A0AA82N7Z2_SCHMA Loading...

Egg protein CP391S-like protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N7Z2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 321 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	37	Very low	45.1	Very low	210 Å²	210	138.7 Å²	138.7	100%	1.034	66%	0.664	S	S	*	*				0	114.1	0	-79.2	173.2	175.9	0	0	108.1	Y3	M1-Y3 HydrophobicContact CB-CD2 4.12Å; M1-Y3 HydrophobicContact CB-CE2 3.94Å; M1-Y3 PolarHBondContact O-N 3.35Å; M1-Y3 HydrophobicContact SD-CE2 4.23Å
2	R	35.9	Very low	47.1	Very low	248 Å²	248	132.8 Å²	132.8	94%	0.936	65%	0.648	S	S	*	*			trans	-72.8	105.6	170.4	-72.8	179.1	175	174.2	-2.3	107	N4	R2-N4 PolarHBondContact O-N 3.42Å
3	Y	39.7	Very low	49	Very low	167 Å²	167	133 Å²	133	66%	0.655	64%	0.644	S	S	*	*			trans	-87.1	94.6	173.6	-89.2	-77.6	0	0	0	108.8	M1 F5	M1-Y3 HydrophobicContact CB-CD2 4.12Å; M1-Y3 HydrophobicContact CB-CE2 3.94Å; M1-Y3 PolarHBondContact O-N 3.35Å; M1-Y3 HydrophobicContact SD-CE2 4.23Å; Y3-F5 AromaticContact CD1-CD2 3.65Å; Y3-F5 HydrophobicContact CD1-CD2 3.65Å; Y3-F5 AromaticContact CD1-CE2 3.33Å; Y3-F5 HydrophobicContact CD1-CE2 3.33Å; Y3-F5 HydrophobicContact CD1-CZ 4.43Å; Y3-F5 HydrophobicContact CE1-CD2 4.48Å; Y3-F5 AromaticContact CE1-CE2 3.72Å; Y3-F5 HydrophobicContact CE1-CE2 3.72Å; Y3-F5 HydrophobicContact CG-CD2 4.27Å; Y3-F5 HydrophobicContact CG-CE2 4.27Å; Y3-F5 PolarHBondContact O-N 3.43Å
4	N	34.3	Very low	50.8	Low	148 Å²	148	134.9 Å²	134.9	79%	0.791	64%	0.643	S	S	*	*			trans	-72.9	95.7	158.1	-77.2	-12.7	0	0	0	107	R2	R2-N4 PolarHBondContact O-N 3.42Å
5	F	40.6	Very low	52.2	Low	148 Å²	148	132.6 Å²	132.6	65%	0.649	64%	0.635	S	S	*	*			trans	-98.2	89.6	166.4	-98.4	-75.8	0	0	0	109.7	Y3 I9	Y3-F5 AromaticContact CD1-CD2 3.65Å; Y3-F5 HydrophobicContact CD1-CD2 3.65Å; Y3-F5 AromaticContact CD1-CE2 3.33Å; Y3-F5 HydrophobicContact CD1-CE2 3.33Å; Y3-F5 HydrophobicContact CD1-CZ 4.43Å; Y3-F5 HydrophobicContact CE1-CD2 4.48Å; Y3-F5 AromaticContact CE1-CE2 3.72Å; Y3-F5 HydrophobicContact CE1-CE2 3.72Å; Y3-F5 HydrophobicContact CG-CD2 4.27Å; Y3-F5 HydrophobicContact CG-CE2 4.27Å; Y3-F5 PolarHBondContact O-N 3.43Å; F5-I9 HydrophobicContact CD1-CD1 4.07Å
6	Y	44.4	Very low	53.6	Low	149 Å²	149	128.6 Å²	128.6	58%	0.584	62%	0.621	S	S	*	*			trans	42.2	100	132.5	-76.7	-84.4	0	0	0	118.6	D8	Y6-D8 HydrophobicContact CD1-CB 3.84Å; Y6-D8 WeakPolarHBondContact CD1-OD2 3.45Å; Y6-D8 WeakPolarHBondContact CE1-OD2 3.22Å; Y6-D8 PolarHBondContact O-N 3.3Å
7	S	50.7	Low	54.8	Low	91 Å²	91	125 Å²	125	64%	0.636	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.4	-19.8	153	50.3	0	0	0	0	113.3	I9 S10	S7-I9 VanDerWaalsContact C-N 3.33Å; S7-I9 PolarHBondContact O-N 3.48Å; S7-S10 PolarHBondContact O-N 3.07Å
8	D	47.9	Very low	55.5	Low	89 Å²	89	122.2 Å²	122.2	48%	0.476	60%	0.6	S	S	.	*	H	α-helix	trans	-72	-24.2	-174.6	-57.5	-16.9	0	0	0	113.2	Y6 S10 S12	Y6-D8 HydrophobicContact CD1-CB 3.84Å; Y6-D8 WeakPolarHBondContact CD1-OD2 3.45Å; Y6-D8 WeakPolarHBondContact CE1-OD2 3.22Å; Y6-D8 PolarHBondContact O-N 3.3Å; D8-S10 VanDerWaalsContact C-N 3.35Å; D8-S12 WeakPolarHBondContact O-CB 3.34Å; D8-S12 PolarHBondContact O-N 3.45Å
9	I	51.6	Low	55.8	Low	104 Å²	104	121.5 Å²	121.5	53%	0.533	60%	0.598	S	S	.	*	H	α-helix	trans	-69.7	-35.4	179.1	-61.8	172.9	0	0	0	110.9	F5 S7 S12 F13	F5-I9 HydrophobicContact CD1-CD1 4.07Å; S7-I9 VanDerWaalsContact C-N 3.33Å; S7-I9 PolarHBondContact O-N 3.48Å; I9-S12 PolarHBondContact O-N 2.95Å; I9-F13 PolarHBondContact O-N 3.28Å
10	S	55.3	Low	56.1	Low	69 Å²	69	120.6 Å²	120.6	48%	0.483	60%	0.595	S	S	.	*	H	α-helix	trans	-63.5	-49.2	176.6	169.6	0	0	0	0	111.1	S7 D8 S12 F13 Y14	S7-S10 PolarHBondContact O-N 3.07Å; D8-S10 VanDerWaalsContact C-N 3.35Å; S10-S12 VanDerWaalsContact C-N 3.32Å; S10-S12 PolarHBondContact O-N 2.87Å; S10-F13 PolarHBondContact O-N 2.95Å; S10-Y14 WeakPolarHBondContact O-CD2 3.47Å; S10-Y14 PolarHBondContact O-N 3.44Å
11	I	58.6	Low	56.2	Low	103 Å²	103	122.1 Å²	122.1	53%	0.528	60%	0.596	S	S	.	*	H	α-helix	trans	-63.5	-41.3	179.7	-61	170.6	0	0	0	110.3	Y14 L15	I11-Y14 PolarHBondContact O-N 2.99Å; I11-L15 HydrophobicContact CG2-CD1 3.94Å; I11-L15 WeakPolarHBondContact O-CB 3.38Å; I11-L15 PolarHBondContact O-N 3.26Å
12	S	69.4	Low	57	Low	67 Å²	67	118.4 Å²	118.4	47%	0.469	57%	0.574	S	S	.	*	H	α-helix	trans	-63.2	-41.6	177.3	-173.1	0	0	0	0	112.6	D8 I9 S10 V16	D8-S12 WeakPolarHBondContact O-CB 3.34Å; D8-S12 PolarHBondContact O-N 3.45Å; I9-S12 PolarHBondContact O-N 2.95Å; S10-S12 VanDerWaalsContact C-N 3.32Å; S10-S12 PolarHBondContact O-N 2.87Å; S12-V16 VanDerWaalsContact O-CG2 3.22Å; S12-V16 WeakPolarHBondContact O-CG2 3.34Å; S12-V16 PolarHBondContact O-N 3.36Å
13	F	72	Confident	57.8	Low	136 Å²	136	110.2 Å²	110.2	60%	0.596	55%	0.553	S	S	*	*	H	α-helix	trans	-68	-43.5	178.5	-174	-99.2	0	0	0	111.6	I9 S10 L15 V16 V17	I9-F13 PolarHBondContact O-N 3.28Å; S10-F13 PolarHBondContact O-N 2.95Å; F13-L15 PolarHBondContact O-N 3.31Å; F13-V16 PolarHBondContact O-N 3.49Å; F13-V17 HydrophobicContact CD1-CG2 4.01Å; F13-V17 HydrophobicContact CE1-CG2 3.65Å; F13-V17 HydrophobicContact CE2-CG2 4.46Å; F13-V17 HydrophobicContact CZ-CG2 3.9Å; F13-V17 WeakPolarHBondContact O-CG2 3.49Å; F13-V17 PolarHBondContact O-N 2.85Å
14	Y	73.4	Confident	58.4	Low	160 Å²	160	106.5 Å²	106.5	63%	0.627	55%	0.545	S	S	*	.	H	α-helix	trans	-60.8	-43.2	175.1	-91.9	-81.8	0	0	0	112.2	S10 I11 V16 V17 V18	S10-Y14 WeakPolarHBondContact O-CD2 3.47Å; S10-Y14 PolarHBondContact O-N 3.44Å; I11-Y14 PolarHBondContact O-N 2.99Å; Y14-V16 VanDerWaalsContact C-N 3.35Å; Y14-V16 PolarHBondContact O-N 2.92Å; Y14-V17 PolarHBondContact O-N 2.87Å; Y14-V18 VanDerWaalsContact O-CG2 3.3Å; Y14-V18 WeakPolarHBondContact O-CG2 3.33Å; Y14-V18 PolarHBondContact O-N 3.39Å
15	L	72.5	Confident	59.1	Low	100 Å²	100	103.9 Å²	103.9	52%	0.524	53%	0.527	S	S	.	.	H	α-helix	trans	-60.3	-43.4	174.4	-88.5	161.7	0	0	0	111.9	I11 F13 V18 L19	I11-L15 HydrophobicContact CG2-CD1 3.94Å; I11-L15 WeakPolarHBondContact O-CB 3.38Å; I11-L15 PolarHBondContact O-N 3.26Å; F13-L15 PolarHBondContact O-N 3.31Å; L15-V18 PolarHBondContact O-N 3.21Å; L15-L19 VanDerWaalsContact O-CB 3.29Å; L15-L19 WeakPolarHBondContact O-CB 3.3Å; L15-L19 WeakPolarHBondContact O-CD1 3.22Å; L15-L19 WeakPolarHBondContact O-CG 3.32Å; L15-L19 PolarHBondContact O-N 3.4Å
