	5.4	0	0	0	113.3	L15 Y21 R23	L15-W19 WeakPolarHBondContact O-CB 3.43Å; L15-W19 PolarHBondContact O-N 3.43Å; W19-Y21 VanDerWaalsContact C-N 3.32Å; W19-Y21 PolarHBondContact O-N 2.98Å; W19-R23 WeakPolarHBondContact O-CB 3.4Å; W19-R23 PolarHBondContact O-N 3.33Å
20	P	53.9	Low	57.7	Low	50 Å²	50	99.9 Å²	99.9	33%	0.325	46%	0.462	S	S	.	.	H	α-helix	trans	-63.3	-40.2	174.7	23.5	-30.9	0	0	0	110.8	I16 F17 K22 R23 F24	I16-P20 WeakPolarHBondContact O-CD 3.45Å; I16-P20 WeakPolarHBondContact O-CG 3.21Å; F17-P20 WeakPolarHBondContact O-CD 3.24Å; F17-P20 WeakPolarHBondContact O-CG 3.48Å; P20-K22 PolarHBondContact O-N 3.34Å; P20-R23 CarbonylContact O-C 3.52Å; P20-R23 WeakPolarHBondContact O-CA 3.24Å; P20-R23 WeakPolarHBondContact O-CB 3.46Å; P20-R23 PolarHBondContact O-N 3.44Å; P20-F24 HydrophobicContact CB-CD2 4.06Å; P20-F24 HydrophobicContact CB-CE2 3.96Å; P20-F24 WeakPolarHBondContact O-CD2 3.21Å; P20-F24 PolarHBondContact O-N 3.26Å
21	Y	55.6	Low	57.9	Low	165 Å²	165	100.1 Å²	100.1	65%	0.647	47%	0.469	S	S	*	.	H	α-helix	trans	-57.2	-48.4	-179.1	-174.5	-98.4	0	0	0	112.9	F17 L18 W19 R23 F24 K25	F17-Y21 WeakPolarHBondContact O-CB 3.37Å; F17-Y21 PolarHBondContact O-N 2.84Å; L18-Y21 PolarHBondContact O-N 3.45Å; W19-Y21 VanDerWaalsContact C-N 3.32Å; W19-Y21 PolarHBondContact O-N 2.98Å; Y21-R23 VanDerWaalsContact C-N 3.26Å; Y21-R23 PolarHBondContact O-N 2.99Å; Y21-F24 PolarHBondContact O-N 3.28Å; Y21-K25 PolarHBondContact O-N 3.05Å
22	K	55.9	Low	58	Low	145 Å²	145	101.5 Å²	101.5	63%	0.63	47%	0.467	S	S	*	.	H	α-helix	trans	-65.4	-31.1	176.7	-166.3	169.6	-174.4	167.2	0	112.4	L18 P20	L18-K22 PolarHBondContact O-N 3.22Å; L18-K22 VanDerWaalsContact O-N 3.09Å; P20-K22 PolarHBondContact O-N 3.34Å
23	R	52.5	Low	57.9	Low	126 Å²	126	99.5 Å²	99.5	48%	0.475	46%	0.461	S	S	.	.	H	α-helix	trans	-73.5	-37.5	176.5	-169.5	178	-177.9	158.8	2.5	112.1	W19 P20 Y21	W19-R23 WeakPolarHBondContact O-CB 3.4Å; W19-R23 PolarHBondContact O-N 3.33Å; P20-R23 CarbonylContact O-C 3.52Å; P20-R23 WeakPolarHBondContact O-CA 3.24Å; P20-R23 WeakPolarHBondContact O-CB 3.46Å; P20-R23 PolarHBondContact O-N 3.44Å; Y21-R23 VanDerWaalsContact C-N 3.26Å; Y21-R23 PolarHBondContact O-N 2.99Å
24	F	49.4	Very low	57.7	Low	137 Å²	137	103.6 Å²	103.6	60%	0.601	48%	0.483	S	S	*	.	H	α-helix	trans	-65.3	-42.8	175.5	-84.9	-69.9	0	0	0	111.1	P20 Y21 C26 N27 V28	P20-F24 HydrophobicContact CB-CD2 4.06Å; P20-F24 HydrophobicContact CB-CE2 3.96Å; P20-F24 WeakPolarHBondContact O-CD2 3.21Å; P20-F24 PolarHBondContact O-N 3.26Å; Y21-F24 PolarHBondContact O-N 3.28Å; F24-C26 VanDerWaalsContact C-N 3.31Å; F24-C26 PolarHBondContact O-N 2.96Å; F24-N27 WeakPolarHBondContact O-CB 3.18Å; F24-N27 PolarHBondContact O-N 3.38Å; F24-V28 WeakPolarHBondContact O-CG2 3.16Å; F24-V28 PolarHBondContact O-N 3.32Å; F24-V28 VanDerWaalsContact O-N 3.09Å
25	K	52.8	Low	57.7	Low	83 Å²	83	98.7 Å²	98.7	36%	0.361	47%	0.466	S	S	.	.	H	α-helix	trans	-57.4	-41.2	-179.3	-160.2	173.4	-177.9	-179.8	0	113.1	Y21 N27 V28 E226	Y21-K25 PolarHBondContact O-N 3.05Å; K25-N27 VanDerWaalsContact C-N 3.27Å; K25-N27 PolarHBondContact O-N 3.42Å; K25-V28 PolarHBondContact O-N 3.33Å; K25-E226 VanDerWaalsContact CE-OE1 3.32Å; K25-E226 WeakPolarHBondContact CE-OE1 3.2Å; K25-E226 VanDerWaalsContact CE-OE2 3.31Å; K25-E226 WeakPolarHBondContact CE-OE2 3.34Å; K25-E226 IonicContact NZ-OE1 2.94Å; K25-E226 PolarHBondContact NZ-OE1 3.33Å; K25-E226 IonicContact NZ-OE2 3.68Å; K25-E226 PolarHBondContact NZ-OE2 3.34Å
26	C	55.1	Low	57.7	Low	71 Å²	71	97 Å²	97	48%	0.48	45%	0.452	S	S	.	.	H	α-helix	trans	-64.3	-29	175	-68.6	0	0	0	0	113.8	F24 C30	F24-C26 VanDerWaalsContact C-N 3.31Å; F24-C26 PolarHBondContact O-N 2.96Å; C26-C30 PolarHBondContact O-SG 2.83Å; C26-C30 VanDerWaalsContact O-SG 3.35Å
27	N	56.8	Low	57.7	Low	36 Å²	36	101.2 Å²	101.2	19%	0.193	47%	0.47	C	S	.	.	H	α-helix	trans	-77	-34.4	176.3	-80	3.5	0	0	0	111.5	F24 K25 D29 C30 E31	F24-N27 WeakPolarHBondContact O-CB 3.18Å; F24-N27 PolarHBondContact O-N 3.38Å; K25-N27 VanDerWaalsContact C-N 3.27Å; K25-N27 PolarHBondContact O-N 3.42Å; N27-D29 PolarHBondContact O-N 3.36Å; N27-C30 CarbonylContact O-C 3.59Å; N27-C30 WeakPolarHBondContact O-CA 3.48Å; N27-C30 WeakPolarHBondContact O-CB 3.44Å; N27-C30 PolarHBondContact O-N 2.91Å; N27-C30 VanDerWaalsContact O-N 3.08Å; N27-E31 WeakPolarHBondContact O-CG 3.27Å; N27-E31 PolarHBondContact O-N 3.29Å
28	V	56.9	Low	58.4	Low	54 Å²	54	96.6 Å²	96.6	33%	0.327	45%	0.449	S	S	.	.	H	α-helix	trans	-60.1	-43.4	-179.8	176.5	0	0	0	0	111.8	F24 K25 C30 E31 R32	F24-V28 WeakPolarHBondContact O-CG2 3.16Å; F24-V28 PolarHBondContact O-N 3.32Å; F24-V28 VanDerWaalsContact O-N 3.09Å; K25-V28 PolarHBondContact O-N 3.33Å; V28-C30 VanDerWaalsContact C-N 3.26Å; V28-C30 PolarHBondContact O-N 2.98Å; V28-E31 PolarHBondContact O-N 3.41Å; V28-E31 VanDerWaalsContact O-N 3.16Å; V28-R32 PolarHBondContact O-N 2.7Å
29	D	61.8	Low	59.6	Low	27 Å²	27	95.6 Å²	95.6	14%	0.144	44%	0.441	C	S	.	.	H	α-helix	trans	-62.9	-37.3	177	-64.3	-20.9	0	0	0	111.1	N27 E31 R32 Y54 I193 Y204	N27-D29 PolarHBondContact O-N 3.36Å; D29-E31 VanDerWaalsContact C-N 3.27Å; D29-E31 PolarHBondContact O-N 2.94Å; D29-R32 PolarHBondContact O-N 3.38Å; D29-Y54 PolarHBondContact OD1-OH 3.29Å; D29-Y54 PolarHBondContact OD2-OH 2.95Å; D29-I193 HydrophobicContact CB-CD1 4.15Å; D29-Y204 PolarHBondContact O-OH 2.01Å
30	C	66.8	Low	61.1	Low	15 Å²	15	86.9 Å²	86.9	10%	0.101	41%	0.409	C	S	.	.	H	α-helix	trans	-70.5	-18.3	177.4	-69	0	0	0	0	114.5	C26 N27 V28 C195 R202	C26-C30 PolarHBondContact O-SG 2.83Å; C26-C30 VanDerWaalsContact O-SG 3.35Å; N27-C30 CarbonylContact O-C 3.59Å; N27-C30 WeakPolarHBondContact O-CA 3.48Å; N27-C30 WeakPolarHBondContact O-CB 3.44Å; N27-C30 PolarHBondContact O-N 2.91Å; N27-C30 VanDerWaalsContact O-N 3.08Å; V28-C30 VanDerWaalsContact C-N 3.26Å; V28-C30 PolarHBondContact O-N 2.98Å; C30-C195 HydrophobicContact CB-CB 3.78Å; C30-C195 WeakPolarHBondContact CB-SG 3.34Å; C30-C195 WeakPolarHBondContact SG-CA 3.34Å; C30-C195 WeakPolarHBondContact SG-CB 3.27Å; C30-C195 CovalentContact SG-SG 2.03Å; C30-C195 PolarHBondContact SG-SG 3.43Å; C30-R202 PolarHBondContact O-NE 2.81Å; C30-R202 VanDerWaalsContact O-NE 3.14Å; C30-R202 PolarHBondContact O-NH2 3.4Å
31	E	63.3	Low	62.8	Low	139 Å²	139	87 Å²	87	65%	0.65	41%	0.409	S	S	*	.	H	α-helix	trans	-95.7	-7.6	-178.8	-73.2	169	-164.9	0	0	112.8	N27 V28 D29 P33	N27-E31 WeakPolarHBondContact O-CG 3.27Å; N27-E31 PolarHBondContact O-N 3.29Å; V28-E31 PolarHBondContact O-N 3.41Å; V28-E31 VanDerWaalsContact O-N 3.16Å; D29-E31 VanDerWaalsContact C-N 3.27Å; D29-E31 PolarHBondContact O-N 2.94Å; E31-P33 WeakPolarHBondContact O-CD 3.39Å
32	R	63.8	Low	64.2	Low	138 Å²	138	79.8 Å²	79.8	52%	0.521	38%	0.381	S	S	.	.			trans	-108.6	82.9	-178.2	-67.7	-177.7	-177.6	-174.2	1.2	112.2	V28 D29 N34 L35	V28-R32 PolarHBondContact O-N 2.7Å; D29-R32 PolarHBondContact O-N 3.38Å; R32-N34 PolarHBondContact O-N 2.86Å; R32-L35 HydrophobicContact CB-CD1 3.79Å; R32-L35 HydrophobicContact CB-CG 4.09Å; R32-L35 PolarHBondContact O-N 3.44Å
33	P	58.2	Low	65.8	Low	68 Å²	68	75.5 Å²	75.5	44%	0.442	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-62.1	-27.7	176.2	25.9	-33.1	0	0	0	112.8	E31 L35 Y36	E31-P33 WeakPolarHBondContact O-CD 3.39Å; P33-L35 PolarHBondContact O-N 3.47Å; P33-Y36 HydrophobicContact CB-CD2 4.36Å; P33-Y36 HydrophobicContact CB-CE2 4.14Å; P33-Y36 WeakPolarHBondContact O-CD2 3.44Å; P33-Y36 PolarHBondContact O-N 2.98Å
34	N	56.3	Low	67.7	Low	144 Å²	144	73 Å²	73	77%	0.77	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-67.8	-9	-175.9	-61.6	-5.8	0	0	0	114.1	R32	R32-N34 PolarHBondContact O-N 2.86Å
35	L	61.6	Low	69.8	Low	33 Å²	33	70 Å²	70	17%	0.173	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-80.9	-13.8	178.9	-69.2	175.8	0	0	0	113.9	R32 P33 Q37 Y38 Y54 Y204	R32-L35 HydrophobicContact CB-CD1 3.79Å; R32-L35 HydrophobicContact CB-CG 4.09Å; R32-L35 PolarHBondContact O-N 3.44Å; P33-L35 PolarHBondContact O-N 3.47Å; L35-Q37 VanDerWaalsContact C-N 3.27Å; L35-Q37 PolarHBondContact O-N 3.23Å; L35-Y38 HydrophobicContact CD2-CD2 4.42Å; L35-Y38 HydrophobicContact CD2-CG 4.47Å; L35-Y38 PolarHBondContact O-N 3.42Å; L35-Y54 HydrophobicContact CB-CD2 4.38Å; L35-Y54 HydrophobicContact CD1-CD2 4.12Å; L35-Y54 HydrophobicContact CD1-CE2 3.87Å; L35-Y54 HydrophobicContact CD2-CD2 4.24Å; L35-Y54 HydrophobicContact CG-CD2 4.49Å; L35-Y204 HydrophobicContact CB-CD1 4.29Å; L35-Y204 HydrophobicContact CB-CE1 3.57Å
36	Y	58.7	Low	71.7	Confident	76 Å²	76	73.4 Å²	73.4	30%	0.298	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-30.9	-175.2	-71.2	-59.1	0	0	0	115	P33 R202 F203 Y204	P33-Y36 HydrophobicContact CB-CD2 4.36Å; P33-Y36 HydrophobicContact CB-CE2 4.14Å; P33-Y36 WeakPolarHBondContact O-CD2 3.44Å; P33-Y36 PolarHBondContact O-N 2.98Å; Y36-R202 HydrophobicContact CE1-CB 3.82Å; Y36-R202 HydrophobicContact CE1-CG 4.27Å; Y36-R202 WeakPolarHBondContact OH-CB 3.28Å; Y36-R202 WeakPolarHBondContact OH-CD 3.45Å; Y36-R202 WeakPolarHBondContact OH-CG 3.34Å; Y36-R202 PolarHBondContact OH-NE 2.86Å; Y36-R202 VanDerWaalsContact OH-NE 3.13Å; Y36-R202 PolarHBondContact OH-NH1 3.28Å; Y36-F203 VanDerWaalsContact CD1-O 3.23Å; Y36-F203 WeakPolarHBondContact CD1-O 3.28Å; Y36-Y204 AromaticContact CD1-CD1 3.92Å; Y36-Y204 HydrophobicContact CD1-CD1 3.92Å; Y36-Y204 AromaticContact CD1-CE1 3.67Å; Y36-Y204 HydrophobicContact CD1-CE1 3.67Å; Y36-Y204 HydrophobicContact CE1-CE1 4.05Å; Y36-Y204 HydrophobicContact CE1-CE2 4.36Å; Y36-Y204 AromaticContact CE1-CZ 3.98Å; Y36-Y204 HydrophobicContact CG-CE1 4.28Å
37	Q	62.8	Low	73.7	Confident	179 Å²	179	73.4 Å²	73.4	84%	0.836	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.2	25.6	-179.4	-64.9	179	-15.2	0	0	110.1	L35 E39	L35-Q37 VanDerWaalsContact C-N 3.27Å; L35-Q37 PolarHBondContact O-N 3.23Å; Q37-E39 VanDerWaalsContact C-N 3.32Å; Q37-E39 PolarHBondContact O-N 3.2Å
38	Y	72.8	Confident	75.5	Confident	46 Å²	46	73.3 Å²	73.3	18%	0.18	37%	0.366	C	S	.	.			trans	-65.7	100.9	176.6	-175.9	-90.4	0	0	0	108.1	L35 I40 I52 H53	L35-Y38 HydrophobicContact CD2-CD2 4.42Å; L35-Y38 HydrophobicContact CD2-CG 4.47Å; L35-Y38 PolarHBondContact O-N 3.42Å; Y38-I40 HydrophobicContact CE1-CD1 3.74Å; Y38-I40 HydrophobicContact CE1-CG1 4.33Å; Y38-I40 HydrophobicContact CE2-CD1 4.11Å; Y38-I40 WeakPolarHBondContact OH-CD1 3.39Å; Y38-I52 HydrophobicContact CE1-CG2 4.28Å; Y38-H53 VanDerWaalsContact O-CA 3.28Å; Y38-H53 WeakPolarHBondContact O-CA 3.09Å
39	E	85	Confident	77.4	Confident	80 Å²	80	71.6 Å²	71.6	37%	0.374	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.8	171.6	174.3	170.3	-143.5	0	0	107.5	Q37 V41 R49 I52 H53	Q37-E39 VanDerWaalsContact C-N 3.32Å; Q37-E39 PolarHBondContact O-N 3.2Å; E39-V41 HydrophobicContact CG-CG2 4.17Å; E39-R49 VanDerWaalsContact CD-NH2 3.35Å; E39-R49 IonicContact OE1-CZ 2.64Å; E39-R49 IonicContact OE1-NE 3.01Å; E39-R49 IonicContact OE1-NH2 2.87Å; E39-R49 PolarHBondContact OE1-NH2 3.28Å; E39-R49 IonicContact OE2-NH2 3.61Å; E39-I52 CarbonylContact C-O 3.55Å; E39-I52 WeakPolarHBondContact CA-O 3.4Å; E39-H53 VanDerWaalsContact CG-CE1 3.48Å; E39-H53 WeakPolarHBondContact CG-CE1 3.4Å; E39-H53 IonicContact OE1-CE1 2.63Å; E39-H53 PolarHBondContact OE1-CE1 3.02Å; E39-H53 IonicContact OE1-NE2 3.46Å
40	I	83.3	Confident	78.9	Confident	13 Å²	13	70.8 Å²	70.8	7%	0.067	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	112.8	167.3	-56.4	155.6	0	0	0	106.7	Y38 I42 S51 I52 I253 K255	Y38-I40 HydrophobicContact CE1-CD1 3.74Å; Y38-I40 HydrophobicContact CE1-CG1 4.33Å; Y38-I40 HydrophobicContact CE2-CD1 4.11Å; Y38-I40 WeakPolarHBondContact OH-CD1 3.39Å; I40-I42 HydrophobicContact CG2-CD1 3.78Å; I40-I42 PolarHBondContact O-N 3.28Å; I40-S51 CarbonylContact O-C 3.5Å; I40-S51 WeakPolarHBondContact O-CA 3.44Å; I40-S51 WeakPolarHBondContact O-CB 2.87Å; I40-I52 HydrophobicContact CB-CB 4.41Å; I40-I52 PolarHBondContact N-O 3.39Å; I40-I52 PolarHBondContact O-N 3.32Å; I40-I253 HydrophobicContact CG2-CB 4.17Å; I40-I253 HydrophobicContact CG2-CD1 3.77Å; I40-I253 HydrophobicContact CG2-CG2 4.02Å; I40-K255 HydrophobicContact CD1-CD 3.25Å; I40-K255 HydrophobicContact CG1-CD 3.99Å
41	V	88.6	Confident	80.1	Confident	52 Å²	52	70 Å²	70	32%	0.315	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	118.7	170.5	-173.3	0	0	0	0	107.6	E39 E44 R49	E39-V41 HydrophobicContact CG-CG2 4.17Å; V41-E44 HydrophobicContact CG1-CB 3.95Å; V41-R49 HydrophobicContact CG1-CG 4.41Å
42	I	86.2	Confident	81.3	Confident	14 Å²	14	63.9 Å²	63.9	7%	0.072	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-46.3	179.7	-55.1	-61.9	0	0	0	109.6	I40 Y50 I52 I253	I40-I42 HydrophobicContact CG2-CD1 3.78Å; I40-I42 PolarHBondContact O-N 3.28Å; I42-Y50 HydrophobicContact CB-CD1 3.91Å; I42-Y50 HydrophobicContact CG1-CD1 3.84Å; I42-Y50 HydrophobicContact CG1-CE1 4.1Å; I42-Y50 HydrophobicContact CG2-CD1 4.41Å; I42-Y50 PolarHBondContact N-O 3.5Å; I42-I52 HydrophobicContact CD1-CD1 3.88Å; I42-I52 HydrophobicContact CD1-CG1 4.22Å; I42-I52 HydrophobicContact CG1-CD1 4.11Å; I42-I52 HydrophobicContact CG1-CG1 4.03Å; I42-I253 HydrophobicContact CD1-CD1 3.58Å
43	I	89	Confident	82.4	Confident	55 Å²	55	57.8 Å²	57.8	28%	0.282	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	141	-179.3	-180	168.4	0	0	0	109.1	Y48 R49 Y50	I43-Y48 HydrophobicContact CG2-CD1 3.99Å; I43-Y48 HydrophobicContact CG2-CE1 3.61Å; I43-R49 WeakPolarHBondContact O-CA 3.3Å; I43-Y50 PolarHBondContact N-O 3.45Å; I43-Y50 PolarHBondContact O-N 2.98Å
44	E	92.8	Very high	83.6	Confident	74 Å²	74	55.8 Å²	55.8	35%	0.346	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	130.1	174.8	-177.1	168.5	-171.2	0	0	109.4	V41 Y48 R49 K211 W212	V41-E44 HydrophobicContact CG1-CB 3.95Å; E44-Y48 CarbonylContact C-O 3.46Å; E44-Y48 WeakPolarHBondContact CA-O 3.34Å; E44-R49 HydrophobicContact CB-CG 4.39Å; E44-R49 HydrophobicContact CG-CB 4.34Å; E44-R49 HydrophobicContact CG-CG 4.36Å; E44-R49 IonicContact OE1-NH1 2.68Å; E44-R49 PolarHBondContact OE1-NH1 3.2Å; E44-R49 IonicContact OE2-CZ 3.43Å; E44-R49 IonicContact OE2-NH1 3.73Å; E44-R49 PolarHBondContact OE2-NH1 2.95Å; E44-K211 VanDerWaalsContact OE1-CE 3.27Å; E44-K211 WeakPolarHBondContact OE1-CE 3.33Å; E44-K211 IonicContact OE1-NZ 2.66Å; E44-K211 PolarHBondContact OE1-NZ 3.45Å; E44-W212 HydrophobicContact CG-CZ2 4Å
45	N	94	Very high	85	Confident	73 Å²	73	50.6 Å²	50.6	39%	0.39	25%	0.247	S	C	.	.			trans	-137.9	-170.7	167.4	67.3	41.6	0	0	0	108.8	T47 Y48 W212	N45-T47 PolarHBondContact O-N 3.34Å; N45-T47 PolarHBondContact OD1-N 3.02Å; N45-T47 PolarHBondContact OD1-OG1 3.39Å; N45-Y48 PolarHBondContact N-O 2.99Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.25Å; N45-Y48 PolarHBondContact OD1-N 3.4Å; N45-W212 WeakPolarHBondContact O-CH2 3.47Å
46	D	92.8	Very high	86.4	Confident	155 Å²	155	49.1 Å²	49.1	83%	0.829	24%	0.239	S	C	*	.	S	Bend	trans	-67.2	-19.2	-175.7	-64.8	-24.2	0	0	0	114.7	H62	D46-H62 PolarHBondContact O-CD2 3.46Å; D46-H62 VanDerWaalsContact O-CD2 3.26Å
47	T	95.3	Very high	88	Confident	70 Å²	70	45.7 Å²	45.7	43%	0.429	23%	0.226	S	C	.	.	S	Bend	trans	-120.8	-13.9	-174	61.9	0	0	0	0	114.1	N45 Q61 H62	N45-T47 PolarHBondContact O-N 3.34Å; N45-T47 PolarHBondContact OD1-N 3.02Å; N45-T47 PolarHBondContact OD1-OG1 3.39Å; T47-Q61 WeakPolarHBondContact O-CA 3.04Å; T47-H62 PolarHBondContact O-N 2.84Å
48	Y	96.1	Very high	89.5	Confident	34 Å²	34	37.2 Å²	37.2	13%	0.133	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	136.8	-171.2	-174.7	-98	0	0	0	111.9	I43 E44 N45 R59 I60 Q61 W212	I43-Y48 HydrophobicContact CG2-CD1 3.99Å; I43-Y48 HydrophobicContact CG2-CE1 3.61Å; E44-Y48 CarbonylContact C-O 3.46Å; E44-Y48 WeakPolarHBondContact CA-O 3.34Å; N45-Y48 PolarHBondContact N-O 2.99Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.25Å; N45-Y48 PolarHBondContact OD1-N 3.4Å; Y48-R59 HydrophobicContact CE2-CG 3.73Å; Y48-I60 WeakPolarHBondContact CA-O 3.49Å; Y48-Q61 HydrophobicContact CD2-CG 3.64Å; Y48-Q61 HydrophobicContact CE2-CG 3.89Å; Y48-W212 VanDerWaalsContact C-CH2 3.46Å
49	R	96.2	Very high	90.7	Very high	18 Å²	18	37.6 Å²	37.6	7%	0.068	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	135.2	168.2	177.7	174.6	172.7	131.1	-9.3	110.3	E39 V41 I43 E44 R59 I60 W212	E39-R49 VanDerWaalsContact CD-NH2 3.35Å; E39-R49 IonicContact OE1-CZ 2.64Å; E39-R49 IonicContact OE1-NE 3.01Å; E39-R49 IonicContact OE1-NH2 2.87Å; E39-R49 PolarHBondContact OE1-NH2 3.28Å; E39-R49 IonicContact OE2-NH2 3.61Å; V41-R49 HydrophobicContact CG1-CG 4.41Å; I43-R49 WeakPolarHBondContact O-CA 3.3Å; E44-R49 HydrophobicContact CB-CG 4.39Å; E44-R49 HydrophobicContact CG-CB 4.34Å; E44-R49 HydrophobicContact CG-CG 4.36Å; E44-R49 IonicContact OE1-NH1 2.68Å; E44-R49 PolarHBondContact OE1-NH1 3.2Å; E44-R49 IonicContact OE2-CZ 3.43Å; E44-R49 IonicContact OE2-NH1 3.73Å; E44-R49 PolarHBondContact OE2-NH1 2.95Å; R49-R59 CarbonylContact O-C 3.54Å; R49-R59 WeakPolarHBondContact O-CA 3.07Å; R49-I60 HydrophobicContact CB-CB 4.22Å; R49-I60 HydrophobicContact CB-CD1 4.49Å; R49-I60 HydrophobicContact CB-CG1 4.48Å; R49-I60 PolarHBondContact N-O 2.88Å; R49-I60 PolarHBondContact O-N 2.9Å; R49-W212 HydrophobicContact CB-CH2 3.84Å; R49-W212 HydrophobicContact CB-CZ2 3.56Å; R49-W212 HydrophobicContact CB-CZ3 4.48Å; R49-W212 HydrophobicContact CG-CZ2 4.48Å
50	Y	93.9	Very high	91.3	Very high	10 Å²	10	33.8 Å²	33.8	4%	0.039	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.8	170.5	-176.1	-105.2	0	0	0	109.9	I42 I43 I52 S57 M58 R59 L261	I42-Y50 HydrophobicContact CB-CD1 3.91Å; I42-Y50 HydrophobicContact CG1-CD1 3.84Å; I42-Y50 HydrophobicContact CG1-CE1 4.1Å; I42-Y50 HydrophobicContact CG2-CD1 4.41Å; I42-Y50 PolarHBondContact N-O 3.5Å; I43-Y50 PolarHBondContact N-O 3.45Å; I43-Y50 PolarHBondContact O-N 2.98Å; Y50-I52 HydrophobicContact CE1-CG1 4.26Å; Y50-S57 WeakPolarHBondContact OH-CB 3.44Å; Y50-M58 WeakPolarHBondContact CA-O 3.45Å; Y50-R59 HydrophobicContact CD2-CB 4.11Å; Y50-L261 HydrophobicContact CE1-CD1 4.21Å; Y50-L261 WeakPolarHBondContact OH-CD1 3.41Å; Y50-L261 WeakPolarHBondContact OH-CD2 3.16Å
51	S	91	Very high	92	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	148.5	-176	53.5	0	0	0	0	111.7	I40 H53 S57 M58	I40-S51 CarbonylContact O-C 3.5Å; I40-S51 WeakPolarHBondContact O-CA 3.44Å; I40-S51 WeakPolarHBondContact O-CB 2.87Å; S51-H53 PolarHBondContact OG-NE2 2.92Å; S51-S57 CarbonylContact O-C 3.53Å; S51-S57 WeakPolarHBondContact O-CA 3.5Å; S51-M58 PolarHBondContact N-O 3.19Å; S51-M58 PolarHBondContact O-N 3.33Å; S51-M58 VanDerWaalsContact OG-CE 3.28Å; S51-M58 WeakPolarHBondContact OG-CE 3.45Å; S51-M58 PolarHBondContact OG-O 3.18Å
52	I	88	Confident	92.3	Very high	9 Å²	9	34 Å²	34	5%	0.046	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130.2	178.4	-58.1	-178.3	0	0	0	108.2	Y38 E39 I40 I42 Y50 I224 I257	Y38-I52 HydrophobicContact CE1-CG2 4.28Å; E39-I52 CarbonylContact C-O 3.55Å; E39-I52 WeakPolarHBondContact CA-O 3.4Å; I40-I52 HydrophobicContact CB-CB 4.41Å; I40-I52 PolarHBondContact N-O 3.39Å; I40-I52 PolarHBondContact O-N 3.32Å; I42-I52 HydrophobicContact CD1-CD1 3.88Å; I42-I52 HydrophobicContact CD1-CG1 4.22Å; I42-I52 HydrophobicContact CG1-CD1 4.11Å; I42-I52 HydrophobicContact CG1-CG1 4.03Å; Y50-I52 HydrophobicContact CE1-CG1 4.26Å; I52-I224 HydrophobicContact CG2-CD1 3.64Å; I52-I257 HydrophobicContact CD1-CB 4.44Å; I52-I257 HydrophobicContact CD1-CG2 3.71Å
53	H	88	Confident	92.8	Very high	11 Å²	11	39.9 Å²	39.9	5%	0.051	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	177.5	-178.3	-63.8	-95.3	0	0	0	110.9	Y38 E39 S51 K55 Y56 I206	Y38-H53 VanDerWaalsContact O-CA 3.28Å; Y38-H53 WeakPolarHBondContact O-CA 3.09Å; E39-H53 VanDerWaalsContact CG-CE1 3.48Å; E39-H53 WeakPolarHBondContact CG-CE1 3.4Å; E39-H53 IonicContact OE1-CE1 2.63Å; E39-H53 PolarHBondContact OE1-CE1 3.02Å; E39-H53 IonicContact OE1-NE2 3.46Å; S51-H53 PolarHBondContact OG-NE2 2.92Å; H53-K55 PolarHBondContact O-N 2.92Å; H53-K55 VanDerWaalsContact O-N 3.08Å; H53-Y56 CarbonylContact C-O 3.55Å; H53-Y56 WeakPolarHBondContact CA-O 3.4Å; H53-Y56 WeakPolarHBondContact CB-O 3.42Å; H53-Y56 PolarHBondContact N-O 3.35Å; H53-Y56 PolarHBondContact O-N 3.09Å; H53-Y56 VanDerWaalsContact O-O 3.05Å; H53-I206 HydrophobicContact CB-CD1 3.49Å; H53-I206 VanDerWaalsContact CB-CD1 3.49Å; H53-I206 HydrophobicContact CB-CG1 3.71Å; H53-I206 HydrophobicContact CB-CG2 4.31Å
54	Y	83.6	Confident	93.1	Very high	26 Å²	26	40.3 Å²	40.3	10%	0.102	20%	0.2	C	C	.	.	S	Bend	trans	-59.2	114.8	172.9	-179	-114.3	0	0	0	111.3	D29 L35 Y56 Y92 Y204	D29-Y54 PolarHBondContact OD1-OH 3.29Å; D29-Y54 PolarHBondContact OD2-OH 2.95Å; L35-Y54 HydrophobicContact CB-CD2 4.38Å; L35-Y54 HydrophobicContact CD1-CD2 4.12Å; L35-Y54 HydrophobicContact CD1-CE2 3.87Å; L35-Y54 HydrophobicContact CD2-CD2 4.24Å; L35-Y54 HydrophobicContact CG-CD2 4.49Å; Y54-Y56 PolarHBondContact O-N 3.44Å; Y54-Y92 HydrophobicContact CD1-CD1 4.31Å; Y54-Y92 HydrophobicContact CD1-CE1 4.27Å; Y54-Y92 HydrophobicContact CE1-CD1 4.49Å; Y54-Y204 AromaticContact CD1-CD1 3.81Å; Y54-Y204 HydrophobicContact CD1-CD1 3.81Å; Y54-Y204 HydrophobicContact CD1-CD2 4.3Å; Y54-Y204 AromaticContact CD1-CG 3.68Å; Y54-Y204 HydrophobicContact CD1-CG 3.68Å; Y54-Y204 HydrophobicContact CE1-CD1 4.19Å; Y54-Y204 HydrophobicContact CE1-CD2 4.05Å; Y54-Y204 HydrophobicContact CE1-CE2 4.46Å; Y54-Y204 AromaticContact CE1-CG 3.9Å; Y54-Y204 HydrophobicContact CE1-CG 3.9Å; Y54-Y204 HydrophobicContact CG-CD1 4.22Å
55	K	85	Confident	93.3	Very high	34 Å²	34	41.9 Å²	41.9	15%	0.148	22%	0.219	C	C	.	.	S	Bend	trans	59.5	0.1	-178.8	-64.8	-178.2	-179.7	163.4	0	116.8	H53 Y92 E191 A223 I224	H53-K55 PolarHBondContact O-N 2.92Å; H53-K55 VanDerWaalsContact O-N 3.08Å; K55-Y92 HydrophobicContact CB-CD1 4.19Å; K55-Y92 HydrophobicContact CD-CD1 4.13Å; K55-Y92 WeakPolarHBondContact CD-O 3.06Å; K55-Y92 PolarHBondContact NZ-O 3.08Å; K55-E191 IonicContact NZ-OE1 2.73Å; K55-E191 IonicContact NZ-OE2 3.17Å; K55-A223 CarbonylContact O-C 3.6Å; K55-A223 WeakPolarHBondContact O-CA 3.13Å; K55-I224 WeakPolarHBondContact O-CG1 3.36Å; K55-I224 PolarHBondContact O-N 2.91Å
56	Y	90.9	Very high	93.3	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.8	177	-75.7	-96.4	0	0	0	112	H53 Y54 Y92 I189 I206 F221 E222 A223	H53-Y56 CarbonylContact C-O 3.55Å; H53-Y56 WeakPolarHBondContact CA-O 3.4Å; H53-Y56 WeakPolarHBondContact CB-O 3.42Å; H53-Y56 PolarHBondContact N-O 3.35Å; H53-Y56 PolarHBondContact O-N 3.09Å; H53-Y56 VanDerWaalsContact O-O 3.05Å; Y54-Y56 PolarHBondContact O-N 3.44Å; Y56-Y92 HydrophobicContact CD2-CD1 4.06Å; Y56-Y92 HydrophobicContact CD2-CD2 4.39Å; Y56-Y92 AromaticContact CD2-CE1 3.78Å; Y56-Y92 HydrophobicContact CD2-CE1 3.78Å; Y56-Y92 HydrophobicContact CD2-CE2 4.15Å; Y56-Y92 HydrophobicContact CD2-CG 4.36Å; Y56-Y92 AromaticContact CD2-CZ 3.84Å; Y56-Y92 AromaticContact CE2-CD1 3.77Å; Y56-Y92 HydrophobicContact CE2-CD1 3.77Å; Y56-Y92 AromaticContact CE2-CD2 3.53Å; Y56-Y92 HydrophobicContact CE2-CD2 3.53Å; Y56-Y92 AromaticContact CE2-CE1 3.85Å; Y56-Y92 HydrophobicContact CE2-CE1 3.85Å; Y56-Y92 AromaticContact CE2-CE2 3.63Å; Y56-Y92 HydrophobicContact CE2-CE2 3.63Å; Y56-Y92 AromaticContact CE2-CG 3.61Å; Y56-Y92 HydrophobicContact CE2-CG 3.61Å; Y56-Y92 AromaticContact CE2-CZ 3.8Å; Y56-Y92 PolarHBondContact OH-N 3.49Å; Y56-I189 HydrophobicContact CD1-CD1 4.06Å; Y56-I189 HydrophobicContact CD2-CD1 4.24Å; Y56-I189 HydrophobicContact CE1-CD1 4.25Å; Y56-I189 HydrophobicContact CE2-CD1 4.43Å; Y56-I189 HydrophobicContact CG-CD1 4.06Å; Y56-I206 HydrophobicContact CD2-CD1 4.22Å; Y56-I206 HydrophobicContact CG-CD1 4.14Å; Y56-F221 HydrophobicContact CD1-CB 3.87Å; Y56-F221 HydrophobicContact CE1-CB 4.45Å; Y56-E222 CarbonylContact C-O 3.53Å; Y56-E222 VanDerWaalsContact CA-O 3.27Å; Y56-E222 WeakPolarHBondContact CA-O 3.43Å; Y56-E222 VanDerWaalsContact CD1-C 3.49Å; Y56-A223 HydrophobicContact CD1-CB 4.4Å; Y56-A223 HydrophobicContact CE1-CB 4.01Å