16	V	75	Confident	59.9	Low	68 Å²	68	101.5 Å²	101.5	41%	0.412	53%	0.528	S	S	.	.	H	α-helix	trans	-64.1	-42.9	177.2	170.6	0	0	0	0	111.2	S12 F13 Y14 L19 L20	S12-V16 VanDerWaalsContact O-CG2 3.22Å; S12-V16 WeakPolarHBondContact O-CG2 3.34Å; S12-V16 PolarHBondContact O-N 3.36Å; F13-V16 PolarHBondContact O-N 3.49Å; Y14-V16 VanDerWaalsContact C-N 3.35Å; Y14-V16 PolarHBondContact O-N 2.92Å; V16-L19 PolarHBondContact O-N 2.88Å; V16-L20 HydrophobicContact CG1-CD1 3.74Å; V16-L20 HydrophobicContact CG1-CG 4.24Å; V16-L20 WeakPolarHBondContact O-CB 3.47Å; V16-L20 VanDerWaalsContact O-CG 3.22Å; V16-L20 WeakPolarHBondContact O-CG 3.49Å; V16-L20 PolarHBondContact O-N 3.26Å
17	V	73.2	Confident	60.3	Low	68 Å²	68	98.9 Å²	98.9	41%	0.412	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-42.9	177.2	173.5	0	0	0	0	111.4	F13 Y14 L20 Y21	F13-V17 HydrophobicContact CD1-CG2 4.01Å; F13-V17 HydrophobicContact CE1-CG2 3.65Å; F13-V17 HydrophobicContact CE2-CG2 4.46Å; F13-V17 HydrophobicContact CZ-CG2 3.9Å; F13-V17 WeakPolarHBondContact O-CG2 3.49Å; F13-V17 PolarHBondContact O-N 2.85Å; Y14-V17 PolarHBondContact O-N 2.87Å; V17-L20 PolarHBondContact O-N 3.19Å; V17-Y21 VanDerWaalsContact O-CB 3.3Å; V17-Y21 WeakPolarHBondContact O-CB 3.49Å; V17-Y21 PolarHBondContact O-N 2.89Å
18	V	66.7	Low	61.3	Low	74 Å²	74	98 Å²	98	45%	0.448	51%	0.51	S	S	.	.	H	α-helix	trans	-65.7	-39.4	176.5	171.9	0	0	0	0	111.5	Y14 L15 Y21 K22	Y14-V18 VanDerWaalsContact O-CG2 3.3Å; Y14-V18 WeakPolarHBondContact O-CG2 3.33Å; Y14-V18 PolarHBondContact O-N 3.39Å; L15-V18 PolarHBondContact O-N 3.21Å; V18-Y21 PolarHBondContact O-N 3.44Å; V18-K22 WeakPolarHBondContact O-CB 3.45Å; V18-K22 WeakPolarHBondContact O-CG 3.29Å; V18-K22 PolarHBondContact O-N 2.97Å
19	L	62.9	Low	62.8	Low	110 Å²	110	94.1 Å²	94.1	58%	0.576	49%	0.489	S	S	*	.	H	α-helix	trans	-66.6	-44	175.2	-76.5	166.8	0	0	0	111.6	L15 V16 Y21 K22 C23	L15-L19 VanDerWaalsContact O-CB 3.29Å; L15-L19 WeakPolarHBondContact O-CB 3.3Å; L15-L19 WeakPolarHBondContact O-CD1 3.22Å; L15-L19 WeakPolarHBondContact O-CG 3.32Å; L15-L19 PolarHBondContact O-N 3.4Å; V16-L19 PolarHBondContact O-N 2.88Å; L19-Y21 VanDerWaalsContact C-N 3.34Å; L19-K22 PolarHBondContact O-N 3.47Å; L19-C23 VanDerWaalsContact O-CB 3.23Å; L19-C23 WeakPolarHBondContact O-CB 3.44Å; L19-C23 PolarHBondContact O-N 3.34Å
20	L	60.2	Low	64.3	Low	102 Å²	102	91.9 Å²	91.9	53%	0.534	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-42.2	175	-74.6	169.3	0	0	0	111.1	V16 V17 C23 L24	V16-L20 HydrophobicContact CG1-CD1 3.74Å; V16-L20 HydrophobicContact CG1-CG 4.24Å; V16-L20 WeakPolarHBondContact O-CB 3.47Å; V16-L20 VanDerWaalsContact O-CG 3.22Å; V16-L20 WeakPolarHBondContact O-CG 3.49Å; V16-L20 PolarHBondContact O-N 3.26Å; V17-L20 PolarHBondContact O-N 3.19Å; L20-C23 CarbonylContact O-C 3.56Å; L20-C23 PolarHBondContact O-N 2.88Å; L20-L24 WeakPolarHBondContact O-CB 3.39Å; L20-L24 VanDerWaalsContact O-CG 3.24Å; L20-L24 WeakPolarHBondContact O-CG 3.47Å; L20-L24 PolarHBondContact O-N 3.22Å
21	Y	59.8	Low	65.6	Low	154 Å²	154	95 Å²	95	60%	0.604	49%	0.489	S	S	*	.	H	α-helix	trans	-63.5	-44.3	176.2	-173	-98.8	0	0	0	112.3	V17 V18 L19 C23 L24 Q25	V17-Y21 VanDerWaalsContact O-CB 3.3Å; V17-Y21 WeakPolarHBondContact O-CB 3.49Å; V17-Y21 PolarHBondContact O-N 2.89Å; V18-Y21 PolarHBondContact O-N 3.44Å; L19-Y21 VanDerWaalsContact C-N 3.34Å; Y21-C23 VanDerWaalsContact C-N 3.32Å; Y21-C23 PolarHBondContact O-N 3.28Å; Y21-L24 WeakPolarHBondContact O-CB 3.13Å; Y21-L24 PolarHBondContact O-N 2.89Å; Y21-Q25 PolarHBondContact O-N 3.45Å; Y21-Q25 VanDerWaalsContact O-N 3.15Å
22	K	52.2	Low	66.8	Low	131 Å²	131	95.3 Å²	95.3	57%	0.57	49%	0.488	S	S	*	.	H	α-helix	trans	-64.4	-36.1	172.6	-77.2	-175.1	176.2	-177.4	0	112.5	V18 L19 L24 Q25 C26	V18-K22 WeakPolarHBondContact O-CB 3.45Å; V18-K22 WeakPolarHBondContact O-CG 3.29Å; V18-K22 PolarHBondContact O-N 2.97Å; L19-K22 PolarHBondContact O-N 3.47Å; K22-L24 VanDerWaalsContact C-N 3.34Å; K22-Q25 PolarHBondContact O-N 3.44Å; K22-C26 PolarHBondContact O-N 3.31Å
23	C	54.2	Low	67.3	Low	76 Å²	76	95 Å²	95	51%	0.514	48%	0.484	S	S	.	.	H	α-helix	trans	-70.4	-32.9	177.2	-153.8	0	0	0	0	111.7	L19 L20 Y21 C26 Q27	L19-C23 VanDerWaalsContact O-CB 3.23Å; L19-C23 WeakPolarHBondContact O-CB 3.44Å; L19-C23 PolarHBondContact O-N 3.34Å; L20-C23 CarbonylContact O-C 3.56Å; L20-C23 PolarHBondContact O-N 2.88Å; Y21-C23 VanDerWaalsContact C-N 3.32Å; Y21-C23 PolarHBondContact O-N 3.28Å; C23-C26 PolarHBondContact O-N 2.88Å; C23-Q27 PolarHBondContact O-N 3.32Å
24	L	51.3	Low	67.9	Low	90 Å²	90	95.2 Å²	95.2	47%	0.471	49%	0.492	S	S	.	.	H	α-helix	trans	-64.7	-40.8	172.7	-76.8	161.8	0	0	0	111.3	L20 Y21 K22 C26 Q27 D28	L20-L24 WeakPolarHBondContact O-CB 3.39Å; L20-L24 VanDerWaalsContact O-CG 3.24Å; L20-L24 WeakPolarHBondContact O-CG 3.47Å; L20-L24 PolarHBondContact O-N 3.22Å; Y21-L24 WeakPolarHBondContact O-CB 3.13Å; Y21-L24 PolarHBondContact O-N 2.89Å; K22-L24 VanDerWaalsContact C-N 3.34Å; L24-C26 VanDerWaalsContact C-N 3.27Å; L24-C26 PolarHBondContact O-N 3.3Å; L24-Q27 WeakPolarHBondContact O-CA 3.4Å; L24-Q27 WeakPolarHBondContact O-CB 3.23Å; L24-Q27 PolarHBondContact O-N 3.49Å; L24-D28 PolarHBondContact O-N 3.47Å; L24-D28 VanDerWaalsContact O-N 3.08Å
25	Q	50.1	Low	68.5	Low	92 Å²	92	90.7 Å²	90.7	43%	0.43	48%	0.478	S	S	.	.	H	α-helix	trans	-59	-35.5	173.7	-81.5	-166.4	-42.7	0	0	113.4	Y21 K22 Q27 D28	Y21-Q25 PolarHBondContact O-N 3.45Å; Y21-Q25 VanDerWaalsContact O-N 3.15Å; K22-Q25 PolarHBondContact O-N 3.44Å; Q25-Q27 PolarHBondContact O-N 2.93Å; Q25-D28 PolarHBondContact O-N 3.29Å
26	C	55.6	Low	69.3	Low	98 Å²	98	86.1 Å²	86.1	66%	0.662	45%	0.454	S	S	*	.	H	α-helix	trans	-65.8	-26	173.2	-62.6	0	0	0	0	112.7	K22 C23 L24	K22-C26 PolarHBondContact O-N 3.31Å; C23-C26 PolarHBondContact O-N 2.88Å; L24-C26 VanDerWaalsContact C-N 3.27Å; L24-C26 PolarHBondContact O-N 3.3Å
27	Q	53.4	Low	70	Confident	94 Å²	94	87.2 Å²	87.2	44%	0.439	46%	0.455	S	S	.	.	H	α-helix	trans	-84.3	-23.3	177.7	-80.7	175.9	-41.4	0	0	113.3	C23 L24 Q25 V29 C30 Q31	C23-Q27 PolarHBondContact O-N 3.32Å; L24-Q27 WeakPolarHBondContact O-CA 3.4Å; L24-Q27 WeakPolarHBondContact O-CB 3.23Å; L24-Q27 PolarHBondContact O-N 3.49Å; Q25-Q27 PolarHBondContact O-N 2.93Å; Q27-V29 VanDerWaalsContact C-N 3.35Å; Q27-V29 PolarHBondContact O-N 3.33Å; Q27-C30 PolarHBondContact O-N 2.93Å; Q27-C30 VanDerWaalsContact O-N 3.1Å; Q27-Q31 WeakPolarHBondContact O-CG 3.2Å; Q27-Q31 PolarHBondContact O-N 3.21Å
28	D	71.6	Confident	70.8	Confident	74 Å²	74	88.9 Å²	88.9	40%	0.396	45%	0.454	S	S	.	.	H	α-helix	trans	-56.4	-46.5	-175.7	-71.8	-21.7	0	0	0	112.2	L24 Q25 C30 Q31 Q32	L24-D28 PolarHBondContact O-N 3.47Å; L24-D28 VanDerWaalsContact O-N 3.08Å; Q25-D28 PolarHBondContact O-N 3.29Å; D28-C30 PolarHBondContact O-N 3.31Å; D28-Q31 PolarHBondContact O-N 3.02Å; D28-Q32 PolarHBondContact O-N 3.31Å
29	V	79.3	Confident	72	Confident	6 Å²	6	90.8 Å²	90.8	4%	0.036	46%	0.459	C	S	.	.	H	α-helix	trans	-64.1	-39.8	178	169	0	0	0	0	112.4	Q27 Q31 Q32 P33 L36 Y54 F191 V198	Q27-V29 VanDerWaalsContact C-N 3.35Å; Q27-V29 PolarHBondContact O-N 3.33Å; V29-Q31 PolarHBondContact O-N 3.31Å; V29-Q32 CarbonylContact O-C 3.6Å; V29-Q32 PolarHBondContact O-N 3.48Å; V29-P33 WeakPolarHBondContact O-CA 3.35Å; V29-P33 VanDerWaalsContact O-N 3.09Å; V29-L36 HydrophobicContact CG1-CD1 3.49Å; V29-L36 VanDerWaalsContact CG1-CD1 3.49Å; V29-L36 HydrophobicContact CG1-CD2 3.6Å; V29-L36 HydrophobicContact CG1-CG 3.6Å; V29-L36 HydrophobicContact CG2-CD2 4.1Å; V29-Y54 HydrophobicContact CG2-CE1 4.28Å; V29-Y54 HydrophobicContact CG2-CE2 3.93Å; V29-Y54 WeakPolarHBondContact CG2-OH 3.44Å; V29-F191 HydrophobicContact CG1-CG 4.43Å; V29-V198 HydrophobicContact CG1-CG2 3.99Å
30	C	83.6	Confident	73.3	Confident	58 Å²	58	88.6 Å²	88.6	39%	0.392	44%	0.444	S	S	.	.	H	α-helix	trans	-71.3	-23	179.5	-62.2	0	0	0	0	112.4	Q27 D28 C193	Q27-C30 PolarHBondContact O-N 2.93Å; Q27-C30 VanDerWaalsContact O-N 3.1Å; D28-C30 PolarHBondContact O-N 3.31Å; C30-C193 WeakPolarHBondContact CA-SG 3.21Å; C30-C193 HydrophobicContact CB-CB 3.78Å; C30-C193 WeakPolarHBondContact CB-SG 3.39Å; C30-C193 WeakPolarHBondContact SG-CA 3.14Å; C30-C193 WeakPolarHBondContact SG-CB 3.44Å; C30-C193 CovalentContact SG-SG 2.04Å; C30-C193 PolarHBondContact SG-SG 2.9Å
31	Q	83.1	Confident	74.7	Confident	134 Å²	134	86.7 Å²	86.7	63%	0.626	44%	0.437	S	S	*	.	H	α-helix	trans	-87.1	-29.1	173.2	-68	-177.3	-2.6	0	0	112.5	Q27 D28 V29	Q27-Q31 WeakPolarHBondContact O-CG 3.2Å; Q27-Q31 PolarHBondContact O-N 3.21Å; D28-Q31 PolarHBondContact O-N 3.02Å; V29-Q31 PolarHBondContact O-N 3.31Å
32	Q	82.4	Confident	76	Confident	110 Å²	110	79.6 Å²	79.6	51%	0.514	41%	0.409	S	S	.	.			trans	-132.8	70.8	-177.9	-59.5	-175	6.5	0	0	111	D28 V29 D34 L35	D28-Q32 PolarHBondContact O-N 3.31Å; V29-Q32 CarbonylContact O-C 3.6Å; V29-Q32 PolarHBondContact O-N 3.48Å; Q32-D34 PolarHBondContact O-N 3.01Å; Q32-D34 VanDerWaalsContact O-N 3.14Å; Q32-L35 HydrophobicContact CB-CD1 3.78Å; Q32-L35 HydrophobicContact CB-CG 3.84Å; Q32-L35 WeakPolarHBondContact O-CB 3.39Å; Q32-L35 WeakPolarHBondContact O-CG 3.22Å; Q32-L35 PolarHBondContact O-N 3.5Å
33	P	81.8	Confident	77.7	Confident	60 Å²	60	74.1 Å²	74.1	39%	0.39	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-61.6	-24.2	-178	24.4	-34.5	0	0	0	113	V29 L35 L36	V29-P33 WeakPolarHBondContact O-CA 3.35Å; V29-P33 VanDerWaalsContact O-N 3.09Å; P33-L35 PolarHBondContact O-N 2.85Å; P33-L36 VanDerWaalsContact O-CB 3.29Å; P33-L36 WeakPolarHBondContact O-CB 3.3Å; P33-L36 PolarHBondContact O-N 3.43Å
34	D	84.3	Confident	79.4	Confident	141 Å²	141	74.1 Å²	74.1	75%	0.754	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-59.1	-27.3	175.8	-65.2	-21.2	0	0	0	112.7	Q32 L36 Q37	Q32-D34 PolarHBondContact O-N 3.01Å; Q32-D34 VanDerWaalsContact O-N 3.14Å; D34-L36 PolarHBondContact O-N 3.4Å; D34-Q37 PolarHBondContact O-N 3.42Å
35	L	85.1	Confident	81.3	Confident	64 Å²	64	72.2 Å²	72.2	34%	0.335	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-60.6	-28.2	175.1	-66.3	179.6	0	0	0	112.5	Q32 P33 Q37 Y38 Y54	Q32-L35 HydrophobicContact CB-CD1 3.78Å; Q32-L35 HydrophobicContact CB-CG 3.84Å; Q32-L35 WeakPolarHBondContact O-CB 3.39Å; Q32-L35 WeakPolarHBondContact O-CG 3.22Å; Q32-L35 PolarHBondContact O-N 3.5Å; P33-L35 PolarHBondContact O-N 2.85Å; L35-Q37 PolarHBondContact O-N 3.49Å; L35-Y38 WeakPolarHBondContact O-CB 3.22Å; L35-Y38 PolarHBondContact O-N 3.45Å; L35-Y38 VanDerWaalsContact O-N 3.1Å; L35-Y54 HydrophobicContact CB-CD2 4.38Å; L35-Y54 WeakPolarHBondContact O-CB 3.33Å
36	L	89.2	Confident	83.2	Confident	4 Å²	4	77 Å²	77	2%	0.021	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-69	-23	-179.4	-66.7	172.4	0	0	0	113.3	V29 P33 D34 Y54 F191 V198 E199 S200	V29-L36 HydrophobicContact CG1-CD1 3.49Å; V29-L36 VanDerWaalsContact CG1-CD1 3.49Å; V29-L36 HydrophobicContact CG1-CD2 3.6Å; V29-L36 HydrophobicContact CG1-CG 3.6Å; V29-L36 HydrophobicContact CG2-CD2 4.1Å; P33-L36 VanDerWaalsContact O-CB 3.29Å; P33-L36 WeakPolarHBondContact O-CB 3.3Å; P33-L36 PolarHBondContact O-N 3.43Å; D34-L36 PolarHBondContact O-N 3.4Å; L36-Y54 HydrophobicContact CD2-CD1 3.72Å; L36-Y54 HydrophobicContact CD2-CE1 3.74Å; L36-Y54 HydrophobicContact CD2-CG 4.2Å; L36-F191 HydrophobicContact CD1-CD2 4.27Å; L36-F191 HydrophobicContact CD2-CD2 3.67Å; L36-F191 HydrophobicContact CD2-CE2 3.42Å; L36-F191 VanDerWaalsContact CD2-CE2 3.42Å; L36-F191 HydrophobicContact CD2-CZ 4.15Å; L36-V198 HydrophobicContact CD1-CB 3.68Å; L36-V198 HydrophobicContact CD1-CG2 3.55Å; L36-E199 WeakPolarHBondContact CB-O 3.38Å; L36-S200 WeakPolarHBondContact O-CA 3.5Å; L36-S200 VanDerWaalsContact O-CB 3.29Å; L36-S200 WeakPolarHBondContact O-CB 3.34Å; L36-S200 PolarHBondContact O-OG 2.95Å
37	Q	89.7	Confident	84.9	Confident	92 Å²	92	75 Å²	75	43%	0.43	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-99.7	9.7	175.7	-53.1	-58.1	-62.5	0	0	111.7	D34 L35 E39 E199	D34-Q37 PolarHBondContact O-N 3.42Å; L35-Q37 PolarHBondContact O-N 3.49Å; Q37-E39 PolarHBondContact O-N 3.48Å; Q37-E39 VanDerWaalsContact O-N 3.15Å; Q37-E199 PolarHBondContact NE2-O 3.37Å
38	Y	89.3	Confident	86.8	Confident	102 Å²	102	72.2 Å²	72.2	40%	0.4	37%	0.366	S	S	.	.			trans	-57.2	122.1	175.8	176.6	-94.7	0	0	0	110	L35 K40 H52 H53 Y54	L35-Y38 WeakPolarHBondContact O-CB 3.22Å; L35-Y38 PolarHBondContact O-N 3.45Å; L35-Y38 VanDerWaalsContact O-N 3.1Å; Y38-K40 HydrophobicContact CE1-CB 4.07Å; Y38-K40 WeakPolarHBondContact OH-CB 3.41Å; Y38-K40 VanDerWaalsContact OH-CD 3.29Å; Y38-K40 WeakPolarHBondContact OH-CD 3.49Å; Y38-H52 HydrophobicContact CE1-CB 4.16Å; Y38-H53 VanDerWaalsContact O-CA 3.28Å; Y38-H53 WeakPolarHBondContact O-CA 3.27Å; Y38-Y54 PolarHBondContact O-N 3.39Å
39	E	92.3	Very high	87.8	Confident	115 Å²	115	69.3 Å²	69.3	54%	0.537	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	131.4	170.6	175.4	175.6	-177.8	0	0	108.5	Q37 H52 H53	Q37-E39 PolarHBondContact O-N 3.48Å; Q37-E39 VanDerWaalsContact O-N 3.15Å; E39-H52 CarbonylContact C-O 3.59Å; E39-H52 WeakPolarHBondContact CA-O 3.39Å; E39-H53 IonicContact OE1-CE1 3.34Å