57	S	92	Very high	93.4	Very high	5 Å²	5	36.9 Å²	36.9	4%	0.035	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	154.1	155.5	65	0	0	0	0	109.3	Y50 S51 F221 E222	Y50-S57 WeakPolarHBondContact OH-CB 3.44Å; S51-S57 CarbonylContact O-C 3.53Å; S51-S57 WeakPolarHBondContact O-CA 3.5Å; S57-F221 VanDerWaalsContact O-CA 3.28Å; S57-F221 WeakPolarHBondContact O-CA 3.34Å; S57-E222 PolarHBondContact N-O 3.14Å; S57-E222 PolarHBondContact O-N 3.33Å; S57-E222 VanDerWaalsContact O-N 3.1Å; S57-E222 PolarHBondContact OG-O 3.49Å
58	M	95.9	Very high	93.4	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	120	172.5	179.1	-179.5	67	0	0	109.1	Y50 S51 I60 I206 V208 V219 E220 F221	Y50-M58 WeakPolarHBondContact CA-O 3.45Å; S51-M58 PolarHBondContact N-O 3.19Å; S51-M58 PolarHBondContact O-N 3.33Å; S51-M58 VanDerWaalsContact OG-CE 3.28Å; S51-M58 WeakPolarHBondContact OG-CE 3.45Å; S51-M58 PolarHBondContact OG-O 3.18Å; M58-I60 HydrophobicContact CE-CD1 3.93Å; M58-I60 HydrophobicContact CE-CG1 4.4Å; M58-I60 HydrophobicContact CG-CG1 4.17Å; M58-I60 HydrophobicContact SD-CD1 4.17Å; M58-I60 HydrophobicContact SD-CG1 4.34Å; M58-I206 HydrophobicContact SD-CG2 4.2Å; M58-V208 HydrophobicContact SD-CG2 4.33Å; M58-V219 HydrophobicContact CG-CG1 3.85Å; M58-V219 HydrophobicContact SD-CG1 4.08Å; M58-E220 CarbonylContact C-O 3.44Å; M58-E220 WeakPolarHBondContact CA-O 3.45Å; M58-F221 HydrophobicContact CB-CD1 4.02Å; M58-F221 HydrophobicContact CB-CE1 4.07Å; M58-F221 HydrophobicContact CG-CD1 4.05Å; M58-F221 HydrophobicContact CG-CE1 3.71Å; M58-F221 HydrophobicContact CG-CZ 4.4Å; M58-F221 HydrophobicContact SD-CE1 3.63Å; M58-F221 HydrophobicContact SD-CZ 4.13Å
59	R	96.9	Very high	93.4	Very high	55 Å²	55	35.6 Å²	35.6	21%	0.208	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132.7	171.4	-178	169.2	68.3	-168	-0.5	109.3	Y48 R49 Y50 Q61 V219 E220	Y48-R59 HydrophobicContact CE2-CG 3.73Å; R49-R59 CarbonylContact O-C 3.54Å; R49-R59 WeakPolarHBondContact O-CA 3.07Å; Y50-R59 HydrophobicContact CD2-CB 4.11Å; R59-Q61 HydrophobicContact CG-CG 4.43Å; R59-V219 CarbonylContact O-C 3.52Å; R59-V219 WeakPolarHBondContact O-CA 3.47Å; R59-E220 HydrophobicContact CB-CB 4.48Å; R59-E220 IonicContact CZ-OE2 3.52Å; R59-E220 PolarHBondContact N-O 3.34Å; R59-E220 IonicContact NE-OE2 2.62Å; R59-E220 PolarHBondContact NE-OE2 2.99Å; R59-E220 VanDerWaalsContact NH2-CD 3.33Å; R59-E220 IonicContact NH2-OE1 3.78Å; R59-E220 PolarHBondContact NH2-OE1 3.39Å; R59-E220 IonicContact NH2-OE2 3.65Å; R59-E220 PolarHBondContact NH2-OE2 3.28Å; R59-E220 PolarHBondContact O-N 3Å
60	I	98.3	Very high	93.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.1	174.2	-49.1	-178	0	0	0	108.3	Y48 R49 M58 V208 W212 T217 L218 V219	Y48-I60 WeakPolarHBondContact CA-O 3.49Å; R49-I60 HydrophobicContact CB-CB 4.22Å; R49-I60 HydrophobicContact CB-CD1 4.49Å; R49-I60 HydrophobicContact CB-CG1 4.48Å; R49-I60 PolarHBondContact N-O 2.88Å; R49-I60 PolarHBondContact O-N 2.9Å; M58-I60 HydrophobicContact CE-CD1 3.93Å; M58-I60 HydrophobicContact CE-CG1 4.4Å; M58-I60 HydrophobicContact CG-CG1 4.17Å; M58-I60 HydrophobicContact SD-CD1 4.17Å; M58-I60 HydrophobicContact SD-CG1 4.34Å; I60-V208 HydrophobicContact CD1-CG1 4.28Å; I60-W212 HydrophobicContact CB-CD2 4.29Å; I60-W212 HydrophobicContact CB-CE3 3.97Å; I60-W212 HydrophobicContact CB-CZ3 4.34Å; I60-W212 HydrophobicContact CD1-CB 4.01Å; I60-W212 HydrophobicContact CD1-CD2 4.04Å; I60-W212 HydrophobicContact CD1-CG 3.74Å; I60-W212 HydrophobicContact CG2-CB 4.06Å; I60-W212 HydrophobicContact CG2-CD2 3.75Å; I60-W212 HydrophobicContact CG2-CE3 3.23Å; I60-W212 HydrophobicContact CG2-CG 4.1Å; I60-W212 HydrophobicContact CG2-CZ3 3.91Å; I60-T217 HydrophobicContact CG2-CG2 3.38Å; I60-L218 WeakPolarHBondContact CA-O 3.46Å; I60-V219 HydrophobicContact CG1-CG1 4.2Å; I60-V219 HydrophobicContact CG1-CG2 4.2Å; I60-V219 HydrophobicContact CG2-CG2 4.11Å
61	Q	97.9	Very high	93.3	Very high	42 Å²	42	42 Å²	42	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	127	178.6	-81.2	169.3	-147	0	0	109.9	T47 Y48 R59 Q64 T217 L218	T47-Q61 WeakPolarHBondContact O-CA 3.04Å; Y48-Q61 HydrophobicContact CD2-CG 3.64Å; Y48-Q61 HydrophobicContact CE2-CG 3.89Å; R59-Q61 HydrophobicContact CG-CG 4.43Å; Q61-Q64 HydrophobicContact CB-CG 3.72Å; Q61-Q64 WeakPolarHBondContact O-CG 3.32Å; Q61-T217 CarbonylContact O-C 3.56Å; Q61-T217 WeakPolarHBondContact O-CA 3.37Å; Q61-L218 PolarHBondContact N-O 2.77Å; Q61-L218 PolarHBondContact O-N 2.78Å
62	H	95.3	Very high	93.6	Very high	28 Å²	28	46.3 Å²	46.3	13%	0.13	25%	0.247	C	C	.	.	S	Bend	trans	-83.3	170.3	168.4	-78.5	-62.2	0	0	0	111.8	D46 T47 Q64 W212 G216 T217	D46-H62 PolarHBondContact O-CD2 3.46Å; D46-H62 VanDerWaalsContact O-CD2 3.26Å; T47-H62 PolarHBondContact O-N 2.84Å; H62-Q64 PolarHBondContact O-N 3Å; H62-Q64 PolarHBondContact O-NE2 3.34Å; H62-W212 AromaticContact CD2-CE3 3.38Å; H62-W212 AromaticContact CD2-CZ3 3.16Å; H62-W212 WeakPolarHBondContact CD2-CZ3 3.39Å; H62-W212 AromaticContact CE1-CE3 3.87Å; H62-W212 AromaticContact NE2-CD2 3.92Å; H62-W212 AromaticContact NE2-CE3 3.04Å; H62-W212 AromaticContact NE2-CZ3 3.35Å; H62-W212 VanDerWaalsContact NE2-CZ3 3.35Å; H62-W212 WeakPolarHBondContact NE2-CZ3 3.34Å; H62-G216 CarbonylContact C-O 3.59Å; H62-T217 PolarHBondContact CE1-OG1 2.94Å; H62-T217 PolarHBondContact ND1-OG1 3.35Å
63	N	95	Very high	94	Very high	137 Å²	137	46 Å²	46	73%	0.733	25%	0.246	S	C	*	.	S	Bend	trans	55.2	34.5	177.5	-56.6	-29.3	0	0	0	114	G216	N63-G216 PolarHBondContact N-O 2.94Å
64	Q	97.1	Very high	94.3	Very high	64 Å²	64	50.3 Å²	50.3	30%	0.299	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-90.4	142.2	176.1	-58.1	-57.8	-68.9	0	0	110.1	Q61 H62 Y172 G216 L218	Q61-Q64 HydrophobicContact CB-CG 3.72Å; Q61-Q64 WeakPolarHBondContact O-CG 3.32Å; H62-Q64 PolarHBondContact O-N 3Å; H62-Q64 PolarHBondContact O-NE2 3.34Å; Q64-Y172 HydrophobicContact CB-CE2 4.46Å; Q64-Y172 WeakPolarHBondContact O-CE2 3.06Å; Q64-Y172 PolarHBondContact O-OH 2.84Å; Q64-G216 PolarHBondContact N-O 3.2Å; Q64-L218 HydrophobicContact CB-CB 3.92Å; Q64-L218 HydrophobicContact CG-CB 3.7Å
65	S	95.3	Very high	94.8	Very high	107 Å²	107	52.1 Å²	52.1	75%	0.748	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-72.3	159.3	167.7	-51.9	0	0	0	0	110.6
66	Q	94.4	Very high	95.3	Very high	60 Å²	60	56.2 Å²	56.2	28%	0.28	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-58.6	124.3	175.6	-173.2	178.1	2.9	0	0	110.2	V68 S70 Y172	Q66-V68 VanDerWaalsContact C-N 3.27Å; Q66-V68 VanDerWaalsContact CG-O 3.24Å; Q66-V68 WeakPolarHBondContact CG-O 3.43Å; Q66-V68 PolarHBondContact NE2-O 3.37Å; Q66-V68 PolarHBondContact O-N 3.02Å; Q66-S70 PolarHBondContact NE2-OG 3.47Å; Q66-Y172 VanDerWaalsContact CA-CZ 3.46Å; Q66-Y172 HydrophobicContact CB-CD1 4.31Å; Q66-Y172 HydrophobicContact CB-CE1 3.63Å; Q66-Y172 HydrophobicContact CG-CD1 3.98Å; Q66-Y172 HydrophobicContact CG-CE1 3.72Å; Q66-Y172 PolarHBondContact N-OH 2.82Å
67	P	94.7	Very high	95.4	Very high	63 Å²	63	56.2 Å²	56.2	41%	0.409	30%	0.302	S	S	.	.	S	Bend	trans	-70.4	-24.7	-173.6	26.2	-34.9	0	0	0	113.1	L162 Y172 L218	P67-L162 HydrophobicContact CB-CD1 4.08Å; P67-L162 HydrophobicContact CG-CD1 3.74Å; P67-Y172 VanDerWaalsContact CD-CG 3.47Å; P67-Y172 HydrophobicContact CG-CG 4.23Å; P67-L218 HydrophobicContact CG-CD1 4.29Å
68	V	95.5	Very high	95.4	Very high	10 Å²	10	62.7 Å²	62.7	6%	0.061	34%	0.337	C	S	.	.	S	Bend	trans	-147	128	-176.7	-177.1	0	0	0	0	108.8	Q66 R72 F73 L134 L139 L162	Q66-V68 VanDerWaalsContact C-N 3.27Å; Q66-V68 VanDerWaalsContact CG-O 3.24Å; Q66-V68 WeakPolarHBondContact CG-O 3.43Å; Q66-V68 PolarHBondContact NE2-O 3.37Å; Q66-V68 PolarHBondContact O-N 3.02Å; V68-R72 HydrophobicContact CG1-CB 4.28Å; V68-F73 HydrophobicContact CB-CE2 4.41Å; V68-F73 HydrophobicContact CG1-CE2 4.08Å; V68-L134 HydrophobicContact CG1-CD1 3.86Å; V68-L139 HydrophobicContact CG1-CD2 4.48Å; V68-L139 HydrophobicContact CG2-CD2 3.74Å; V68-L162 HydrophobicContact CB-CD1 4.38Å; V68-L162 HydrophobicContact CG2-CD1 3.51Å; V68-L162 HydrophobicContact CG2-CD2 4.08Å; V68-L162 HydrophobicContact CG2-CG 4.46Å
69	S	95.6	Very high	95.1	Very high	66 Å²	66	70.3 Å²	70.3	46%	0.462	37%	0.367	S	S	.	.			trans	-60.8	141.1	178.6	-178.3	0	0	0	0	112.4	D71 R72	S69-D71 VanDerWaalsContact C-N 3.27Å; S69-D71 WeakPolarHBondContact CB-OD1 3.32Å; S69-D71 PolarHBondContact O-N 3.07Å; S69-D71 PolarHBondContact OG-OD1 3.27Å; S69-R72 PolarHBondContact O-N 2.76Å
70	S	95	Very high	95	Very high	44 Å²	44	73.1 Å²	73.1	31%	0.308	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-65.5	-25.4	-174	-60.6	0	0	0	0	113.9	Q66 R72 F73 Q143	Q66-S70 PolarHBondContact NE2-OG 3.47Å; S70-R72 PolarHBondContact O-N 3.28Å; S70-F73 PolarHBondContact O-N 3.49Å; S70-Q143 PolarHBondContact OG-NE2 3.06Å
71	D	95.1	Very high	94.9	Very high	118 Å²	118	76 Å²	76	63%	0.631	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-62.9	-23.6	176.7	66.5	-36.7	0	0	0	113.5	S69 F73	S69-D71 VanDerWaalsContact C-N 3.27Å; S69-D71 WeakPolarHBondContact CB-OD1 3.32Å; S69-D71 PolarHBondContact O-N 3.07Å; S69-D71 PolarHBondContact OG-OD1 3.27Å; D71-F73 VanDerWaalsContact C-N 3.27Å; D71-F73 PolarHBondContact O-N 3Å
72	R	96.6	Very high	94.8	Very high	91 Å²	91	76.2 Å²	76.2	34%	0.343	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-74.4	-15.1	176.6	-62.1	-178.6	58.3	-171.1	1.5	113.7	V68 S69 S70 T74 L134 E136	V68-R72 HydrophobicContact CG1-CB 4.28Å; S69-R72 PolarHBondContact O-N 2.76Å; S70-R72 PolarHBondContact O-N 3.28Å; R72-T74 PolarHBondContact O-N 3.14Å; R72-L134 HydrophobicContact CB-CD1 3.47Å; R72-L134 VanDerWaalsContact CB-CD1 3.47Å; R72-E136 IonicContact CZ-OE1 3.61Å; R72-E136 IonicContact CZ-OE2 3.58Å; R72-E136 IonicContact NE-OE1 3.35Å; R72-E136 PolarHBondContact NE-OE1 2.8Å; R72-E136 IonicContact NH2-OE1 3.94Å; R72-E136 PolarHBondContact NH2-OE1 2.03Å; R72-E136 IonicContact NH2-OE2 2.65Å; R72-E136 PolarHBondContact NH2-OE2 3.41Å
73	F	96.9	Very high	94.8	Very high	4 Å²	4	74.9 Å²	74.9	2%	0.018	39%	0.389	C	S	.	.			trans	-87	85.8	175.5	-64.8	-96.4	0	0	0	109.6	V68 S70 D71 R132 L134 Q143 T160 L162	V68-F73 HydrophobicContact CB-CE2 4.41Å; V68-F73 HydrophobicContact CG1-CE2 4.08Å; S70-F73 PolarHBondContact O-N 3.49Å; D71-F73 VanDerWaalsContact C-N 3.27Å; D71-F73 PolarHBondContact O-N 3Å; F73-R132 HydrophobicContact CB-CB 3.78Å; F73-R132 WeakPolarHBondContact O-CD 3.49Å; F73-L134 HydrophobicContact CD1-CB 3.6Å; F73-L134 HydrophobicContact CE1-CB 3.68Å; F73-L134 HydrophobicContact CE2-CD1 4.43Å; F73-L134 HydrophobicContact CG-CB 4.12Å; F73-L134 HydrophobicContact CZ-CB 4.26Å; F73-L134 HydrophobicContact CZ-CD1 4.45Å; F73-Q143 HydrophobicContact CB-CB 4.25Å; F73-Q143 HydrophobicContact CD1-CB 3.53Å; F73-Q143 HydrophobicContact CD2-CB 3.99Å; F73-Q143 HydrophobicContact CE1-CB 3.78Å; F73-Q143 HydrophobicContact CE2-CB 4.2Å; F73-Q143 HydrophobicContact CG-CB 3.65Å; F73-Q143 HydrophobicContact CZ-CB 4.11Å; F73-T160 HydrophobicContact CE1-CG2 4.17Å; F73-T160 HydrophobicContact CE2-CG2 4.19Å; F73-T160 HydrophobicContact CZ-CG2 3.48Å; F73-T160 VanDerWaalsContact CZ-CG2 3.48Å; F73-L162 HydrophobicContact CE1-CD2 4.47Å; F73-L162 HydrophobicContact CZ-CD2 3.91Å
74	T	93.9	Very high	94.8	Very high	100 Å²	100	75.9 Å²	75.9	61%	0.613	38%	0.382	S	S	*	.			trans	-91.4	-31.8	-169.6	54.3	0	0	0	0	113.6	R72 K76 V133	R72-T74 PolarHBondContact O-N 3.14Å; T74-K76 PolarHBondContact O-N 3.32Å; T74-V133 PolarHBondContact N-O 2.93Å
75	N	93.4	Very high	94.6	Very high	65 Å²	65	73.8 Å²	73.8	35%	0.348	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	103.1	-170.4	-67.6	-37.3	0	0	0	111.4	Y81 R132 V133	N75-Y81 HydrophobicContact CB-CD2 4.44Å; N75-Y81 HydrophobicContact CB-CE2 3.88Å; N75-Y81 PolarHBondContact ND2-OH 2.89Å; N75-R132 CarbonylContact O-C 3.54Å; N75-R132 VanDerWaalsContact O-CA 3.25Å; N75-R132 WeakPolarHBondContact O-CA 3.43Å; N75-V133 HydrophobicContact CB-CB 4.22Å; N75-V133 PolarHBondContact N-O 3.45Å; N75-V133 PolarHBondContact O-N 3.44Å
76	K	95	Very high	94.4	Very high	120 Å²	120	74.7 Å²	74.7	52%	0.522	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	134.5	172.3	-177.2	168.6	176.3	161.3	0	110.7	T74 E130	T74-K76 PolarHBondContact O-N 3.32Å; K76-E130 WeakPolarHBondContact CE-OE2 3.49Å; K76-E130 IonicContact NZ-OE2 3.71Å; K76-E130 PolarHBondContact NZ-OE2 3.21Å
77	I	94.8	Very high	94.2	Very high	1 Å²	1	73.3 Å²	73.3	1%	0.005	36%	0.359	C	S	.	.			trans	-83.8	114.8	173.7	-53.7	-175.1	0	0	0	108.5	F101 E103 S131 V133 V142	I77-F101 HydrophobicContact CD1-CB 3.5Å; I77-E103 HydrophobicContact CG2-CB 4.06Å; I77-S131 PolarHBondContact N-O 2.9Å; I77-V133 HydrophobicContact CD1-CG2 3.57Å; I77-V133 HydrophobicContact CG1-CG2 3.62Å; I77-V142 HydrophobicContact CD1-CG2 4Å
78	D	90.2	Very high	94	Very high	141 Å²	141	74.5 Å²	74.5	75%	0.754	37%	0.369	S	S	*	.	S	Bend	trans	-100.1	105.8	165.2	-176	11.8	0	0	0	107.9	R80	D78-R80 PolarHBondContact O-N 3.14Å
79	Y	91.1	Very high	93.8	Very high	161 Å²	161	74.4 Å²	74.4	63%	0.631	37%	0.369	S	S	*	.	S	Bend	trans	61.9	-59.6	-170.3	178.6	-110.6	0	0	0	115.7	Y102 E103	Y79-Y102 WeakPolarHBondContact O-CA 3.48Å; Y79-E103 PolarHBondContact N-OE2 3.13Å; Y79-E103 PolarHBondContact O-N 3.25Å
80	R	94.7	Very high	93.5	Very high	114 Å²	114	73.9 Å²	73.9	43%	0.43	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	131.9	-174.4	-177	-165.8	66.3	178.8	-0.5	113	D78 R100 F101 Y102	D78-R80 PolarHBondContact O-N 3.14Å; R80-R100 HydrophobicContact CG-CB 4.42Å; R80-F101 CarbonylContact C-O 3.59Å; R80-F101 VanDerWaalsContact CA-O 3.31Å; R80-F101 WeakPolarHBondContact CA-O 3.45Å; R80-Y102 HydrophobicContact CB-CD1 4.2Å; R80-Y102 HydrophobicContact CB-CE1 4.23Å; R80-Y102 HydrophobicContact CG-CD1 4.28Å; R80-Y102 HydrophobicContact CG-CE1 4.05Å
81	Y	96.1	Very high	93.4	Very high	60 Å²	60	72 Å²	72	24%	0.235	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132.1	168	-168.8	-84.1	0	0	0	110.4	N75 A83 R100 F101 V133 D135	N75-Y81 HydrophobicContact CB-CD2 4.44Å; N75-Y81 HydrophobicContact CB-CE2 3.88Å; N75-Y81 PolarHBondContact ND2-OH 2.89Å; Y81-A83 HydrophobicContact CD1-CB 4.2Å; Y81-A83 HydrophobicContact CE1-CB 4.01Å; Y81-R100 CarbonylContact O-C 3.54Å; Y81-R100 WeakPolarHBondContact O-CA 3.35Å; Y81-F101 HydrophobicContact CD1-CD2 4.44Å; Y81-F101 PolarHBondContact N-O 3.18Å; Y81-F101 PolarHBondContact O-N 3.41Å; Y81-V133 HydrophobicContact CD1-CB 4.27Å; Y81-V133 HydrophobicContact CD1-CG1 3.89Å; Y81-V133 HydrophobicContact CD1-CG2 4.01Å; Y81-V133 HydrophobicContact CE1-CB 4.38Å; Y81-V133 HydrophobicContact CE1-CG1 3.74Å; Y81-V133 HydrophobicContact CG-CB 4.39Å; Y81-V133 HydrophobicContact CG-CG2 3.95Å; Y81-D135 HydrophobicContact CE1-CB 4.41Å
82	S	95.7	Very high	93.1	Very high	47 Å²	47	66.5 Å²	66.5	33%	0.329	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	109.4	178.6	-55.1	0	0	0	0	109.5
83	A	94.9	Very high	92.5	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	137.6	-180	0	0	0	0	0	110.6	Y81 E98 I99 F101 L140	Y81-A83 HydrophobicContact CD1-CB 4.2Å; Y81-A83 HydrophobicContact CE1-CB 4.01Å; A83-E98 CarbonylContact O-C 3.56Å; A83-E98 WeakPolarHBondContact O-CA 3.49Å; A83-I99 PolarHBondContact N-O 2.96Å; A83-I99 PolarHBondContact O-N 2.86Å; A83-F101 HydrophobicContact CB-CD2 4.48Å; A83-F101 HydrophobicContact CB-CE2 4.03Å; A83-L140 HydrophobicContact CB-CD1 3.59Å; A83-L140 HydrophobicContact CB-CD2 3.91Å; A83-L140 HydrophobicContact CB-CG 4.4Å
84	R	94.8	Very high	92	Very high	157 Å²	157	67 Å²	67	59%	0.592	35%	0.349	S	S	*	.			trans	-113.9	103.1	170.7	-69.4	-176.6	-178.6	167.4	1	107.6	Q86	R84-Q86 PolarHBondContact O-N 3.32Å
85	P	92.4	Very high	91.8	Very high	21 Å²	21	69.5 Å²	69.5	14%	0.136	35%	0.348	C	S	.	.			trans	-51.2	129.3	-177.6	-25	31.4	0	0	0	111.4	F87 L89 V96 I99 L140	P85-F87 HydrophobicContact CB-CD1 4.39Å; P85-F87 HydrophobicContact CB-CD2 4.26Å; P85-F87 HydrophobicContact CB-CE1 4.21Å; P85-F87 HydrophobicContact CB-CE2 4.08Å; P85-F87 HydrophobicContact CB-CG 4.45Å; P85-F87 HydrophobicContact CB-CZ 4.06Å; P85-F87 PolarHBondContact O-N 2.94Å; P85-L89 HydrophobicContact CG-CD2 4.03Å; P85-V96 HydrophobicContact CG-CG1 4.48Å; P85-I99 HydrophobicContact CG-CD1 4.46Å; P85-L140 HydrophobicContact CG-CD2 3.9Å
86	Q	90.8	Very high	91.8	Very high	126 Å²	126	66.8 Å²	66.8	59%	0.589	33%	0.334	S	S	*	.	S	Bend	trans	-79	9.5	178.5	-61	-177.8	48.3	0	0	112.8	R84	R84-Q86 PolarHBondContact O-N 3.32Å
87	F	91.5	Very high	91.8	Very high	30 Å²	30	64 Å²	64	13%	0.132	32%	0.322	C	S	.	.	S	Bend	trans	-131.5	160.6	179.7	52.1	-95.1	0	0	0	110.4	P85 L89 K137 L140 I163 P165	P85-F87 HydrophobicContact CB-CD1 4.39Å; P85-F87 HydrophobicContact CB-CD2 4.26Å; P85-F87 HydrophobicContact CB-CE1 4.21Å; P85-F87 HydrophobicContact CB-CE2 4.08Å; P85-F87 HydrophobicContact CB-CG 4.45Å; P85-F87 HydrophobicContact CB-CZ 4.06Å; P85-F87 PolarHBondContact O-N 2.94Å; F87-L89 HydrophobicContact CD2-CB 4.11Å; F87-L89 HydrophobicContact CE2-CB 3.96Å; F87-L89 HydrophobicContact CE2-CD1 4.28Å; F87-L89 HydrophobicContact CE2-CD2 4.41Å; F87-L89 HydrophobicContact CE2-CG 4.45Å; F87-L89 PolarHBondContact O-N 3.26Å; F87-L89 VanDerWaalsContact O-N 3.14Å; F87-K137 WeakPolarHBondContact CD1-O 3.25Å; F87-L140 HydrophobicContact CE1-CB 4.31Å; F87-L140 HydrophobicContact CZ-CB 4.17Å; F87-I163 HydrophobicContact CE2-CG2 4.31Å; F87-I163 HydrophobicContact CZ-CG2 4.27Å; F87-P165 HydrophobicContact CB-CB 4.19Å; F87-P165 HydrophobicContact CB-CG 4.45Å; F87-P165 HydrophobicContact CD1-CG 4.21Å; F87-P165 HydrophobicContact CD2-CB 4.22Å; F87-P165 HydrophobicContact CD2-CG 4.47Å; F87-P165 HydrophobicContact CG-CB 4.14Å; F87-P165 HydrophobicContact CG-CG 4.14Å
88	S	89.1	Confident	91.9	Very high	88 Å²	88	65 Å²	65	62%	0.615	33%	0.327	S	S	*	.			trans	-75.7	105.2	177.9	-72.5	0	0	0	0	110.7
89	L	91.5	Very high	92.2	Very high	9 Å²	9	58.4 Å²	58.4	5%	0.047	29%	0.291	C	S	.	.			trans	-105.5	137.3	178.8	178.4	62.8	0	0	0	111.6	P85 F87 V96 I99 I163	P85-L89 HydrophobicContact CG-CD2 4.03Å; F87-L89 HydrophobicContact CD2-CB 4.11Å; F87-L89 HydrophobicContact CE2-CB 3.96Å; F87-L89 HydrophobicContact CE2-CD1 4.28Å; F87-L89 HydrophobicContact CE2-CD2 4.41Å; F87-L89 HydrophobicContact CE2-CG 4.45Å; F87-L89 PolarHBondContact O-N 3.26Å; F87-L89 VanDerWaalsContact O-N 3.14Å; L89-V96 HydrophobicContact CB-CB 4.11Å; L89-V96 HydrophobicContact CB-CG2 4.44Å; L89-V96 HydrophobicContact CD2-CB 3.91Å; L89-V96 HydrophobicContact CD2-CG1 4Å; L89-V96 HydrophobicContact CD2-CG2 3.94Å; L89-V96 HydrophobicContact CG-CB 3.96Å; L89-V96 HydrophobicContact CG-CG2 3.83Å; L89-V96 PolarHBondContact O-N 3.48Å; L89-I99 HydrophobicContact CD2-CD1 3.86Å; L89-I163 HydrophobicContact CD1-CG2 3.73Å; L89-I163 HydrophobicContact CD2-CG2 3.59Å; L89-I163 HydrophobicContact CG-CG2 4.32Å
90	S	90.3	Very high	92.4	Very high	54 Å²	54	53.9 Å²	53.9	38%	0.378	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.6	169.8	-173	0	0	0	0	109.8	G93 S94	S90-G93 WeakPolarHBondContact OG-CA 3.47Å; S90-S94 WeakPolarHBondContact CA-O 3.41Å
91	Y	91.9	Very high	92.4	Very high	5 Å²	5	48.6 Å²	48.6	2%	0.02	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	116.8	177.6	-175.2	-103.8	0	0	0	108.8	G93 S94 V96 V109 S119 I120 I169 F190	Y91-G93 PolarHBondContact O-N 3.27Å; Y91-G93 VanDerWaalsContact O-N 3.1Å; Y91-S94 PolarHBondContact N-O 2.93Å; Y91-S94 WeakPolarHBondContact O-CB 3.48Å; Y91-S94 PolarHBondContact O-N 3.09Å; Y91-V96 VanDerWaalsContact CB-CG2 3.45Å; Y91-V109 HydrophobicContact CD1-CB 4.17Å; Y91-V109 HydrophobicContact CD1-CG1 3.93Å; Y91-V109 HydrophobicContact CD1-CG2 4.38Å; Y91-V109 HydrophobicContact CE1-CB 4.37Å; Y91-V109 HydrophobicContact CE1-CG2 4.34Å; Y91-V109 HydrophobicContact CG-CG1 4Å; Y91-V109 HydrophobicContact CG-CG2 4.49Å; Y91-S119 PolarHBondContact OH-O 3.21Å; Y91-I120 HydrophobicContact CE2-CD1 4.43Å; Y91-I120 HydrophobicContact CE2-CG1 4.04Å; Y91-I169 HydrophobicContact CD2-CD1 3.8Å; Y91-I169 HydrophobicContact CE2-CD1 3.64Å; Y91-F190 WeakPolarHBondContact CE1-O 3.41Å; Y91-F190 PolarHBondContact OH-N 2.86Å; Y91-F190 VanDerWaalsContact OH-N 3.1Å; Y91-F190 PolarHBondContact OH-O 3.02Å
92	Y	88.6	Confident	92.3	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.008	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	32.4	-170.6	-72.3	-98.5	0	0	0	114.2	Y54 K55 Y56 S94 I189 E191	Y54-Y92 HydrophobicContact CD1-CD1 4.31Å; Y54-Y92 HydrophobicContact CD1-CE1 4.27Å; Y54-Y92 HydrophobicContact CE1-CD1 4.49Å; K55-Y92 HydrophobicContact CB-CD1 4.19Å; K55-Y92 HydrophobicContact CD-CD1 4.13Å; K55-Y92 WeakPolarHBondContact CD-O 3.06Å; K55-Y92 PolarHBondContact NZ-O 3.08Å; Y56-Y92 HydrophobicContact CD2-CD1 4.06Å; Y56-Y92 HydrophobicContact CD2-CD2 4.39Å; Y56-Y92 AromaticContact CD2-CE1 3.78Å; Y56-Y92 HydrophobicContact CD2-CE1 3.78Å; Y56-Y92 HydrophobicContact CD2-CE2 4.15Å; Y56-Y92 HydrophobicContact CD2-CG 4.36Å; Y56-Y92 AromaticContact CD2-CZ 3.84Å; Y56-Y92 AromaticContact CE2-CD1 3.77Å; Y56-Y92 HydrophobicContact CE2-CD1 3.77Å; Y56-Y92 AromaticContact CE2-CD2 3.53Å; Y56-Y92 HydrophobicContact CE2-CD2 3.53Å; Y56-Y92 AromaticContact CE2-CE1 3.85Å; Y56-Y92 HydrophobicContact CE2-CE1 3.85Å; Y56-Y92 AromaticContact CE2-CE2 3.63Å; Y56-Y92 HydrophobicContact CE2-CE2 3.63Å; Y56-Y92 AromaticContact CE2-CG 3.61Å; Y56-Y92 HydrophobicContact CE2-CG 3.61Å; Y56-Y92 AromaticContact CE2-CZ 3.8Å; Y56-Y92 PolarHBondContact OH-N 3.49Å; Y92-S94 VanDerWaalsContact C-N 3.31Å; Y92-I189 HydrophobicContact CE2-CD1 4.27Å; Y92-I189 PolarHBondContact OH-O 3.43Å; Y92-E191 WeakPolarHBondContact CB-OE1 3.39Å; Y92-E191 WeakPolarHBondContact CB-OE2 3.37Å; Y92-E191 HydrophobicContact CD1-CB 3.65Å; Y92-E191 HydrophobicContact CD1-CG 4.28Å; Y92-E191 WeakPolarHBondContact CD1-OE2 3.3Å; Y92-E191 HydrophobicContact CD2-CB 3.8Å; Y92-E191 HydrophobicContact CD2-CG 4.46Å; Y92-E191 HydrophobicContact CE1-CB 3.98Å; Y92-E191 HydrophobicContact CE2-CB 4.1Å; Y92-E191 HydrophobicContact CG-CB 3.56Å; Y92-E191 HydrophobicContact CG-CG 3.97Å
93	G	84.4	Confident	91.9	Very high	64 Å²	64	47.4 Å²	47.4	66%	0.66	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.3	-4.4	-178.1	0	0	0	0	0	114.7	S90 Y91	S90-G93 WeakPolarHBondContact OG-CA 3.47Å; Y91-G93 PolarHBondContact O-N 3.27Å; Y91-G93 VanDerWaalsContact O-N 3.1Å
94	S	86	Confident	91.4	Very high	42 Å²	42	51.7 Å²	51.7	29%	0.294	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	128.9	174.8	-69.2	0	0	0	0	111.1	S90 Y91 Y92 V96	S90-S94 WeakPolarHBondContact CA-O 3.41Å; Y91-S94 PolarHBondContact N-O 2.93Å; Y91-S94 WeakPolarHBondContact O-CB 3.48Å; Y91-S94 PolarHBondContact O-N 3.09Å; Y92-S94 VanDerWaalsContact C-N 3.31Å; S94-V96 PolarHBondContact O-N 2.78Å
95	R	91.2	Very high	90.9	Very high	152 Å²	152	47.3 Å²	47.3	57%	0.574	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	124.2	177	-155.9	-167.9	175.1	166.4	2.2	110.4	N111 F112	R95-N111 WeakPolarHBondContact O-CA 3.45Å; R95-N111 WeakPolarHBondContact O-CB 3.33Å; R95-F112 HydrophobicContact CB-CD2 3.87Å; R95-F112 HydrophobicContact CB-CE2 4.06Å; R95-F112 HydrophobicContact CG-CD2 3.84Å; R95-F112 HydrophobicContact CG-CE2 3.5Å; R95-F112 WeakPolarHBondContact O-CD2 3.27Å
96	V	93.8	Very high	90.7	Very high	9 Å²	9	47.2 Å²	47.2	6%	0.055	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	133.2	-176.8	179.5	0	0	0	0	110.4	P85 L89 Y91 S94 I99 V109 F112	P85-V96 HydrophobicContact CG-CG1 4.48Å; L89-V96 HydrophobicContact CB-CB 4.11Å; L89-V96 HydrophobicContact CB-CG2 4.44Å; L89-V96 HydrophobicContact CD2-CB 3.91Å; L89-V96 HydrophobicContact CD2-CG1 4Å; L89-V96 HydrophobicContact CD2-CG2 3.94Å; L89-V96 HydrophobicContact CG-CB 3.96Å; L89-V96 HydrophobicContact CG-CG2 3.83Å; L89-V96 PolarHBondContact O-N 3.48Å; Y91-V96 VanDerWaalsContact CB-CG2 3.45Å; S94-V96 PolarHBondContact O-N 2.78Å; V96-I99 HydrophobicContact CG1-CD1 4.18Å; V96-I99 HydrophobicContact CG1-CG1 3.75Å; V96-V109 HydrophobicContact CB-CG1 4.34Å; V96-V109 HydrophobicContact CG1-CG1 3.82Å; V96-V109 HydrophobicContact CG2-CG1 3.61Å; V96-F112 WeakPolarHBondContact O-CE2 3.36Å