40	K	90.3	Very high	88.4	Confident	63 Å²	63	69.2 Å²	69.2	27%	0.274	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	106.8	171.1	-173.7	-177.7	174.5	-177.3	0	109.3	Y38 I42 S51 H52 N249	Y38-K40 HydrophobicContact CE1-CB 4.07Å; Y38-K40 WeakPolarHBondContact OH-CB 3.41Å; Y38-K40 VanDerWaalsContact OH-CD 3.29Å; Y38-K40 WeakPolarHBondContact OH-CD 3.49Å; K40-I42 HydrophobicContact CB-CD1 4.39Å; K40-I42 HydrophobicContact CD-CD1 3.87Å; K40-I42 HydrophobicContact CG-CD1 3.84Å; K40-I42 PolarHBondContact O-N 3.01Å; K40-S51 CarbonylContact O-C 3.51Å; K40-S51 VanDerWaalsContact O-CA 3.29Å; K40-S51 WeakPolarHBondContact O-CA 3.3Å; K40-H52 HydrophobicContact CB-CB 4.47Å; K40-H52 PolarHBondContact N-O 3.29Å; K40-H52 PolarHBondContact O-N 3.03Å; K40-N249 WeakPolarHBondContact CE-O 3.22Å; K40-N249 PolarHBondContact NZ-O 3.2Å
41	V	90.9	Very high	88.8	Confident	63 Å²	63	66.4 Å²	66.4	38%	0.382	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	115.7	171.1	-178.8	0	0	0	0	108.3	V44 L49	V41-V44 HydrophobicContact CG1-CB 4.06Å; V41-V44 HydrophobicContact CG1-CG1 4.17Å; V41-L49 HydrophobicContact CG1-CD1 4.05Å
42	I	86.8	Confident	89.3	Confident	4 Å²	4	60.4 Å²	60.4	2%	0.021	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-42.5	178.7	-53.3	-55.1	0	0	0	109.6	K40 Y50 N249 T251 I253 Y262 N266	K40-I42 HydrophobicContact CB-CD1 4.39Å; K40-I42 HydrophobicContact CD-CD1 3.87Å; K40-I42 HydrophobicContact CG-CD1 3.84Å; K40-I42 PolarHBondContact O-N 3.01Å; I42-Y50 HydrophobicContact CB-CD1 3.67Å; I42-Y50 HydrophobicContact CB-CE1 4.12Å; I42-Y50 HydrophobicContact CG1-CD1 4.04Å; I42-Y50 HydrophobicContact CG1-CE1 4.07Å; I42-Y50 HydrophobicContact CG2-CD1 3.94Å; I42-Y50 HydrophobicContact CG2-CE1 4.21Å; I42-Y50 PolarHBondContact N-O 2.89Å; I42-N249 PolarHBondContact O-ND2 3.27Å; I42-T251 HydrophobicContact CD1-CG2 4.2Å; I42-T251 HydrophobicContact CG2-CG2 3.99Å; I42-I253 HydrophobicContact CG2-CG2 4.42Å; I42-Y262 HydrophobicContact CG2-CE2 4.36Å; I42-Y262 WeakPolarHBondContact CG2-OH 3.29Å; I42-N266 PolarHBondContact O-OD1 3.04Å
43	Y	86.5	Confident	89.8	Confident	16 Å²	16	55.6 Å²	55.6	6%	0.063	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	144.8	178.6	-175.1	-124	0	0	0	112.1	N45 Y48 L49 Y50 Y262 E265 N266	Y43-N45 HydrophobicContact CE1-CB 4.3Å; Y43-N45 WeakPolarHBondContact CE1-ND2 3.23Å; Y43-N45 PolarHBondContact OH-ND2 3Å; Y43-N45 VanDerWaalsContact OH-ND2 3.09Å; Y43-Y48 AromaticContact CD1-CD1 3.42Å; Y43-Y48 HydrophobicContact CD1-CD1 3.42Å; Y43-Y48 VanDerWaalsContact CD1-CD1 3.42Å; Y43-Y48 AromaticContact CD1-CE1 3.73Å; Y43-Y48 HydrophobicContact CD1-CE1 3.73Å; Y43-Y48 HydrophobicContact CD1-CG 4.44Å; Y43-Y48 AromaticContact CE1-CD1 3.94Å; Y43-Y48 HydrophobicContact CE1-CD1 3.94Å; Y43-L49 CarbonylContact O-C 3.48Å; Y43-L49 WeakPolarHBondContact O-CA 3.48Å; Y43-Y50 PolarHBondContact N-O 2.8Å; Y43-Y50 PolarHBondContact O-N 3.47Å; Y43-Y262 VanDerWaalsContact CB-CD2 3.45Å; Y43-Y262 AromaticContact CD1-CD2 3.42Å; Y43-Y262 HydrophobicContact CD1-CD2 3.42Å; Y43-Y262 VanDerWaalsContact CD1-CD2 3.42Å; Y43-Y262 HydrophobicContact CD1-CE2 4.23Å; Y43-Y262 AromaticContact CD1-CG 3.94Å; Y43-Y262 HydrophobicContact CD1-CG 3.94Å; Y43-Y262 AromaticContact CD2-CD2 3.68Å; Y43-Y262 HydrophobicContact CD2-CD2 3.68Å; Y43-Y262 HydrophobicContact CD2-CE2 4.26Å; Y43-Y262 HydrophobicContact CE1-CD2 4.07Å; Y43-Y262 HydrophobicContact CE1-CG 4.33Å; Y43-Y262 HydrophobicContact CE2-CD2 4.27Å; Y43-Y262 AromaticContact CG-CD2 3.23Å; Y43-Y262 HydrophobicContact CG-CD2 3.23Å; Y43-Y262 AromaticContact CG-CE2 3.73Å; Y43-Y262 HydrophobicContact CG-CE2 3.73Å; Y43-Y262 HydrophobicContact CG-CG 4.2Å; Y43-E265 VanDerWaalsContact CE2-OE2 3.24Å; Y43-E265 WeakPolarHBondContact CE2-OE2 3.21Å; Y43-E265 PolarHBondContact OH-OE2 3.14Å; Y43-N266 WeakPolarHBondContact CD2-ND2 3.41Å
44	V	90.3	Very high	90.2	Very high	76 Å²	76	55 Å²	55	46%	0.461	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	130.6	176.9	62.5	0	0	0	0	109.7	V41 Y48 L49	V41-V44 HydrophobicContact CG1-CB 4.06Å; V41-V44 HydrophobicContact CG1-CG1 4.17Å; V44-Y48 WeakPolarHBondContact CA-O 3.3Å; V44-L49 HydrophobicContact CB-CD1 3.75Å; V44-L49 HydrophobicContact CG2-CD1 3.56Å
45	N	91.1	Very high	90.5	Very high	51 Å²	51	49 Å²	49	27%	0.273	24%	0.238	S	C	.	.			trans	-138.7	-171.5	166.5	74.3	30.4	0	0	0	109.7	Y43 S47 Y48 R208	Y43-N45 HydrophobicContact CE1-CB 4.3Å; Y43-N45 WeakPolarHBondContact CE1-ND2 3.23Å; Y43-N45 PolarHBondContact OH-ND2 3Å; Y43-N45 VanDerWaalsContact OH-ND2 3.09Å; N45-S47 PolarHBondContact O-N 3.27Å; N45-S47 PolarHBondContact OD1-N 3.22Å; N45-Y48 PolarHBondContact N-O 3.48Å; N45-Y48 VanDerWaalsContact O-O 3.1Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.46Å; N45-Y48 PolarHBondContact OD1-N 3.01Å; N45-R208 PolarHBondContact O-NH1 3.39Å; N45-R208 PolarHBondContact O-NH2 2.72Å
46	K	90.3	Very high	91	Very high	191 Å²	191	46 Å²	46	83%	0.83	22%	0.222	S	C	*	.	S	Bend	trans	-61.1	-29.5	-177.2	-69	-176.8	180	177.5	0	114.1	L62 R208	K46-L62 WeakPolarHBondContact O-CD1 3.41Å; K46-R208 PolarHBondContact O-NH1 3.27Å
47	S	91.7	Very high	91.2	Very high	58 Å²	58	46 Å²	46	41%	0.406	22%	0.222	S	C	.	.	S	Bend	trans	-117.7	-7.5	-171.9	-52.3	0	0	0	0	113.8	N45 L62	N45-S47 PolarHBondContact O-N 3.27Å; N45-S47 PolarHBondContact OD1-N 3.22Å; S47-L62 WeakPolarHBondContact O-CG 3.41Å; S47-L62 PolarHBondContact O-N 2.85Å
48	Y	92.5	Very high	91.4	Very high	35 Å²	35	41.6 Å²	41.6	14%	0.137	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	139.9	-170.9	-172.1	-86.2	0	0	0	111	Y43 V44 N45 Y50 R59 I60 T61	Y43-Y48 AromaticContact CD1-CD1 3.42Å; Y43-Y48 HydrophobicContact CD1-CD1 3.42Å; Y43-Y48 VanDerWaalsContact CD1-CD1 3.42Å; Y43-Y48 AromaticContact CD1-CE1 3.73Å; Y43-Y48 HydrophobicContact CD1-CE1 3.73Å; Y43-Y48 HydrophobicContact CD1-CG 4.44Å; Y43-Y48 AromaticContact CE1-CD1 3.94Å; Y43-Y48 HydrophobicContact CE1-CD1 3.94Å; V44-Y48 WeakPolarHBondContact CA-O 3.3Å; N45-Y48 PolarHBondContact N-O 3.48Å; N45-Y48 VanDerWaalsContact O-O 3.1Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.46Å; N45-Y48 PolarHBondContact OD1-N 3.01Å; Y48-Y50 VanDerWaalsContact CE1-CB 3.41Å; Y48-R59 HydrophobicContact CE2-CG 3.69Å; Y48-R59 PolarHBondContact OH-NE 3.47Å; Y48-I60 CarbonylContact C-O 3.59Å; Y48-I60 VanDerWaalsContact CA-O 3.28Å; Y48-I60 WeakPolarHBondContact CA-O 3.49Å; Y48-T61 HydrophobicContact CD2-CG2 3.59Å; Y48-T61 HydrophobicContact CE2-CG2 3.76Å