97	H	94.4	Very high	90.6	Very high	62 Å²	62	41.2 Å²	41.2	29%	0.287	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	-42.4	175.6	176.6	61.8	0	0	0	112.2	Y110 F112	H97-Y110 PolarHBondContact N-O 2.73Å; H97-F112 HydrophobicContact CB-CB 4.4Å; H97-F112 HydrophobicContact CB-CD1 4.09Å; H97-F112 HydrophobicContact CB-CD2 3.98Å; H97-F112 HydrophobicContact CB-CE1 4.33Å; H97-F112 HydrophobicContact CB-CE2 4.2Å; H97-F112 HydrophobicContact CB-CG 3.92Å; H97-F112 HydrophobicContact CB-CZ 4.38Å; H97-F112 AromaticContact ND1-CD1 3.67Å; H97-F112 AromaticContact ND1-CE1 3.56Å
98	E	95.8	Very high	90.7	Very high	22 Å²	22	42.4 Å²	42.4	10%	0.103	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	143.6	-173.9	179.9	177.4	-107.9	0	0	109.5	A83 R100 Y110	A83-E98 CarbonylContact O-C 3.56Å; A83-E98 WeakPolarHBondContact O-CA 3.49Å; E98-R100 HydrophobicContact CG-CG 4.16Å; E98-R100 IonicContact OE2-CZ 2.69Å; E98-R100 IonicContact OE2-NE 2.75Å; E98-R100 PolarHBondContact OE2-NE 3.11Å; E98-R100 IonicContact OE2-NH2 2.78Å; E98-R100 PolarHBondContact OE2-NH2 3.21Å; E98-Y110 PolarHBondContact N-O 3.45Å; E98-Y110 PolarHBondContact O-N 3.31Å
99	I	96.2	Very high	90.8	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	126	168.8	-55.7	-176.8	0	0	0	107.6	A83 P85 L89 V96 F101 K108 V109 L140 I163	A83-I99 PolarHBondContact N-O 2.96Å; A83-I99 PolarHBondContact O-N 2.86Å; P85-I99 HydrophobicContact CG-CD1 4.46Å; L89-I99 HydrophobicContact CD2-CD1 3.86Å; V96-I99 HydrophobicContact CG1-CD1 4.18Å; V96-I99 HydrophobicContact CG1-CG1 3.75Å; I99-F101 HydrophobicContact CB-CZ 4.36Å; I99-F101 HydrophobicContact CG2-CD1 4.26Å; I99-F101 HydrophobicContact CG2-CE1 3.72Å; I99-F101 HydrophobicContact CG2-CE2 4.08Å; I99-F101 HydrophobicContact CG2-CZ 3.62Å; I99-K108 CarbonylContact C-O 3.59Å; I99-K108 WeakPolarHBondContact CA-O 3.31Å; I99-V109 HydrophobicContact CG1-CG1 4.49Å; I99-V109 HydrophobicContact CG1-CG2 4.43Å; I99-L140 HydrophobicContact CD1-CD2 4Å; I99-I163 HydrophobicContact CD1-CD1 3.33Å
100	R	96.2	Very high	90.8	Very high	66 Å²	66	39.2 Å²	39.2	25%	0.249	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	112.5	177.8	-61.3	-178.2	-173.9	163.9	0.9	109.2	R80 Y81 E98 Y102 G107 K108 Y110	R80-R100 HydrophobicContact CG-CB 4.42Å; Y81-R100 CarbonylContact O-C 3.54Å; Y81-R100 WeakPolarHBondContact O-CA 3.35Å; E98-R100 HydrophobicContact CG-CG 4.16Å; E98-R100 IonicContact OE2-CZ 2.69Å; E98-R100 IonicContact OE2-NE 2.75Å; E98-R100 PolarHBondContact OE2-NE 3.11Å; E98-R100 IonicContact OE2-NH2 2.78Å; E98-R100 PolarHBondContact OE2-NH2 3.21Å; R100-Y102 HydrophobicContact CB-CE2 3.96Å; R100-G107 CarbonylContact O-C 3.55Å; R100-G107 WeakPolarHBondContact O-CA 3.49Å; R100-K108 PolarHBondContact N-O 3.16Å; R100-K108 PolarHBondContact O-N 2.86Å; R100-Y110 HydrophobicContact CB-CE2 4.14Å; R100-Y110 VanDerWaalsContact CD-CE2 3.47Å; R100-Y110 HydrophobicContact CG-CD2 4.11Å; R100-Y110 HydrophobicContact CG-CE2 3.76Å
101	F	95.8	Very high	90.7	Very high	3 Å²	3	37.8 Å²	37.8	1%	0.013	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	128.4	172.3	-58	-69.5	0	0	0	109.3	I77 R80 Y81 A83 I99 V133 L140 V142 I163	I77-F101 HydrophobicContact CD1-CB 3.5Å; R80-F101 CarbonylContact C-O 3.59Å; R80-F101 VanDerWaalsContact CA-O 3.31Å; R80-F101 WeakPolarHBondContact CA-O 3.45Å; Y81-F101 HydrophobicContact CD1-CD2 4.44Å; Y81-F101 PolarHBondContact N-O 3.18Å; Y81-F101 PolarHBondContact O-N 3.41Å; A83-F101 HydrophobicContact CB-CD2 4.48Å; A83-F101 HydrophobicContact CB-CE2 4.03Å; I99-F101 HydrophobicContact CB-CZ 4.36Å; I99-F101 HydrophobicContact CG2-CD1 4.26Å; I99-F101 HydrophobicContact CG2-CE1 3.72Å; I99-F101 HydrophobicContact CG2-CE2 4.08Å; I99-F101 HydrophobicContact CG2-CZ 3.62Å; F101-V133 HydrophobicContact CB-CG2 4.42Å; F101-V133 HydrophobicContact CD2-CG1 4.41Å; F101-V133 HydrophobicContact CD2-CG2 3.97Å; F101-V133 HydrophobicContact CE2-CG1 4.44Å; F101-V133 HydrophobicContact CG-CG2 4.41Å; F101-L140 HydrophobicContact CE2-CD1 4.02Å; F101-L140 HydrophobicContact CE2-CD2 4.32Å; F101-L140 HydrophobicContact CE2-CG 4.18Å; F101-L140 HydrophobicContact CZ-CD2 4.33Å; F101-L140 HydrophobicContact CZ-CG 4.19Å; F101-V142 HydrophobicContact CD1-CB 3.86Å; F101-V142 HydrophobicContact CD1-CG1 3.62Å; F101-V142 HydrophobicContact CD1-CG2 4.45Å; F101-V142 HydrophobicContact CE1-CB 4.05Å; F101-V142 HydrophobicContact CE1-CG1 3.65Å; F101-V142 HydrophobicContact CG-CB 4.21Å; F101-V142 HydrophobicContact CG-CG1 4.44Å; F101-V142 HydrophobicContact CZ-CG1 4.5Å; F101-I163 HydrophobicContact CZ-CD1 4.49Å
102	Y	92.7	Very high	90.4	Very high	36 Å²	36	43 Å²	43	14%	0.141	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	147.3	175.4	-71.5	-93	0	0	0	110	Y79 R80 R100 H104 D105 K108	Y79-Y102 WeakPolarHBondContact O-CA 3.48Å; R80-Y102 HydrophobicContact CB-CD1 4.2Å; R80-Y102 HydrophobicContact CB-CE1 4.23Å; R80-Y102 HydrophobicContact CG-CD1 4.28Å; R80-Y102 HydrophobicContact CG-CE1 4.05Å; R100-Y102 HydrophobicContact CB-CE2 3.96Å; Y102-H104 VanDerWaalsContact C-N 3.3Å; Y102-H104 PolarHBondContact O-N 3.45Å; Y102-D105 HydrophobicContact CG-CB 4.5Å; Y102-K108 HydrophobicContact CD2-CG 4.39Å; Y102-K108 HydrophobicContact CE2-CB 4.38Å; Y102-K108 HydrophobicContact CE2-CD 3.79Å; Y102-K108 HydrophobicContact CE2-CG 3.96Å
103	E	88.6	Confident	90.2	Very high	47 Å²	47	51.9 Å²	51.9	22%	0.22	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-42.3	-174.3	-172.3	-176.8	178.6	0	0	112.6	I77 Y79 S129 S131	I77-E103 HydrophobicContact CG2-CB 4.06Å; Y79-E103 PolarHBondContact N-OE2 3.13Å; Y79-E103 PolarHBondContact O-N 3.25Å; E103-S129 PolarHBondContact O-OG 3.35Å; E103-S131 PolarHBondContact O-OG 3.39Å
104	H	83.8	Confident	90.2	Very high	90 Å²	90	51.3 Å²	51.3	42%	0.417	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.1	24.7	-176.2	-56.2	-41.7	0	0	0	113.6	Y102 Y123 S129	Y102-H104 VanDerWaalsContact C-N 3.3Å; Y102-H104 PolarHBondContact O-N 3.45Å; H104-Y123 WeakPolarHBondContact CA-OH 3.37Å; H104-Y123 WeakPolarHBondContact CB-OH 3.27Å; H104-S129 PolarHBondContact CE1-O 2.03Å; H104-S129 PolarHBondContact ND1-O 3.31Å; H104-S129 VanDerWaalsContact ND1-O 3.16Å
105	D	84.8	Confident	90.2	Very high	64 Å²	64	54.1 Å²	54.1	34%	0.342	25%	0.25	S	S	.	.	S	Bend	trans	-149	-177.3	-175.9	-160.6	5.7	0	0	0	111.4	Y102 R144	Y102-D105 HydrophobicContact CG-CB 4.5Å; D105-R144 PolarHBondContact O-NH2 2.62Å
106	E	86.7	Confident	90.2	Very high	20 Å²	20	49.1 Å²	49.1	9%	0.093	23%	0.232	C	C	.	.			trans	-62.1	158.5	-178.6	68.4	-174.4	-162.4	0	0	114.6	K108 S119 Y121 F190	E106-K108 HydrophobicContact CG-CG 4Å; E106-K108 WeakPolarHBondContact OE1-CE 2.97Å; E106-S119 WeakPolarHBondContact OE1-CB 3.39Å; E106-S119 PolarHBondContact OE1-OG 3.1Å; E106-S119 WeakPolarHBondContact OE2-CB 3.03Å; E106-Y121 HydrophobicContact CB-CD2 3.54Å; E106-Y121 HydrophobicContact CB-CE2 4.21Å; E106-Y121 HydrophobicContact CB-CG 4.27Å; E106-Y121 HydrophobicContact CG-CD2 4.49Å; E106-F190 WeakPolarHBondContact OE2-CE1 3.27Å
107	G	88.9	Confident	90.1	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	111.7	165.8	0	0	0	0	0	110	R100 S119 I120	R100-G107 CarbonylContact O-C 3.55Å; R100-G107 WeakPolarHBondContact O-CA 3.49Å; G107-S119 CarbonylContact O-C 3.47Å; G107-S119 WeakPolarHBondContact O-CA 3.36Å; G107-S119 WeakPolarHBondContact O-CB 3.44Å; G107-I120 PolarHBondContact N-O 2.84Å; G107-I120 PolarHBondContact O-N 2.96Å
108	K	93.8	Very high	90	Very high	54 Å²	54	46.1 Å²	46.1	24%	0.235	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.7	180	-63.8	-168.6	179.2	174.3	0	111	I99 R100 Y102 E106 Y110 Y116	I99-K108 CarbonylContact C-O 3.59Å; I99-K108 WeakPolarHBondContact CA-O 3.31Å; R100-K108 PolarHBondContact N-O 3.16Å; R100-K108 PolarHBondContact O-N 2.86Å; Y102-K108 HydrophobicContact CD2-CG 4.39Å; Y102-K108 HydrophobicContact CE2-CB 4.38Å; Y102-K108 HydrophobicContact CE2-CD 3.79Å; Y102-K108 HydrophobicContact CE2-CG 3.96Å; E106-K108 HydrophobicContact CG-CG 4Å; E106-K108 WeakPolarHBondContact OE1-CE 2.97Å; K108-Y110 HydrophobicContact CB-CD2 4.45Å; K108-Y110 HydrophobicContact CB-CE2 3.59Å; K108-Y110 WeakPolarHBondContact O-CD2 2.98Å; K108-Y116 HydrophobicContact CB-CD2 4.19Å; K108-Y116 HydrophobicContact CB-CE2 3.9Å; K108-Y116 HydrophobicContact CD-CE2 4.2Å; K108-Y116 HydrophobicContact CG-CE2 3.99Å
109	V	90.8	Very high	90	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	126.7	-176.7	-175.4	0	0	0	0	110.2	Y91 V96 I99 S117 G118 I120	Y91-V109 HydrophobicContact CD1-CB 4.17Å; Y91-V109 HydrophobicContact CD1-CG1 3.93Å; Y91-V109 HydrophobicContact CD1-CG2 4.38Å; Y91-V109 HydrophobicContact CE1-CB 4.37Å; Y91-V109 HydrophobicContact CE1-CG2 4.34Å; Y91-V109 HydrophobicContact CG-CG1 4Å; Y91-V109 HydrophobicContact CG-CG2 4.49Å; V96-V109 HydrophobicContact CB-CG1 4.34Å; V96-V109 HydrophobicContact CG1-CG1 3.82Å; V96-V109 HydrophobicContact CG2-CG1 3.61Å; I99-V109 HydrophobicContact CG1-CG1 4.49Å; I99-V109 HydrophobicContact CG1-CG2 4.43Å; V109-S117 PolarHBondContact O-N 3.32Å; V109-G118 WeakPolarHBondContact CB-O 3.38Å; V109-G118 PolarHBondContact N-O 2.86Å; V109-I120 HydrophobicContact CG2-CD1 4.16Å; V109-I120 HydrophobicContact CG2-CG1 4.12Å
110	Y	92.1	Very high	90	Very high	30 Å²	30	45.2 Å²	45.2	12%	0.118	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	138.6	179.5	-63.3	-94.9	0	0	0	110.9	H97 E98 R100 K108 L115 Y116	H97-Y110 PolarHBondContact N-O 2.73Å; E98-Y110 PolarHBondContact N-O 3.45Å; E98-Y110 PolarHBondContact O-N 3.31Å; R100-Y110 HydrophobicContact CB-CE2 4.14Å; R100-Y110 VanDerWaalsContact CD-CE2 3.47Å; R100-Y110 HydrophobicContact CG-CD2 4.11Å; R100-Y110 HydrophobicContact CG-CE2 3.76Å; K108-Y110 HydrophobicContact CB-CD2 4.45Å; K108-Y110 HydrophobicContact CB-CE2 3.59Å; K108-Y110 WeakPolarHBondContact O-CD2 2.98Å; Y110-L115 WeakPolarHBondContact CA-O 3.36Å; Y110-Y116 HydrophobicContact CE1-CD2 4.37Å
111	N	88.8	Confident	90	Very high	24 Å²	24	43.3 Å²	43.3	13%	0.128	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	174.5	175.9	63.6	41.1	0	0	0	112.1	R95 R113 G114 L115 S117	R95-N111 WeakPolarHBondContact O-CA 3.45Å; R95-N111 WeakPolarHBondContact O-CB 3.33Å; N111-R113 PolarHBondContact O-N 2.91Å; N111-R113 WeakPolarHBondContact OD1-CA 3.46Å; N111-R113 VanDerWaalsContact OD1-CB 3.32Å; N111-R113 WeakPolarHBondContact OD1-CB 3.27Å; N111-R113 PolarHBondContact OD1-N 3.15Å; N111-G114 WeakPolarHBondContact O-CA 3.37Å; N111-G114 PolarHBondContact O-N 3.2Å; N111-L115 PolarHBondContact N-O 3.22Å; N111-L115 PolarHBondContact ND2-O 3.37Å; N111-L115 PolarHBondContact OD1-N 3.23Å; N111-L115 PolarHBondContact OD1-O 3.25Å; N111-S117 WeakPolarHBondContact CB-OG 3.36Å; N111-S117 PolarHBondContact ND2-OG 3.48Å; N111-S117 VanDerWaalsContact ND2-OG 3.08Å
112	F	85	Confident	90	Very high	114 Å²	114	43.2 Å²	43.2	50%	0.5	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-9.8	179	-80.1	-90.8	0	0	0	115.6	R95 V96 H97 G114	R95-F112 HydrophobicContact CB-CD2 3.87Å; R95-F112 HydrophobicContact CB-CE2 4.06Å; R95-F112 HydrophobicContact CG-CD2 3.84Å; R95-F112 HydrophobicContact CG-CE2 3.5Å; R95-F112 WeakPolarHBondContact O-CD2 3.27Å; V96-F112 WeakPolarHBondContact O-CE2 3.36Å; H97-F112 HydrophobicContact CB-CB 4.4Å; H97-F112 HydrophobicContact CB-CD1 4.09Å; H97-F112 HydrophobicContact CB-CD2 3.98Å; H97-F112 HydrophobicContact CB-CE1 4.33Å; H97-F112 HydrophobicContact CB-CE2 4.2Å; H97-F112 HydrophobicContact CB-CG 3.92Å; H97-F112 HydrophobicContact CB-CZ 4.38Å; H97-F112 AromaticContact ND1-CD1 3.67Å; H97-F112 AromaticContact ND1-CE1 3.56Å; F112-G114 VanDerWaalsContact C-N 3.3Å
113	R	84.2	Confident	90	Very high	190 Å²	190	42 Å²	42	72%	0.717	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	5	171.6	-58.8	178.2	173.8	-179.1	-5	112.4	N111 L115	N111-R113 PolarHBondContact O-N 2.91Å; N111-R113 WeakPolarHBondContact OD1-CA 3.46Å; N111-R113 VanDerWaalsContact OD1-CB 3.32Å; N111-R113 WeakPolarHBondContact OD1-CB 3.27Å; N111-R113 PolarHBondContact OD1-N 3.15Å; R113-L115 HydrophobicContact CB-CD1 4.07Å; R113-L115 HydrophobicContact CB-CG 4.01Å; R113-L115 PolarHBondContact O-N 2.88Å
114	G	83.6	Confident	90.2	Very high	51 Å²	51	39.8 Å²	39.8	53%	0.526	19%	0.191	S	C	.	.	S	Bend	trans	69.9	9.9	-172.4	0	0	0	0	0	113.5	N111 F112	N111-G114 WeakPolarHBondContact O-CA 3.37Å; N111-G114 PolarHBondContact O-N 3.2Å; F112-G114 VanDerWaalsContact C-N 3.3Å
115	L	87.5	Confident	90.5	Very high	101 Å²	101	40 Å²	40	53%	0.529	19%	0.191	S	C	.	.			trans	-87.8	135.2	-178.3	-60.9	174.1	0	0	0	110	Y110 N111 R113 S117	Y110-L115 WeakPolarHBondContact CA-O 3.36Å; N111-L115 PolarHBondContact N-O 3.22Å; N111-L115 PolarHBondContact ND2-O 3.37Å; N111-L115 PolarHBondContact OD1-N 3.23Å; N111-L115 PolarHBondContact OD1-O 3.25Å; R113-L115 HydrophobicContact CB-CD1 4.07Å; R113-L115 HydrophobicContact CB-CG 4.01Å; R113-L115 PolarHBondContact O-N 2.88Å; L115-S117 PolarHBondContact O-N 2.63Å; L115-S117 PolarHBondContact O-OG 3.33Å
116	Y	90.9	Very high	90.5	Very high	48 Å²	48	46.4 Å²	46.4	19%	0.188	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	124.1	171.3	175.7	-105.5	0	0	0	109.9	K108 Y110 G118 S119 F190 Q192	K108-Y116 HydrophobicContact CB-CD2 4.19Å; K108-Y116 HydrophobicContact CB-CE2 3.9Å; K108-Y116 HydrophobicContact CD-CE2 4.2Å; K108-Y116 HydrophobicContact CG-CE2 3.99Å; Y110-Y116 HydrophobicContact CE1-CD2 4.37Å; Y116-G118 VanDerWaalsContact CE2-C 3.49Å; Y116-G118 WeakPolarHBondContact CE2-O 3.07Å; Y116-G118 VanDerWaalsContact CZ-C 3.45Å; Y116-G118 VanDerWaalsContact OH-C 3.31Å; Y116-S119 WeakPolarHBondContact CE2-OG 3.34Å; Y116-S119 PolarHBondContact OH-OG 2.85Å; Y116-F190 HydrophobicContact CE1-CE2 4.46Å; Y116-F190 WeakPolarHBondContact OH-CE2 3.43Å; Y116-F190 WeakPolarHBondContact OH-CZ 3.2Å; Y116-Q192 HydrophobicContact CD1-CB 3.91Å; Y116-Q192 HydrophobicContact CD1-CG 4.3Å; Y116-Q192 HydrophobicContact CE1-CB 3.67Å; Y116-Q192 HydrophobicContact CE1-CG 4.24Å; Y116-Q192 VanDerWaalsContact CE1-OE1 3.25Å
117	S	91.1	Very high	90.5	Very high	7 Å²	7	46.7 Å²	46.7	5%	0.049	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-16.9	-177.1	-55.8	0	0	0	0	112.3	V109 N111 L115 E191 Q192	V109-S117 PolarHBondContact O-N 3.32Å; N111-S117 WeakPolarHBondContact CB-OG 3.36Å; N111-S117 PolarHBondContact ND2-OG 3.48Å; N111-S117 VanDerWaalsContact ND2-OG 3.08Å; L115-S117 PolarHBondContact O-N 2.63Å; L115-S117 PolarHBondContact O-OG 3.33Å; S117-E191 WeakPolarHBondContact O-CA 3.21Å; S117-Q192 PolarHBondContact O-N 2.89Å
118	G	94	Very high	90.5	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148	-169.5	-178.7	0	0	0	0	0	112	V109 Y116 F190	V109-G118 WeakPolarHBondContact CB-O 3.38Å; V109-G118 PolarHBondContact N-O 2.86Å; Y116-G118 VanDerWaalsContact CE2-C 3.49Å; Y116-G118 WeakPolarHBondContact CE2-O 3.07Å; Y116-G118 VanDerWaalsContact CZ-C 3.45Å; Y116-G118 VanDerWaalsContact OH-C 3.31Å; G118-F190 CarbonylContact C-O 3.57Å; G118-F190 WeakPolarHBondContact CA-O 3.49Å
119	S	95.3	Very high	90.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	151.5	-178.6	-68.5	0	0	0	0	114.1	Y91 E106 G107 Y116 F190	Y91-S119 PolarHBondContact OH-O 3.21Å; E106-S119 WeakPolarHBondContact OE1-CB 3.39Å; E106-S119 PolarHBondContact OE1-OG 3.1Å; E106-S119 WeakPolarHBondContact OE2-CB 3.03Å; G107-S119 CarbonylContact O-C 3.47Å; G107-S119 WeakPolarHBondContact O-CA 3.36Å; G107-S119 WeakPolarHBondContact O-CB 3.44Å; Y116-S119 WeakPolarHBondContact CE2-OG 3.34Å; Y116-S119 PolarHBondContact OH-OG 2.85Å; S119-F190 VanDerWaalsContact CB-CE1 3.47Å; S119-F190 PolarHBondContact N-O 2.85Å; S119-F190 PolarHBondContact O-N 2.89Å
120	I	96.4	Very high	90.5	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.026	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	110	170.5	-59.6	173	0	0	0	106.6	Y91 G107 V109 I163 I169 F171 I189	Y91-I120 HydrophobicContact CE2-CD1 4.43Å; Y91-I120 HydrophobicContact CE2-CG1 4.04Å; G107-I120 PolarHBondContact N-O 2.84Å; G107-I120 PolarHBondContact O-N 2.96Å; V109-I120 HydrophobicContact CG2-CD1 4.16Å; V109-I120 HydrophobicContact CG2-CG1 4.12Å; I120-I163 HydrophobicContact CD1-CD1 3.57Å; I120-I163 HydrophobicContact CD1-CG1 4.1Å; I120-I169 HydrophobicContact CD1-CD1 3.88Å; I120-I169 HydrophobicContact CD1-CG1 4.4Å; I120-I169 HydrophobicContact CD1-CG2 4.4Å; I120-I169 HydrophobicContact CG1-CD1 4.26Å; I120-I169 HydrophobicContact CG2-CG2 4.26Å; I120-F171 HydrophobicContact CG2-CE1 3.44Å; I120-F171 VanDerWaalsContact CG2-CE1 3.44Å; I120-F171 HydrophobicContact CG2-CZ 3.66Å; I120-I189 HydrophobicContact CG1-CG2 4.28Å; I120-I189 HydrophobicContact CG2-CG2 4.35Å
121	Y	94.8	Very high	90.7	Very high	26 Å²	26	54.4 Å²	54.4	10%	0.102	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118.8	-174.7	-168.2	-72.4	0	0	0	108.7	E106 Y123 K186 S187 R188	E106-Y121 HydrophobicContact CB-CD2 3.54Å; E106-Y121 HydrophobicContact CB-CE2 4.21Å; E106-Y121 HydrophobicContact CB-CG 4.27Å; E106-Y121 HydrophobicContact CG-CD2 4.49Å; Y121-Y123 VanDerWaalsContact CE1-CB 3.41Å; Y121-K186 HydrophobicContact CD1-CB 4.09Å; Y121-K186 WeakPolarHBondContact CD1-O 3.42Å; Y121-K186 HydrophobicContact CE1-CB 3.55Å; Y121-K186 VanDerWaalsContact CE1-O 3.29Å; Y121-K186 WeakPolarHBondContact CE1-O 3.37Å; Y121-S187 CarbonylContact O-C 3.58Å; Y121-S187 VanDerWaalsContact O-CA 3.24Å; Y121-S187 WeakPolarHBondContact O-CA 2.91Å; Y121-R188 HydrophobicContact CG-CG 4.29Å; Y121-R188 PolarHBondContact N-O 2.84Å; Y121-R188 PolarHBondContact O-N 3.13Å
122	N	95.9	Very high	91.1	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	95.7	174.5	-177.4	1.1	0	0	0	107.3	R144 M159 T160 S161 F171 Y173 S187	N122-R144 PolarHBondContact O-NH1 3.3Å; N122-M159 WeakPolarHBondContact OD1-CB 3.37Å; N122-M159 PolarHBondContact OD1-SD 2.84Å; N122-T160 PolarHBondContact ND2-O 3.31Å; N122-T160 VanDerWaalsContact ND2-O 3.13Å; N122-S161 VanDerWaalsContact CB-OG 3.26Å; N122-S161 WeakPolarHBondContact CB-OG 3.42Å; N122-S161 PolarHBondContact ND2-OG 2.72Å; N122-F171 HydrophobicContact CB-CD1 4.09Å; N122-F171 HydrophobicContact CB-CD2 4.4Å; N122-F171 HydrophobicContact CB-CE1 4.06Å; N122-F171 HydrophobicContact CB-CE2 4.35Å; N122-F171 HydrophobicContact CB-CG 4.28Å; N122-F171 HydrophobicContact CB-CZ 4.19Å; N122-Y173 WeakPolarHBondContact OD1-CE1 3.41Å; N122-S187 PolarHBondContact OD1-OG 2.82Å; N122-S187 VanDerWaalsContact OD1-OG 3.06Å
123	Y	92.7	Very high	91.6	Very high	11 Å²	11	51.3 Å²	51.3	4%	0.043	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	153.4	-163.8	-149.1	-94	0	0	0	112.8	H104 Y121 V127 S129 F146 K186	H104-Y123 WeakPolarHBondContact CA-OH 3.37Å; H104-Y123 WeakPolarHBondContact CB-OH 3.27Å; Y121-Y123 VanDerWaalsContact CE1-CB 3.41Å; Y123-V127 PolarHBondContact OH-O 3.24Å; Y123-S129 WeakPolarHBondContact CE2-OG 3.06Å; Y123-S129 PolarHBondContact OH-OG 3.07Å; Y123-F146 AromaticContact CD1-CE1 3.87Å; Y123-F146 HydrophobicContact CD1-CE1 3.87Å; Y123-F146 HydrophobicContact CD1-CZ 4.2Å; Y123-F146 HydrophobicContact CD2-CE1 4.05Å; Y123-F146 AromaticContact CD2-CZ 3.74Å; Y123-F146 HydrophobicContact CD2-CZ 3.74Å; Y123-F146 AromaticContact CE1-CE1 3.66Å; Y123-F146 HydrophobicContact CE1-CE1 3.66Å; Y123-F146 HydrophobicContact CE1-CZ 4.31Å; Y123-F146 AromaticContact CE2-CE1 3.86Å; Y123-F146 HydrophobicContact CE2-CE1 3.86Å; Y123-F146 AromaticContact CE2-CZ 3.89Å; Y123-F146 HydrophobicContact CE2-CZ 3.89Å; Y123-F146 HydrophobicContact CG-CE1 4.03Å; Y123-F146 AromaticContact CG-CZ 3.87Å; Y123-F146 HydrophobicContact CG-CZ 3.87Å; Y123-F146 AromaticContact CZ-CE1 3.62Å; Y123-K186 PolarHBondContact N-O 3.31Å; Y123-K186 PolarHBondContact O-N 3.34Å; Y123-K186 VanDerWaalsContact O-N 3.12Å
124	I	93.1	Very high	92.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	114.8	168.3	-55.2	-178	0	0	0	108.7	V127 F146 M148 T157 M159 I180 Q184 L185	I124-V127 HydrophobicContact CB-CB 4.43Å; I124-V127 HydrophobicContact CG2-CB 4.13Å; I124-V127 HydrophobicContact CG2-CG2 3.7Å; I124-F146 HydrophobicContact CB-CD1 3.82Å; I124-F146 HydrophobicContact CB-CE1 3.85Å; I124-F146 HydrophobicContact CB-CG 4.19Å; I124-F146 HydrophobicContact CB-CZ 4.28Å; I124-F146 HydrophobicContact CD1-CB 4.12Å; I124-F146 HydrophobicContact CD1-CD1 4.37Å; I124-F146 HydrophobicContact CD1-CD2 3.89Å; I124-F146 HydrophobicContact CD1-CE2 4.46Å; I124-F146 HydrophobicContact CD1-CG 3.86Å; I124-F146 HydrophobicContact CG1-CD1 4.21Å; I124-F146 HydrophobicContact CG1-CD2 4.05Å; I124-F146 HydrophobicContact CG1-CE1 4.28Å; I124-F146 HydrophobicContact CG1-CE2 4.15Å; I124-F146 HydrophobicContact CG1-CG 4.11Å; I124-F146 HydrophobicContact CG1-CZ 4.27Å; I124-M148 HydrophobicContact CD1-CE 3.63Å; I124-T157 HydrophobicContact CD1-CG2 3.9Å; I124-M159 HydrophobicContact CD1-CE 3.86Å; I124-M159 HydrophobicContact CD1-SD 4.45Å; I124-M159 HydrophobicContact CG1-CE 3.41Å; I124-M159 VanDerWaalsContact CG1-CE 3.41Å; I124-M159 HydrophobicContact CG1-SD 3.74Å; I124-I180 HydrophobicContact CD1-CD1 4.04Å; I124-I180 HydrophobicContact CG2-CD1 3.6Å; I124-Q184 HydrophobicContact CG2-CB 4.25Å; I124-L185 HydrophobicContact CD1-CD2 4.38Å; I124-L185 HydrophobicContact CG1-CD2 4.18Å
125	K	91	Very high	92.8	Very high	94 Å²	94	41.8 Å²	41.8	41%	0.409	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	147	180	-73.7	-177.5	164.7	178.7	0	111.4	V127 Q184 K186	K125-V127 PolarHBondContact O-N 3.4Å; K125-V127 VanDerWaalsContact O-N 3.16Å; K125-Q184 PolarHBondContact N-O 3.16Å; K125-K186 HydrophobicContact CD-CG 3.88Å; K125-K186 HydrophobicContact CG-CG 4.11Å
126	K	84.5	Confident	93.1	Very high	199 Å²	199	40.5 Å²	40.5	87%	0.865	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.9	6.1	175.5	-51.5	176	-180	175.6	0	115.3
127	V	87.1	Confident	93.2	Very high	26 Å²	26	45.1 Å²	45.1	16%	0.158	20%	0.202	C	C	.	.			trans	-112.3	133.3	176	-173.7	0	0	0	0	109	Y123 I124 K125 F146 L147	Y123-V127 PolarHBondContact OH-O 3.24Å; I124-V127 HydrophobicContact CB-CB 4.43Å; I124-V127 HydrophobicContact CG2-CB 4.13Å; I124-V127 HydrophobicContact CG2-CG2 3.7Å; K125-V127 PolarHBondContact O-N 3.4Å; K125-V127 VanDerWaalsContact O-N 3.16Å; V127-F146 HydrophobicContact CB-CD1 4.03Å; V127-F146 HydrophobicContact CG1-CB 3.9Å; V127-F146 HydrophobicContact CG1-CD1 4.01Å; V127-F146 HydrophobicContact CG1-CG 4.46Å; V127-L147 WeakPolarHBondContact CG1-O 3.44Å
128	K	87.9	Confident	93.3	Very high	175 Å²	175	51.6 Å²	51.6	76%	0.761	23%	0.231	S	C	*	.			trans	-71.4	140.9	173.7	-69.6	-173.8	178.2	-177.1	0	109.1
129	S	92.2	Very high	93.3	Very high	6 Å²	6	52.2 Å²	52.2	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	146.9	176	66.2	0	0	0	0	111.9	E103 H104 Y123 S131 N145	E103-S129 PolarHBondContact O-OG 3.35Å; H104-S129 PolarHBondContact CE1-O 2.03Å; H104-S129 PolarHBondContact ND1-O 3.31Å; H104-S129 VanDerWaalsContact ND1-O 3.16Å; Y123-S129 WeakPolarHBondContact CE2-OG 3.06Å; Y123-S129 PolarHBondContact OH-OG 3.07Å; S129-S131 PolarHBondContact OG-OG 3.22Å; S129-N145 CarbonylContact C-O 3.58Å; S129-N145 WeakPolarHBondContact CA-O 3.44Å; S129-N145 WeakPolarHBondContact CB-O 3.31Å
130	E	93.5	Very high	93.4	Very high	65 Å²	65	52.2 Å²	52.2	30%	0.304	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	122.9	158.9	-175.8	171.8	76.5	0	0	109	K76 R132 N145	K76-E130 WeakPolarHBondContact CE-OE2 3.49Å; K76-E130 IonicContact NZ-OE2 3.71Å; K76-E130 PolarHBondContact NZ-OE2 3.21Å; E130-R132 IonicContact OE1-CZ 2.9Å; E130-R132 IonicContact OE1-NH1 3.15Å; E130-R132 PolarHBondContact OE1-NH1 3.31Å; E130-R132 IonicContact OE1-NH2 2.73Å; E130-R132 PolarHBondContact OE1-NH2 3.43Å; E130-R132 IonicContact OE2-NH2 3.19Å; E130-N145 PolarHBondContact N-O 3.08Å; E130-N145 PolarHBondContact O-N 2.9Å
131	S	95.9	Very high	93.4	Very high	1 Å²	1	52 Å²	52	1%	0.007	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	132.8	-177.6	-62.4	0	0	0	0	111	I77 E103 S129 Q143 R144	I77-S131 PolarHBondContact N-O 2.9Å; E103-S131 PolarHBondContact O-OG 3.39Å; S129-S131 PolarHBondContact OG-OG 3.22Å; S131-Q143 CarbonylContact C-O 3.41Å; S131-Q143 WeakPolarHBondContact CA-O 3.37Å; S131-R144 WeakPolarHBondContact OG-CG 3.27Å