49	L	93.3	Very high	91.7	Very high	12 Å²	12	38 Å²	38	6%	0.063	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	132.9	168.1	179.2	81.5	0	0	0	107.9	V41 Y43 V44 M58 R59 I60 P205	V41-L49 HydrophobicContact CG1-CD1 4.05Å; Y43-L49 CarbonylContact O-C 3.48Å; Y43-L49 WeakPolarHBondContact O-CA 3.48Å; V44-L49 HydrophobicContact CB-CD1 3.75Å; V44-L49 HydrophobicContact CG2-CD1 3.56Å; L49-M58 HydrophobicContact CD2-CE 3.81Å; L49-R59 CarbonylContact O-C 3.38Å; L49-R59 WeakPolarHBondContact O-CA 3.03Å; L49-I60 HydrophobicContact CB-CB 4.06Å; L49-I60 HydrophobicContact CB-CD1 4.48Å; L49-I60 HydrophobicContact CB-CG1 4.37Å; L49-I60 HydrophobicContact CD2-CD1 3.64Å; L49-I60 HydrophobicContact CD2-CG1 4.16Å; L49-I60 PolarHBondContact N-O 3.49Å; L49-I60 PolarHBondContact O-N 3.23Å; L49-P205 HydrophobicContact CD2-CG 4.28Å
50	Y	92.3	Very high	91.9	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	128.5	169.6	179.5	-118.7	0	0	0	110.1	I42 Y43 Y48 H52 T57 M58 R59 I253	I42-Y50 HydrophobicContact CB-CD1 3.67Å; I42-Y50 HydrophobicContact CB-CE1 4.12Å; I42-Y50 HydrophobicContact CG1-CD1 4.04Å; I42-Y50 HydrophobicContact CG1-CE1 4.07Å; I42-Y50 HydrophobicContact CG2-CD1 3.94Å; I42-Y50 HydrophobicContact CG2-CE1 4.21Å; I42-Y50 PolarHBondContact N-O 2.89Å; Y43-Y50 PolarHBondContact N-O 2.8Å; Y43-Y50 PolarHBondContact O-N 3.47Å; Y48-Y50 VanDerWaalsContact CE1-CB 3.41Å; Y50-H52 AromaticContact CE1-CD2 3.94Å; Y50-H52 AromaticContact CE1-NE2 3.45Å; Y50-H52 WeakPolarHBondContact CE1-NE2 3.49Å; Y50-H52 AromaticContact CZ-CD2 3.76Å; Y50-H52 AromaticContact CZ-NE2 3.38Å; Y50-H52 PolarHBondContact OH-NE2 3.36Å; Y50-T57 HydrophobicContact CE2-CG2 4.46Å; Y50-M58 WeakPolarHBondContact CA-O 3.47Å; Y50-R59 HydrophobicContact CD2-CB 4.21Å; Y50-I253 HydrophobicContact CE1-CB 4.45Å; Y50-I253 HydrophobicContact CE1-CG2 3.73Å
51	S	92.5	Very high	92.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	148.7	-173.5	54.4	0	0	0	0	110.9	K40 H53 T57 M58	K40-S51 CarbonylContact O-C 3.51Å; K40-S51 VanDerWaalsContact O-CA 3.29Å; K40-S51 WeakPolarHBondContact O-CA 3.3Å; S51-H53 PolarHBondContact OG-CD2 2.93Å; S51-H53 PolarHBondContact OG-NE2 3.44Å; S51-T57 WeakPolarHBondContact O-CA 3.43Å; S51-M58 PolarHBondContact N-O 3.32Å; S51-M58 PolarHBondContact O-N 2.92Å; S51-M58 WeakPolarHBondContact OG-CE 3.12Å; S51-M58 PolarHBondContact OG-O 2.82Å
52	H	91.6	Very high	92.3	Very high	7 Å²	7	27.7 Å²	27.7	3%	0.032	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.1	173.3	-67.2	-178.7	0	0	0	109.1	Y38 E39 K40 Y50 M220 A225 T251	Y38-H52 HydrophobicContact CE1-CB 4.16Å; E39-H52 CarbonylContact C-O 3.59Å; E39-H52 WeakPolarHBondContact CA-O 3.39Å; K40-H52 HydrophobicContact CB-CB 4.47Å; K40-H52 PolarHBondContact N-O 3.29Å; K40-H52 PolarHBondContact O-N 3.03Å; Y50-H52 AromaticContact CE1-CD2 3.94Å; Y50-H52 AromaticContact CE1-NE2 3.45Å; Y50-H52 WeakPolarHBondContact CE1-NE2 3.49Å; Y50-H52 AromaticContact CZ-CD2 3.76Å; Y50-H52 AromaticContact CZ-NE2 3.38Å; Y50-H52 PolarHBondContact OH-NE2 3.36Å; H52-M220 HydrophobicContact CB-CE 4.03Å; H52-A225 WeakPolarHBondContact CE1-CB 3.16Å; H52-T251 PolarHBondContact CE1-OG1 3.02Å
53	H	93.1	Very high	92.7	Very high	9 Å²	9	33.4 Å²	33.4	4%	0.042	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	173	178.7	-65.6	-93.7	0	0	0	109.7	Y38 E39 S51 N55 Y56 I202 M220	Y38-H53 VanDerWaalsContact O-CA 3.28Å; Y38-H53 WeakPolarHBondContact O-CA 3.27Å; E39-H53 IonicContact OE1-CE1 3.34Å; S51-H53 PolarHBondContact OG-CD2 2.93Å; S51-H53 PolarHBondContact OG-NE2 3.44Å; H53-N55 PolarHBondContact O-N 3.45Å; H53-N55 VanDerWaalsContact O-N 3.09Å; H53-Y56 CarbonylContact C-O 3.54Å; H53-Y56 WeakPolarHBondContact CA-O 3.24Å; H53-Y56 WeakPolarHBondContact CB-O 3.35Å; H53-Y56 PolarHBondContact N-O 3.42Å; H53-Y56 PolarHBondContact O-N 2.86Å; H53-Y56 VanDerWaalsContact O-O 3.04Å; H53-I202 HydrophobicContact CB-CD1 3.42Å; H53-I202 VanDerWaalsContact CB-CD1 3.42Å; H53-I202 HydrophobicContact CB-CG1 3.86Å; H53-M220 VanDerWaalsContact O-CE 3.26Å; H53-M220 WeakPolarHBondContact O-CE 3.01Å
54	Y	90.4	Very high	93	Very high	49 Å²	49	36.2 Å²	36.2	19%	0.192	18%	0.181	C	C	.	.	S	Bend	trans	-57.4	118.4	169.3	-175.5	-99.5	0	0	0	110.8	V29 L35 L36 Y38 Y56 Y91 F191	V29-Y54 HydrophobicContact CG2-CE1 4.28Å; V29-Y54 HydrophobicContact CG2-CE2 3.93Å; V29-Y54 WeakPolarHBondContact CG2-OH 3.44Å; L35-Y54 HydrophobicContact CB-CD2 4.38Å; L35-Y54 WeakPolarHBondContact O-CB 3.33Å; L36-Y54 HydrophobicContact CD2-CD1 3.72Å; L36-Y54 HydrophobicContact CD2-CE1 3.74Å; L36-Y54 HydrophobicContact CD2-CG 4.2Å; Y38-Y54 PolarHBondContact O-N 3.39Å; Y54-Y56 PolarHBondContact O-N 2.93Å; Y54-Y91 AromaticContact CD1-CD1 4Å; Y54-Y91 HydrophobicContact CD1-CD1 4Å; Y54-Y91 HydrophobicContact CD1-CE1 4.09Å; Y54-Y91 HydrophobicContact CE1-CD1 4.26Å; Y54-Y91 WeakPolarHBondContact O-CE1 3.14Å; Y54-F191 HydrophobicContact CD1-CZ 4.35Å; Y54-F191 HydrophobicContact CE1-CE1 4.31Å; Y54-F191 HydrophobicContact CE1-CE2 4.25Å; Y54-F191 AromaticContact CE1-CZ 3.69Å; Y54-F191 HydrophobicContact CE1-CZ 3.69Å
55	N	91.8	Very high	93.1	Very high	15 Å²	15	37.4 Å²	37.4	8%	0.08	19%	0.191	C	C	.	.	S	Bend	trans	65.4	-4.6	176.8	-149	-5.8	0	0	0	116.9	H53 Y91 E92 P219 M220	H53-N55 PolarHBondContact O-N 3.45Å; H53-N55 VanDerWaalsContact O-N 3.09Å; N55-Y91 HydrophobicContact CB-CD1 3.88Å; N55-Y91 HydrophobicContact CB-CE1 4.4Å; N55-Y91 WeakPolarHBondContact ND2-CA 3.42Å; N55-E92 WeakPolarHBondContact ND2-CG 3.31Å; N55-E92 PolarHBondContact ND2-N 3.4Å; N55-P219 WeakPolarHBondContact O-CA 3.45Å; N55-M220 PolarHBondContact O-N 3.09Å
56	Y	94.7	Very high	92.9	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	148.1	179.3	-75.5	-91.6	0	0	0	111.7	H53 Y54 Y90 Y91 M187 E218 P219 M220	H53-Y56 CarbonylContact C-O 3.54Å; H53-Y56 WeakPolarHBondContact CA-O 3.24Å; H53-Y56 WeakPolarHBondContact CB-O 3.35Å; H53-Y56 PolarHBondContact N-O 3.42Å; H53-Y56 PolarHBondContact O-N 2.86Å; H53-Y56 VanDerWaalsContact O-O 3.04Å; Y54-Y56 PolarHBondContact O-N 2.93Å; Y56-Y90 WeakPolarHBondContact OH-CA 3.41Å; Y56-Y91 HydrophobicContact CD2-CD1 4.23Å; Y56-Y91 HydrophobicContact CD2-CD2 4.29Å; Y56-Y91 HydrophobicContact CD2-CE1 4.02Å; Y56-Y91 HydrophobicContact CD2-CE2 4.1Å; Y56-Y91 HydrophobicContact CD2-CG 4.39Å; Y56-Y91 AromaticContact CD2-CZ 3.97Å; Y56-Y91 HydrophobicContact CE2-CD1 4.06Å; Y56-Y91 AromaticContact CE2-CD2 3.54Å; Y56-Y91 HydrophobicContact CE2-CD2 3.54Å; Y56-Y91 HydrophobicContact CE2-CE1 4.19Å; Y56-Y91 AromaticContact CE2-CE2 3.71Å; Y56-Y91 HydrophobicContact CE2-CE2 3.71Å; Y56-Y91 AromaticContact CE2-CG 3.77Å; Y56-Y91 HydrophobicContact CE2-CG 3.77Å; Y56-Y91 PolarHBondContact OH-N 3.21Å; Y56-Y91 VanDerWaalsContact OH-N 3.13Å; Y56-M187 HydrophobicContact CD1-CE 3.85Å; Y56-M187 HydrophobicContact CD2-CE 3.38Å; Y56-M187 HydrophobicContact CE1-CE 4.1Å; Y56-M187 HydrophobicContact CE2-CE 3.68Å; Y56-M187 HydrophobicContact CG-CE 3.48Å; Y56-M187 VanDerWaalsContact CG-CE 3.48Å; Y56-E218 CarbonylContact C-O 3.56Å; Y56-E218 WeakPolarHBondContact CA-O 3.29Å; Y56-P219 HydrophobicContact CD1-CG 4.48Å; Y56-P219 HydrophobicContact CE1-CB 4.47Å; Y56-P219 HydrophobicContact CE1-CG 3.9Å; Y56-M220 WeakPolarHBondContact O-CE 3.24Å