132	R	96.5	Very high	93.5	Very high	72 Å²	72	50.8 Å²	50.8	27%	0.272	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.5	174.2	-63.6	-167.6	177.3	73.3	4.9	111.2	F73 N75 E130 V142 Q143	F73-R132 HydrophobicContact CB-CB 3.78Å; F73-R132 WeakPolarHBondContact O-CD 3.49Å; N75-R132 CarbonylContact O-C 3.54Å; N75-R132 VanDerWaalsContact O-CA 3.25Å; N75-R132 WeakPolarHBondContact O-CA 3.43Å; E130-R132 IonicContact OE1-CZ 2.9Å; E130-R132 IonicContact OE1-NH1 3.15Å; E130-R132 PolarHBondContact OE1-NH1 3.31Å; E130-R132 IonicContact OE1-NH2 2.73Å; E130-R132 PolarHBondContact OE1-NH2 3.43Å; E130-R132 IonicContact OE2-NH2 3.19Å; R132-V142 CarbonylContact O-C 3.51Å; R132-V142 WeakPolarHBondContact O-CA 3.4Å; R132-Q143 PolarHBondContact N-O 2.9Å; R132-Q143 PolarHBondContact O-N 3.42Å
133	V	96.8	Very high	93.5	Very high	0 Å²	0	51 Å²	51	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.7	-176.7	176.4	0	0	0	0	110.8	T74 N75 I77 Y81 F101 D135 L140 G141 V142	T74-V133 PolarHBondContact N-O 2.93Å; N75-V133 HydrophobicContact CB-CB 4.22Å; N75-V133 PolarHBondContact N-O 3.45Å; N75-V133 PolarHBondContact O-N 3.44Å; I77-V133 HydrophobicContact CD1-CG2 3.57Å; I77-V133 HydrophobicContact CG1-CG2 3.62Å; Y81-V133 HydrophobicContact CD1-CB 4.27Å; Y81-V133 HydrophobicContact CD1-CG1 3.89Å; Y81-V133 HydrophobicContact CD1-CG2 4.01Å; Y81-V133 HydrophobicContact CE1-CB 4.38Å; Y81-V133 HydrophobicContact CE1-CG1 3.74Å; Y81-V133 HydrophobicContact CG-CB 4.39Å; Y81-V133 HydrophobicContact CG-CG2 3.95Å; F101-V133 HydrophobicContact CB-CG2 4.42Å; F101-V133 HydrophobicContact CD2-CG1 4.41Å; F101-V133 HydrophobicContact CD2-CG2 3.97Å; F101-V133 HydrophobicContact CE2-CG1 4.44Å; F101-V133 HydrophobicContact CG-CG2 4.41Å; V133-D135 HydrophobicContact CG1-CB 4.09Å; V133-L140 HydrophobicContact CG1-CD1 4.41Å; V133-G141 WeakPolarHBondContact CA-O 3.3Å; V133-G141 WeakPolarHBondContact CG1-O 3.41Å; V133-V142 HydrophobicContact CG2-CG2 4.48Å
134	L	96.4	Very high	93.7	Very high	1 Å²	1	50.6 Å²	50.6	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.3	163.7	177.8	149.2	0	0	0	106.9	V68 R72 F73 E136 L139 L140 G141	V68-L134 HydrophobicContact CG1-CD1 3.86Å; R72-L134 HydrophobicContact CB-CD1 3.47Å; R72-L134 VanDerWaalsContact CB-CD1 3.47Å; F73-L134 HydrophobicContact CD1-CB 3.6Å; F73-L134 HydrophobicContact CE1-CB 3.68Å; F73-L134 HydrophobicContact CE2-CD1 4.43Å; F73-L134 HydrophobicContact CG-CB 4.12Å; F73-L134 HydrophobicContact CZ-CB 4.26Å; F73-L134 HydrophobicContact CZ-CD1 4.45Å; L134-E136 HydrophobicContact CD2-CB 4.42Å; L134-E136 HydrophobicContact CD2-CG 4.15Å; L134-E136 HydrophobicContact CG-CG 4.22Å; L134-L139 HydrophobicContact CD1-CD2 4.4Å; L134-L139 HydrophobicContact CD2-CB 3.75Å; L134-L139 HydrophobicContact CD2-CD2 3.73Å; L134-L139 HydrophobicContact CD2-CG 3.63Å; L134-L139 VanDerWaalsContact CD2-O 3.3Å; L134-L139 WeakPolarHBondContact CD2-O 3.4Å; L134-L140 CarbonylContact O-C 3.58Å; L134-L140 WeakPolarHBondContact O-CA 3.35Å; L134-L140 WeakPolarHBondContact O-CD1 3Å; L134-G141 PolarHBondContact N-O 3.27Å; L134-G141 PolarHBondContact O-N 2.66Å
135	D	95.3	Very high	93.8	Very high	40 Å²	40	52 Å²	52	21%	0.214	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	86.8	-178.7	-170	-3.8	0	0	0	109.1	Y81 V133 L140	Y81-D135 HydrophobicContact CE1-CB 4.41Å; V133-D135 HydrophobicContact CG1-CB 4.09Å; D135-L140 HydrophobicContact CB-CD1 3.85Å
136	E	94.1	Very high	94	Very high	75 Å²	75	47.5 Å²	47.5	35%	0.35	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	169.8	-176.2	-63.4	-179.1	-158.6	0	0	111.3	R72 L134 E138 L139	R72-E136 IonicContact CZ-OE1 3.61Å; R72-E136 IonicContact CZ-OE2 3.58Å; R72-E136 IonicContact NE-OE1 3.35Å; R72-E136 PolarHBondContact NE-OE1 2.8Å; R72-E136 IonicContact NH2-OE1 3.94Å; R72-E136 PolarHBondContact NH2-OE1 2.03Å; R72-E136 IonicContact NH2-OE2 2.65Å; R72-E136 PolarHBondContact NH2-OE2 3.41Å; L134-E136 HydrophobicContact CD2-CB 4.42Å; L134-E136 HydrophobicContact CD2-CG 4.15Å; L134-E136 HydrophobicContact CG-CG 4.22Å; E136-E138 VanDerWaalsContact C-N 3.26Å; E136-E138 PolarHBondContact O-N 3.19Å; E136-L139 CarbonylContact C-O 3.53Å; E136-L139 WeakPolarHBondContact CA-O 3.48Å; E136-L139 PolarHBondContact N-O 3.49Å; E136-L139 PolarHBondContact O-N 2.89Å; E136-L139 VanDerWaalsContact O-O 3.09Å
137	K	92.5	Very high	94.4	Very high	145 Å²	145	42.2 Å²	42.2	63%	0.63	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-35	-176.3	-172.2	-177.9	176.4	-169.9	0	113.6	F87	F87-K137 WeakPolarHBondContact CD1-O 3.25Å
138	E	92.6	Very high	94.5	Very high	142 Å²	142	42.1 Å²	42.1	66%	0.664	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.2	10.3	-173.9	-61	-169.8	161	0	0	113	E136 P165	E136-E138 VanDerWaalsContact C-N 3.26Å; E136-E138 PolarHBondContact O-N 3.19Å; E138-P165 HydrophobicContact CB-CG 4.2Å; E138-P165 WeakPolarHBondContact O-CD 3.38Å; E138-P165 VanDerWaalsContact O-CG 3.3Å; E138-P165 WeakPolarHBondContact O-CG 3.47Å
139	L	95.5	Very high	94.6	Very high	14 Å²	14	39.2 Å²	39.2	7%	0.073	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	132.9	-179.9	-166.5	64.5	0	0	0	110.6	V68 L134 E136 L162	V68-L139 HydrophobicContact CG1-CD2 4.48Å; V68-L139 HydrophobicContact CG2-CD2 3.74Å; L134-L139 HydrophobicContact CD1-CD2 4.4Å; L134-L139 HydrophobicContact CD2-CB 3.75Å; L134-L139 HydrophobicContact CD2-CD2 3.73Å; L134-L139 HydrophobicContact CD2-CG 3.63Å; L134-L139 VanDerWaalsContact CD2-O 3.3Å; L134-L139 WeakPolarHBondContact CD2-O 3.4Å; E136-L139 CarbonylContact C-O 3.53Å; E136-L139 WeakPolarHBondContact CA-O 3.48Å; E136-L139 PolarHBondContact N-O 3.49Å; E136-L139 PolarHBondContact O-N 2.89Å; E136-L139 VanDerWaalsContact O-O 3.09Å; L139-L162 HydrophobicContact CD1-CB 4.34Å; L139-L162 HydrophobicContact CD1-CD2 4.43Å; L139-L162 HydrophobicContact CD2-CD2 4.22Å; L139-L162 HydrophobicContact CG-CD2 4.36Å
140	L	96.6	Very high	94.5	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.5	170.8	177	65.1	0	0	0	108.5	A83 P85 F87 I99 F101 V133 L134 D135 L162 I163	A83-L140 HydrophobicContact CB-CD1 3.59Å; A83-L140 HydrophobicContact CB-CD2 3.91Å; A83-L140 HydrophobicContact CB-CG 4.4Å; P85-L140 HydrophobicContact CG-CD2 3.9Å; F87-L140 HydrophobicContact CE1-CB 4.31Å; F87-L140 HydrophobicContact CZ-CB 4.17Å; I99-L140 HydrophobicContact CD1-CD2 4Å; F101-L140 HydrophobicContact CE2-CD1 4.02Å; F101-L140 HydrophobicContact CE2-CD2 4.32Å; F101-L140 HydrophobicContact CE2-CG 4.18Å; F101-L140 HydrophobicContact CZ-CD2 4.33Å; F101-L140 HydrophobicContact CZ-CG 4.19Å; V133-L140 HydrophobicContact CG1-CD1 4.41Å; L134-L140 CarbonylContact O-C 3.58Å; L134-L140 WeakPolarHBondContact O-CA 3.35Å; L134-L140 WeakPolarHBondContact O-CD1 3Å; D135-L140 HydrophobicContact CB-CD1 3.85Å; L140-L162 CarbonylContact O-C 3.58Å; L140-I163 HydrophobicContact CB-CB 4.35Å; L140-I163 HydrophobicContact CD2-CD1 4.33Å; L140-I163 PolarHBondContact N-O 3.25Å; L140-I163 VanDerWaalsContact N-O 3.1Å; L140-I163 PolarHBondContact O-N 2.95Å
141	G	96.4	Very high	94.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	166.2	179.4	0	0	0	0	0	114.5	V133 L134 S161	V133-G141 WeakPolarHBondContact CA-O 3.3Å; V133-G141 WeakPolarHBondContact CG1-O 3.41Å; L134-G141 PolarHBondContact N-O 3.27Å; L134-G141 PolarHBondContact O-N 2.66Å; G141-S161 CarbonylContact C-O 3.48Å; G141-S161 WeakPolarHBondContact CA-O 3.47Å
142	V	97	Very high	94	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	130.5	172.7	59.8	0	0	0	0	109.2	I77 F101 R132 V133 R144 S161	I77-V142 HydrophobicContact CD1-CG2 4Å; F101-V142 HydrophobicContact CD1-CB 3.86Å; F101-V142 HydrophobicContact CD1-CG1 3.62Å; F101-V142 HydrophobicContact CD1-CG2 4.45Å; F101-V142 HydrophobicContact CE1-CB 4.05Å; F101-V142 HydrophobicContact CE1-CG1 3.65Å; F101-V142 HydrophobicContact CG-CB 4.21Å; F101-V142 HydrophobicContact CG-CG1 4.44Å; F101-V142 HydrophobicContact CZ-CG1 4.5Å; R132-V142 CarbonylContact O-C 3.51Å; R132-V142 WeakPolarHBondContact O-CA 3.4Å; V133-V142 HydrophobicContact CG2-CG2 4.48Å; V142-R144 HydrophobicContact CG2-CG 4.2Å; V142-S161 PolarHBondContact N-O 2.92Å; V142-S161 PolarHBondContact O-N 2.78Å
143	Q	96.7	Very high	93.8	Very high	5 Å²	5	47.3 Å²	47.3	2%	0.023	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	133.6	170.9	-178.9	176.6	91.5	0	0	108.6	S70 F73 S131 R132 T158	S70-Q143 PolarHBondContact OG-NE2 3.06Å; F73-Q143 HydrophobicContact CB-CB 4.25Å; F73-Q143 HydrophobicContact CD1-CB 3.53Å; F73-Q143 HydrophobicContact CD2-CB 3.99Å; F73-Q143 HydrophobicContact CE1-CB 3.78Å; F73-Q143 HydrophobicContact CE2-CB 4.2Å; F73-Q143 HydrophobicContact CG-CB 3.65Å; F73-Q143 HydrophobicContact CZ-CB 4.11Å; S131-Q143 CarbonylContact C-O 3.41Å; S131-Q143 WeakPolarHBondContact CA-O 3.37Å; R132-Q143 PolarHBondContact N-O 2.9Å; R132-Q143 PolarHBondContact O-N 3.42Å; Q143-T158 HydrophobicContact CG-CG2 3.46Å; Q143-T158 VanDerWaalsContact CG-CG2 3.46Å
144	R	96.3	Very high	93.5	Very high	2 Å²	2	53.9 Å²	53.9	1%	0.008	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	120.8	179	-58.4	-166.5	172.7	80.3	-2	109.9	D105 N122 S131 V142 F146 T158 M159	D105-R144 PolarHBondContact O-NH2 2.62Å; N122-R144 PolarHBondContact O-NH1 3.3Å; S131-R144 WeakPolarHBondContact OG-CG 3.27Å; V142-R144 HydrophobicContact CG2-CG 4.2Å; R144-F146 HydrophobicContact CB-CD2 4.46Å; R144-F146 HydrophobicContact CB-CE2 3.61Å; R144-F146 HydrophobicContact CB-CZ 3.84Å; R144-T158 WeakPolarHBondContact O-CA 3.29Å; R144-M159 PolarHBondContact N-O 3.48Å; R144-M159 PolarHBondContact O-N 3.17Å
145	N	95.4	Very high	93.4	Very high	29 Å²	29	55.2 Å²	55.2	16%	0.155	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.3	179.8	-61	-20.9	0	0	0	108.6	S129 E130 T156 T157 T158	S129-N145 CarbonylContact C-O 3.58Å; S129-N145 WeakPolarHBondContact CA-O 3.44Å; S129-N145 WeakPolarHBondContact CB-O 3.31Å; E130-N145 PolarHBondContact N-O 3.08Å; E130-N145 PolarHBondContact O-N 2.9Å; N145-T156 HydrophobicContact CB-CG2 4.12Å; N145-T157 CarbonylContact C-O 3.57Å; N145-T157 WeakPolarHBondContact CA-O 3.45Å; N145-T158 VanDerWaalsContact OD1-CG2 3.27Å; N145-T158 WeakPolarHBondContact OD1-CG2 3.4Å; N145-T158 PolarHBondContact OD1-OG1 2.74Å; N145-T158 VanDerWaalsContact OD1-OG1 3.1Å
146	F	94.6	Very high	93.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.4	-179.5	-60.7	-90.2	0	0	0	109.2	Y123 I124 V127 R144 M148 T156 T157 M159	Y123-F146 AromaticContact CD1-CE1 3.87Å; Y123-F146 HydrophobicContact CD1-CE1 3.87Å; Y123-F146 HydrophobicContact CD1-CZ 4.2Å; Y123-F146 HydrophobicContact CD2-CE1 4.05Å; Y123-F146 AromaticContact CD2-CZ 3.74Å; Y123-F146 HydrophobicContact CD2-CZ 3.74Å; Y123-F146 AromaticContact CE1-CE1 3.66Å; Y123-F146 HydrophobicContact CE1-CE1 3.66Å; Y123-F146 HydrophobicContact CE1-CZ 4.31Å; Y123-F146 AromaticContact CE2-CE1 3.86Å; Y123-F146 HydrophobicContact CE2-CE1 3.86Å; Y123-F146 AromaticContact CE2-CZ 3.89Å; Y123-F146 HydrophobicContact CE2-CZ 3.89Å; Y123-F146 HydrophobicContact CG-CE1 4.03Å; Y123-F146 AromaticContact CG-CZ 3.87Å; Y123-F146 HydrophobicContact CG-CZ 3.87Å; Y123-F146 AromaticContact CZ-CE1 3.62Å; I124-F146 HydrophobicContact CB-CD1 3.82Å; I124-F146 HydrophobicContact CB-CE1 3.85Å; I124-F146 HydrophobicContact CB-CG 4.19Å; I124-F146 HydrophobicContact CB-CZ 4.28Å; I124-F146 HydrophobicContact CD1-CB 4.12Å; I124-F146 HydrophobicContact CD1-CD1 4.37Å; I124-F146 HydrophobicContact CD1-CD2 3.89Å; I124-F146 HydrophobicContact CD1-CE2 4.46Å; I124-F146 HydrophobicContact CD1-CG 3.86Å; I124-F146 HydrophobicContact CG1-CD1 4.21Å; I124-F146 HydrophobicContact CG1-CD2 4.05Å; I124-F146 HydrophobicContact CG1-CE1 4.28Å; I124-F146 HydrophobicContact CG1-CE2 4.15Å; I124-F146 HydrophobicContact CG1-CG 4.11Å; I124-F146 HydrophobicContact CG1-CZ 4.27Å; V127-F146 HydrophobicContact CB-CD1 4.03Å; V127-F146 HydrophobicContact CG1-CB 3.9Å; V127-F146 HydrophobicContact CG1-CD1 4.01Å; V127-F146 HydrophobicContact CG1-CG 4.46Å; R144-F146 HydrophobicContact CB-CD2 4.46Å; R144-F146 HydrophobicContact CB-CE2 3.61Å; R144-F146 HydrophobicContact CB-CZ 3.84Å; F146-M148 HydrophobicContact CB-CE 4.1Å; F146-T156 WeakPolarHBondContact O-CA 3.21Å; F146-T157 PolarHBondContact N-O 2.97Å; F146-T157 PolarHBondContact O-N 2.98Å; F146-M159 HydrophobicContact CD2-CG 4.34Å; F146-M159 HydrophobicContact CE2-CB 4.02Å; F146-M159 HydrophobicContact CE2-CG 3.87Å; F146-M159 HydrophobicContact CE2-SD 3.98Å
147	L	92.9	Very high	93.4	Very high	88 Å²	88	52.9 Å²	52.9	46%	0.461	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	118.4	173.2	-163.1	64.6	0	0	0	108.9	V127 E154 T156	V127-L147 WeakPolarHBondContact CG1-O 3.44Å; L147-E154 VanDerWaalsContact CD1-CD 3.45Å; L147-E154 HydrophobicContact CD1-CG 3.35Å; L147-E154 HydrophobicContact CD2-CG 4.27Å; L147-E154 WeakPolarHBondContact CD2-OE2 3.46Å; L147-E154 HydrophobicContact CG-CG 3.71Å; L147-T156 WeakPolarHBondContact CD1-OG1 3.35Å
148	M	90.2	Very high	93.6	Very high	23 Å²	23	46.7 Å²	46.7	11%	0.113	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151.2	-177.9	65.4	-176.5	81.6	0	0	111.6	I124 F146 V150 E154 V155 T157 P177 I180	I124-M148 HydrophobicContact CD1-CE 3.63Å; F146-M148 HydrophobicContact CB-CE 4.1Å; M148-V150 HydrophobicContact CG-CG2 3.96Å; M148-V150 HydrophobicContact SD-CG2 4.07Å; M148-E154 WeakPolarHBondContact O-CA 3.37Å; M148-V155 HydrophobicContact CG-CB 4.29Å; M148-V155 WeakPolarHBondContact CG-O 3.37Å; M148-V155 PolarHBondContact N-O 3.43Å; M148-V155 PolarHBondContact O-N 2.94Å; M148-T157 HydrophobicContact CE-CG2 3.9Å; M148-T157 WeakPolarHBondContact CE-OG1 3.01Å; M148-P177 HydrophobicContact SD-CG 3.54Å; M148-P177 VanDerWaalsContact SD-CG 3.54Å; M148-I180 HydrophobicContact CE-CD1 4.4Å; M148-I180 HydrophobicContact SD-CD1 4.33Å
149	N	90	Very high	93.8	Very high	115 Å²	115	39.9 Å²	39.9	62%	0.615	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	117.9	172.4	-170.1	-52.5	0	0	0	108.9	G152 T153	N149-G152 WeakPolarHBondContact OD1-CA 3.34Å; N149-G152 PolarHBondContact OD1-N 3.19Å; N149-T153 WeakPolarHBondContact CA-O 3.31Å
150	V	88.7	Confident	93.9	Very high	23 Å²	23	39.3 Å²	39.3	14%	0.139	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	115.9	176.5	-177.8	0	0	0	0	107.9	M148 G152 T153 V155 P177 E179	M148-V150 HydrophobicContact CG-CG2 3.96Å; M148-V150 HydrophobicContact SD-CG2 4.07Å; V150-G152 PolarHBondContact O-N 2.92Å; V150-G152 VanDerWaalsContact O-N 3.14Å; V150-T153 PolarHBondContact N-O 3.24Å; V150-T153 PolarHBondContact O-N 3.36Å; V150-V155 HydrophobicContact CB-CG2 4.24Å; V150-V155 HydrophobicContact CG2-CG2 4.32Å; V150-P177 HydrophobicContact CG1-CB 4.32Å; V150-P177 HydrophobicContact CG2-CB 3.83Å; V150-P177 HydrophobicContact CG2-CG 3.79Å; V150-E179 HydrophobicContact CG1-CB 3.96Å; V150-E179 HydrophobicContact CG1-CG 3.88Å; V150-E179 WeakPolarHBondContact CG1-OE2 3.2Å
151	N	89.7	Confident	93.9	Very high	137 Å²	137	39.4 Å²	39.4	73%	0.733	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	37.7	179.5	-58.6	-29.8	0	0	0	113.7	T153	N151-T153 VanDerWaalsContact C-N 3.32Å; N151-T153 PolarHBondContact O-N 2.86Å
152	G	89.3	Confident	94	Very high	62 Å²	62	39.5 Å²	39.5	64%	0.639	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.1	-5.7	-179.9	0	0	0	0	0	114.9	N149 V150	N149-G152 WeakPolarHBondContact OD1-CA 3.34Å; N149-G152 PolarHBondContact OD1-N 3.19Å; V150-G152 PolarHBondContact O-N 2.92Å; V150-G152 VanDerWaalsContact O-N 3.14Å
153	T	91.8	Very high	94	Very high	91 Å²	91	39.6 Å²	39.6	56%	0.558	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	134.7	177.8	-55.9	0	0	0	0	110.4	N149 V150 N151 V155	N149-T153 WeakPolarHBondContact CA-O 3.31Å; V150-T153 PolarHBondContact N-O 3.24Å; V150-T153 PolarHBondContact O-N 3.36Å; N151-T153 VanDerWaalsContact C-N 3.32Å; N151-T153 PolarHBondContact O-N 2.86Å; T153-V155 HydrophobicContact CG2-CG2 4.48Å
154	E	91.8	Very high	93.9	Very high	139 Å²	139	41.5 Å²	41.5	65%	0.65	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	123	172.8	-171.9	171.1	92.4	0	0	110.2	L147 M148	L147-E154 VanDerWaalsContact CD1-CD 3.45Å; L147-E154 HydrophobicContact CD1-CG 3.35Å; L147-E154 HydrophobicContact CD2-CG 4.27Å; L147-E154 WeakPolarHBondContact CD2-OE2 3.46Å; L147-E154 HydrophobicContact CG-CG 3.71Å; M148-E154 WeakPolarHBondContact O-CA 3.37Å
155	V	93	Very high	93.7	Very high	29 Å²	29	44.1 Å²	44.1	18%	0.176	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	132.6	-178.9	-177.2	0	0	0	0	108.5	M148 V150 T153 N175 P177	M148-V155 HydrophobicContact CG-CB 4.29Å; M148-V155 WeakPolarHBondContact CG-O 3.37Å; M148-V155 PolarHBondContact N-O 3.43Å; M148-V155 PolarHBondContact O-N 2.94Å; V150-V155 HydrophobicContact CB-CG2 4.24Å; V150-V155 HydrophobicContact CG2-CG2 4.32Å; T153-V155 HydrophobicContact CG2-CG2 4.48Å; V155-N175 VanDerWaalsContact CG1-ND2 3.35Å; V155-N175 WeakPolarHBondContact CG1-ND2 3.35Å; V155-P177 HydrophobicContact CG1-CG 4.1Å
156	T	94.8	Very high	93.4	Very high	66 Å²	66	47.4 Å²	47.4	41%	0.405	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.5	171.1	-61	0	0	0	0	109.6	N145 F146 L147 N175	N145-T156 HydrophobicContact CB-CG2 4.12Å; F146-T156 WeakPolarHBondContact O-CA 3.21Å; L147-T156 WeakPolarHBondContact CD1-OG1 3.35Å; T156-N175 PolarHBondContact O-ND2 2.88Å
157	T	95.2	Very high	93.2	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	137.9	178.2	-63.5	0	0	0	0	110.1	I124 N145 F146 M148 N175 I176 P177	I124-T157 HydrophobicContact CD1-CG2 3.9Å; N145-T157 CarbonylContact C-O 3.57Å; N145-T157 WeakPolarHBondContact CA-O 3.45Å; F146-T157 PolarHBondContact N-O 2.97Å; F146-T157 PolarHBondContact O-N 2.98Å; M148-T157 HydrophobicContact CE-CG2 3.9Å; M148-T157 WeakPolarHBondContact CE-OG1 3.01Å; T157-N175 WeakPolarHBondContact CB-O 3.08Å; T157-N175 WeakPolarHBondContact CG2-O 3.11Å; T157-N175 PolarHBondContact OG1-O 2.81Å; T157-I176 HydrophobicContact CG2-CB 4.48Å; T157-I176 HydrophobicContact CG2-CD1 3.21Å; T157-I176 HydrophobicContact CG2-CG1 4.28Å; T157-P177 WeakPolarHBondContact OG1-CD 3.13Å
158	T	96.2	Very high	93.2	Very high	14 Å²	14	45.5 Å²	45.5	9%	0.086	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.9	-172.6	-58.5	0	0	0	0	110.6	Q143 R144 N145 D174	Q143-T158 HydrophobicContact CG-CG2 3.46Å; Q143-T158 VanDerWaalsContact CG-CG2 3.46Å; R144-T158 WeakPolarHBondContact O-CA 3.29Å; N145-T158 VanDerWaalsContact OD1-CG2 3.27Å; N145-T158 WeakPolarHBondContact OD1-CG2 3.4Å; N145-T158 PolarHBondContact OD1-OG1 2.74Å; N145-T158 VanDerWaalsContact OD1-OG1 3.1Å; T158-D174 PolarHBondContact N-O 3.01Å; T158-D174 PolarHBondContact O-N 2.85Å
159	M	96.9	Very high	93.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	121.6	171.2	-61.2	-172.3	160.2	0	0	109.7	N122 I124 R144 F146 Y173 I176 L185 I213	N122-M159 WeakPolarHBondContact OD1-CB 3.37Å; N122-M159 PolarHBondContact OD1-SD 2.84Å; I124-M159 HydrophobicContact CD1-CE 3.86Å; I124-M159 HydrophobicContact CD1-SD 4.45Å; I124-M159 HydrophobicContact CG1-CE 3.41Å; I124-M159 VanDerWaalsContact CG1-CE 3.41Å; I124-M159 HydrophobicContact CG1-SD 3.74Å; R144-M159 PolarHBondContact N-O 3.48Å; R144-M159 PolarHBondContact O-N 3.17Å; F146-M159 HydrophobicContact CD2-CG 4.34Å; F146-M159 HydrophobicContact CE2-CB 4.02Å; F146-M159 HydrophobicContact CE2-CG 3.87Å; F146-M159 HydrophobicContact CE2-SD 3.98Å; M159-Y173 HydrophobicContact CB-CD1 4.47Å; M159-Y173 HydrophobicContact CE-CD1 4.23Å; M159-Y173 HydrophobicContact CG-CD1 4.05Å; M159-Y173 HydrophobicContact SD-CD1 4.45Å; M159-I176 HydrophobicContact CE-CD1 3.76Å; M159-I176 HydrophobicContact CG-CD1 4.31Å; M159-L185 HydrophobicContact CE-CD2 3.83Å; M159-I213 HydrophobicContact CE-CG2 3.78Å
160	T	97.5	Very high	93.9	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.7	-178	-56.8	0	0	0	0	110.1	F73 N122 L162 F171 Y172	F73-T160 HydrophobicContact CE1-CG2 4.17Å; F73-T160 HydrophobicContact CE2-CG2 4.19Å; F73-T160 HydrophobicContact CZ-CG2 3.48Å; F73-T160 VanDerWaalsContact CZ-CG2 3.48Å; N122-T160 PolarHBondContact ND2-O 3.31Å; N122-T160 VanDerWaalsContact ND2-O 3.13Å; T160-L162 HydrophobicContact CG2-CD2 4.07Å; T160-L162 HydrophobicContact CG2-CG 4.06Å; T160-F171 CarbonylContact O-C 3.56Å; T160-F171 VanDerWaalsContact O-CA 3.28Å; T160-F171 WeakPolarHBondContact O-CA 2.89Å; T160-Y172 PolarHBondContact N-O 3.07Å; T160-Y172 PolarHBondContact O-N 2.83Å
161	S	97.9	Very high	94.4	Very high	2 Å²	2	38.1 Å²	38.1	1%	0.014	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.3	170.8	-50.3	0	0	0	0	109.5	N122 G141 V142 S170	N122-S161 VanDerWaalsContact CB-OG 3.26Å; N122-S161 WeakPolarHBondContact CB-OG 3.42Å; N122-S161 PolarHBondContact ND2-OG 2.72Å; G141-S161 CarbonylContact C-O 3.48Å; G141-S161 WeakPolarHBondContact CA-O 3.47Å; V142-S161 PolarHBondContact N-O 2.92Å; V142-S161 PolarHBondContact O-N 2.78Å; S161-S170 CarbonylContact C-O 3.54Å; S161-S170 WeakPolarHBondContact CA-O 3.49Å
162	L	97.4	Very high	94.8	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	147.7	-179.5	-61.5	173.1	0	0	0	110.2	P67 V68 F73 L139 L140 T160 I169 S170	P67-L162 HydrophobicContact CB-CD1 4.08Å; P67-L162 HydrophobicContact CG-CD1 3.74Å; V68-L162 HydrophobicContact CB-CD1 4.38Å; V68-L162 HydrophobicContact CG2-CD1 3.51Å; V68-L162 HydrophobicContact CG2-CD2 4.08Å; V68-L162 HydrophobicContact CG2-CG 4.46Å; F73-L162 HydrophobicContact CE1-CD2 4.47Å; F73-L162 HydrophobicContact CZ-CD2 3.91Å; L139-L162 HydrophobicContact CD1-CB 4.34Å; L139-L162 HydrophobicContact CD1-CD2 4.43Å; L139-L162 HydrophobicContact CD2-CD2 4.22Å; L139-L162 HydrophobicContact CG-CD2 4.36Å; L140-L162 CarbonylContact O-C 3.58Å; T160-L162 HydrophobicContact CG2-CD2 4.07Å; T160-L162 HydrophobicContact CG2-CG 4.06Å; L162-I169 CarbonylContact O-C 3.54Å; L162-I169 WeakPolarHBondContact O-CA 3.47Å; L162-S170 PolarHBondContact N-O 3.49Å; L162-S170 PolarHBondContact O-N 2.72Å
163	I	97.1	Very high	95.2	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.015	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	117	179.8	-54.8	174.6	0	0	0	106.8	F87 L89 I99 F101 I120 L140	F87-I163 HydrophobicContact CE2-CG2 4.31Å; F87-I163 HydrophobicContact CZ-CG2 4.27Å; L89-I163 HydrophobicContact CD1-CG2 3.73Å; L89-I163 HydrophobicContact CD2-CG2 3.59Å; L89-I163 HydrophobicContact CG-CG2 4.32Å; I99-I163 HydrophobicContact CD1-CD1 3.33Å; F101-I163 HydrophobicContact CZ-CD1 4.49Å; I120-I163 HydrophobicContact CD1-CD1 3.57Å; I120-I163 HydrophobicContact CD1-CG1 4.1Å; L140-I163 HydrophobicContact CB-CB 4.35Å; L140-I163 HydrophobicContact CD2-CD1 4.33Å; L140-I163 PolarHBondContact N-O 3.25Å; L140-I163 VanDerWaalsContact N-O 3.1Å; L140-I163 PolarHBondContact O-N 2.95Å
164	H	95.1	Very high	95.5	Very high	44 Å²	44	27.5 Å²	27.5	20%	0.204	16%	0.155	C	C	.	.			trans	-97.5	158	-175.2	-63.2	-90.6	0	0	0	111.7	S166 G167 K168	H164-S166 PolarHBondContact O-N 3.08Å; H164-S166 VanDerWaalsContact O-N 3.15Å; H164-G167 PolarHBondContact O-N 2.79Å; H164-K168 HydrophobicContact CB-CB 4.23Å; H164-K168 PolarHBondContact CD2-O 3.02Å; H164-K168 PolarHBondContact N-O 3.1Å
165	P	91.9	Very high	95.6	Very high	57 Å²	57	24.6 Å²	24.6	37%	0.37	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-27.8	175.4	-28.5	36.3	0	0	0	114.4	F87 E138 G167	F87-P165 HydrophobicContact CB-CB 4.19Å; F87-P165 HydrophobicContact CB-CG 4.45Å; F87-P165 HydrophobicContact CD1-CG 4.21Å; F87-P165 HydrophobicContact CD2-CB 4.22Å; F87-P165 HydrophobicContact CD2-CG 4.47Å; F87-P165 HydrophobicContact CG-CB 4.14Å; F87-P165 HydrophobicContact CG-CG 4.14Å; E138-P165 HydrophobicContact CB-CG 4.2Å; E138-P165 WeakPolarHBondContact O-CD 3.38Å; E138-P165 VanDerWaalsContact O-CG 3.3Å; E138-P165 WeakPolarHBondContact O-CG 3.47Å; P165-G167 PolarHBondContact O-N 3.28Å
166	S	89.1	Confident	95.7	Very high	98 Å²	98	23.7 Å²	23.7	69%	0.685	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-10.9	174.7	60.4	0	0	0	0	114	H164 K168	H164-S166 PolarHBondContact O-N 3.08Å; H164-S166 VanDerWaalsContact O-N 3.15Å; S166-K168 VanDerWaalsContact C-N 3.32Å; S166-K168 WeakPolarHBondContact OG-CB 3.15Å; S166-K168 PolarHBondContact OG-N 3.04Å
167	G	90	Very high	95.7	Very high	7 Å²	7	21.3 Å²	21.3	7%	0.072	12%	0.124	C	C	.	.	S	Bend	trans	86.4	0.1	-169.8	0	0	0	0	0	114.2	H164 P165	H164-G167 PolarHBondContact O-N 2.79Å; P165-G167 PolarHBondContact O-N 3.28Å
168	K	94.3	Very high	95.6	Very high	41 Å²	41	33 Å²	33	18%	0.178	17%	0.168	C	C	.	.			trans	-64.5	134.6	171.7	-177.1	171.4	72.3	171	0	110.5	H164 S166 E220 F221 E222	H164-K168 HydrophobicContact CB-CB 4.23Å; H164-K168 PolarHBondContact CD2-O 3.02Å; H164-K168 PolarHBondContact N-O 3.1Å; S166-K168 VanDerWaalsContact C-N 3.32Å; S166-K168 WeakPolarHBondContact OG-CB 3.15Å; S166-K168 PolarHBondContact OG-N 3.04Å; K168-E220 HydrophobicContact CD-CB 4.28Å; K168-E220 HydrophobicContact CD-CG 4.36Å; K168-E220 WeakPolarHBondContact CE-OE1 3.33Å; K168-E220 IonicContact NZ-OE1 2.63Å; K168-E220 PolarHBondContact NZ-OE1 3.1Å; K168-F221 WeakPolarHBondContact CA-O 3.06Å; K168-E222 HydrophobicContact CB-CG 4.23Å; K168-E222 HydrophobicContact CD-CG 3.88Å; K168-E222 WeakPolarHBondContact CD-OE1 3.46Å; K168-E222 HydrophobicContact CG-CG 3.84Å
169	I	97.3	Very high	95.4	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.015	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130.6	172.4	-59.2	167.4	0	0	0	107.7	Y91 I120 L162 F171 I189 E220 F221	Y91-I169 HydrophobicContact CD2-CD1 3.8Å; Y91-I169 HydrophobicContact CE2-CD1 3.64Å; I120-I169 HydrophobicContact CD1-CD1 3.88Å; I120-I169 HydrophobicContact CD1-CG1 4.4Å; I120-I169 HydrophobicContact CD1-CG2 4.4Å; I120-I169 HydrophobicContact CG1-CD1 4.26Å; I120-I169 HydrophobicContact CG2-CG2 4.26Å; L162-I169 CarbonylContact O-C 3.54Å; L162-I169 WeakPolarHBondContact O-CA 3.47Å; I169-F171 HydrophobicContact CG2-CD1 4.47Å; I169-F171 HydrophobicContact CG2-CE1 3.91Å; I169-F171 HydrophobicContact CG2-CZ 4.48Å; I169-I189 HydrophobicContact CD1-CG2 4.24Å; I169-I189 HydrophobicContact CG2-CG2 4.28Å; I169-E220 CarbonylContact O-C 3.45Å; I169-E220 WeakPolarHBondContact O-CA 3.24Å; I169-F221 HydrophobicContact CB-CB 4.33Å; I169-F221 HydrophobicContact CB-CD2 4.25Å; I169-F221 HydrophobicContact CG2-CD2 4.25Å; I169-F221 PolarHBondContact N-O 2.86Å; I169-F221 PolarHBondContact O-N 2.83Å
170	S	97.8	Very high	95.1	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.1	-178.7	-55.9	0	0	0	0	111.3	S161 L162 V219	S161-S170 CarbonylContact C-O 3.54Å; S161-S170 WeakPolarHBondContact CA-O 3.49Å; L162-S170 PolarHBondContact N-O 3.49Å; L162-S170 PolarHBondContact O-N 2.72Å; S170-V219 CarbonylContact C-O 3.46Å; S170-V219 WeakPolarHBondContact CA-O 3.49Å
171	F	98.5	Very high	94.8	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.9	168	-59.3	-23.7	0	0	0	110	I120 N122 T160 I169 Y173 I189 V208 L218 V219 F221	I120-F171 HydrophobicContact CG2-CE1 3.44Å; I120-F171 VanDerWaalsContact CG2-CE1 3.44Å; I120-F171 HydrophobicContact CG2-CZ 3.66Å; N122-F171 HydrophobicContact CB-CD1 4.09Å; N122-F171 HydrophobicContact CB-CD2 4.4Å; N122-F171 HydrophobicContact CB-CE1 4.06Å; N122-F171 HydrophobicContact CB-CE2 4.35Å; N122-F171 HydrophobicContact CB-CG 4.28Å; N122-F171 HydrophobicContact CB-CZ 4.19Å; T160-F171 CarbonylContact O-C 3.56Å; T160-F171 VanDerWaalsContact O-CA 3.28Å; T160-F171 WeakPolarHBondContact O-CA 2.89Å; I169-F171 HydrophobicContact CG2-CD1 4.47Å; I169-F171 HydrophobicContact CG2-CE1 3.91Å; I169-F171 HydrophobicContact CG2-CZ 4.48Å; F171-Y173 HydrophobicContact CB-CE1 4.18Å; F171-I189 HydrophobicContact CE2-CG2 4.44Å; F171-I189 HydrophobicContact CZ-CG2 3.82Å; F171-V208 HydrophobicContact CD2-CG2 4.15Å; F171-V208 HydrophobicContact CE2-CG2 4.47Å; F171-L218 CarbonylContact O-C 3.45Å; F171-L218 WeakPolarHBondContact O-CA 3.01Å; F171-V219 HydrophobicContact CB-CB 4.2Å; F171-V219 PolarHBondContact N-O 3.41Å; F171-V219 PolarHBondContact O-N 3.47Å; F171-F221 AromaticContact CD2-CE2 3.68Å; F171-F221 HydrophobicContact CD2-CE2 3.68Å; F171-F221 HydrophobicContact CD2-CZ 4.24Å; F171-F221 AromaticContact CE2-CE2 3.53Å; F171-F221 HydrophobicContact CE2-CE2 3.53Å; F171-F221 HydrophobicContact CE2-CZ 4.01Å; F171-F221 HydrophobicContact CG-CE2 4.3Å; F171-F221 HydrophobicContact CZ-CE2 4.03Å
172	Y	98.5	Very high	94.6	Very high	14 Å²	14	49.5 Å²	49.5	6%	0.055	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139.6	173.1	-179.3	-102.9	0	0	0	109.9	Q64 Q66 P67 T160 D174 T217 L218	Q64-Y172 HydrophobicContact CB-CE2 4.46Å; Q64-Y172 WeakPolarHBondContact O-CE2 3.06Å; Q64-Y172 PolarHBondContact O-OH 2.84Å; Q66-Y172 VanDerWaalsContact CA-CZ 3.46Å; Q66-Y172 HydrophobicContact CB-CD1 4.31Å; Q66-Y172 HydrophobicContact CB-CE1 3.63Å; Q66-Y172 HydrophobicContact CG-CD1 3.98Å; Q66-Y172 HydrophobicContact CG-CE1 3.72Å; Q66-Y172 PolarHBondContact N-OH 2.82Å; P67-Y172 VanDerWaalsContact CD-CG 3.47Å; P67-Y172 HydrophobicContact CG-CG 4.23Å; T160-Y172 PolarHBondContact N-O 3.07Å; T160-Y172 PolarHBondContact O-N 2.83Å; Y172-D174 HydrophobicContact CD1-CB 4.36Å; Y172-D174 HydrophobicContact CE1-CB 3.76Å; Y172-T217 WeakPolarHBondContact CA-O 2.93Å; Y172-T217 WeakPolarHBondContact CD2-O 3.39Å; Y172-L218 HydrophobicContact CD2-CD1 4.4Å
173	Y	97.9	Very high	94.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	127.1	-178.4	-51	-52.1	0	0	0	110.2	N122 M159 F171 I176 S187 I213 K214 G216 T217 V219	N122-Y173 WeakPolarHBondContact OD1-CE1 3.41Å; M159-Y173 HydrophobicContact CB-CD1 4.47Å; M159-Y173 HydrophobicContact CE-CD1 4.23Å; M159-Y173 HydrophobicContact CG-CD1 4.05Å; M159-Y173 HydrophobicContact SD-CD1 4.45Å; F171-Y173 HydrophobicContact CB-CE1 4.18Å; Y173-I176 HydrophobicContact CG-CD1 4.49Å; Y173-S187 WeakPolarHBondContact CE1-OG 2.92Å; Y173-S187 WeakPolarHBondContact OH-CB 3.31Å; Y173-S187 PolarHBondContact OH-OG 2.84Å; Y173-I213 HydrophobicContact CD1-CG2 3.97Å; Y173-I213 HydrophobicContact CD2-CB 4.22Å; Y173-I213 HydrophobicContact CD2-CG2 3.88Å; Y173-I213 HydrophobicContact CE1-CG2 3.94Å; Y173-I213 HydrophobicContact CE2-CB 4.02Å; Y173-I213 HydrophobicContact CE2-CG1 3.85Å; Y173-I213 HydrophobicContact CE2-CG2 3.91Å; Y173-I213 HydrophobicContact CG-CG2 3.95Å; Y173-K214 WeakPolarHBondContact CB-O 3.47Å; Y173-G216 PolarHBondContact O-N 3.42Å; Y173-T217 HydrophobicContact CD2-CG2 4.46Å; Y173-T217 PolarHBondContact N-O 2.81Å; Y173-V219 HydrophobicContact CE2-CG2 3.92Å
174	D	96.4	Very high	94.1	Very high	53 Å²	53	54.6 Å²	54.6	28%	0.283	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.3	-179.2	-166.8	21.6	0	0	0	110.8	T158 Y172 I176	T158-D174 PolarHBondContact N-O 3.01Å; T158-D174 PolarHBondContact O-N 2.85Å; Y172-D174 HydrophobicContact CD1-CB 4.36Å; Y172-D174 HydrophobicContact CE1-CB 3.76Å; D174-I176 VanDerWaalsContact C-N 3.3Å; D174-I176 PolarHBondContact O-N 3.03Å
175	N	95.4	Very high	94.1	Very high	78 Å²	78	52.9 Å²	52.9	42%	0.417	27%	0.268	S	S	.	.	S	Bend	trans	48.9	44.6	-178.5	-159.6	29.4	0	0	0	114.4	V155 T156 T157 P177 S215	V155-N175 VanDerWaalsContact CG1-ND2 3.35Å; V155-N175 WeakPolarHBondContact CG1-ND2 3.35Å; T156-N175 PolarHBondContact O-ND2 2.88Å; T157-N175 WeakPolarHBondContact CB-O 3.08Å; T157-N175 WeakPolarHBondContact CG2-O 3.11Å; T157-N175 PolarHBondContact OG1-O 2.81Å; N175-P177 VanDerWaalsContact O-CD 3.31Å; N175-P177 WeakPolarHBondContact O-CD 3.37Å; N175-S215 WeakPolarHBondContact CA-OG 2.86Å; N175-S215 PolarHBondContact N-OG 3.1Å
176	I	95.5	Very high	94.2	Very high	11 Å²	11	52.5 Å²	52.5	6%	0.056	26%	0.261	C	S	.	.			trans	-75.8	116.7	171	-47.3	-59.9	0	0	0	109.1	T157 M159 Y173 D174 I180 L185 S215	T157-I176 HydrophobicContact CG2-CB 4.48Å; T157-I176 HydrophobicContact CG2-CD1 3.21Å; T157-I176 HydrophobicContact CG2-CG1 4.28Å; M159-I176 HydrophobicContact CE-CD1 3.76Å; M159-I176 HydrophobicContact CG-CD1 4.31Å; Y173-I176 HydrophobicContact CG-CD1 4.49Å; D174-I176 VanDerWaalsContact C-N 3.3Å; D174-I176 PolarHBondContact O-N 3.03Å; I176-I180 HydrophobicContact CG2-CG2 4.13Å; I176-L185 HydrophobicContact CG2-CD1 4.41Å; I176-L185 HydrophobicContact CG2-CD2 4.2Å; I176-S215 PolarHBondContact N-OG 3.22Å; I176-S215 PolarHBondContact O-OG 3.37Å
177	P	93.8	Very high	94.6	Very high	16 Å²	16	47.9 Å²	47.9	10%	0.104	23%	0.228	C	C	.	.			trans	-67.8	151.8	178.4	-23.1	38.8	0	0	0	111.3	M148 V150 V155 T157 N175 E179 I180	M148-P177 HydrophobicContact SD-CG 3.54Å; M148-P177 VanDerWaalsContact SD-CG 3.54Å; V150-P177 HydrophobicContact CG1-CB 4.32Å; V150-P177 HydrophobicContact CG2-CB 3.83Å; V150-P177 HydrophobicContact CG2-CG 3.79Å; V155-P177 HydrophobicContact CG1-CG 4.1Å; T157-P177 WeakPolarHBondContact OG1-CD 3.13Å; N175-P177 VanDerWaalsContact O-CD 3.31Å; N175-P177 WeakPolarHBondContact O-CD 3.37Å; P177-E179 VanDerWaalsContact C-N 3.3Å; P177-E179 WeakPolarHBondContact CB-OE2 3.33Å; P177-I180 VanDerWaalsContact O-CG2 3.26Å; P177-I180 WeakPolarHBondContact O-CG2 3.11Å
178	R	92.7	Very high	94.9	Very high	244 Å²	244	51.3 Å²	51.3	92%	0.921	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-20.5	-178.2	-66.6	-177.8	178.6	-177.5	0.1	112.4	I180	R178-I180 VanDerWaalsContact C-N 3.32Å
179	E	91.7	Very high	94.9	Very high	111 Å²	111	49.4 Å²	49.4	52%	0.519	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-13.4	-175.9	-60	78.5	-175.6	0	0	112.7	V150 P177	V150-E179 HydrophobicContact CG1-CB 3.96Å; V150-E179 HydrophobicContact CG1-CG 3.88Å; V150-E179 WeakPolarHBondContact CG1-OE2 3.2Å; P177-E179 VanDerWaalsContact C-N 3.3Å; P177-E179 WeakPolarHBondContact CB-OE2 3.33Å
180	I	91	Very high	94.7	Very high	26 Å²	26	49.6 Å²	49.6	13%	0.133	23%	0.231	C	C	.	.	S	Bend	trans	-69.2	135.4	-178.6	-164	167.5	0	0	0	111.1	I124 M148 I176 P177 R178 E182 Q184 L185	I124-I180 HydrophobicContact CD1-CD1 4.04Å; I124-I180 HydrophobicContact CG2-CD1 3.6Å; M148-I180 HydrophobicContact CE-CD1 4.4Å; M148-I180 HydrophobicContact SD-CD1 4.33Å; I176-I180 HydrophobicContact CG2-CG2 4.13Å; P177-I180 VanDerWaalsContact O-CG2 3.26Å; P177-I180 WeakPolarHBondContact O-CG2 3.11Å; R178-I180 VanDerWaalsContact C-N 3.32Å; I180-E182 PolarHBondContact O-N 2.9Å; I180-Q184 HydrophobicContact CG1-CB 4.47Å; I180-L185 HydrophobicContact CD1-CD2 3.95Å; I180-L185 HydrophobicContact CG2-CD1 3.82Å; I180-L185 HydrophobicContact CG2-CD2 3.98Å; I180-L185 HydrophobicContact CG2-CG 4.01Å
181	E	92.2	Very high	94.4	Very high	114 Å²	114	50.1 Å²	50.1	53%	0.533	23%	0.233	S	C	.	.			trans	-64	127	176.1	-65.3	178.3	165.5	0	0	111	S183 Q184	E181-S183 PolarHBondContact O-N 3.45Å; E181-S183 PolarHBondContact OE2-OG 3.44Å; E181-Q184 HydrophobicContact CB-CG 4.14Å; E181-Q184 WeakPolarHBondContact O-CB 3.47Å; E181-Q184 PolarHBondContact O-N 2.98Å; E181-Q184 PolarHBondContact OE2-NE2 2.74Å; E181-Q184 VanDerWaalsContact OE2-NE2 3.15Å
182	E	93	Very high	93.9	Very high	115 Å²	115	52.9 Å²	52.9	54%	0.537	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-26.1	175.6	-70.7	-166.1	174.3	0	0	113.3	I180 Q184 L185 K186 A210	I180-E182 PolarHBondContact O-N 2.9Å; E182-Q184 PolarHBondContact O-N 3.36Å; E182-L185 PolarHBondContact O-N 3.06Å; E182-K186 PolarHBondContact O-NZ 2.78Å; E182-A210 HydrophobicContact CB-CB 3.69Å; E182-A210 HydrophobicContact CG-CB 4.04Å
183	S	92.2	Very high	93.2	Very high	70 Å²	70	53 Å²	53	49%	0.49	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.9	176.5	82.4	0	0	0	0	112.6	E181 K186	E181-S183 PolarHBondContact O-N 3.45Å; E181-S183 PolarHBondContact OE2-OG 3.44Å; S183-K186 WeakPolarHBondContact O-CE 3.04Å; S183-K186 PolarHBondContact O-NZ 2.66Å
184	Q	92.6	Very high	92.3	Very high	41 Å²	41	57.2 Å²	57.2	19%	0.192	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-31.4	-178.7	-59.7	-178.3	15.7	0	0	112.4	I124 K125 I180 E181 E182 K186	I124-Q184 HydrophobicContact CG2-CB 4.25Å; K125-Q184 PolarHBondContact N-O 3.16Å; I180-Q184 HydrophobicContact CG1-CB 4.47Å; E181-Q184 HydrophobicContact CB-CG 4.14Å; E181-Q184 WeakPolarHBondContact O-CB 3.47Å; E181-Q184 PolarHBondContact O-N 2.98Å; E181-Q184 PolarHBondContact OE2-NE2 2.74Å; E181-Q184 VanDerWaalsContact OE2-NE2 3.15Å; E182-Q184 PolarHBondContact O-N 3.36Å; Q184-K186 PolarHBondContact O-N 3.38Å
185	L	94.7	Very high	91.5	Very high	8 Å²	8	55 Å²	55	4%	0.042	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	114.9	177.1	-60.8	177.4	0	0	0	109.9	I124 M159 I176 I180 E182 I213	I124-L185 HydrophobicContact CD1-CD2 4.38Å; I124-L185 HydrophobicContact CG1-CD2 4.18Å; M159-L185 HydrophobicContact CE-CD2 3.83Å; I176-L185 HydrophobicContact CG2-CD1 4.41Å; I176-L185 HydrophobicContact CG2-CD2 4.2Å; I180-L185 HydrophobicContact CD1-CD2 3.95Å; I180-L185 HydrophobicContact CG2-CD1 3.82Å; I180-L185 HydrophobicContact CG2-CD2 3.98Å; I180-L185 HydrophobicContact CG2-CG 4.01Å; E182-L185 PolarHBondContact O-N 3.06Å; L185-I213 HydrophobicContact CB-CB 4.33Å; L185-I213 HydrophobicContact CB-CD1 3.97Å; L185-I213 HydrophobicContact CB-CG2 4.19Å; L185-I213 HydrophobicContact CD1-CB 4.07Å; L185-I213 HydrophobicContact CD1-CG2 4.1Å; L185-I213 HydrophobicContact CD2-CG2 4.05Å; L185-I213 HydrophobicContact CG-CG2 4.35Å
186	K	94	Very high	90.4	Very high	50 Å²	50	59.5 Å²	59.5	22%	0.217	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	110.4	-177.1	-68	-72.2	163.5	-87.1	0	109.8	Y121 Y123 K125 E182 S183 Q184	Y121-K186 HydrophobicContact CD1-CB 4.09Å; Y121-K186 WeakPolarHBondContact CD1-O 3.42Å; Y121-K186 HydrophobicContact CE1-CB 3.55Å; Y121-K186 VanDerWaalsContact CE1-O 3.29Å; Y121-K186 WeakPolarHBondContact CE1-O 3.37Å; Y123-K186 PolarHBondContact N-O 3.31Å; Y123-K186 PolarHBondContact O-N 3.34Å; Y123-K186 VanDerWaalsContact O-N 3.12Å; K125-K186 HydrophobicContact CD-CG 3.88Å; K125-K186 HydrophobicContact CG-CG 4.11Å; E182-K186 PolarHBondContact O-NZ 2.78Å; S183-K186 WeakPolarHBondContact O-CE 3.04Å; S183-K186 PolarHBondContact O-NZ 2.66Å; Q184-K186 PolarHBondContact O-N 3.38Å
187	S	96.9	Very high	89.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	125.5	172.9	-57.8	0	0	0	0	109.8	Y121 N122 Y173 V208	Y121-S187 CarbonylContact O-C 3.58Å; Y121-S187 VanDerWaalsContact O-CA 3.24Å; Y121-S187 WeakPolarHBondContact O-CA 2.91Å; N122-S187 PolarHBondContact OD1-OG 2.82Å; N122-S187 VanDerWaalsContact OD1-OG 3.06Å; Y173-S187 WeakPolarHBondContact CE1-OG 2.92Å; Y173-S187 WeakPolarHBondContact OH-CB 3.31Å; Y173-S187 PolarHBondContact OH-OG 2.84Å; S187-V208 PolarHBondContact O-N 2.83Å
188	R	95.8	Very high	87.9	Confident	80 Å²	80	65.7 Å²	65.7	30%	0.302	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	154.6	-179.2	60.4	177	-173.2	153.1	5.1	111.8	Y121 S205 I206 L207	Y121-R188 HydrophobicContact CG-CG 4.29Å; Y121-R188 PolarHBondContact N-O 2.84Å; Y121-R188 PolarHBondContact O-N 3.13Å; R188-S205 WeakPolarHBondContact CD-OG 3.34Å; R188-I206 WeakPolarHBondContact CA-O 3.25Å; R188-I206 WeakPolarHBondContact CB-O 3.26Å; R188-L207 HydrophobicContact CB-CD1 4.24Å
189	I	95.7	Very high	87	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.9	158.2	59.3	168.5	0	0	0	108	Y56 Y92 I120 I169 F171 S205 I206 F221	Y56-I189 HydrophobicContact CD1-CD1 4.06Å; Y56-I189 HydrophobicContact CD2-CD1 4.24Å; Y56-I189 HydrophobicContact CE1-CD1 4.25Å; Y56-I189 HydrophobicContact CE2-CD1 4.43Å; Y56-I189 HydrophobicContact CG-CD1 4.06Å; Y92-I189 HydrophobicContact CE2-CD1 4.27Å; Y92-I189 PolarHBondContact OH-O 3.43Å; I120-I189 HydrophobicContact CG1-CG2 4.28Å; I120-I189 HydrophobicContact CG2-CG2 4.35Å; I169-I189 HydrophobicContact CD1-CG2 4.24Å; I169-I189 HydrophobicContact CG2-CG2 4.28Å; F171-I189 HydrophobicContact CE2-CG2 4.44Å; F171-I189 HydrophobicContact CZ-CG2 3.82Å; I189-S205 WeakPolarHBondContact O-CA 3.15Å; I189-I206 HydrophobicContact CD1-CD1 4.05Å; I189-I206 HydrophobicContact CG1-CB 3.95Å; I189-I206 HydrophobicContact CG1-CD1 4.16Å; I189-I206 HydrophobicContact CG1-CG1 4.4Å; I189-I206 PolarHBondContact N-O 3.14Å; I189-I206 VanDerWaalsContact N-O 3.14Å; I189-I206 PolarHBondContact O-N 3.34Å; I189-F221 HydrophobicContact CD1-CB 3.74Å; I189-F221 HydrophobicContact CD1-CD1 3.65Å; I189-F221 HydrophobicContact CD1-CD2 4.22Å; I189-F221 HydrophobicContact CD1-CE1 4.3Å; I189-F221 HydrophobicContact CD1-CG 3.59Å; I189-F221 HydrophobicContact CG1-CD1 3.96Å; I189-F221 HydrophobicContact CG1-CE1 4.09Å; I189-F221 HydrophobicContact CG1-CG 4.17Å; I189-F221 HydrophobicContact CG1-CZ 4.42Å; I189-F221 HydrophobicContact CG2-CD2 4.17Å; I189-F221 HydrophobicContact CG2-CE2 4.19Å
190	F	92.9	Very high	86.3	Confident	7 Å²	7	58.6 Å²	58.6	3%	0.031	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.4	172.4	73	-90.3	0	0	0	113.9	Y91 E106 Y116 G118 S119 F203 Y204	Y91-F190 WeakPolarHBondContact CE1-O 3.41Å; Y91-F190 PolarHBondContact OH-N 2.86Å; Y91-F190 VanDerWaalsContact OH-N 3.1Å; Y91-F190 PolarHBondContact OH-O 3.02Å; E106-F190 WeakPolarHBondContact OE2-CE1 3.27Å; Y116-F190 HydrophobicContact CE1-CE2 4.46Å; Y116-F190 WeakPolarHBondContact OH-CE2 3.43Å; Y116-F190 WeakPolarHBondContact OH-CZ 3.2Å; G118-F190 CarbonylContact C-O 3.57Å; G118-F190 WeakPolarHBondContact CA-O 3.49Å; S119-F190 VanDerWaalsContact CB-CE1 3.47Å; S119-F190 PolarHBondContact N-O 2.85Å; S119-F190 PolarHBondContact O-N 2.89Å; F190-F203 AromaticContact CD2-CD1 3.78Å; F190-F203 HydrophobicContact CD2-CD1 3.78Å; F190-F203 AromaticContact CE2-CD1 3.68Å; F190-F203 HydrophobicContact CE2-CD1 3.68Å; F190-F203 AromaticContact CE2-CE1 4Å; F190-F203 HydrophobicContact CE2-CE1 4Å; F190-Y204 CarbonylContact C-O 3.44Å; F190-Y204 WeakPolarHBondContact CA-O 3.41Å; F190-Y204 WeakPolarHBondContact CB-O 2.99Å
191	E	91.5	Very high	85.8	Confident	14 Å²	14	60.5 Å²	60.5	7%	0.065	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	144.5	170.2	-172.1	175.2	-156.8	0	0	110.1	K55 Y92 S117 I193 F203 Y204	K55-E191 IonicContact NZ-OE1 2.73Å; K55-E191 IonicContact NZ-OE2 3.17Å; Y92-E191 WeakPolarHBondContact CB-OE1 3.39Å; Y92-E191 WeakPolarHBondContact CB-OE2 3.37Å; Y92-E191 HydrophobicContact CD1-CB 3.65Å; Y92-E191 HydrophobicContact CD1-CG 4.28Å; Y92-E191 WeakPolarHBondContact CD1-OE2 3.3Å; Y92-E191 HydrophobicContact CD2-CB 3.8Å; Y92-E191 HydrophobicContact CD2-CG 4.46Å; Y92-E191 HydrophobicContact CE1-CB 3.98Å; Y92-E191 HydrophobicContact CE2-CB 4.1Å; Y92-E191 HydrophobicContact CG-CB 3.56Å; Y92-E191 HydrophobicContact CG-CG 3.97Å; S117-E191 WeakPolarHBondContact O-CA 3.21Å; E191-I193 HydrophobicContact CG-CD1 4.48Å; E191-I193 HydrophobicContact CG-CG1 3.89Å; E191-F203 VanDerWaalsContact O-CA 3.29Å; E191-F203 WeakPolarHBondContact O-CA 3.41Å; E191-Y204 PolarHBondContact N-O 2.93Å; E191-Y204 PolarHBondContact O-N 3.16Å
192	Q	88.4	Confident	85.3	Confident	58 Å²	58	57.5 Å²	57.5	27%	0.271	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.1	165.4	-173.5	-176	-77.2	0	0	110	Y116 S117 V201 R202 F203	Y116-Q192 HydrophobicContact CD1-CB 3.91Å; Y116-Q192 HydrophobicContact CD1-CG 4.3Å; Y116-Q192 HydrophobicContact CE1-CB 3.67Å; Y116-Q192 HydrophobicContact CE1-CG 4.24Å; Y116-Q192 VanDerWaalsContact CE1-OE1 3.25Å; S117-Q192 PolarHBondContact O-N 2.89Å; Q192-V201 VanDerWaalsContact CD-CG1 3.47Å; Q192-V201 HydrophobicContact CG-CG1 3.2Å; Q192-R202 WeakPolarHBondContact CA-O 3.28Å; Q192-F203 HydrophobicContact CB-CD1 4.13Å; Q192-F203 HydrophobicContact CB-CE1 3.99Å; Q192-F203 HydrophobicContact CG-CD1 4.09Å; Q192-F203 HydrophobicContact CG-CE1 3.64Å; Q192-F203 HydrophobicContact CG-CZ 4.25Å
193	I	82.3	Confident	84.9	Confident	18 Å²	18	56.6 Å²	56.6	9%	0.092	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.4	175.5	-53.9	-166.9	0	0	0	109.4	D29 E191 V201 R202 Y204	D29-I193 HydrophobicContact CB-CD1 4.15Å; E191-I193 HydrophobicContact CG-CD1 4.48Å; E191-I193 HydrophobicContact CG-CG1 3.89Å; I193-V201 WeakPolarHBondContact O-CA 3.13Å; I193-R202 HydrophobicContact CB-CB 4.39Å; I193-R202 PolarHBondContact N-O 3.45Å; I193-R202 PolarHBondContact O-N 2.73Å; I193-Y204 HydrophobicContact CB-CE2 4.49Å; I193-Y204 HydrophobicContact CD1-CD2 3.71Å; I193-Y204 HydrophobicContact CD1-CE2 3.45Å; I193-Y204 VanDerWaalsContact CD1-CE2 3.45Å; I193-Y204 HydrophobicContact CG1-CD2 4.01Å; I193-Y204 HydrophobicContact CG1-CE2 3.97Å
194	S	80.3	Confident	84.7	Confident	87 Å²	87	53.4 Å²	53.4	61%	0.608	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	112.9	172.5	60.6	0	0	0	0	110.5
195	C	79	Confident	84.6	Confident	7 Å²	7	53.5 Å²	53.5	5%	0.047	29%	0.29	C	S	.	.			trans	-85.9	118.7	177.9	-63.1	0	0	0	0	110.8	C30 V197 G199 F200 R202	C30-C195 HydrophobicContact CB-CB 3.78Å; C30-C195 WeakPolarHBondContact CB-SG 3.34Å; C30-C195 WeakPolarHBondContact SG-CA 3.34Å; C30-C195 WeakPolarHBondContact SG-CB 3.27Å; C30-C195 CovalentContact SG-SG 2.03Å; C30-C195 PolarHBondContact SG-SG 3.43Å; C195-V197 VanDerWaalsContact C-N 3.34Å; C195-G199 VanDerWaalsContact O-CA 3.27Å; C195-G199 WeakPolarHBondContact O-CA 3.04Å; C195-G199 PolarHBondContact O-N 3.22Å; C195-F200 VanDerWaalsContact CB-O 3.27Å; C195-F200 WeakPolarHBondContact CB-O 3.4Å; C195-F200 PolarHBondContact N-O 2.89Å; C195-R202 VanDerWaalsContact SG-CG 3.59Å
196	R	71.8	Confident	84.6	Confident	173 Å²	173	53.3 Å²	53.3	65%	0.653	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-34.2	-179.1	-73.3	-179	172.5	174	-5	112.6
197	V	69	Low	84.6	Confident	103 Å²	103	55.2 Å²	55.2	62%	0.624	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	117.6	174.5	-175.3	0	0	0	0	107.3	C195 G199	C195-V197 VanDerWaalsContact C-N 3.34Å; V197-G199 VanDerWaalsContact C-N 3.3Å; V197-G199 PolarHBondContact O-N 3.09Å
198	G	67.7	Low	84.6	Confident	53 Å²	53	55.3 Å²	55.3	55%	0.546	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	-15	-177.6	0	0	0	0	0	115.6	F200	G198-F200 WeakPolarHBondContact O-CD2 3.19Å; G198-F200 WeakPolarHBondContact O-CE2 3.32Å; G198-F200 PolarHBondContact O-N 2.81Å
199	G	73.6	Confident	84.6	Confident	60 Å²	60	52.9 Å²	52.9	62%	0.619	30%	0.296	S	S	*	.	S	Bend	trans	71.6	6	177.2	0	0	0	0	0	114.7	C195 V197	C195-G199 VanDerWaalsContact O-CA 3.27Å; C195-G199 WeakPolarHBondContact O-CA 3.04Å; C195-G199 PolarHBondContact O-N 3.22Å; V197-G199 VanDerWaalsContact C-N 3.3Å; V197-G199 PolarHBondContact O-N 3.09Å
200	F	77.4	Confident	84.6	Confident	146 Å²	146	53.8 Å²	53.8	64%	0.64	30%	0.304	S	S	*	.			trans	-74.6	153	-179.9	-49.8	-73.8	0	0	0	111.5	C195 G198	C195-F200 VanDerWaalsContact CB-O 3.27Å; C195-F200 WeakPolarHBondContact CB-O 3.4Å; C195-F200 PolarHBondContact N-O 2.89Å; G198-F200 WeakPolarHBondContact O-CD2 3.19Å; G198-F200 WeakPolarHBondContact O-CE2 3.32Å; G198-F200 PolarHBondContact O-N 2.81Å
201	V	80.7	Confident	84.7	Confident	67 Å²	67	57.9 Å²	57.9	41%	0.406	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	131.8	174.8	177.1	0	0	0	0	108.7	Q192 I193 F203	Q192-V201 VanDerWaalsContact CD-CG1 3.47Å; Q192-V201 HydrophobicContact CG-CG1 3.2Å; I193-V201 WeakPolarHBondContact O-CA 3.13Å; V201-F203 HydrophobicContact CG1-CE1 4.13Å; V201-F203 HydrophobicContact CG1-CE2 3.89Å; V201-F203 HydrophobicContact CG1-CZ 3.67Å
202	R	81.5	Confident	84.9	Confident	51 Å²	51	57.6 Å²	57.6	19%	0.192	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.4	178.7	-64.5	-162.1	165.9	-127.5	-0.6	109.8	C30 Y36 Q192 I193 C195 Y204	C30-R202 PolarHBondContact O-NE 2.81Å; C30-R202 VanDerWaalsContact O-NE 3.14Å; C30-R202 PolarHBondContact O-NH2 3.4Å; Y36-R202 HydrophobicContact CE1-CB 3.82Å; Y36-R202 HydrophobicContact CE1-CG 4.27Å; Y36-R202 WeakPolarHBondContact OH-CB 3.28Å; Y36-R202 WeakPolarHBondContact OH-CD 3.45Å; Y36-R202 WeakPolarHBondContact OH-CG 3.34Å; Y36-R202 PolarHBondContact OH-NE 2.86Å; Y36-R202 VanDerWaalsContact OH-NE 3.13Å; Y36-R202 PolarHBondContact OH-NH1 3.28Å; Q192-R202 WeakPolarHBondContact CA-O 3.28Å; I193-R202 HydrophobicContact CB-CB 4.39Å; I193-R202 PolarHBondContact N-O 3.45Å; I193-R202 PolarHBondContact O-N 2.73Å; C195-R202 VanDerWaalsContact SG-CG 3.59Å; R202-Y204 HydrophobicContact CB-CE2 4.25Å