57	T	92.8	Very high	92.7	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	147.2	156.8	72.7	0	0	0	0	108.7	Y50 S51 Y217 E218 M220 A225	Y50-T57 HydrophobicContact CE2-CG2 4.46Å; S51-T57 WeakPolarHBondContact O-CA 3.43Å; T57-Y217 VanDerWaalsContact O-CA 3.28Å; T57-Y217 WeakPolarHBondContact O-CA 3.28Å; T57-E218 PolarHBondContact N-O 3.3Å; T57-E218 PolarHBondContact O-N 2.84Å; T57-M220 HydrophobicContact CG2-CE 3.89Å; T57-M220 HydrophobicContact CG2-SD 3.71Å; T57-A225 HydrophobicContact CG2-CB 3.94Å
58	M	95.1	Very high	92.2	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	125.8	175.1	-179.7	-178.2	65	0	0	109.4	L49 Y50 S51 I60 I202 I204 V215 E216 Y217	L49-M58 HydrophobicContact CD2-CE 3.81Å; Y50-M58 WeakPolarHBondContact CA-O 3.47Å; S51-M58 PolarHBondContact N-O 3.32Å; S51-M58 PolarHBondContact O-N 2.92Å; S51-M58 WeakPolarHBondContact OG-CE 3.12Å; S51-M58 PolarHBondContact OG-O 2.82Å; M58-I60 HydrophobicContact CE-CD1 4.16Å; M58-I60 HydrophobicContact CE-CG1 4.5Å; M58-I60 HydrophobicContact CG-CG1 4.3Å; M58-I60 HydrophobicContact SD-CD1 4.23Å; M58-I60 HydrophobicContact SD-CG1 4.33Å; M58-I202 HydrophobicContact CB-CG2 4.49Å; M58-I202 HydrophobicContact CE-CG2 4.19Å; M58-I202 HydrophobicContact SD-CG2 3.66Å; M58-I204 HydrophobicContact SD-CG1 4.49Å; M58-V215 HydrophobicContact CG-CG1 3.99Å; M58-V215 HydrophobicContact SD-CG1 4.22Å; M58-E216 CarbonylContact C-O 3.54Å; M58-E216 WeakPolarHBondContact CA-O 3.27Å; M58-Y217 HydrophobicContact CB-CD1 3.98Å; M58-Y217 HydrophobicContact CB-CE1 3.98Å; M58-Y217 HydrophobicContact CG-CD1 4.01Å; M58-Y217 HydrophobicContact CG-CE1 3.63Å; M58-Y217 HydrophobicContact SD-CE1 3.63Å
59	R	94.9	Very high	90.8	Very high	26 Å²	26	35.6 Å²	35.6	10%	0.098	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131.6	170.7	-171.9	-172.3	-65	134.3	3.6	109.6	Y48 L49 Y50 T61 V215 E216	Y48-R59 HydrophobicContact CE2-CG 3.69Å; Y48-R59 PolarHBondContact OH-NE 3.47Å; L49-R59 CarbonylContact O-C 3.38Å; L49-R59 WeakPolarHBondContact O-CA 3.03Å; Y50-R59 HydrophobicContact CD2-CB 4.21Å; R59-T61 HydrophobicContact CG-CG2 4.07Å; R59-V215 CarbonylContact O-C 3.52Å; R59-V215 WeakPolarHBondContact O-CA 3.48Å; R59-E216 HydrophobicContact CB-CB 4.4Å; R59-E216 WeakPolarHBondContact CD-OE2 3.48Å; R59-E216 IonicContact CZ-OE2 2.7Å; R59-E216 PolarHBondContact N-O 3.37Å; R59-E216 IonicContact NH1-OE2 3.89Å; R59-E216 PolarHBondContact NH1-OE2 2.86Å; R59-E216 PolarHBondContact O-N 2.83Å
60	I	96.3	Very high	89.1	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.2	171.8	-53.7	-177.1	0	0	0	108.1	Y48 L49 M58 L62 I204 R208 T213 L214 V215	Y48-I60 CarbonylContact C-O 3.59Å; Y48-I60 VanDerWaalsContact CA-O 3.28Å; Y48-I60 WeakPolarHBondContact CA-O 3.49Å; L49-I60 HydrophobicContact CB-CB 4.06Å; L49-I60 HydrophobicContact CB-CD1 4.48Å; L49-I60 HydrophobicContact CB-CG1 4.37Å; L49-I60 HydrophobicContact CD2-CD1 3.64Å; L49-I60 HydrophobicContact CD2-CG1 4.16Å; L49-I60 PolarHBondContact N-O 3.49Å; L49-I60 PolarHBondContact O-N 3.23Å; M58-I60 HydrophobicContact CE-CD1 4.16Å; M58-I60 HydrophobicContact CE-CG1 4.5Å; M58-I60 HydrophobicContact CG-CG1 4.3Å; M58-I60 HydrophobicContact SD-CD1 4.23Å; M58-I60 HydrophobicContact SD-CG1 4.33Å; I60-L62 HydrophobicContact CG2-CD2 4.34Å; I60-I204 HydrophobicContact CD1-CG2 3.94Å; I60-R208 HydrophobicContact CD1-CB 4.34Å; I60-R208 HydrophobicContact CD1-CG 4.36Å; I60-R208 HydrophobicContact CG2-CB 4.11Å; I60-R208 HydrophobicContact CG2-CG 4.45Å; I60-T213 HydrophobicContact CG2-CG2 3.7Å; I60-L214 WeakPolarHBondContact CA-O 3.17Å; I60-V215 HydrophobicContact CB-CG2 4.31Å; I60-V215 HydrophobicContact CD1-CG2 4.26Å; I60-V215 HydrophobicContact CG1-CB 4.46Å; I60-V215 HydrophobicContact CG1-CG1 4.13Å; I60-V215 HydrophobicContact CG1-CG2 3.82Å; I60-V215 HydrophobicContact CG2-CG2 4.03Å
61	T	95.4	Very high	87.7	Confident	16 Å²	16	45.1 Å²	45.1	10%	0.098	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	131.8	176.5	52.3	0	0	0	0	110	Y48 R59 Q64 T213 L214	Y48-T61 HydrophobicContact CD2-CG2 3.59Å; Y48-T61 HydrophobicContact CE2-CG2 3.76Å; R59-T61 HydrophobicContact CG-CG2 4.07Å; T61-Q64 WeakPolarHBondContact OG1-CG 3.04Å; T61-T213 WeakPolarHBondContact O-CA 3.33Å; T61-L214 PolarHBondContact N-O 3.25Å; T61-L214 PolarHBondContact O-N 3.03Å
62	L	95.3	Very high	86.9	Confident	9 Å²	9	52 Å²	52	5%	0.047	27%	0.269	C	S	.	.	S	Bend	trans	-92.6	158.9	178.7	-52.6	-176.9	0	0	0	110.7	K46 S47 I60 Q64 G212 T213	K46-L62 WeakPolarHBondContact O-CD1 3.41Å; S47-L62 WeakPolarHBondContact O-CG 3.41Å; S47-L62 PolarHBondContact O-N 2.85Å; I60-L62 HydrophobicContact CG2-CD2 4.34Å; L62-Q64 VanDerWaalsContact C-N 3.29Å; L62-Q64 PolarHBondContact O-N 3.41Å; L62-Q64 PolarHBondContact O-NE2 3.38Å; L62-G212 CarbonylContact C-O 3.57Å; L62-T213 HydrophobicContact CD2-CG2 3.93Å; L62-T213 WeakPolarHBondContact CD2-OG1 3.28Å
63	N	94.5	Very high	86.3	Confident	124 Å²	124	52.9 Å²	52.9	66%	0.663	27%	0.273	S	S	*	.	S	Bend	trans	57.3	37.3	176.4	-48.4	-37.9	0	0	0	113.8	G212	N63-G212 WeakPolarHBondContact CA-O 3.48Å; N63-G212 PolarHBondContact N-O 2.51Å
64	Q	93.7	Very high	85.6	Confident	74 Å²	74	58.4 Å²	58.4	35%	0.346	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-87.4	147.5	176.6	-61.2	-52.8	-65.2	0	0	111.4	T61 L62 Y170 G212 L214	T61-Q64 WeakPolarHBondContact OG1-CG 3.04Å; L62-Q64 VanDerWaalsContact C-N 3.29Å; L62-Q64 PolarHBondContact O-N 3.41Å; L62-Q64 PolarHBondContact O-NE2 3.38Å; Q64-Y170 HydrophobicContact CB-CE2 4.4Å; Q64-Y170 WeakPolarHBondContact O-CE2 3.49Å; Q64-Y170 PolarHBondContact O-OH 2.85Å; Q64-G212 PolarHBondContact N-O 2.84Å; Q64-L214 HydrophobicContact CB-CB 3.98Å; Q64-L214 HydrophobicContact CG-CB 3.89Å; Q64-L214 HydrophobicContact CG-CD2 4.44Å
65	P	91.7	Very high	85.1	Confident	102 Å²	102	62.9 Å²	62.9	66%	0.662	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-65.9	160.7	167.9	31.3	-35.3	0	0	0	110.7	P67 Y170	P65-P67 WeakPolarHBondContact O-CD 3.31Å; P65-Y170 WeakPolarHBondContact O-CE2 3.2Å