203	F	85.2	Confident	85.3	Confident	96 Å²	96	54.9 Å²	54.9	42%	0.421	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.3	177.6	-61	-82.1	0	0	0	110.4	Y36 F190 E191 Q192 V201	Y36-F203 VanDerWaalsContact CD1-O 3.23Å; Y36-F203 WeakPolarHBondContact CD1-O 3.28Å; F190-F203 AromaticContact CD2-CD1 3.78Å; F190-F203 HydrophobicContact CD2-CD1 3.78Å; F190-F203 AromaticContact CE2-CD1 3.68Å; F190-F203 HydrophobicContact CE2-CD1 3.68Å; F190-F203 AromaticContact CE2-CE1 4Å; F190-F203 HydrophobicContact CE2-CE1 4Å; E191-F203 VanDerWaalsContact O-CA 3.29Å; E191-F203 WeakPolarHBondContact O-CA 3.41Å; Q192-F203 HydrophobicContact CB-CD1 4.13Å; Q192-F203 HydrophobicContact CB-CE1 3.99Å; Q192-F203 HydrophobicContact CG-CD1 4.09Å; Q192-F203 HydrophobicContact CG-CE1 3.64Å; Q192-F203 HydrophobicContact CG-CZ 4.25Å; V201-F203 HydrophobicContact CG1-CE1 4.13Å; V201-F203 HydrophobicContact CG1-CE2 3.89Å; V201-F203 HydrophobicContact CG1-CZ 3.67Å
204	Y	87.6	Confident	86	Confident	3 Å²	3	59.3 Å²	59.3	1%	0.012	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	110.1	172.7	-66.9	-82.5	0	0	0	108.3	D29 L35 Y36 Y54 F190 E191 I193 R202	D29-Y204 PolarHBondContact O-OH 2.01Å; L35-Y204 HydrophobicContact CB-CD1 4.29Å; L35-Y204 HydrophobicContact CB-CE1 3.57Å; Y36-Y204 AromaticContact CD1-CD1 3.92Å; Y36-Y204 HydrophobicContact CD1-CD1 3.92Å; Y36-Y204 AromaticContact CD1-CE1 3.67Å; Y36-Y204 HydrophobicContact CD1-CE1 3.67Å; Y36-Y204 HydrophobicContact CE1-CE1 4.05Å; Y36-Y204 HydrophobicContact CE1-CE2 4.36Å; Y36-Y204 AromaticContact CE1-CZ 3.98Å; Y36-Y204 HydrophobicContact CG-CE1 4.28Å; Y54-Y204 AromaticContact CD1-CD1 3.81Å; Y54-Y204 HydrophobicContact CD1-CD1 3.81Å; Y54-Y204 HydrophobicContact CD1-CD2 4.3Å; Y54-Y204 AromaticContact CD1-CG 3.68Å; Y54-Y204 HydrophobicContact CD1-CG 3.68Å; Y54-Y204 HydrophobicContact CE1-CD1 4.19Å; Y54-Y204 HydrophobicContact CE1-CD2 4.05Å; Y54-Y204 HydrophobicContact CE1-CE2 4.46Å; Y54-Y204 AromaticContact CE1-CG 3.9Å; Y54-Y204 HydrophobicContact CE1-CG 3.9Å; Y54-Y204 HydrophobicContact CG-CD1 4.22Å; F190-Y204 CarbonylContact C-O 3.44Å; F190-Y204 WeakPolarHBondContact CA-O 3.41Å; F190-Y204 WeakPolarHBondContact CB-O 2.99Å; E191-Y204 PolarHBondContact N-O 2.93Å; E191-Y204 PolarHBondContact O-N 3.16Å; I193-Y204 HydrophobicContact CB-CE2 4.49Å; I193-Y204 HydrophobicContact CD1-CD2 3.71Å; I193-Y204 HydrophobicContact CD1-CE2 3.45Å; I193-Y204 VanDerWaalsContact CD1-CE2 3.45Å; I193-Y204 HydrophobicContact CG1-CD2 4.01Å; I193-Y204 HydrophobicContact CG1-CE2 3.97Å; R202-Y204 HydrophobicContact CB-CE2 4.25Å
205	S	91.1	Very high	86.7	Confident	43 Å²	43	57.7 Å²	57.7	30%	0.301	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130	-172.4	-177	0	0	0	0	110.7	R188 I189	R188-S205 WeakPolarHBondContact CD-OG 3.34Å; I189-S205 WeakPolarHBondContact O-CA 3.15Å
206	I	94	Very high	87.6	Confident	4 Å²	4	58 Å²	58	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	108.6	170.1	-56	173.1	0	0	0	106.8	H53 Y56 M58 R188 I189 F221	H53-I206 HydrophobicContact CB-CD1 3.49Å; H53-I206 VanDerWaalsContact CB-CD1 3.49Å; H53-I206 HydrophobicContact CB-CG1 3.71Å; H53-I206 HydrophobicContact CB-CG2 4.31Å; Y56-I206 HydrophobicContact CD2-CD1 4.22Å; Y56-I206 HydrophobicContact CG-CD1 4.14Å; M58-I206 HydrophobicContact SD-CG2 4.2Å; R188-I206 WeakPolarHBondContact CA-O 3.25Å; R188-I206 WeakPolarHBondContact CB-O 3.26Å; I189-I206 HydrophobicContact CD1-CD1 4.05Å; I189-I206 HydrophobicContact CG1-CB 3.95Å; I189-I206 HydrophobicContact CG1-CD1 4.16Å; I189-I206 HydrophobicContact CG1-CG1 4.4Å; I189-I206 PolarHBondContact N-O 3.14Å; I189-I206 VanDerWaalsContact N-O 3.14Å; I189-I206 PolarHBondContact O-N 3.34Å; I206-F221 HydrophobicContact CB-CE1 4.24Å; I206-F221 HydrophobicContact CG2-CD1 4.09Å; I206-F221 HydrophobicContact CG2-CE1 3.58Å
207	L	94.7	Very high	88.9	Confident	89 Å²	89	49.7 Å²	49.7	47%	0.466	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	130.4	-178.7	-177.4	70.6	0	0	0	109.8	R188 P209	R188-L207 HydrophobicContact CB-CD1 4.24Å; L207-P209 WeakPolarHBondContact O-CD 3.45Å
208	V	97	Very high	90.3	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.012	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-73.2	120.7	164.9	-175.5	0	0	0	0	107.7	M58 I60 F171 S187 A210 W212 I213 V219 F221	M58-V208 HydrophobicContact SD-CG2 4.33Å; I60-V208 HydrophobicContact CD1-CG1 4.28Å; F171-V208 HydrophobicContact CD2-CG2 4.15Å; F171-V208 HydrophobicContact CE2-CG2 4.47Å; S187-V208 PolarHBondContact O-N 2.83Å; V208-A210 PolarHBondContact O-N 3.28Å; V208-W212 HydrophobicContact CG1-CB 4.37Å; V208-I213 HydrophobicContact CB-CD1 4.39Å; V208-I213 HydrophobicContact CB-CG1 4.41Å; V208-I213 HydrophobicContact CG1-CD1 4.37Å; V208-I213 HydrophobicContact CG1-CG1 3.86Å; V208-V219 HydrophobicContact CG1-CG2 3.83Å; V208-V219 HydrophobicContact CG2-CG1 3.91Å; V208-V219 HydrophobicContact CG2-CG2 4.24Å; V208-F221 HydrophobicContact CG2-CZ 3.76Å
209	P	95.5	Very high	91.7	Very high	29 Å²	29	43.1 Å²	43.1	19%	0.188	24%	0.236	C	C	.	.	P	Polyproline II helix	trans	-62.7	133.2	179.6	-13.9	25.3	0	0	0	110	L207 K211 W212	L207-P209 WeakPolarHBondContact O-CD 3.45Å; P209-K211 HydrophobicContact CB-CG 4.37Å; P209-K211 PolarHBondContact O-N 3.27Å; P209-K211 VanDerWaalsContact O-N 3.1Å; P209-W212 WeakPolarHBondContact O-CB 3.34Å; P209-W212 PolarHBondContact O-N 2.51Å
210	A	95.3	Very high	92.9	Very high	20 Å²	20	40.9 Å²	40.9	17%	0.165	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-56.8	-33.6	-170.1	0	0	0	0	0	113.4	E182 V208 W212 I213	E182-A210 HydrophobicContact CB-CB 3.69Å; E182-A210 HydrophobicContact CG-CB 4.04Å; V208-A210 PolarHBondContact O-N 3.28Å; A210-W212 PolarHBondContact O-N 3.32Å; A210-I213 PolarHBondContact O-N 3.48Å
211	K	94.5	Very high	93.8	Very high	93 Å²	93	33.9 Å²	33.9	40%	0.404	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-55.5	-22.2	175.2	72.7	177.2	-171.7	172.1	0	115	E44 P209 K214	E44-K211 VanDerWaalsContact OE1-CE 3.27Å; E44-K211 WeakPolarHBondContact OE1-CE 3.33Å; E44-K211 IonicContact OE1-NZ 2.66Å; E44-K211 PolarHBondContact OE1-NZ 3.45Å; P209-K211 HydrophobicContact CB-CG 4.37Å; P209-K211 PolarHBondContact O-N 3.27Å; P209-K211 VanDerWaalsContact O-N 3.1Å; K211-K214 WeakPolarHBondContact O-CD 3.2Å; K211-K214 WeakPolarHBondContact O-CE 3.03Å; K211-K214 PolarHBondContact O-NZ 3.44Å
212	W	96.3	Very high	94.5	Very high	7 Å²	7	34.4 Å²	34.4	3%	0.027	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-92.5	-15.9	178	-70.6	98.2	0	0	0	113.2	E44 N45 Y48 R49 I60 H62 V208 P209 A210 K214 T217	E44-W212 HydrophobicContact CG-CZ2 4Å; N45-W212 WeakPolarHBondContact O-CH2 3.47Å; Y48-W212 VanDerWaalsContact C-CH2 3.46Å; R49-W212 HydrophobicContact CB-CH2 3.84Å; R49-W212 HydrophobicContact CB-CZ2 3.56Å; R49-W212 HydrophobicContact CB-CZ3 4.48Å; R49-W212 HydrophobicContact CG-CZ2 4.48Å; I60-W212 HydrophobicContact CB-CD2 4.29Å; I60-W212 HydrophobicContact CB-CE3 3.97Å; I60-W212 HydrophobicContact CB-CZ3 4.34Å; I60-W212 HydrophobicContact CD1-CB 4.01Å; I60-W212 HydrophobicContact CD1-CD2 4.04Å; I60-W212 HydrophobicContact CD1-CG 3.74Å; I60-W212 HydrophobicContact CG2-CB 4.06Å; I60-W212 HydrophobicContact CG2-CD2 3.75Å; I60-W212 HydrophobicContact CG2-CE3 3.23Å; I60-W212 HydrophobicContact CG2-CG 4.1Å; I60-W212 HydrophobicContact CG2-CZ3 3.91Å; H62-W212 AromaticContact CD2-CE3 3.38Å; H62-W212 AromaticContact CD2-CZ3 3.16Å; H62-W212 WeakPolarHBondContact CD2-CZ3 3.39Å; H62-W212 AromaticContact CE1-CE3 3.87Å; H62-W212 AromaticContact NE2-CD2 3.92Å; H62-W212 AromaticContact NE2-CE3 3.04Å; H62-W212 AromaticContact NE2-CZ3 3.35Å; H62-W212 VanDerWaalsContact NE2-CZ3 3.35Å; H62-W212 WeakPolarHBondContact NE2-CZ3 3.34Å; V208-W212 HydrophobicContact CG1-CB 4.37Å; P209-W212 WeakPolarHBondContact O-CB 3.34Å; P209-W212 PolarHBondContact O-N 2.51Å; A210-W212 PolarHBondContact O-N 3.32Å; W212-K214 VanDerWaalsContact C-N 3.27Å; W212-K214 PolarHBondContact O-N 2.83Å; W212-T217 WeakPolarHBondContact O-CB 3.23Å; W212-T217 VanDerWaalsContact O-CG2 3.31Å; W212-T217 WeakPolarHBondContact O-CG2 3.1Å; W212-T217 PolarHBondContact O-OG1 2.86Å
213	I	97	Very high	94.8	Very high	2 Å²	2	35 Å²	35	1%	0.01	19%	0.193	C	C	.	.			trans	-79.6	78.4	-179.7	-54.3	176.7	0	0	0	108.7	M159 Y173 L185 V208 A210	M159-I213 HydrophobicContact CE-CG2 3.78Å; Y173-I213 HydrophobicContact CD1-CG2 3.97Å; Y173-I213 HydrophobicContact CD2-CB 4.22Å; Y173-I213 HydrophobicContact CD2-CG2 3.88Å; Y173-I213 HydrophobicContact CE1-CG2 3.94Å; Y173-I213 HydrophobicContact CE2-CB 4.02Å; Y173-I213 HydrophobicContact CE2-CG1 3.85Å; Y173-I213 HydrophobicContact CE2-CG2 3.91Å; Y173-I213 HydrophobicContact CG-CG2 3.95Å; L185-I213 HydrophobicContact CB-CB 4.33Å; L185-I213 HydrophobicContact CB-CD1 3.97Å; L185-I213 HydrophobicContact CB-CG2 4.19Å; L185-I213 HydrophobicContact CD1-CB 4.07Å; L185-I213 HydrophobicContact CD1-CG2 4.1Å; L185-I213 HydrophobicContact CD2-CG2 4.05Å; L185-I213 HydrophobicContact CG-CG2 4.35Å; V208-I213 HydrophobicContact CB-CD1 4.39Å; V208-I213 HydrophobicContact CB-CG1 4.41Å; V208-I213 HydrophobicContact CG1-CD1 4.37Å; V208-I213 HydrophobicContact CG1-CG1 3.86Å; A210-I213 PolarHBondContact O-N 3.48Å
214	K	95.9	Very high	94.6	Very high	110 Å²	110	32 Å²	32	48%	0.478	18%	0.181	S	C	.	.	S	Bend	trans	-134.8	160.5	-177.5	-67	172.6	176.7	156.6	0	109.6	Y173 K211 W212 G216 T217	Y173-K214 WeakPolarHBondContact CB-O 3.47Å; K211-K214 WeakPolarHBondContact O-CD 3.2Å; K211-K214 WeakPolarHBondContact O-CE 3.03Å; K211-K214 PolarHBondContact O-NZ 3.44Å; W212-K214 VanDerWaalsContact C-N 3.27Å; W212-K214 PolarHBondContact O-N 2.83Å; K214-G216 PolarHBondContact O-N 3.17Å; K214-T217 WeakPolarHBondContact O-CB 3.42Å; K214-T217 PolarHBondContact O-N 2.88Å; K214-T217 PolarHBondContact O-OG1 2.98Å
215	S	97	Very high	93.6	Very high	54 Å²	54	34 Å²	34	38%	0.378	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	135.1	177	-53.3	0	0	0	0	112	N175 I176 T217	N175-S215 WeakPolarHBondContact CA-OG 2.86Å; N175-S215 PolarHBondContact N-OG 3.1Å; I176-S215 PolarHBondContact N-OG 3.22Å; I176-S215 PolarHBondContact O-OG 3.37Å; S215-T217 VanDerWaalsContact C-N 3.33Å
216	G	97.1	Very high	92.1	Very high	12 Å²	12	37.1 Å²	37.1	12%	0.124	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	13.7	179.1	0	0	0	0	0	114.2	H62 N63 Q64 Y173 K214	H62-G216 CarbonylContact C-O 3.59Å; N63-G216 PolarHBondContact N-O 2.94Å; Q64-G216 PolarHBondContact N-O 3.2Å; Y173-G216 PolarHBondContact O-N 3.42Å; K214-G216 PolarHBondContact O-N 3.17Å
217	T	98.3	Very high	90.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	131.2	172.1	-48.6	0	0	0	0	111.3	I60 Q61 H62 Y172 Y173 W212 K214 S215 V219	I60-T217 HydrophobicContact CG2-CG2 3.38Å; Q61-T217 CarbonylContact O-C 3.56Å; Q61-T217 WeakPolarHBondContact O-CA 3.37Å; H62-T217 PolarHBondContact CE1-OG1 2.94Å; H62-T217 PolarHBondContact ND1-OG1 3.35Å; Y172-T217 WeakPolarHBondContact CA-O 2.93Å; Y172-T217 WeakPolarHBondContact CD2-O 3.39Å; Y173-T217 HydrophobicContact CD2-CG2 4.46Å; Y173-T217 PolarHBondContact N-O 2.81Å; W212-T217 WeakPolarHBondContact O-CB 3.23Å; W212-T217 VanDerWaalsContact O-CG2 3.31Å; W212-T217 WeakPolarHBondContact O-CG2 3.1Å; W212-T217 PolarHBondContact O-OG1 2.86Å; K214-T217 WeakPolarHBondContact O-CB 3.42Å; K214-T217 PolarHBondContact O-N 2.88Å; K214-T217 PolarHBondContact O-OG1 2.98Å; S215-T217 VanDerWaalsContact C-N 3.33Å; T217-V219 HydrophobicContact CG2-CG2 4.31Å
218	L	98.4	Very high	89.2	Confident	18 Å²	18	33.7 Å²	33.7	9%	0.094	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	129.6	165.3	-174.5	67.5	0	0	0	109.5	I60 Q61 Q64 P67 F171 Y172 E220	I60-L218 WeakPolarHBondContact CA-O 3.46Å; Q61-L218 PolarHBondContact N-O 2.77Å; Q61-L218 PolarHBondContact O-N 2.78Å; Q64-L218 HydrophobicContact CB-CB 3.92Å; Q64-L218 HydrophobicContact CG-CB 3.7Å; P67-L218 HydrophobicContact CG-CD1 4.29Å; F171-L218 CarbonylContact O-C 3.45Å; F171-L218 WeakPolarHBondContact O-CA 3.01Å; Y172-L218 HydrophobicContact CD2-CD1 4.4Å; L218-E220 HydrophobicContact CD2-CG 4.11Å; L218-E220 HydrophobicContact CG-CG 4Å
219	V	98.5	Very high	87.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	133.6	170.3	-176.9	0	0	0	0	108.2	M58 R59 I60 S170 F171 Y173 V208 T217 F221	M58-V219 HydrophobicContact CG-CG1 3.85Å; M58-V219 HydrophobicContact SD-CG1 4.08Å; R59-V219 CarbonylContact O-C 3.52Å; R59-V219 WeakPolarHBondContact O-CA 3.47Å; I60-V219 HydrophobicContact CG1-CG1 4.2Å; I60-V219 HydrophobicContact CG1-CG2 4.2Å; I60-V219 HydrophobicContact CG2-CG2 4.11Å; S170-V219 CarbonylContact C-O 3.46Å; S170-V219 WeakPolarHBondContact CA-O 3.49Å; F171-V219 HydrophobicContact CB-CB 4.2Å; F171-V219 PolarHBondContact N-O 3.41Å; F171-V219 PolarHBondContact O-N 3.47Å; Y173-V219 HydrophobicContact CE2-CG2 3.92Å; V208-V219 HydrophobicContact CG1-CG2 3.83Å; V208-V219 HydrophobicContact CG2-CG1 3.91Å; V208-V219 HydrophobicContact CG2-CG2 4.24Å; T217-V219 HydrophobicContact CG2-CG2 4.31Å; V219-F221 HydrophobicContact CG1-CD2 4.46Å; V219-F221 HydrophobicContact CG1-CE1 4.29Å; V219-F221 HydrophobicContact CG1-CE2 3.77Å; V219-F221 HydrophobicContact CG1-CZ 3.68Å
220	E	98.2	Very high	86.1	Confident	12 Å²	12	41.1 Å²	41.1	6%	0.056	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.1	179.5	-65.3	174.8	107.1	0	0	110.3	M58 R59 K168 I169 L218	M58-E220 CarbonylContact C-O 3.44Å; M58-E220 WeakPolarHBondContact CA-O 3.45Å; R59-E220 HydrophobicContact CB-CB 4.48Å; R59-E220 IonicContact CZ-OE2 3.52Å; R59-E220 PolarHBondContact N-O 3.34Å; R59-E220 IonicContact NE-OE2 2.62Å; R59-E220 PolarHBondContact NE-OE2 2.99Å; R59-E220 VanDerWaalsContact NH2-CD 3.33Å; R59-E220 IonicContact NH2-OE1 3.78Å; R59-E220 PolarHBondContact NH2-OE1 3.39Å; R59-E220 IonicContact NH2-OE2 3.65Å; R59-E220 PolarHBondContact NH2-OE2 3.28Å; R59-E220 PolarHBondContact O-N 3Å; K168-E220 HydrophobicContact CD-CB 4.28Å; K168-E220 HydrophobicContact CD-CG 4.36Å; K168-E220 WeakPolarHBondContact CE-OE1 3.33Å; K168-E220 IonicContact NZ-OE1 2.63Å; K168-E220 PolarHBondContact NZ-OE1 3.1Å; I169-E220 CarbonylContact O-C 3.45Å; I169-E220 WeakPolarHBondContact O-CA 3.24Å; L218-E220 HydrophobicContact CD2-CG 4.11Å; L218-E220 HydrophobicContact CG-CG 4Å
221	F	97	Very high	85.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.3	172.6	-52.8	-86.2	0	0	0	109.2	Y56 S57 M58 K168 I169 F171 I189 I206 V208 V219	Y56-F221 HydrophobicContact CD1-CB 3.87Å; Y56-F221 HydrophobicContact CE1-CB 4.45Å; S57-F221 VanDerWaalsContact O-CA 3.28Å; S57-F221 WeakPolarHBondContact O-CA 3.34Å; M58-F221 HydrophobicContact CB-CD1 4.02Å; M58-F221 HydrophobicContact CB-CE1 4.07Å; M58-F221 HydrophobicContact CG-CD1 4.05Å; M58-F221 HydrophobicContact CG-CE1 3.71Å; M58-F221 HydrophobicContact CG-CZ 4.4Å; M58-F221 HydrophobicContact SD-CE1 3.63Å; M58-F221 HydrophobicContact SD-CZ 4.13Å; K168-F221 WeakPolarHBondContact CA-O 3.06Å; I169-F221 HydrophobicContact CB-CB 4.33Å; I169-F221 HydrophobicContact CB-CD2 4.25Å; I169-F221 HydrophobicContact CG2-CD2 4.25Å; I169-F221 PolarHBondContact N-O 2.86Å; I169-F221 PolarHBondContact O-N 2.83Å; F171-F221 AromaticContact CD2-CE2 3.68Å; F171-F221 HydrophobicContact CD2-CE2 3.68Å; F171-F221 HydrophobicContact CD2-CZ 4.24Å; F171-F221 AromaticContact CE2-CE2 3.53Å; F171-F221 HydrophobicContact CE2-CE2 3.53Å; F171-F221 HydrophobicContact CE2-CZ 4.01Å; F171-F221 HydrophobicContact CG-CE2 4.3Å; F171-F221 HydrophobicContact CZ-CE2 4.03Å; I189-F221 HydrophobicContact CD1-CB 3.74Å; I189-F221 HydrophobicContact CD1-CD1 3.65Å; I189-F221 HydrophobicContact CD1-CD2 4.22Å; I189-F221 HydrophobicContact CD1-CE1 4.3Å; I189-F221 HydrophobicContact CD1-CG 3.59Å; I189-F221 HydrophobicContact CG1-CD1 3.96Å; I189-F221 HydrophobicContact CG1-CE1 4.09Å; I189-F221 HydrophobicContact CG1-CG 4.17Å; I189-F221 HydrophobicContact CG1-CZ 4.42Å; I189-F221 HydrophobicContact CG2-CD2 4.17Å; I189-F221 HydrophobicContact CG2-CE2 4.19Å; I206-F221 HydrophobicContact CB-CE1 4.24Å; I206-F221 HydrophobicContact CG2-CD1 4.09Å; I206-F221 HydrophobicContact CG2-CE1 3.58Å; V208-F221 HydrophobicContact CG2-CZ 3.76Å; V219-F221 HydrophobicContact CG1-CD2 4.46Å; V219-F221 HydrophobicContact CG1-CE1 4.29Å; V219-F221 HydrophobicContact CG1-CE2 3.77Å; V219-F221 HydrophobicContact CG1-CZ 3.68Å
222	E	93.8	Very high	84	Confident	77 Å²	77	44.8 Å²	44.8	36%	0.36	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.8	176.6	-67.3	-172.7	-173.7	0	0	110	Y56 S57 K168 I224	Y56-E222 CarbonylContact C-O 3.53Å; Y56-E222 VanDerWaalsContact CA-O 3.27Å; Y56-E222 WeakPolarHBondContact CA-O 3.43Å; Y56-E222 VanDerWaalsContact CD1-C 3.49Å; S57-E222 PolarHBondContact N-O 3.14Å; S57-E222 PolarHBondContact O-N 3.33Å; S57-E222 VanDerWaalsContact O-N 3.1Å; S57-E222 PolarHBondContact OG-O 3.49Å; K168-E222 HydrophobicContact CB-CG 4.23Å; K168-E222 HydrophobicContact CD-CG 3.88Å; K168-E222 WeakPolarHBondContact CD-OE1 3.46Å; K168-E222 HydrophobicContact CG-CG 3.84Å; E222-I224 PolarHBondContact O-N 2.82Å
223	A	89.3	Confident	83.2	Confident	65 Å²	65	47 Å²	47	54%	0.537	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	123.2	179.3	0	0	0	0	0	109.6	K55 Y56	K55-A223 CarbonylContact O-C 3.6Å; K55-A223 WeakPolarHBondContact O-CA 3.13Å; Y56-A223 HydrophobicContact CD1-CB 4.4Å; Y56-A223 HydrophobicContact CE1-CB 4.01Å
224	I	80.2	Confident	82.4	Confident	31 Å²	31	49.5 Å²	49.5	16%	0.159	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-95.4	130.7	170.7	59.4	178.6	0	0	0	107.9	I52 K55 E222 I258	I52-I224 HydrophobicContact CG2-CD1 3.64Å; K55-I224 WeakPolarHBondContact O-CG1 3.36Å; K55-I224 PolarHBondContact O-N 2.91Å; E222-I224 PolarHBondContact O-N 2.82Å; I224-I258 HydrophobicContact CB-CD1 4.39Å
225	G	65.9	Low	81.7	Confident	45 Å²	45	51.2 Å²	51.2	46%	0.464	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-60.8	152.5	173.7	0	0	0	0	0	111.7	I227	G225-I227 VanDerWaalsContact C-N 3.31Å; G225-I227 PolarHBondContact O-N 2.87Å
226	E	60.2	Low	81.1	Confident	109 Å²	109	51.3 Å²	51.3	51%	0.509	29%	0.287	S	S	.	.	S	Bend	trans	-71.4	83.1	170.8	-70.1	177.2	-164.8	0	0	110	K25	K25-E226 VanDerWaalsContact CE-OE1 3.32Å; K25-E226 WeakPolarHBondContact CE-OE1 3.2Å; K25-E226 VanDerWaalsContact CE-OE2 3.31Å; K25-E226 WeakPolarHBondContact CE-OE2 3.34Å; K25-E226 IonicContact NZ-OE1 2.94Å; K25-E226 PolarHBondContact NZ-OE1 3.33Å; K25-E226 IonicContact NZ-OE2 3.68Å; K25-E226 PolarHBondContact NZ-OE2 3.34Å
227	I	60.4	Low	80.3	Confident	19 Å²	19	50.7 Å²	50.7	10%	0.097	28%	0.281	C	S	.	.	S	Bend	trans	-133.1	-58.9	-171.6	-67.3	-179.2	0	0	0	111.7	G225 Y231 I242 L245	G225-I227 VanDerWaalsContact C-N 3.31Å; G225-I227 PolarHBondContact O-N 2.87Å; I227-Y231 WeakPolarHBondContact O-CE2 3.49Å; I227-I242 HydrophobicContact CB-CB 4.49Å; I227-I242 HydrophobicContact CB-CD1 4.1Å; I227-I242 HydrophobicContact CD1-CB 4.22Å; I227-I242 HydrophobicContact CD1-CG2 3.8Å; I227-I242 HydrophobicContact CG1-CB 4.25Å; I227-I242 HydrophobicContact CG1-CD1 4.26Å; I227-I242 HydrophobicContact CG1-CG2 3.9Å; I227-I242 HydrophobicContact CG2-CB 3.61Å; I227-I242 HydrophobicContact CG2-CD1 3.58Å; I227-I242 HydrophobicContact CG2-CG1 3.93Å; I227-I242 HydrophobicContact CG2-CG2 4.24Å; I227-L245 HydrophobicContact CD1-CB 3.95Å; I227-L245 HydrophobicContact CD1-CD1 3.24Å; I227-L245 HydrophobicContact CD1-CG 4.08Å; I227-L245 HydrophobicContact CG2-CB 4.19Å
228	C	66.6	Low	79.3	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.014	31%	0.307	C	S	.	.	S	Bend	trans	-96.1	-35.9	-168.9	-58.5	0	0	0	0	114.3	Q230 Y231 C247 C256 I258	C228-Q230 PolarHBondContact O-N 2.84Å; C228-Y231 VanDerWaalsContact O-CD2 3.31Å; C228-Y231 WeakPolarHBondContact O-CD2 3.28Å; C228-Y231 PolarHBondContact O-N 2.99Å; C228-C247 WeakPolarHBondContact CA-SG 3.48Å; C228-C247 HydrophobicContact CB-CB 3.88Å; C228-C247 WeakPolarHBondContact CB-SG 3.43Å; C228-C247 WeakPolarHBondContact SG-CA 3.48Å; C228-C247 WeakPolarHBondContact SG-CB 3.46Å; C228-C247 CovalentContact SG-SG 2.03Å; C228-C247 PolarHBondContact SG-SG 2.94Å; C228-C256 HydrophobicContact CB-CB 4.29Å; C228-C256 VanDerWaalsContact O-CB 3.27Å; C228-C256 WeakPolarHBondContact O-CB 3.28Å; C228-C256 PolarHBondContact O-SG 3.26Å; C228-I258 HydrophobicContact CB-CG1 4.15Å; C228-I258 WeakPolarHBondContact SG-CG1 3.48Å
229	S	63.4	Low	78.2	Confident	69 Å²	69	61.8 Å²	61.8	48%	0.483	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-8.6	-170.8	-48.1	0	0	0	0	115.1	Y231	S229-Y231 VanDerWaalsContact C-N 3.29Å
230	Q	65.2	Low	76.7	Confident	118 Å²	118	62 Å²	62	55%	0.551	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-20.3	172.1	67.3	-174.8	1.9	0	0	112.9	C228	C228-Q230 PolarHBondContact O-N 2.84Å
231	Y	73.2	Confident	74.9	Confident	57 Å²	57	66.7 Å²	66.7	22%	0.224	37%	0.368	C	S	.	.			trans	-90.9	115.6	179.1	-54.6	-65.9	0	0	0	109.4	I227 C228 S229 A240 I242 C256	I227-Y231 WeakPolarHBondContact O-CE2 3.49Å; C228-Y231 VanDerWaalsContact O-CD2 3.31Å; C228-Y231 WeakPolarHBondContact O-CD2 3.28Å; C228-Y231 PolarHBondContact O-N 2.99Å; S229-Y231 VanDerWaalsContact C-N 3.29Å; Y231-A240 HydrophobicContact CD2-CB 3.55Å; Y231-A240 HydrophobicContact CE1-CB 4.15Å; Y231-A240 HydrophobicContact CE2-CB 3.1Å; Y231-A240 HydrophobicContact CG-CB 4.24Å; Y231-A240 VanDerWaalsContact CZ-CB 3.42Å; Y231-I242 HydrophobicContact CE2-CD1 4.17Å; Y231-C256 VanDerWaalsContact O-CB 3.28Å; Y231-C256 WeakPolarHBondContact O-CB 3.4Å
232	N	72.1	Confident	73.1	Confident	133 Å²	133	68.9 Å²	68.9	71%	0.711	38%	0.379	S	S	*	.			trans	-101.9	3.7	-174.3	62.7	-18	0	0	0	113.1	W249	N232-W249 WeakPolarHBondContact O-CH2 3.42Å
233	T	79.1	Confident	71.5	Confident	55 Å²	55	70.4 Å²	70.4	34%	0.337	40%	0.399	S	S	.	.	S	Bend	trans	-128.9	151.4	175.9	69.5	0	0	0	0	110.6	E235 T236 C237	T233-E235 VanDerWaalsContact C-N 3.26Å; T233-E235 PolarHBondContact O-N 3.28Å; T233-T236 PolarHBondContact N-OG1 3.33Å; T233-T236 PolarHBondContact O-N 3Å; T233-T236 PolarHBondContact O-OG1 3.31Å; T233-T236 VanDerWaalsContact O-OG1 3.07Å; T233-T236 WeakPolarHBondContact OG1-CB 3.37Å; T233-T236 VanDerWaalsContact OG1-CG2 3.27Å; T233-T236 WeakPolarHBondContact OG1-CG2 3.43Å; T233-T236 PolarHBondContact OG1-N 3.42Å; T233-T236 PolarHBondContact OG1-OG1 2.95Å; T233-C237 VanDerWaalsContact O-CB 3.25Å; T233-C237 WeakPolarHBondContact O-CB 3.33Å; T233-C237 PolarHBondContact O-N 2.9Å
234	N	81.1	Confident	70	Confident	53 Å²	53	74.1 Å²	74.1	28%	0.283	41%	0.41	S	S	.	.	H	α-helix	trans	-53.4	-46.6	175.4	-172.9	10.5	0	0	0	111.4	T236 C237 Q238 W249	N234-T236 PolarHBondContact O-N 3.27Å; N234-C237 WeakPolarHBondContact O-CB 3.48Å; N234-C237 PolarHBondContact O-N 3.36Å; N234-Q238 WeakPolarHBondContact O-CB 3.45Å; N234-Q238 WeakPolarHBondContact O-CG 3.38Å; N234-Q238 PolarHBondContact O-N 2.94Å; N234-Q238 WeakPolarHBondContact OD1-CG 3.48Å; N234-Q238 PolarHBondContact OD1-NE2 3.35Å; N234-W249 VanDerWaalsContact CA-CD2 3.47Å; N234-W249 HydrophobicContact CB-CB 4.28Å; N234-W249 HydrophobicContact CB-CD2 3.81Å; N234-W249 HydrophobicContact CB-CE3 4.42Å; N234-W249 HydrophobicContact CB-CG 3.73Å; N234-W249 WeakPolarHBondContact OD1-CB 3.33Å
235	E	81.4	Confident	69.1	Low	146 Å²	146	75 Å²	75	68%	0.682	42%	0.415	S	S	*	.	H	α-helix	trans	-60.5	-48	179.9	-62.6	176.1	179.5	0	0	112.8	T233 C237 N239	T233-E235 VanDerWaalsContact C-N 3.26Å; T233-E235 PolarHBondContact O-N 3.28Å; E235-C237 VanDerWaalsContact C-N 3.27Å; E235-C237 PolarHBondContact O-N 3.46Å; E235-N239 WeakPolarHBondContact O-CB 3.29Å; E235-N239 VanDerWaalsContact O-CG 3.31Å; E235-N239 PolarHBondContact O-N 3.33Å; E235-N239 PolarHBondContact O-ND2 3.43Å
236	T	83.1	Confident	69.2	Low	56 Å²	56	76.6 Å²	76.6	34%	0.344	42%	0.415	S	S	.	.	H	α-helix	trans	-69.1	-31.4	-179.7	55.3	0	0	0	0	111.6	T233 N234 A240	T233-T236 PolarHBondContact N-OG1 3.33Å; T233-T236 PolarHBondContact O-N 3Å; T233-T236 PolarHBondContact O-OG1 3.31Å; T233-T236 VanDerWaalsContact O-OG1 3.07Å; T233-T236 WeakPolarHBondContact OG1-CB 3.37Å; T233-T236 VanDerWaalsContact OG1-CG2 3.27Å; T233-T236 WeakPolarHBondContact OG1-CG2 3.43Å; T233-T236 PolarHBondContact OG1-N 3.42Å; T233-T236 PolarHBondContact OG1-OG1 2.95Å; N234-T236 PolarHBondContact O-N 3.27Å; T236-A240 WeakPolarHBondContact O-CB 3.16Å; T236-A240 PolarHBondContact O-N 2.87Å