66	N	87.9	Confident	84.3	Confident	34 Å²	34	62.7 Å²	62.7	18%	0.182	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-63.5	123.1	174.3	-170.7	-19.8	0	0	0	109.6	V68 F158 Y170 E172	N66-V68 VanDerWaalsContact CG-O 3.32Å; N66-V68 PolarHBondContact O-N 3.34Å; N66-V68 PolarHBondContact OD1-N 3.2Å; N66-V68 PolarHBondContact OD1-O 3.45Å; N66-F158 WeakPolarHBondContact ND2-CE2 3.41Å; N66-Y170 VanDerWaalsContact CA-CE1 3.41Å; N66-Y170 VanDerWaalsContact CA-CZ 3.49Å; N66-Y170 HydrophobicContact CB-CD1 4.06Å; N66-Y170 HydrophobicContact CB-CE1 3.47Å; N66-Y170 VanDerWaalsContact CB-CE1 3.47Å; N66-Y170 PolarHBondContact N-OH 2.77Å; N66-E172 PolarHBondContact ND2-OE1 2.94Å
67	P	85.8	Confident	83.2	Confident	59 Å²	59	66.5 Å²	66.5	38%	0.383	35%	0.348	S	S	.	.	S	Bend	trans	-68	-19.8	177.2	28	-36	0	0	0	113.4	P65 L160 Y170 L214	P65-P67 WeakPolarHBondContact O-CD 3.31Å; P67-L160 HydrophobicContact CB-CD1 4.2Å; P67-L160 HydrophobicContact CG-CD1 3.82Å; P67-Y170 HydrophobicContact CG-CG 4.27Å; P67-L214 HydrophobicContact CG-CD1 4.18Å
68	V	80	Confident	82.4	Confident	13 Å²	13	71.2 Å²	71.2	8%	0.079	38%	0.377	C	S	.	.			trans	-104	106.7	176.6	-175.1	0	0	0	0	108.9	N66 E71 L160	N66-V68 VanDerWaalsContact CG-O 3.32Å; N66-V68 PolarHBondContact O-N 3.34Å; N66-V68 PolarHBondContact OD1-N 3.2Å; N66-V68 PolarHBondContact OD1-O 3.45Å; V68-E71 HydrophobicContact CG1-CB 3.98Å; V68-E71 HydrophobicContact CG1-CG 3.82Å; V68-E71 WeakPolarHBondContact CG1-OE2 3.46Å; V68-L160 HydrophobicContact CG2-CD1 3.58Å; V68-L160 HydrophobicContact CG2-CD2 3.38Å; V68-L160 HydrophobicContact CG2-CG 4.1Å
69	F	62.9	Low	81.8	Confident	191 Å²	191	75.1 Å²	75.1	84%	0.838	40%	0.398	S	S	*	.			trans	-84.6	-28.8	-171.3	-168.7	-106.6	0	0	0	115.1
70	N	58.9	Low	81.5	Confident	145 Å²	145	76.9 Å²	76.9	78%	0.775	41%	0.407	S	S	*	.	S	Bend	trans	-172	44.9	-174.4	-150.6	14	0	0	0	115.3
71	E	63.1	Low	81.4	Confident	70 Å²	70	82.8 Å²	82.8	33%	0.327	44%	0.435	S	S	.	.			trans	-80.5	144	-174.8	-74.5	176.7	171.8	0	0	113.1	V68 L73 L132	V68-E71 HydrophobicContact CG1-CB 3.98Å; V68-E71 HydrophobicContact CG1-CG 3.82Å; V68-E71 WeakPolarHBondContact CG1-OE2 3.46Å; E71-L73 HydrophobicContact CB-CG 4.36Å; E71-L73 PolarHBondContact O-N 3.43Å; E71-L132 HydrophobicContact CB-CD2 3.91Å; E71-L132 HydrophobicContact CG-CD2 3.82Å; E71-L132 WeakPolarHBondContact OE2-CD2 3.48Å
72	N	74.3	Confident	81.4	Confident	145 Å²	145	82.3 Å²	82.3	78%	0.775	43%	0.432	S	S	*	.			trans	-70.9	58.2	172.1	-70.6	-26	0	0	0	111	L74	N72-L74 PolarHBondContact O-N 3.33Å; N72-L74 VanDerWaalsContact O-N 3.15Å
73	L	78.8	Confident	81.4	Confident	25 Å²	25	89.3 Å²	89.3	13%	0.131	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-58.2	118.2	175.3	-74.1	158	0	0	0	108.9	E71 Q130 L132 A139 R141 F158	E71-L73 HydrophobicContact CB-CG 4.36Å; E71-L73 PolarHBondContact O-N 3.43Å; L73-Q130 HydrophobicContact CB-CB 3.72Å; L73-L132 HydrophobicContact CD2-CB 3.66Å; L73-L132 HydrophobicContact CG-CB 4.45Å; L73-A139 HydrophobicContact CD2-CB 4.06Å; L73-R141 HydrophobicContact CD1-CB 3.88Å; L73-R141 HydrophobicContact CD1-CG 4.5Å; L73-F158 HydrophobicContact CD1-CE1 3.95Å
74	L	79.6	Confident	81.5	Confident	125 Å²	125	84.1 Å²	84.1	65%	0.654	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	140.2	-179.3	-64.6	176.6	0	0	0	109.3	N72 S76 Q130 V131	N72-L74 PolarHBondContact O-N 3.33Å; N72-L74 VanDerWaalsContact O-N 3.15Å; L74-S76 PolarHBondContact O-N 3.3Å; L74-Q130 CarbonylContact O-C 3.45Å; L74-Q130 WeakPolarHBondContact O-CA 3.42Å; L74-Q130 WeakPolarHBondContact O-CB 3.49Å; L74-V131 PolarHBondContact N-O 3.23Å; L74-V131 PolarHBondContact O-N 2.81Å
75	K	79.2	Confident	81.6	Confident	143 Å²	143	85.2 Å²	85.2	62%	0.622	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.4	124.6	172.2	-174.2	177.4	-170.6	131.6	0	109.3	E128	K75-E128 WeakPolarHBondContact CD-OE1 3.38Å; K75-E128 WeakPolarHBondContact CE-OE1 3.38Å; K75-E128 HydrophobicContact CG-CG 4.25Å; K75-E128 WeakPolarHBondContact CG-OE1 3Å; K75-E128 IonicContact NZ-OE1 3.37Å; K75-E128 PolarHBondContact NZ-OE1 2.97Å; K75-E128 IonicContact NZ-OE2 2.81Å; K75-E128 PolarHBondContact NZ-OE2 3.32Å
76	S	75.8	Confident	81.9	Confident	11 Å²	11	81.5 Å²	81.5	8%	0.077	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-97.4	152.3	178	175.4	0	0	0	0	110.1	L74 E80 V129	L74-S76 PolarHBondContact O-N 3.3Å; S76-E80 WeakPolarHBondContact CB-OE2 3.37Å; S76-E80 WeakPolarHBondContact OG-CB 3.35Å; S76-E80 PolarHBondContact OG-OE2 2.04Å; S76-V129 PolarHBondContact N-O 3.22Å
77	P	72.2	Confident	82.3	Confident	82 Å²	82	87.4 Å²	87.4	53%	0.532	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-56.5	173.3	164.6	25.5	-34.3	0	0	0	111.6	N79 E80	P77-N79 PolarHBondContact O-N 3.48Å; P77-N79 VanDerWaalsContact O-N 3.17Å; P77-E80 HydrophobicContact CG-CB 4.25Å
78	T	75.2	Confident	82.8	Confident	100 Å²	100	84.9 Å²	84.9	61%	0.613	43%	0.426	S	S	*	.	S	Bend	trans	-55.8	-36.9	-178.6	46.5	0	0	0	0	112.8	S102	T78-S102 VanDerWaalsContact O-CB 3.27Å; T78-S102 WeakPolarHBondContact O-CB 3.35Å; T78-S102 PolarHBondContact O-N 2.8Å; T78-S102 PolarHBondContact O-OG 2.6Å
79	N	83.3	Confident	83.5	Confident	84 Å²	84	90 Å²	90	45%	0.449	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132	176.4	-54.1	-19.5	0	0	0	108.7	P77 V100 Y101	P77-N79 PolarHBondContact O-N 3.48Å; P77-N79 VanDerWaalsContact O-N 3.17Å; N79-V100 WeakPolarHBondContact CA-O 3.47Å; N79-Y101 HydrophobicContact CB-CD1 4.18Å; N79-Y101 HydrophobicContact CB-CE1 4.38Å; N79-Y101 WeakPolarHBondContact OD1-CD1 3.47Å
80	E	88.4	Confident	85.1	Confident	62 Å²	62	80.9 Å²	80.9	29%	0.29	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129	178.2	-174.8	177	169.7	0	0	111.1	S76 P77 V82 N99 V100 V131	S76-E80 WeakPolarHBondContact CB-OE2 3.37Å; S76-E80 WeakPolarHBondContact OG-CB 3.35Å; S76-E80 PolarHBondContact OG-OE2 2.04Å; P77-E80 HydrophobicContact CG-CB 4.25Å; E80-V82 HydrophobicContact CB-CG2 4.48Å; E80-V82 HydrophobicContact CG-CG2 3.96Å; E80-N99 CarbonylContact O-C 3.49Å; E80-N99 WeakPolarHBondContact O-CA 3.35Å; E80-V100 PolarHBondContact N-O 2.89Å; E80-V100 PolarHBondContact O-N 2.89Å; E80-V131 WeakPolarHBondContact OE2-CG2 3.4Å
81	E	93.7	Very high	86.8	Confident	125 Å²	125	74.2 Å²	74.2	58%	0.584	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	118.1	166.4	-172.3	-176.3	169	0	0	108.8	N97 N99	E81-N97 HydrophobicContact CG-CB 4.26Å; E81-N97 VanDerWaalsContact OE1-CG 3.28Å; E81-N97 PolarHBondContact OE1-ND2 3.45Å; E81-N99 VanDerWaalsContact CA-OD1 3.31Å; E81-N99 WeakPolarHBondContact CA-OD1 2.84Å; E81-N99 VanDerWaalsContact CB-OD1 3.31Å; E81-N99 WeakPolarHBondContact CB-OD1 3.13Å