237	C	81	Confident	69.9	Low	0 Å²	0	71.6 Å²	71.6	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-69.3	-49.4	176.6	-176.2	0	0	0	0	113.1	T233 N234 E235 N239 A240 C247 F248 W249 C256	T233-C237 VanDerWaalsContact O-CB 3.25Å; T233-C237 WeakPolarHBondContact O-CB 3.33Å; T233-C237 PolarHBondContact O-N 2.9Å; N234-C237 WeakPolarHBondContact O-CB 3.48Å; N234-C237 PolarHBondContact O-N 3.36Å; E235-C237 VanDerWaalsContact C-N 3.27Å; E235-C237 PolarHBondContact O-N 3.46Å; C237-N239 VanDerWaalsContact C-N 3.27Å; C237-N239 PolarHBondContact O-N 2.64Å; C237-A240 WeakPolarHBondContact O-CB 3.43Å; C237-A240 PolarHBondContact O-N 2.04Å; C237-C247 WeakPolarHBondContact O-CB 3.47Å; C237-F248 PolarHBondContact SG-O 2.8Å; C237-W249 HydrophobicContact CB-CB 4.37Å; C237-W249 HydrophobicContact CB-CE3 3.75Å; C237-W249 HydrophobicContact CB-CZ3 4.49Å; C237-W249 PolarHBondContact SG-N 2.87Å; C237-W249 VanDerWaalsContact SG-N 3.4Å; C237-C256 WeakPolarHBondContact CA-SG 3.33Å; C237-C256 HydrophobicContact CB-CB 3.49Å; C237-C256 VanDerWaalsContact CB-CB 3.49Å; C237-C256 WeakPolarHBondContact CB-SG 3.1Å; C237-C256 WeakPolarHBondContact SG-CA 3.24Å; C237-C256 WeakPolarHBondContact SG-CB 3.17Å; C237-C256 CovalentContact SG-SG 2.01Å; C237-C256 PolarHBondContact SG-SG 3.25Å
238	Q	78.1	Confident	70.8	Confident	116 Å²	116	72.4 Å²	72.4	54%	0.542	40%	0.395	S	S	.	.	H	α-helix	trans	-65.8	-32.8	-178.6	-71.8	-176.7	-3.2	0	0	111.9	N234 A240	N234-Q238 WeakPolarHBondContact O-CB 3.45Å; N234-Q238 WeakPolarHBondContact O-CG 3.38Å; N234-Q238 PolarHBondContact O-N 2.94Å; N234-Q238 WeakPolarHBondContact OD1-CG 3.48Å; N234-Q238 PolarHBondContact OD1-NE2 3.35Å; Q238-A240 VanDerWaalsContact C-N 3.29Å; Q238-A240 PolarHBondContact O-N 3.02Å
239	N	73.7	Confident	71.4	Confident	134 Å²	134	74.3 Å²	74.3	72%	0.717	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-6.3	178.3	-68.5	-31	0	0	0	113.6	E235 C237 T241	E235-N239 WeakPolarHBondContact O-CB 3.29Å; E235-N239 VanDerWaalsContact O-CG 3.31Å; E235-N239 PolarHBondContact O-N 3.33Å; E235-N239 PolarHBondContact O-ND2 3.43Å; C237-N239 VanDerWaalsContact C-N 3.27Å; C237-N239 PolarHBondContact O-N 2.64Å; N239-T241 PolarHBondContact O-N 2.9Å
240	A	68.2	Low	72	Confident	5 Å²	5	71 Å²	71	4%	0.041	38%	0.379	C	S	.	.			trans	-81.3	102.5	-178.4	0	0	0	0	0	111.7	Y231 T236 C237 Q238 C247	Y231-A240 HydrophobicContact CD2-CB 3.55Å; Y231-A240 HydrophobicContact CE1-CB 4.15Å; Y231-A240 HydrophobicContact CE2-CB 3.1Å; Y231-A240 HydrophobicContact CG-CB 4.24Å; Y231-A240 VanDerWaalsContact CZ-CB 3.42Å; T236-A240 WeakPolarHBondContact O-CB 3.16Å; T236-A240 PolarHBondContact O-N 2.87Å; C237-A240 WeakPolarHBondContact O-CB 3.43Å; C237-A240 PolarHBondContact O-N 2.04Å; Q238-A240 VanDerWaalsContact C-N 3.29Å; Q238-A240 PolarHBondContact O-N 3.02Å; A240-C247 HydrophobicContact CB-CB 4.1Å
241	T	60	Low	72.7	Confident	111 Å²	111	70.9 Å²	70.9	68%	0.681	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106	107.7	166.8	-50.6	0	0	0	0	108.5	N239	N239-T241 PolarHBondContact O-N 2.9Å
242	I	59.7	Low	72.9	Confident	45 Å²	45	74.4 Å²	74.4	23%	0.231	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	100.9	176.3	-61.6	177.1	0	0	0	108.7	I227 Y231 N244 L245	I227-I242 HydrophobicContact CB-CB 4.49Å; I227-I242 HydrophobicContact CB-CD1 4.1Å; I227-I242 HydrophobicContact CD1-CB 4.22Å; I227-I242 HydrophobicContact CD1-CG2 3.8Å; I227-I242 HydrophobicContact CG1-CB 4.25Å; I227-I242 HydrophobicContact CG1-CD1 4.26Å; I227-I242 HydrophobicContact CG1-CG2 3.9Å; I227-I242 HydrophobicContact CG2-CB 3.61Å; I227-I242 HydrophobicContact CG2-CD1 3.58Å; I227-I242 HydrophobicContact CG2-CG1 3.93Å; I227-I242 HydrophobicContact CG2-CG2 4.24Å; Y231-I242 HydrophobicContact CE2-CD1 4.17Å; I242-N244 PolarHBondContact O-N 3.42Å; I242-L245 PolarHBondContact N-O 3.37Å; I242-L245 PolarHBondContact O-N 2.98Å
243	S	60.5	Low	72.9	Confident	110 Å²	110	69.8 Å²	69.8	77%	0.769	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	-94.5	-179.3	-52.9	0	0	0	0	112.6
244	N	57.7	Low	72.8	Confident	143 Å²	143	74.5 Å²	74.5	77%	0.765	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	10.7	-173.2	-60.9	-10.9	0	0	0	112.8	I242 N260	I242-N244 PolarHBondContact O-N 3.42Å; N244-N260 PolarHBondContact O-ND2 3.28Å
245	L	61.2	Low	72.5	Confident	50 Å²	50	75.5 Å²	75.5	26%	0.262	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113.8	-174.7	-71.8	128.9	0	0	0	109.6	I227 I242 I258	I227-L245 HydrophobicContact CD1-CB 3.95Å; I227-L245 HydrophobicContact CD1-CD1 3.24Å; I227-L245 HydrophobicContact CD1-CG 4.08Å; I227-L245 HydrophobicContact CG2-CB 4.19Å; I242-L245 PolarHBondContact N-O 3.37Å; I242-L245 PolarHBondContact O-N 2.98Å; L245-I258 HydrophobicContact CD2-CD1 4.39Å; L245-I258 HydrophobicContact CD2-CG2 3.39Å
246	T	68.1	Low	72.2	Confident	77 Å²	77	68.7 Å²	68.7	47%	0.472	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	127.6	171.3	-31.2	0	0	0	0	108.2	S259	T246-S259 WeakPolarHBondContact CB-OG 3.43Å; T246-S259 WeakPolarHBondContact O-CB 3.39Å; T246-S259 PolarHBondContact O-N 2.85Å; T246-S259 PolarHBondContact O-OG 3.13Å
247	C	74.6	Confident	71.7	Confident	5 Å²	5	66.4 Å²	66.4	3%	0.034	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	152.4	169.5	-65.4	0	0	0	0	110.3	C228 C237 A240 C256 I257	C228-C247 WeakPolarHBondContact CA-SG 3.48Å; C228-C247 HydrophobicContact CB-CB 3.88Å; C228-C247 WeakPolarHBondContact CB-SG 3.43Å; C228-C247 WeakPolarHBondContact SG-CA 3.48Å; C228-C247 WeakPolarHBondContact SG-CB 3.46Å; C228-C247 CovalentContact SG-SG 2.03Å; C228-C247 PolarHBondContact SG-SG 2.94Å; C237-C247 WeakPolarHBondContact O-CB 3.47Å; A240-C247 HydrophobicContact CB-CB 4.1Å; C247-C256 VanDerWaalsContact CB-SG 3.57Å; C247-I257 CarbonylContact C-O 3.51Å; C247-I257 WeakPolarHBondContact CA-O 3.21Å
248	F	78.4	Confident	71.2	Confident	36 Å²	36	67.4 Å²	67.4	16%	0.158	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	151.4	168.6	79	-79.7	0	0	0	110.4	C237 C250 I257 S259 T264 C267	C237-F248 PolarHBondContact SG-O 2.8Å; F248-C250 HydrophobicContact CE2-CB 4.37Å; F248-I257 HydrophobicContact CD1-CG1 3.99Å; F248-I257 WeakPolarHBondContact CD1-O 3.31Å; F248-I257 HydrophobicContact CD2-CG1 4.33Å; F248-I257 HydrophobicContact CE1-CB 4.42Å; F248-I257 HydrophobicContact CE1-CD1 3.59Å; F248-I257 HydrophobicContact CE1-CG1 3.44Å; F248-I257 VanDerWaalsContact CE1-CG1 3.44Å; F248-I257 HydrophobicContact CE2-CD1 3.71Å; F248-I257 HydrophobicContact CE2-CG1 3.83Å; F248-I257 HydrophobicContact CG-CG1 4.42Å; F248-I257 HydrophobicContact CZ-CD1 3.08Å; F248-I257 HydrophobicContact CZ-CG1 3.37Å; F248-I257 PolarHBondContact N-O 2.91Å; F248-I257 PolarHBondContact O-N 2.8Å; F248-S259 VanDerWaalsContact CD1-CA 3.46Å; F248-T264 HydrophobicContact CE1-CG2 3.42Å; F248-T264 VanDerWaalsContact CE1-CG2 3.42Å; F248-T264 HydrophobicContact CE2-CG2 4.48Å; F248-T264 VanDerWaalsContact CZ-CB 3.42Å; F248-T264 HydrophobicContact CZ-CG2 3.23Å; F248-C267 HydrophobicContact CE2-CB 3.78Å; F248-C267 HydrophobicContact CZ-CB 4.14Å
249	W	80.3	Confident	70.5	Confident	42 Å²	42	63 Å²	63	16%	0.159	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.8	-179.3	-172.8	-103.2	0	0	0	109.7	N232 N234 C237 E254 C256	N232-W249 WeakPolarHBondContact O-CH2 3.42Å; N234-W249 VanDerWaalsContact CA-CD2 3.47Å; N234-W249 HydrophobicContact CB-CB 4.28Å; N234-W249 HydrophobicContact CB-CD2 3.81Å; N234-W249 HydrophobicContact CB-CE3 4.42Å; N234-W249 HydrophobicContact CB-CG 3.73Å; N234-W249 WeakPolarHBondContact OD1-CB 3.33Å; C237-W249 HydrophobicContact CB-CB 4.37Å; C237-W249 HydrophobicContact CB-CE3 3.75Å; C237-W249 HydrophobicContact CB-CZ3 4.49Å; C237-W249 PolarHBondContact SG-N 2.87Å; C237-W249 VanDerWaalsContact SG-N 3.4Å; W249-E254 WeakPolarHBondContact CH2-O 3.37Å; W249-E254 HydrophobicContact CZ2-CB 4.14Å; W249-E254 WeakPolarHBondContact CZ2-O 3.35Å; W249-C256 HydrophobicContact CE3-CB 4.11Å; W249-C256 HydrophobicContact CZ3-CB 4.32Å
250	C	76.2	Confident	69.8	Low	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	109.8	168.7	-178.3	0	0	0	0	109.4	F248 K252 I253 E254 K255 I257 C267	F248-C250 HydrophobicContact CE2-CB 4.37Å; C250-K252 VanDerWaalsContact C-N 3.3Å; C250-K252 PolarHBondContact O-N 2.89Å; C250-I253 HydrophobicContact CB-CD1 4.02Å; C250-I253 HydrophobicContact CB-CG1 3.66Å; C250-I253 PolarHBondContact O-N 2.79Å; C250-E254 WeakPolarHBondContact O-CA 3.27Å; C250-E254 PolarHBondContact O-N 3.22Å; C250-K255 PolarHBondContact N-O 3.37Å; C250-K255 PolarHBondContact O-N 3.17Å; C250-I257 HydrophobicContact CB-CD1 3.72Å; C250-I257 HydrophobicContact CB-CG1 4Å; C250-C267 HydrophobicContact CB-CB 3.7Å; C250-C267 WeakPolarHBondContact CB-SG 3.48Å; C250-C267 WeakPolarHBondContact SG-CB 3.49Å; C250-C267 CovalentContact SG-SG 2.04Å; C250-C267 PolarHBondContact SG-SG 2.73Å
251	E	79.9	Confident	69.2	Low	114 Å²	114	63.1 Å²	63.1	53%	0.533	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-60.5	-40	179.8	-68.1	-176	174.2	0	0	111.7	I253 E254	E251-I253 PolarHBondContact O-N 2.93Å; E251-I253 VanDerWaalsContact O-N 3.12Å; E251-E254 PolarHBondContact O-N 2.88Å
252	K	75.9	Confident	68.8	Low	132 Å²	132	65.7 Å²	65.7	57%	0.574	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-56.6	-31.4	-178.9	-174.2	174.1	-179.6	171.2	0	114.2	C250 D266	C250-K252 VanDerWaalsContact C-N 3.3Å; C250-K252 PolarHBondContact O-N 2.89Å; K252-D266 IonicContact NZ-OD1 2.62Å; K252-D266 IonicContact NZ-OD2 3.18Å; K252-D266 PolarHBondContact NZ-OD2 2.75Å
253	I	72.4	Confident	68.4	Low	36 Å²	36	67.2 Å²	67.2	19%	0.185	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-117.4	4.1	-178.3	61.5	168.5	0	0	0	112.7	I40 I42 C250 E251 K255 I257	I40-I253 HydrophobicContact CG2-CB 4.17Å; I40-I253 HydrophobicContact CG2-CD1 3.77Å; I40-I253 HydrophobicContact CG2-CG2 4.02Å; I42-I253 HydrophobicContact CD1-CD1 3.58Å; C250-I253 HydrophobicContact CB-CD1 4.02Å; C250-I253 HydrophobicContact CB-CG1 3.66Å; C250-I253 PolarHBondContact O-N 2.79Å; E251-I253 PolarHBondContact O-N 2.93Å; E251-I253 VanDerWaalsContact O-N 3.12Å; I253-K255 VanDerWaalsContact C-N 3.25Å; I253-K255 HydrophobicContact CD1-CB 4.03Å; I253-K255 HydrophobicContact CG1-CB 4.1Å; I253-K255 WeakPolarHBondContact O-CG 3.44Å; I253-K255 PolarHBondContact O-N 2.82Å; I253-I257 HydrophobicContact CD1-CG2 3.99Å
254	E	77.6	Confident	68	Low	154 Å²	154	62.2 Å²	62.2	72%	0.72	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	43.4	-175.9	-59.6	-176.3	162.1	0	0	113.9	W249 C250 E251	W249-E254 WeakPolarHBondContact CH2-O 3.37Å; W249-E254 HydrophobicContact CZ2-CB 4.14Å; W249-E254 WeakPolarHBondContact CZ2-O 3.35Å; C250-E254 WeakPolarHBondContact O-CA 3.27Å; C250-E254 PolarHBondContact O-N 3.22Å; E251-E254 PolarHBondContact O-N 2.88Å
255	K	73.8	Confident	67.7	Low	74 Å²	74	62 Å²	62	32%	0.322	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	151.7	-175.8	-73.3	179.7	-171.5	-178.6	0	113.3	I40 C250 I253	I40-K255 HydrophobicContact CD1-CD 3.25Å; I40-K255 HydrophobicContact CG1-CD 3.99Å; C250-K255 PolarHBondContact N-O 3.37Å; C250-K255 PolarHBondContact O-N 3.17Å; I253-K255 VanDerWaalsContact C-N 3.25Å; I253-K255 HydrophobicContact CD1-CB 4.03Å; I253-K255 HydrophobicContact CG1-CB 4.1Å; I253-K255 WeakPolarHBondContact O-CG 3.44Å; I253-K255 PolarHBondContact O-N 2.82Å
256	C	75.1	Confident	67.4	Low	2 Å²	2	63.3 Å²	63.3	1%	0.014	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	123.6	175	-167	0	0	0	0	111.9	C228 Y231 C237 C247 W249	C228-C256 HydrophobicContact CB-CB 4.29Å; C228-C256 VanDerWaalsContact O-CB 3.27Å; C228-C256 WeakPolarHBondContact O-CB 3.28Å; C228-C256 PolarHBondContact O-SG 3.26Å; Y231-C256 VanDerWaalsContact O-CB 3.28Å; Y231-C256 WeakPolarHBondContact O-CB 3.4Å; C237-C256 WeakPolarHBondContact CA-SG 3.33Å; C237-C256 HydrophobicContact CB-CB 3.49Å; C237-C256 VanDerWaalsContact CB-CB 3.49Å; C237-C256 WeakPolarHBondContact CB-SG 3.1Å; C237-C256 WeakPolarHBondContact SG-CA 3.24Å; C237-C256 WeakPolarHBondContact SG-CB 3.17Å; C237-C256 CovalentContact SG-SG 2.01Å; C237-C256 PolarHBondContact SG-SG 3.25Å; C247-C256 VanDerWaalsContact CB-SG 3.57Å; W249-C256 HydrophobicContact CE3-CB 4.11Å; W249-C256 HydrophobicContact CZ3-CB 4.32Å
257	I	72.8	Confident	67	Low	8 Å²	8	60.4 Å²	60.4	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	162.9	-177.3	55.2	165.7	0	0	0	111.5	I52 C247 F248 C250 I253 T264 C267	I52-I257 HydrophobicContact CD1-CB 4.44Å; I52-I257 HydrophobicContact CD1-CG2 3.71Å; C247-I257 CarbonylContact C-O 3.51Å; C247-I257 WeakPolarHBondContact CA-O 3.21Å; F248-I257 HydrophobicContact CD1-CG1 3.99Å; F248-I257 WeakPolarHBondContact CD1-O 3.31Å; F248-I257 HydrophobicContact CD2-CG1 4.33Å; F248-I257 HydrophobicContact CE1-CB 4.42Å; F248-I257 HydrophobicContact CE1-CD1 3.59Å; F248-I257 HydrophobicContact CE1-CG1 3.44Å; F248-I257 VanDerWaalsContact CE1-CG1 3.44Å; F248-I257 HydrophobicContact CE2-CD1 3.71Å; F248-I257 HydrophobicContact CE2-CG1 3.83Å; F248-I257 HydrophobicContact CG-CG1 4.42Å; F248-I257 HydrophobicContact CZ-CD1 3.08Å; F248-I257 HydrophobicContact CZ-CG1 3.37Å; F248-I257 PolarHBondContact N-O 2.91Å; F248-I257 PolarHBondContact O-N 2.8Å; C250-I257 HydrophobicContact CB-CD1 3.72Å; C250-I257 HydrophobicContact CB-CG1 4Å; I253-I257 HydrophobicContact CD1-CG2 3.99Å; I257-T264 HydrophobicContact CD1-CG2 4.25Å; I257-C267 HydrophobicContact CD1-CB 4.41Å
258	I	71.1	Confident	66	Low	21 Å²	21	67.1 Å²	67.1	11%	0.108	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	128.1	-176.4	-64.4	165.9	0	0	0	109.8	I224 C228 L245 N260 L261	I224-I258 HydrophobicContact CB-CD1 4.39Å; C228-I258 HydrophobicContact CB-CG1 4.15Å; C228-I258 WeakPolarHBondContact SG-CG1 3.48Å; L245-I258 HydrophobicContact CD2-CD1 4.39Å; L245-I258 HydrophobicContact CD2-CG2 3.39Å; I258-N260 HydrophobicContact CG2-CB 4.28Å; I258-N260 PolarHBondContact O-N 2.92Å; I258-L261 PolarHBondContact O-N 2.8Å
259	S	64.1	Low	64.3	Low	23 Å²	23	71.6 Å²	71.6	16%	0.161	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-29.1	-177.3	63.7	0	0	0	0	115.2	T246 F248 L261	T246-S259 WeakPolarHBondContact CB-OG 3.43Å; T246-S259 WeakPolarHBondContact O-CB 3.39Å; T246-S259 PolarHBondContact O-N 2.85Å; T246-S259 PolarHBondContact O-OG 3.13Å; F248-S259 VanDerWaalsContact CD1-CA 3.46Å; S259-L261 PolarHBondContact O-N 2.78Å; S259-L261 VanDerWaalsContact O-N 3.09Å
260	N	57.6	Low	62.1	Low	111 Å²	111	77.3 Å²	77.3	59%	0.594	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-0.9	-178.9	-75.9	-10.3	0	0	0	113.6	N244 I258 Q262	N244-N260 PolarHBondContact O-ND2 3.28Å; I258-N260 HydrophobicContact CG2-CB 4.28Å; I258-N260 PolarHBondContact O-N 2.92Å; N260-Q262 PolarHBondContact O-N 2.86Å; N260-Q262 VanDerWaalsContact O-N 3.16Å
261	L	55.5	Low	60	Low	32 Å²	32	85.8 Å²	85.8	17%	0.168	40%	0.404	C	S	.	.			trans	-74.5	105.6	167.3	-66.6	169.8	0	0	0	107.8	Y50 I258 S259 H263 T264	Y50-L261 HydrophobicContact CE1-CD1 4.21Å; Y50-L261 WeakPolarHBondContact OH-CD1 3.41Å; Y50-L261 WeakPolarHBondContact OH-CD2 3.16Å; I258-L261 PolarHBondContact O-N 2.8Å; S259-L261 PolarHBondContact O-N 2.78Å; S259-L261 VanDerWaalsContact O-N 3.09Å; L261-H263 PolarHBondContact O-N 2.85Å; L261-T264 HydrophobicContact CB-CG2 3.85Å; L261-T264 WeakPolarHBondContact O-CB 3.49Å; L261-T264 WeakPolarHBondContact O-CG2 3.04Å; L261-T264 PolarHBondContact O-N 2.68Å; L261-T264 PolarHBondContact O-OG1 2.69Å
262	Q	51.8	Low	57.6	Low	164 Å²	164	85.6 Å²	85.6	77%	0.766	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-9.3	175.7	-155.8	157.1	3.2	0	0	113	N260 H265	N260-Q262 PolarHBondContact O-N 2.86Å; N260-Q262 VanDerWaalsContact O-N 3.16Å; Q262-H265 PolarHBondContact O-CD2 3.3Å
263	H	52.6	Low	55.6	Low	78 Å²	78	84.8 Å²	84.8	36%	0.361	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	19.3	-179	-58.5	-62	0	0	0	114.3	L261 H265	L261-H263 PolarHBondContact O-N 2.85Å; H263-H265 VanDerWaalsContact C-N 3.29Å; H263-H265 PolarHBondContact O-N 2.88Å
264	T	52.1	Low	53.5	Low	5 Å²	5	89.6 Å²	89.6	3%	0.031	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-89.2	8.8	-176.4	50.8	0	0	0	0	113.7	F248 I257 L261 D266 C267 R268	F248-T264 HydrophobicContact CE1-CG2 3.42Å; F248-T264 VanDerWaalsContact CE1-CG2 3.42Å; F248-T264 HydrophobicContact CE2-CG2 4.48Å; F248-T264 VanDerWaalsContact CZ-CB 3.42Å; F248-T264 HydrophobicContact CZ-CG2 3.23Å; I257-T264 HydrophobicContact CD1-CG2 4.25Å; L261-T264 HydrophobicContact CB-CG2 3.85Å; L261-T264 WeakPolarHBondContact O-CB 3.49Å; L261-T264 WeakPolarHBondContact O-CG2 3.04Å; L261-T264 PolarHBondContact O-N 2.68Å; L261-T264 PolarHBondContact O-OG1 2.69Å; T264-D266 VanDerWaalsContact C-N 3.27Å; T264-D266 PolarHBondContact O-N 2.85Å; T264-C267 CarbonylContact O-C 3.5Å; T264-C267 PolarHBondContact O-N 3.06Å; T264-R268 WeakPolarHBondContact O-CG 3.12Å; T264-R268 PolarHBondContact O-N 3.27Å
265	H	50.1	Low	51.3	Low	139 Å²	139	88 Å²	88	64%	0.644	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-54.8	-38.5	178.6	-74.4	-74.6	0	0	0	113.2	Q262 H263 C267 R268	Q262-H265 PolarHBondContact O-CD2 3.3Å; H263-H265 VanDerWaalsContact C-N 3.29Å; H263-H265 PolarHBondContact O-N 2.88Å; H265-C267 VanDerWaalsContact C-N 3.32Å; H265-C267 PolarHBondContact O-N 2.83Å; H265-R268 PolarHBondContact O-N 2.83Å
266	D	55	Low	49.3	Very low	77 Å²	77	90.9 Å²	90.9	41%	0.412	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-80.5	-12.7	-179.6	-160.7	33.4	0	0	0	113.5	K252 T264	K252-D266 IonicContact NZ-OD1 2.62Å; K252-D266 IonicContact NZ-OD2 3.18Å; K252-D266 PolarHBondContact NZ-OD2 2.75Å; T264-D266 VanDerWaalsContact C-N 3.27Å; T264-D266 PolarHBondContact O-N 2.85Å
267	C	60.7	Low	47.3	Very low	16 Å²	16	97.5 Å²	97.5	11%	0.108	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-97.4	-10.1	169.3	-74.8	0	0	0	0	112.6	F248 C250 I257 T264 H265 I269	F248-C267 HydrophobicContact CE2-CB 3.78Å; F248-C267 HydrophobicContact CZ-CB 4.14Å; C250-C267 HydrophobicContact CB-CB 3.7Å; C250-C267 WeakPolarHBondContact CB-SG 3.48Å; C250-C267 WeakPolarHBondContact SG-CB 3.49Å; C250-C267 CovalentContact SG-SG 2.04Å; C250-C267 PolarHBondContact SG-SG 2.73Å; I257-C267 HydrophobicContact CD1-CB 4.41Å; T264-C267 CarbonylContact O-C 3.5Å; T264-C267 PolarHBondContact O-N 3.06Å; H265-C267 VanDerWaalsContact C-N 3.32Å; H265-C267 PolarHBondContact O-N 2.83Å; C267-I269 PolarHBondContact O-N 3.48Å
268	R	52.8	Low	45.2	Very low	146 Å²	146	103.9 Å²	103.9	55%	0.551	54%	0.536	S	S	*	.			trans	-91.9	80.2	173.8	-74.2	-179.1	-172.9	-173.7	1.8	108.1	T264 H265 E270	T264-R268 WeakPolarHBondContact O-CG 3.12Å; T264-R268 PolarHBondContact O-N 3.27Å; H265-R268 PolarHBondContact O-N 2.83Å; R268-E270 PolarHBondContact O-N 2.88Å
269	I	42.6	Very low	43.2	Very low	130 Å²	130	109.9 Å²	109.9	67%	0.667	57%	0.568	S	S	*	*			trans	-71	108.2	157.6	-59.2	176.2	0	0	0	104.8	C267 K271	C267-I269 PolarHBondContact O-N 3.48Å; I269-K271 PolarHBondContact O-N 3.27Å
270	E	35.5	Very low	41.7	Very low	161 Å²	161	114.1 Å²	114.1	75%	0.752	60%	0.598	S	S	*	*			trans	-51.1	115.9	167.2	-74.9	-177.4	161.4	0	0	107.5	R268 T272	R268-E270 PolarHBondContact O-N 2.88Å; E270-T272 PolarHBondContact O-N 2.99Å
271	K	31.2	Very low	40.2	Very low	179 Å²	179	113.7 Å²	113.7	78%	0.778	60%	0.604	S	S	*	*			trans	-66.3	86.7	158.5	-81.9	-175	176.3	-179.4	0	106.4	I269 S273	I269-K271 PolarHBondContact O-N 3.27Å; K271-S273 PolarHBondContact O-N 2.97Å
272	T	28.6	Very low	39	Very low	110 Å²	110	118.8 Å²	118.8	68%	0.675	64%	0.636	S	S	*	*			trans	-57.8	96.2	151.2	43.5	0	0	0	0	106	E270 D274	E270-T272 PolarHBondContact O-N 2.99Å; T272-D274 VanDerWaalsContact C-N 3.28Å; T272-D274 PolarHBondContact O-N 2.77Å
273	S	34	Very low	37.8	Very low	114 Å²	114	116.7 Å²	116.7	80%	0.797	64%	0.635	S	S	*	*			trans	-76.9	93.7	161.3	25.7	0	0	0	0	105.5	K271	K271-S273 PolarHBondContact O-N 2.97Å
274	D	29.4	Very low	36.7	Very low	138 Å²	138	118.3 Å²	118.3	74%	0.738	65%	0.65	S	S	*	*			trans	-55.9	151.6	150.1	-76	-46.8	0	0	0	109	T272	T272-D274 VanDerWaalsContact C-N 3.28Å; T272-D274 PolarHBondContact O-N 2.77Å
275	V	31.3	Very low	35.7	Very low	119 Å²	119	126.7 Å²	126.7	72%	0.721	69%	0.689	S	S	*	*			trans	113.9	101.5	162.1	-173	0	0	0	0	115.1
276	N	30.8	Very low	34.6	Very low	135 Å²	135	129.5 Å²	129.5	72%	0.722	70%	0.702	S	S	*	*			trans	77.7	116.7	152.8	-57.4	-9.1	0	0	0	115.1
277	D	32.7	Very low	33.3	Very low	142 Å²	142	129.5 Å²	129.5	76%	0.759	72%	0.72	S	S	*	*				-176.1	144.1	54.7	-98	-37	0	0	0	110.6
278	L	30.1	Very low	31.7	Very low	141 Å²	141	137.6 Å²	137.6	74%	0.738	76%	0.757	S	S	*	*			trans	24.8	124.5	154.6	-88.8	76.3	0	0	0	122.5
279	N	29.7	Very low	30.6	Very low	147 Å²	147	136.5 Å²	136.5	79%	0.786	77%	0.766	S	S	*	*			trans	61.1	103.6	132.3	-69	-6.4	0	0	0	119.2
280	S	30.9	Very low	29.7	Very low	113 Å²	113	136.2 Å²	136.2	79%	0.79	77%	0.77	S	S	*	*				167.5	111.5	101.9	-178.6	0	0	0	0	109.6
281	S	27.8	Very low	29.3	Very low	102 Å²	102	134.4 Å²	134.4	71%	0.713	78%	0.776	S	S	*	*			trans	-52.6	140.3	165.5	52.7	0	0	0	0	112.1
282	T	30.3	Very low	29.1	Very low	138 Å²	138	128.8 Å²	128.8	85%	0.847	77%	0.769	S	S	*	*				-160.3	127.7	120.9	-47.9	0	0	0	0	110.3
283	T	25.4	Very low	29	Very low	121 Å²	121	131.1 Å²	131.1	74%	0.742	78%	0.775	S	S	*	*			trans	-57	158.7	173.9	-35.5	0	0	0	0	113.6
284	T	30.1	Very low	28.8	Very low	111 Å²	111	131.7 Å²	131.7	68%	0.681	77%	0.774	S	S	*	*				150.6	115.6	118.5	-47.7	0	0	0	0	113.9
285	E	30.1	Very low	28.7	Very low	181 Å²	181	133.9 Å²	133.9	85%	0.846	78%	0.78	S	S	*	*			trans	47.1	131.3	144.1	-61.9	-177.2	146.1	0	0	125.9
286	H	26.7	Very low	28.5	Very low	199 Å²	199	134.5 Å²	134.5	92%	0.921	78%	0.784	S	S	*	*			trans	12.1	136.6	136.2	-93	-23.4	0	0	0	122.1
287	G	29.2	Very low	28.3	Very low	77 Å²	77	137.3 Å²	137.3	79%	0.794	79%	0.792	S	S	*	*			trans	180	120.9	153.3	0	0	0	0	0	112.6
288	E	26.5	Very low	28.2	Very low	186 Å²	186	136.7 Å²	136.7	87%	0.869	79%	0.794	S	S	*	*			trans	-64.1	163.8	-178.6	-62.7	168	131.6	0	0	114.8
289	T	28.7	Very low	28.1	Very low	123 Å²	123	135 Å²	135	76%	0.755	79%	0.794	S	S	*	*				137.8	106.4	129	-54.3	0	0	0	0	115
290	T	25.3	Very low	28.3	Very low	123 Å²	123	137 Å²	137	76%	0.755	80%	0.798	S	S	*	*				34.2	142.3	124.1	-45.7	0	0	0	0	123.2
291	S	27.1	Very low	28.2	Very low	123 Å²	123	138.6 Å²	138.6	86%	0.86	80%	0.798	S	S	*	*			trans	76.2	137.4	163	-73.6	0	0	0	0	116.4
292	G	26.1	Very low	28.3	Very low	61 Å²	61	141.8 Å²	141.8	63%	0.629	81%	0.806	S	S	*	*			cis	164.2	160.7	4.3	0	0	0	0	0	108.3
293	I	27.7	Very low	28.3	Very low	160 Å²	160	144 Å²	144	82%	0.821	81%	0.809	S	S	*	*			trans	70.8	123.3	158	-33.2	-179.8	0	0	0	118
294	T	29.7	Very low	28.5	Very low	126 Å²	126	147.4 Å²	147.4	77%	0.773	81%	0.813	S	S	*	*				148.3	131.8	108.8	-36.4	0	0	0	0	113
295	E	25.9	Very low	28.6	Very low	184 Å²	184	148.2 Å²	148.2	86%	0.86	82%	0.819	S	S	*	*			trans	-64.3	149.2	169	-63.7	172.8	132.5	0	0	113.3
296	V	28.5	Very low	28.6	Very low	132 Å²	132	145.2 Å²	145.2	80%	0.8	81%	0.813	S	S	*	*			trans	-146	122	155.6	-179.7	0	0	0	0	110.3	V298	V296-V298 HydrophobicContact CG1-CG2 4.14Å
297	Q	26.7	Very low	28.8	Very low	193 Å²	193	144.4 Å²	144.4	90%	0.902	81%	0.809	S	S	*	*			trans	-84.4	145.7	162.2	-73	-171.1	-33.1	0	0	110.4
298	V	30.2	Very low	29.1	Very low	130 Å²	130	150.1 Å²	150.1	79%	0.788	82%	0.815	S	S	*	*			trans	-136.1	123.6	164.2	178.2	0	0	0	0	110	V296	V296-V298 HydrophobicContact CG1-CG2 4.14Å
299	S	27.5	Very low	29.2	Very low	105 Å²	105	146.1 Å²	146.1	73%	0.734	80%	0.804	S	S	*	*			trans	-100.9	147	166.4	63.4	0	0	0	0	110.1
300	E	34.3	Very low	29.5	Very low	189 Å²	189	147 Å²	147	88%	0.883	80%	0.804	S	S	*	*			trans	-152.7	150.9	156.4	-132.2	173.5	-177.9	0	0	114
301	N	28.6	Very low	30.1	Very low	147 Å²	147	149.6 Å²	149.6	79%	0.786	81%	0.805	S	S	*	*			trans	-101.5	162.2	-156.7	-62.3	-59.7	0	0	0	114.6
302	L	29.1	Very low	30.6	Very low	168 Å²	168	152.3 Å²	152.3	88%	0.88	80%	0.804	S	S	*	*			trans	-169.1	102	145.1	-144	72	0	0	0	110.5
303	M	31.7	Very low	31.2	Very low	184 Å²	184	154 Å²	154	91%	0.906	81%	0.806	S	S	*	*				94.2	125.5	76.8	-153.6	175.2	170.7	0	0	115.5
304	K	29.4	Very low	31.7	Very low	193 Å²	193	155.1 Å²	155.1	84%	0.839	80%	0.801	S	S	*	*			trans	-75.3	162.2	-177	-80.6	174.6	167.3	178.7	0	115
305	T	31.2	Very low	32.1	Very low	129 Å²	129	156.1 Å²	156.1	79%	0.791	80%	0.799	S	S	*	*			trans	-167.3	108.1	138.4	-60.1	0	0	0	0	109
306	T	30.8	Very low	32.8	Very low	118 Å²	118	152 Å²	152	72%	0.724	79%	0.786	S	S	*	*				74.2	105	98.5	-37.3	0	0	0	0	114
307	E	30.5	Very low	33.4	Very low	181 Å²	181	152 Å²	152	85%	0.846	79%	0.787	S	S	*	*				75.5	104.3	80.4	-145.8	175.8	-130.7	0	0	114.4
308	E	35.1	Very low	34	Very low	197 Å²	197	153.2 Å²	153.2	92%	0.921	78%	0.783	S	S	*	*			trans	-150.6	146.8	161	-110.2	-166.7	177.1	0	0	110.4
309	T	28.4	Very low	34.5	Very low	102 Å²	102	150.1 Å²	150.1	63%	0.626	76%	0.764	S	S	*	*			trans	-118.1	154.8	-139.1	-19.8	0	0	0	0	112.9	K311	T309-K311 PolarHBondContact O-N 3.1Å
310	D	35.3	Very low	35.3	Very low	141 Å²	141	149.9 Å²	149.9	75%	0.754	76%	0.759	S	S	*	*			trans	45.8	51.2	138.2	-62.8	-19.6	0	0	0	121.4
311	K	38.9	Very low	35.8	Very low	178 Å²	178	149 Å²	149	77%	0.774	75%	0.754	S	S	*	*			trans	-118.3	6.6	168.4	-82	-178.6	179.3	169.8	0	116.3	T309 S313	T309-K311 PolarHBondContact O-N 3.1Å; K311-S313 PolarHBondContact O-N 3.16Å
312	Q	36.3	Very low	36.7	Very low	180 Å²	180	148.6 Å²	148.6	84%	0.841	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-5.5	-161	-154	156.4	-0.4	0	0	116.1
313	S	38.6	Very low	37.5	Very low	96 Å²	96	145.1 Å²	145.1	67%	0.671	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-12.6	-171.2	-174.9	0	0	0	0	115.8	K311	K311-S313 PolarHBondContact O-N 3.16Å
314	Y	38.6	Very low	38.2	Very low	184 Å²	184	144.6 Å²	144.6	72%	0.722	72%	0.723	S	S	*	*	S	Bend	trans	-109.6	-2.3	-169.4	-22.3	-81.3	0	0	0	114.2
315	M	39.4	Very low	39.1	Very low	148 Å²	148	142.2 Å²	142.2	73%	0.729	72%	0.715	S	S	*	*	S	Bend	trans	-91.3	-11.3	-178.2	-102.9	-150	-173.2	0	0	114.6	T317	M315-T317 VanDerWaalsContact C-N 3.34Å; M315-T317 PolarHBondContact O-N 2.84Å
316	T	39.8	Very low	40.2	Very low	97 Å²	97	142.3 Å²	142.3	60%	0.595	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-18.7	-162.6	-47.6	0	0	0	0	114.5	T319	T316-T319 PolarHBondContact O-OG1 3.4Å
317	T	40.2	Very low	41.2	Very low	132 Å²	132	143.4 Å²	143.4	81%	0.81	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-23.9	-175.2	-30.1	0	0	0	0	113.4	M315	M315-T317 VanDerWaalsContact C-N 3.34Å; M315-T317 PolarHBondContact O-N 2.84Å
318	R	39.4	Very low	42.5	Very low	218 Å²	218	138.1 Å²	138.1	82%	0.823	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-18.1	-176.8	-146.4	174.2	-176.3	152.2	0.6	113.5	T320	R318-T320 VanDerWaalsContact C-N 3.33Å; R318-T320 PolarHBondContact O-N 3.18Å
319	T	41.9	Very low	43.6	Very low	65 Å²	65	133.6 Å²	133.6	40%	0.399	66%	0.662	S	S	.	*	H	α-helix	trans	-76.4	-12.7	-177.2	41.8	0	0	0	0	114.5	T316 N323	T316-T319 PolarHBondContact O-OG1 3.4Å; T319-N323 VanDerWaalsContact O-CB 3.26Å; T319-N323 WeakPolarHBondContact O-CB 3.32Å; T319-N323 PolarHBondContact O-N 3.2Å
320	T	43.5	Very low	45.4	Very low	100 Å²	100	134.5 Å²	134.5	61%	0.613	65%	0.654	S	S	*	*	H	α-helix	trans	-77.9	-29.4	-173.6	-47.1	0	0	0	0	113.3	R318	R318-T320 VanDerWaalsContact C-N 3.33Å; R318-T320 PolarHBondContact O-N 3.18Å
321	E	45.1	Very low	46.9	Very low	170 Å²	170	134.8 Å²	134.8	79%	0.794	65%	0.646	S	S	*	*	H	α-helix	trans	-83.3	-40.3	176.9	-76.9	-170.6	149.3	0	0	113	N323 K324	E321-N323 VanDerWaalsContact C-N 3.27Å; E321-N323 PolarHBondContact O-N 3.04Å; E321-K324 PolarHBondContact O-N 3.28Å
322	E	46.6	Very low	48.5	Very low	140 Å²	140	130.9 Å²	130.9	65%	0.654	63%	0.633	S	S	*	*	H	α-helix	trans	-63.7	-31.9	176.4	-72.4	-177.1	159.6	0	0	112.6	K324 Q325 H326	E322-K324 VanDerWaalsContact C-N 3.31Å; E322-K324 PolarHBondContact O-N 3.46Å; E322-Q325 PolarHBondContact O-N 2.98Å; E322-H326 PolarHBondContact O-N 3.31Å
323	N	47.1	Very low	50.2	Low	95 Å²	95	129.9 Å²	129.9	51%	0.508	62%	0.623	S	S	.	*	H	α-helix	trans	-69.9	-24.7	-178.5	-155.3	-13.2	0	0	0	112.9	T319 E321 K327	T319-N323 VanDerWaalsContact O-CB 3.26Å; T319-N323 WeakPolarHBondContact O-CB 3.32Å; T319-N323 PolarHBondContact O-N 3.2Å; E321-N323 VanDerWaalsContact C-N 3.27Å; E321-N323 PolarHBondContact O-N 3.04Å; N323-K327 WeakPolarHBondContact O-CB 3.35Å; N323-K327 PolarHBondContact O-N 3.28Å
324	K	46.7	Very low	51.9	Low	173 Å²	173	126.9 Å²	126.9	75%	0.752	60%	0.6	S	S	*	*	H	α-helix	trans	-71.1	-41.3	172.7	-85.7	-176.2	178.1	176.1	0	111.9	E321 E322 S328	E321-K324 PolarHBondContact O-N 3.28Å; E322-K324 VanDerWaalsContact C-N 3.31Å; E322-K324 PolarHBondContact O-N 3.46Å; K324-S328 PolarHBondContact O-N 2.88Å
325	Q	48.6	Very low	53.6	Low	142 Å²	142	119.6 Å²	119.6	66%	0.664	58%	0.575	S	S	*	*	H	α-helix	trans	-72.4	-38.4	-179.3	-158.3	171.8	-1.6	0	0	111.4	E322 K327 S328 H329	E322-Q325 PolarHBondContact O-N 2.98Å; Q325-K327 PolarHBondContact O-N 2.85Å; Q325-S328 PolarHBondContact O-N 3.24Å; Q325-H329 PolarHBondContact O-N 2.84Å
326	H	52.5	Low	55.4	Low	132 Å²	132	116.9 Å²	116.9	61%	0.611	56%	0.562	S	S	*	*	H	α-helix	trans	-68.5	-33.1	176.6	-160	-48.8	0	0	0	113.1	E322 W330	E322-H326 PolarHBondContact O-N 3.31Å; H326-W330 WeakPolarHBondContact O-CB 3.16Å; H326-W330 PolarHBondContact O-N 2.91Å
327	K	52.3	Low	57.4	Low	141 Å²	141	115.5 Å²	115.5	61%	0.613	56%	0.555	S	S	*	*	H	α-helix	trans	-64.5	-39.1	174.5	-96.5	-178.4	176.6	177.1	0	112.8	N323 Q325 W330 Y331	N323-K327 WeakPolarHBondContact O-CB 3.35Å; N323-K327 PolarHBondContact O-N 3.28Å; Q325-K327 PolarHBondContact O-N 2.85Å; K327-W330 PolarHBondContact O-N 2.9Å; K327-Y331 PolarHBondContact O-N 3.12Å; K327-Y331 VanDerWaalsContact O-N 3.12Å
328	S	58.2	Low	59.3	Low	69 Å²	69	112.7 Å²	112.7	48%	0.483	53%	0.534	S	S	.	.	H	α-helix	trans	-64.7	-47.2	179.2	177.9	0	0	0	0	111.7	K324 Q325 W330 Y331 L332	K324-S328 PolarHBondContact O-N 2.88Å; Q325-S328 PolarHBondContact O-N 3.24Å; S328-W330 PolarHBondContact O-N 3.47Å; S328-Y331 PolarHBondContact O-N 2.87Å; S328-L332 PolarHBondContact O-N 2.94Å; S328-L332 VanDerWaalsContact O-N 3.16Å
329	H	58.1	Low	61.4	Low	102 Å²	102	105.3 Å²	105.3	47%	0.472	51%	0.513	S	S	.	.	H	α-helix	trans	-65.5	-39.6	177.6	-81.2	-112.6	0	0	0	112.3	Q325 Y331 L332 Y333	Q325-H329 PolarHBondContact O-N 2.84Å; H329-Y331 VanDerWaalsContact C-N 3.33Å; H329-Y331 PolarHBondContact O-N 3.19Å; H329-L332 PolarHBondContact O-N 2.78Å; H329-Y333 HydrophobicContact CB-CD2 4.4Å; H329-Y333 AromaticContact ND1-CE2 3.78Å; H329-Y333 VanDerWaalsContact O-CD2 3.28Å; H329-Y333 WeakPolarHBondContact O-CD2 3.19Å; H329-Y333 PolarHBondContact O-N 3.4Å
330	W	65.7	Low	63.4	Low	121 Å²	121	104.5 Å²	104.5	46%	0.458	51%	0.513	S	S	.	.	H	α-helix	trans	-62.1	-40.6	177.2	-178.6	75.3	0	0	0	112.2	H326 K327 S328 V334 V335	H326-W330 WeakPolarHBondContact O-CB 3.16Å; H326-W330 PolarHBondContact O-N 2.91Å; K327-W330 PolarHBondContact O-N 2.9Å; S328-W330 PolarHBondContact O-N 3.47Å; W330-V334 HydrophobicContact CG-CG2 4.44Å; W330-V334 VanDerWaalsContact O-CB 3.23Å; W330-V334 WeakPolarHBondContact O-CB 3.39Å; W330-V334 PolarHBondContact O-N 3.35Å; W330-V335 HydrophobicContact CE3-CG2 4.16Å; W330-V335 HydrophobicContact CH2-CG2 4.05Å; W330-V335 HydrophobicContact CZ3-CG2 3.86Å
331	Y	68	Low	65.3	Low	147 Å²	147	102.3 Å²	102.3	58%	0.576	50%	0.502	S	S	*	.	I	π-helix	trans	-65.1	-43.1	177.8	-151.4	-92.8	0	0	0	111.9	K327 S328 H329 V335 I336	K327-Y331 PolarHBondContact O-N 3.12Å; K327-Y331 VanDerWaalsContact O-N 3.12Å; S328-Y331 PolarHBondContact O-N 2.87Å; H329-Y331 VanDerWaalsContact C-N 3.33Å; H329-Y331 PolarHBondContact O-N 3.19Å; Y331-V335 HydrophobicContact CD1-CB 4.44Å; Y331-V335 HydrophobicContact CD2-CB 4.19Å; Y331-V335 HydrophobicContact CD2-CG1 4.42Å; Y331-V335 HydrophobicContact CD2-CG2 3.87Å; Y331-V335 HydrophobicContact CE1-CG1 4.34Å; Y331-V335 HydrophobicContact CE2-CB 4.34Å; Y331-V335 HydrophobicContact CE2-CG1 4.07Å; Y331-V335 HydrophobicContact CE2-CG2 4.21Å; Y331-V335 HydrophobicContact CG-CB 4.25Å; Y331-V335 HydrophobicContact CG-CG2 4.26Å; Y331-V335 WeakPolarHBondContact O-CB 3.35Å; Y331-V335 PolarHBondContact O-N 3.1Å; Y331-I336 PolarHBondContact O-N 2.65Å
332	L	71.6	Confident	67.2	Low	97 Å²	97	98.2 Å²	98.2	51%	0.508	49%	0.485	S	S	.	.	I	π-helix	trans	-71.7	-39.6	-175.2	-135.7	150.9	0	0	0	112.7	S328 H329 I336	S328-L332 PolarHBondContact O-N 2.94Å; S328-L332 VanDerWaalsContact O-N 3.16Å; H329-L332 PolarHBondContact O-N 2.78Å; L332-I336 HydrophobicContact CD2-CD1 4.44Å; L332-I336 HydrophobicContact CG-CD1 4.14Å
333	Y	72.9	Confident	69	Low	159 Å²	159	98.1 Å²	98.1	62%	0.624	48%	0.483	S	S	*	.	I	π-helix	trans	-97.5	-17.5	-175.7	-67.6	-74.9	0	0	0	115.1	H329 P337	H329-Y333 HydrophobicContact CB-CD2 4.4Å; H329-Y333 AromaticContact ND1-CE2 3.78Å; H329-Y333 VanDerWaalsContact O-CD2 3.28Å; H329-Y333 WeakPolarHBondContact O-CD2 3.19Å; H329-Y333 PolarHBondContact O-N 3.4Å; Y333-P337 WeakPolarHBondContact O-CG 3.43Å
334	V	73.6	Confident	70.8	Confident	33 Å²	33	99.5 Å²	99.5	20%	0.2	49%	0.49	C	S	.	.	I	π-helix	trans	-113.3	-50.1	-178.6	-173.7	0	0	0	0	111.6	W330 I338	W330-V334 HydrophobicContact CG-CG2 4.44Å; W330-V334 VanDerWaalsContact O-CB 3.23Å; W330-V334 WeakPolarHBondContact O-CB 3.39Å; W330-V334 PolarHBondContact O-N 3.35Å; V334-I338 HydrophobicContact CG1-CD1 3.77Å; V334-I338 VanDerWaalsContact O-CD1 3.32Å; V334-I338 WeakPolarHBondContact O-CD1 3.49Å; V334-I338 WeakPolarHBondContact O-CG1 3.27Å; V334-I338 PolarHBondContact O-N 3.35Å
335	V	73.9	Confident	72.7	Confident	31 Å²	31	96.4 Å²	96.4	19%	0.188	48%	0.48	C	S	.	.	I	π-helix	trans	-72.1	-44.8	-173.8	-178.1	0	0	0	0	111.4	W330 Y331 I338 V339	W330-V335 HydrophobicContact CE3-CG2 4.16Å; W330-V335 HydrophobicContact CH2-CG2 4.05Å; W330-V335 HydrophobicContact CZ3-CG2 3.86Å; Y331-V335 HydrophobicContact CD1-CB 4.44Å; Y331-V335 HydrophobicContact CD2-CB 4.19Å; Y331-V335 HydrophobicContact CD2-CG1 4.42Å; Y331-V335 HydrophobicContact CD2-CG2 3.87Å; Y331-V335 HydrophobicContact CE1-CG1 4.34Å; Y331-V335 HydrophobicContact CE2-CB 4.34Å; Y331-V335 HydrophobicContact CE2-CG1 4.07Å; Y331-V335 HydrophobicContact CE2-CG2 4.21Å; Y331-V335 HydrophobicContact CG-CB 4.25Å; Y331-V335 HydrophobicContact CG-CG2 4.26Å; Y331-V335 WeakPolarHBondContact O-CB 3.35Å; Y331-V335 PolarHBondContact O-N 3.1Å; V335-I338 PolarHBondContact O-N 2.94Å; V335-V339 HydrophobicContact CG1-CG2 4.19Å; V335-V339 VanDerWaalsContact O-CG2 3.31Å; V335-V339 WeakPolarHBondContact O-CG2 3.43Å; V335-V339 PolarHBondContact O-N 3.12Å
336	I	78.1	Confident	74.5	Confident	90 Å²	90	93 Å²	93	46%	0.462	47%	0.471	S	S	.	.	H	α-helix	trans	-61.1	-48.8	-178.9	-62.1	175.9	0	0	0	112.1	Y331 L332 I338 V339 A340	Y331-I336 PolarHBondContact O-N 2.65Å; L332-I336 HydrophobicContact CD2-CD1 4.44Å; L332-I336 HydrophobicContact CG-CD1 4.14Å; I336-I338 VanDerWaalsContact C-N 3.34Å; I336-I338 PolarHBondContact O-N 3.32Å; I336-V339 PolarHBondContact O-N 3.16Å; I336-A340 WeakPolarHBondContact O-CB 3.36Å; I336-A340 PolarHBondContact O-N 2.77Å
337	P	81.7	Confident	76.2	Confident	68 Å²	68	91 Å²	91	44%	0.442	46%	0.464	S	S	.	.	H	α-helix	trans	-64	-36.3	177.8	-25.2	37	0	0	0	113.4	Y333 A340 S341	Y333-P337 WeakPolarHBondContact O-CG 3.43Å; P337-A340 PolarHBondContact O-N 2.88Å; P337-S341 WeakPolarHBondContact O-CB 3.31Å; P337-S341 PolarHBondContact O-N 3.01Å
338	I	80.3	Confident	77.8	Confident	73 Å²	73	86.2 Å²	86.2	37%	0.374	45%	0.454	S	S	.	.	H	α-helix	trans	-63.3	-48.8	176.1	-70	170.3	0	0	0	110.1	V334 V335 I336 A340 S341 L342	V334-I338 HydrophobicContact CG1-CD1 3.77Å; V334-I338 VanDerWaalsContact O-CD1 3.32Å; V334-I338 WeakPolarHBondContact O-CD1 3.49Å; V334-I338 WeakPolarHBondContact O-CG1 3.27Å; V334-I338 PolarHBondContact O-N 3.35Å; V335-I338 PolarHBondContact O-N 2.94Å; I336-I338 VanDerWaalsContact C-N 3.34Å; I336-I338 PolarHBondContact O-N 3.32Å; I338-A340 VanDerWaalsContact C-N 3.35Å; I338-A340 PolarHBondContact O-N 2.84Å; I338-S341 PolarHBondContact O-N 2.84Å; I338-S341 PolarHBondContact O-OG 3.44Å; I338-L342 HydrophobicContact CG2-CD1 4.18Å; I338-L342 WeakPolarHBondContact O-CG 3.35Å; I338-L342 PolarHBondContact O-N 3.21Å
339	V	83.1	Confident	79	Confident	64 Å²	64	86.2 Å²	86.2	39%	0.388	45%	0.454	S	S	.	.	H	α-helix	trans	-61.2	-44.7	178.4	173.5	0	0	0	0	110.7	V335 I336 S341 L342 F343	V335-V339 HydrophobicContact CG1-CG2 4.19Å; V335-V339 VanDerWaalsContact O-CG2 3.31Å; V335-V339 WeakPolarHBondContact O-CG2 3.43Å; V335-V339 PolarHBondContact O-N 3.12Å; I336-V339 PolarHBondContact O-N 3.16Å; V339-S341 VanDerWaalsContact C-N 3.34Å; V339-S341 PolarHBondContact O-N 2.63Å; V339-L342 PolarHBondContact O-N 3.01Å; V339-F343 HydrophobicContact CG1-CD2 3.75Å; V339-F343 HydrophobicContact CG1-CE2 3.53Å; V339-F343 WeakPolarHBondContact O-CD2 3.4Å; V339-F343 PolarHBondContact O-N 3.02Å
340	A	83.1	Confident	80.3	Confident	48 Å²	48	87 Å²	87	40%	0.397	46%	0.46	S	S	.	.	H	α-helix	trans	-60.1	-41.8	175.4	0	0	0	0	0	112.4	I336 P337 I338 L342 F343 L344	I336-A340 WeakPolarHBondContact O-CB 3.36Å; I336-A340 PolarHBondContact O-N 2.77Å; P337-A340 PolarHBondContact O-N 2.88Å; I338-A340 VanDerWaalsContact C-N 3.35Å; I338-A340 PolarHBondContact O-N 2.84Å; A340-L342 VanDerWaalsContact C-N 3.35Å; A340-L342 PolarHBondContact O-N 2.84Å; A340-F343 PolarHBondContact O-N 3.15Å; A340-L344 WeakPolarHBondContact O-CG 3.4Å; A340-L344 PolarHBondContact O-N 2.8Å
341	S	83.2	Confident	81.2	Confident	53 Å²	53	85.6 Å²	85.6	37%	0.371	46%	0.461	S	S	.	.	H	α-helix	trans	-63.8	-39.1	176.8	77.2	0	0	0	0	112.2	P337 I338 V339 L344 I345	P337-S341 WeakPolarHBondContact O-CB 3.31Å; P337-S341 PolarHBondContact O-N 3.01Å; I338-S341 PolarHBondContact O-N 2.84Å; I338-S341 PolarHBondContact O-OG 3.44Å; V339-S341 VanDerWaalsContact C-N 3.34Å; V339-S341 PolarHBondContact O-N 2.63Å; S341-L344 PolarHBondContact O-N 2.88Å; S341-I345 VanDerWaalsContact O-CG1 3.27Å; S341-I345 WeakPolarHBondContact O-CG1 3.45Å; S341-I345 PolarHBondContact O-N 2.87Å
342	L	85.9	Confident	81.9	Confident	85 Å²	85	87 Å²	87	45%	0.445	47%	0.465	S	S	.	.	H	α-helix	trans	-65.7	-39.5	176.1	-70.5	171.7	0	0	0	111.4	I338 V339 A340 I345 C346	I338-L342 HydrophobicContact CG2-CD1 4.18Å; I338-L342 WeakPolarHBondContact O-CG 3.35Å; I338-L342 PolarHBondContact O-N 3.21Å; V339-L342 PolarHBondContact O-N 3.01Å; A340-L342 VanDerWaalsContact C-N 3.35Å; A340-L342 PolarHBondContact O-N 2.84Å; L342-I345 PolarHBondContact O-N 3.22Å; L342-C346 WeakPolarHBondContact O-CB 3.47Å; L342-C346 PolarHBondContact O-N 2.8Å; L342-C346 PolarHBondContact O-SG 3.29Å
343	F	84.5	Confident	82.4	Confident	137 Å²	137	90.6 Å²	90.6	60%	0.601	47%	0.472	S	S	*	.	H	α-helix	trans	-63	-44	174	-84.5	-71.8	0	0	0	112.1	V339 A340 I345 C346 I347	V339-F343 HydrophobicContact CG1-CD2 3.75Å; V339-F343 HydrophobicContact CG1-CE2 3.53Å; V339-F343 WeakPolarHBondContact O-CD2 3.4Å; V339-F343 PolarHBondContact O-N 3.02Å; A340-F343 PolarHBondContact O-N 3.15Å; F343-I345 PolarHBondContact O-N 2.8Å; F343-C346 PolarHBondContact O-N 3.34Å; F343-I347 VanDerWaalsContact O-CG1 3.27Å; F343-I347 WeakPolarHBondContact O-CG1 2.95Å; F343-I347 PolarHBondContact O-N 3.27Å
344	L	85.4	Confident	82.8	Confident	125 Å²	125	90.3 Å²	90.3	65%	0.654	47%	0.47	S	S	*	.	H	α-helix	trans	-63.3	-41.7	177.2	-70.5	173.4	0	0	0	112.3	A340 S341 I347 G348	A340-L344 WeakPolarHBondContact O-CG 3.4Å; A340-L344 PolarHBondContact O-N 2.8Å; S341-L344 PolarHBondContact O-N 2.88Å; L344-I347 PolarHBondContact O-N 2.91Å; L344-G348 PolarHBondContact O-N 3.26Å
345	I	86.9	Confident	83.1	Confident	107 Å²	107	93.3 Å²	93.3	55%	0.549	48%	0.484	S	S	.	.	H	α-helix	trans	-63.5	-42.7	175.5	-67.6	165.4	0	0	0	110.7	S341 L342 F343 G348 C349	S341-I345 VanDerWaalsContact O-CG1 3.27Å; S341-I345 WeakPolarHBondContact O-CG1 3.45Å; S341-I345 PolarHBondContact O-N 2.87Å; L342-I345 PolarHBondContact O-N 3.22Å; F343-I345 PolarHBondContact O-N 2.8Å; I345-G348 PolarHBondContact O-N 2.84Å; I345-C349 WeakPolarHBondContact O-CB 3.45Å; I345-C349 PolarHBondContact O-N 3.03Å; I345-C349 PolarHBondContact O-SG 2.66Å
346	C	85.1	Confident	83.2	Confident	71 Å²	71	97 Å²	97	48%	0.48	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-45	176.3	-78.2	0	0	0	0	112	L342 F343 C349 I350	L342-C346 WeakPolarHBondContact O-CB 3.47Å; L342-C346 PolarHBondContact O-N 2.8Å; L342-C346 PolarHBondContact O-SG 3.29Å; F343-C346 PolarHBondContact O-N 3.34Å; C346-C349 PolarHBondContact O-N 2.94Å; C346-I350 VanDerWaalsContact O-CG1 3.3Å; C346-I350 WeakPolarHBondContact O-CG1 3.43Å; C346-I350 PolarHBondContact O-N 2.89Å
347	I	87.7	Confident	82.9	Confident	91 Å²	91	102.7 Å²	102.7	47%	0.467	52%	0.518	S	S	.	.	H	α-helix	trans	-61.1	-46.2	176	-67.5	164.1	0	0	0	110.1	F343 L344 C349 I350 I351	F343-I347 VanDerWaalsContact O-CG1 3.27Å; F343-I347 WeakPolarHBondContact O-CG1 2.95Å; F343-I347 PolarHBondContact O-N 3.27Å; L344-I347 PolarHBondContact O-N 2.91Å; I347-C349 VanDerWaalsContact C-N 3.33Å; I347-C349 PolarHBondContact O-N 2.62Å; I347-I350 PolarHBondContact O-N 2.7Å; I347-I351 HydrophobicContact CG2-CD1 3.72Å; I347-I351 HydrophobicContact CG2-CG1 4.38Å; I347-I351 WeakPolarHBondContact O-CG1 3.03Å; I347-I351 PolarHBondContact O-N 2.99Å
348	G	85.8	Confident	82.4	Confident	39 Å²	39	106.6 Å²	106.6	40%	0.402	52%	0.524	S	S	.	.	H	α-helix	trans	-58.5	-41.8	175.9	0	0	0	0	0	112.9	L344 I345 I351 W352	L344-G348 PolarHBondContact O-N 3.26Å; I345-G348 PolarHBondContact O-N 2.84Å; G348-I351 PolarHBondContact O-N 2.91Å; G348-W352 VanDerWaalsContact O-CB 3.25Å; G348-W352 WeakPolarHBondContact O-CB 3.41Å; G348-W352 PolarHBondContact O-N 2.92Å
349	C	85.2	Confident	81.6	Confident	70 Å²	70	111.7 Å²	111.7	47%	0.473	54%	0.543	S	S	.	.	H	α-helix	trans	-65.5	-37.9	176.4	-70.3	0	0	0	0	112.8	I345 C346 I347 R353	I345-C349 WeakPolarHBondContact O-CB 3.45Å; I345-C349 PolarHBondContact O-N 3.03Å; I345-C349 PolarHBondContact O-SG 2.66Å; C346-C349 PolarHBondContact O-N 2.94Å; I347-C349 VanDerWaalsContact C-N 3.33Å; I347-C349 PolarHBondContact O-N 2.62Å; C349-R353 WeakPolarHBondContact O-CB 3.26Å; C349-R353 WeakPolarHBondContact O-CG 3.46Å; C349-R353 PolarHBondContact O-N 3.18Å
350	I	84.9	Confident	80.3	Confident	118 Å²	118	111.5 Å²	111.5	61%	0.605	56%	0.555	S	S	*	*	H	α-helix	trans	-67.5	-47.1	177	-68.2	166.4	0	0	0	110.1	C346 I347 W352 R353 W354	C346-I350 VanDerWaalsContact O-CG1 3.3Å; C346-I350 WeakPolarHBondContact O-CG1 3.43Å; C346-I350 PolarHBondContact O-N 2.89Å; I347-I350 PolarHBondContact O-N 2.7Å; I350-W352 PolarHBondContact O-N 2.97Å; I350-R353 PolarHBondContact O-N 3.37Å; I350-W354 WeakPolarHBondContact O-CB 3.41Å; I350-W354 PolarHBondContact O-N 2.92Å
351	I	84.9	Confident	79	Confident	92 Å²	92	113.4 Å²	113.4	47%	0.472	57%	0.565	S	S	.	*	H	α-helix	trans	-61.2	-45.6	177.2	-65.2	168.9	0	0	0	110.4	I347 G348 R353 W354 L355	I347-I351 HydrophobicContact CG2-CD1 3.72Å; I347-I351 HydrophobicContact CG2-CG1 4.38Å; I347-I351 WeakPolarHBondContact O-CG1 3.03Å; I347-I351 PolarHBondContact O-N 2.99Å; G348-I351 PolarHBondContact O-N 2.91Å; I351-R353 PolarHBondContact O-N 3.28Å; I351-W354 WeakPolarHBondContact O-CB 3.49Å; I351-W354 PolarHBondContact O-N 2.99Å; I351-W354 VanDerWaalsContact O-N 3.14Å; I351-L355 HydrophobicContact CG2-CD1 4.04Å; I351-L355 HydrophobicContact CG2-CG 4.44Å; I351-L355 WeakPolarHBondContact O-CG 3.44Å; I351-L355 PolarHBondContact O-N 3.1Å
352	W	82.2	Confident	77.5	Confident	177 Å²	177	117.6 Å²	117.6	67%	0.67	58%	0.583	S	S	*	*	H	α-helix	trans	-59.5	-44.9	177.3	-176	-80.1	0	0	0	112.2	G348 I350 W354 L355 L356	G348-W352 VanDerWaalsContact O-CB 3.25Å; G348-W352 WeakPolarHBondContact O-CB 3.41Å; G348-W352 PolarHBondContact O-N 2.92Å; I350-W352 PolarHBondContact O-N 2.97Å; W352-W354 VanDerWaalsContact C-N 3.31Å; W352-W354 PolarHBondContact O-N 3.3Å; W352-L355 PolarHBondContact O-N 2.94Å; W352-L356 VanDerWaalsContact CD1-CD1 3.44Å; W352-L356 WeakPolarHBondContact O-CB 3.13Å; W352-L356 PolarHBondContact O-N 2.89Å
353	R	82.4	Confident	75.4	Confident	171 Å²	171	125.1 Å²	125.1	65%	0.645	62%	0.616	S	S	*	*	H	α-helix	trans	-62.9	-37.7	174.8	-82.2	-174.1	177.8	-176	3.3	112.5	C349 I350 I351 R357	C349-R353 WeakPolarHBondContact O-CB 3.26Å; C349-R353 WeakPolarHBondContact O-CG 3.46Å; C349-R353 PolarHBondContact O-N 3.18Å; I350-R353 PolarHBondContact O-N 3.37Å; I351-R353 PolarHBondContact O-N 3.28Å; R353-R357 PolarHBondContact O-N 3.33Å; R353-R357 VanDerWaalsContact O-N 3.11Å
354	W	81.1	Confident	74.9	Confident	153 Å²	153	124.5 Å²	124.5	58%	0.58	62%	0.617	S	S	*	*	H	α-helix	trans	-67.8	-43.1	178.4	-169.7	78.5	0	0	0	111.5	I350 I351 W352 R357 R358	I350-W354 WeakPolarHBondContact O-CB 3.41Å; I350-W354 PolarHBondContact O-N 2.92Å; I351-W354 WeakPolarHBondContact O-CB 3.49Å; I351-W354 PolarHBondContact O-N 2.99Å; I351-W354 VanDerWaalsContact O-N 3.14Å; W352-W354 VanDerWaalsContact C-N 3.31Å; W352-W354 PolarHBondContact O-N 3.3Å; W354-R357 PolarHBondContact O-N 3.15Å; W354-R358 PolarHBondContact O-N 3.46Å; W354-R358 VanDerWaalsContact O-N 3.13Å
355	L	80.2	Confident	74.3	Confident	97 Å²	97	124.5 Å²	124.5	51%	0.508	62%	0.615	S	S	.	*	H	α-helix	trans	-64.2	-41.6	175	-71.7	172.1	0	0	0	112.6	I351 W352 R357 R358 K359	I351-L355 HydrophobicContact CG2-CD1 4.04Å; I351-L355 HydrophobicContact CG2-CG 4.44Å; I351-L355 WeakPolarHBondContact O-CG 3.44Å; I351-L355 PolarHBondContact O-N 3.1Å; W352-L355 PolarHBondContact O-N 2.94Å; L355-R357 VanDerWaalsContact C-N 3.33Å; L355-R357 PolarHBondContact O-N 3.48Å; L355-R358 PolarHBondContact O-N 2.81Å; L355-K359 PolarHBondContact O-N 2.85Å; L355-K359 VanDerWaalsContact O-N 3.16Å
356	L	74.5	Confident	73.6	Confident	107 Å²	107	125.4 Å²	125.4	56%	0.56	62%	0.618	S	S	*	*	H	α-helix	trans	-62.3	-37.8	175.2	-83.9	174.1	0	0	0	112.6	W352 R358	W352-L356 VanDerWaalsContact CD1-CD1 3.44Å; W352-L356 WeakPolarHBondContact O-CB 3.13Å; W352-L356 PolarHBondContact O-N 2.89Å; L356-R358 VanDerWaalsContact C-N 3.34Å
357	R	73.3	Confident	73	Confident	210 Å²	210	128.6 Å²	128.6	79%	0.792	63%	0.627	S	S	*	*	H	α-helix	trans	-67.4	-34.5	175.1	-82.6	-172.7	-173.8	174	1.1	112.6	R353 W354 L355 G360	R353-R357 PolarHBondContact O-N 3.33Å; R353-R357 VanDerWaalsContact O-N 3.11Å; W354-R357 PolarHBondContact O-N 3.15Å; L355-R357 VanDerWaalsContact C-N 3.33Å; L355-R357 PolarHBondContact O-N 3.48Å; R357-G360 PolarHBondContact O-N 2.93Å
358	R	70.1	Confident	72	Confident	150 Å²	150	131 Å²	131	57%	0.566	64%	0.637	S	S	*	*	H	α-helix	trans	-71.5	-36	-178.6	-150.1	172.3	-173.6	178.3	0.3	112.1	W354 L355 L356 G360 S361	W354-R358 PolarHBondContact O-N 3.46Å; W354-R358 VanDerWaalsContact O-N 3.13Å; L355-R358 PolarHBondContact O-N 2.81Å; L356-R358 VanDerWaalsContact C-N 3.34Å; R358-G360 PolarHBondContact O-N 3.14Å; R358-S361 PolarHBondContact O-N 2.93Å
359	K	63.5	Low	71.1	Confident	180 Å²	180	137.1 Å²	137.1	78%	0.783	65%	0.652	S	S	*	*	H	α-helix	trans	-66.8	-19.9	175.1	-104.8	-174.3	174.8	-174.6	0	114.8	L355	L355-K359 PolarHBondContact O-N 2.85Å; L355-K359 VanDerWaalsContact O-N 3.16Å
360	G	56.7	Low	70.1	Confident	61 Å²	61	141.9 Å²	141.9	63%	0.629	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	10.3	176.3	0	0	0	0	0	114.7	R357 R358	R357-G360 PolarHBondContact O-N 2.93Å; R358-G360 PolarHBondContact O-N 3.14Å
361	S	55.1	Low	69	Low	88 Å²	88	143.8 Å²	143.8	62%	0.615	67%	0.67	S	S	*	*	S	Bend	trans	-113.1	-5.3	-179.1	175.4	0	0	0	0	113.2	R358	R358-S361 PolarHBondContact O-N 2.93Å
362	D	53.1	Low	67.7	Low	141 Å²	141	148.1 Å²	148.1	75%	0.754	69%	0.686	S	S	*	*			trans	-112.2	12.6	-176.6	-67.4	-26.7	0	0	0	112.6
363	E	39.9	Very low	66.3	Low	242 Å²	242	145.5 Å²	145.5	100%	1.131	69%	0.688	S	S	*	*			trans	-120.8	0	162.7	-80.9	-178.1	162.1	0	0	108.4

Retrieved 363 of 363 residues in 363.2 ms (Link to these results)

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