82	V	94.6	Very high	88.1	Confident	6 Å²	6	76 Å²	76	4%	0.036	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.4	-179	179	0	0	0	0	109.3	E80 N97 F98 V100 N133 F138	E80-V82 HydrophobicContact CB-CG2 4.48Å; E80-V82 HydrophobicContact CG-CG2 3.96Å; V82-N97 CarbonylContact O-C 3.51Å; V82-N97 VanDerWaalsContact O-CA 3.28Å; V82-N97 WeakPolarHBondContact O-CA 3.42Å; V82-N97 WeakPolarHBondContact O-CB 3.12Å; V82-F98 HydrophobicContact CB-CD2 3.83Å; V82-F98 HydrophobicContact CB-CE2 3.48Å; V82-F98 VanDerWaalsContact CB-CE2 3.48Å; V82-F98 HydrophobicContact CB-CZ 4.23Å; V82-F98 HydrophobicContact CG1-CD2 4.41Å; V82-F98 HydrophobicContact CG1-CE2 3.6Å; V82-F98 HydrophobicContact CG1-CZ 3.89Å; V82-F98 HydrophobicContact CG2-CE2 4.17Å; V82-F98 PolarHBondContact N-O 3.15Å; V82-F98 PolarHBondContact O-N 3.42Å; V82-V100 HydrophobicContact CG2-CG2 3.92Å; V82-N133 HydrophobicContact CG1-CB 4.25Å; V82-F138 HydrophobicContact CG1-CD2 4.08Å; V82-F138 HydrophobicContact CG1-CE2 3.98Å; V82-F138 HydrophobicContact CG2-CE2 4.27Å
83	K	96.4	Very high	89	Confident	156 Å²	156	70.8 Å²	70.8	68%	0.678	36%	0.355	S	S	*	.			trans	-92.2	115	164.5	-174.1	174.3	-177.8	178.8	0	108.8	N133	K83-N133 PolarHBondContact O-ND2 3.32Å
84	P	96.3	Very high	89.8	Confident	14 Å²	14	72.5 Å²	72.5	9%	0.091	36%	0.362	C	S	.	.			trans	-60.9	140.2	-178.4	-9.3	17	0	0	0	111.3	F86 F88 F98 N133	P84-F86 HydrophobicContact CB-CD2 4.45Å; P84-F86 HydrophobicContact CB-CE1 4.4Å; P84-F86 HydrophobicContact CB-CE2 4.32Å; P84-F86 HydrophobicContact CB-CZ 4.29Å; P84-F86 PolarHBondContact O-N 3.1Å; P84-F88 HydrophobicContact CB-CD1 4.46Å; P84-F88 HydrophobicContact CB-CE1 4.17Å; P84-F88 HydrophobicContact CG-CD1 4.33Å; P84-F88 HydrophobicContact CG-CE1 3.69Å; P84-F98 HydrophobicContact CB-CE1 4.27Å; P84-F98 HydrophobicContact CG-CD1 4.08Å; P84-F98 HydrophobicContact CG-CE1 3.56Å; P84-F98 HydrophobicContact CG-CZ 4.26Å; P84-N133 WeakPolarHBondContact CA-OD1 3.4Å
85	N	96.3	Very high	90.7	Very high	97 Å²	97	67 Å²	67	52%	0.519	33%	0.333	S	S	.	.	S	Bend	trans	-77.3	8.3	176.4	-78.5	-24.3	0	0	0	113.8	N133	N85-N133 PolarHBondContact N-OD1 2.98Å; N85-N133 PolarHBondContact ND2-O 3.12Å
86	F	97.3	Very high	91.5	Very high	24 Å²	24	63.9 Å²	63.9	11%	0.105	32%	0.323	C	S	.	.	S	Bend	trans	-140.3	165.7	176.4	51	-90.2	0	0	0	110.3	P84 F88 E134 K135 L137 F138 I161 P163	P84-F86 HydrophobicContact CB-CD2 4.45Å; P84-F86 HydrophobicContact CB-CE1 4.4Å; P84-F86 HydrophobicContact CB-CE2 4.32Å; P84-F86 HydrophobicContact CB-CZ 4.29Å; P84-F86 PolarHBondContact O-N 3.1Å; F86-F88 HydrophobicContact CD2-CB 4.16Å; F86-F88 AromaticContact CD2-CD1 3.88Å; F86-F88 HydrophobicContact CD2-CD1 3.88Å; F86-F88 HydrophobicContact CD2-CG 4.38Å; F86-F88 HydrophobicContact CE2-CB 4.19Å; F86-F88 AromaticContact CE2-CD1 3.52Å; F86-F88 HydrophobicContact CE2-CD1 3.52Å; F86-F88 HydrophobicContact CE2-CE1 4.13Å; F86-F88 HydrophobicContact CE2-CG 4.02Å; F86-E134 WeakPolarHBondContact CD1-O 3.09Å; F86-E134 WeakPolarHBondContact CE1-O 3.47Å; F86-K135 WeakPolarHBondContact CB-O 3.17Å; F86-K135 WeakPolarHBondContact CD1-O 3.05Å; F86-L137 VanDerWaalsContact CE1-C 3.43Å; F86-F138 HydrophobicContact CE1-CB 4.03Å; F86-F138 HydrophobicContact CZ-CB 3.84Å; F86-I161 HydrophobicContact CE2-CG2 4.3Å; F86-I161 HydrophobicContact CZ-CG2 4.42Å; F86-I161 WeakPolarHBondContact CZ-O 2.99Å; F86-P163 HydrophobicContact CB-CB 4.24Å; F86-P163 HydrophobicContact CB-CG 3.93Å; F86-P163 HydrophobicContact CD1-CG 4.31Å; F86-P163 HydrophobicContact CD2-CB 4.12Å; F86-P163 HydrophobicContact CD2-CG 3.95Å; F86-P163 HydrophobicContact CG-CB 4.3Å; F86-P163 HydrophobicContact CG-CG 3.8Å
87	Q	96.2	Very high	92.6	Very high	159 Å²	159	64.6 Å²	64.6	74%	0.743	33%	0.326	S	S	*	.			trans	-96.9	134.3	171.7	-66.7	-175.9	9.9	0	0	109.4
88	F	96.3	Very high	93.7	Very high	6 Å²	6	60.7 Å²	60.7	3%	0.026	30%	0.301	C	S	.	.			trans	-147.3	166.2	171.4	76.6	-75.8	0	0	0	110.5	P84 F86 Q94 V95 F98 I161	P84-F88 HydrophobicContact CB-CD1 4.46Å; P84-F88 HydrophobicContact CB-CE1 4.17Å; P84-F88 HydrophobicContact CG-CD1 4.33Å; P84-F88 HydrophobicContact CG-CE1 3.69Å; F86-F88 HydrophobicContact CD2-CB 4.16Å; F86-F88 AromaticContact CD2-CD1 3.88Å; F86-F88 HydrophobicContact CD2-CD1 3.88Å; F86-F88 HydrophobicContact CD2-CG 4.38Å; F86-F88 HydrophobicContact CE2-CB 4.19Å; F86-F88 AromaticContact CE2-CD1 3.52Å; F86-F88 HydrophobicContact CE2-CD1 3.52Å; F86-F88 HydrophobicContact CE2-CE1 4.13Å; F86-F88 HydrophobicContact CE2-CG 4.02Å; F88-Q94 PolarHBondContact O-NE2 3.18Å; F88-Q94 VanDerWaalsContact O-NE2 3.12Å; F88-V95 HydrophobicContact CD1-CB 4.27Å; F88-V95 HydrophobicContact CD2-CG2 4.17Å; F88-V95 HydrophobicContact CE1-CB 3.74Å; F88-V95 HydrophobicContact CE1-CG1 3.81Å; F88-V95 HydrophobicContact CE1-CG2 4.04Å; F88-V95 HydrophobicContact CE2-CB 4.26Å; F88-V95 HydrophobicContact CE2-CG2 3.61Å; F88-V95 HydrophobicContact CZ-CB 3.75Å; F88-V95 HydrophobicContact CZ-CG1 3.74Å; F88-V95 HydrophobicContact CZ-CG2 3.55Å; F88-V95 PolarHBondContact O-N 2.96Å; F88-F98 HydrophobicContact CE1-CD1 4.39Å; F88-F98 HydrophobicContact CE1-CE1 4.02Å; F88-F98 HydrophobicContact CZ-CD1 4.19Å; F88-F98 HydrophobicContact CZ-CE1 4.06Å; F88-I161 HydrophobicContact CD1-CG2 4.43Å; F88-I161 HydrophobicContact CD2-CG2 3.87Å; F88-I161 HydrophobicContact CE1-CG2 4.16Å; F88-I161 HydrophobicContact CE2-CG2 3.56Å; F88-I161 HydrophobicContact CG-CG2 4.29Å; F88-I161 HydrophobicContact CZ-CG2 3.71Å
89	K	95.6	Very high	94.7	Very high	119 Å²	119	57.2 Å²	57.2	52%	0.517	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	143.4	175.3	-67.4	177.4	179.4	176.1	0	110.6	S93	K89-S93 CarbonylContact C-O 3.57Å; K89-S93 VanDerWaalsContact CA-O 3.29Å; K89-S93 WeakPolarHBondContact CA-O 3.39Å
90	Y	96.6	Very high	95.2	Very high	1 Å²	1	53.2 Å²	53.2	0%	0.004	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.3	172.6	-175.8	-91.5	0	0	0	108.3	Y56 E92 S93 I108 Q116 I117 I167 M187 R188	Y56-Y90 WeakPolarHBondContact OH-CA 3.41Å; Y90-E92 VanDerWaalsContact C-N 3.32Å; Y90-E92 PolarHBondContact O-N 3.4Å; Y90-S93 PolarHBondContact N-O 3.02Å; Y90-S93 WeakPolarHBondContact O-CB 3.28Å; Y90-S93 PolarHBondContact O-N 3.43Å; Y90-I108 HydrophobicContact CD1-CB 4.36Å; Y90-I108 HydrophobicContact CD1-CG1 4.48Å; Y90-I108 HydrophobicContact CD1-CG2 4.1Å; Y90-I108 HydrophobicContact CD2-CG1 4.26Å; Y90-I108 HydrophobicContact CD2-CG2 4.47Å; Y90-I108 HydrophobicContact CE1-CG1 4.44Å; Y90-I108 HydrophobicContact CE2-CG1 4.2Å; Y90-I108 HydrophobicContact CG-CB 4.48Å; Y90-I108 HydrophobicContact CG-CG1 4.39Å; Y90-I108 HydrophobicContact CG-CG2 3.92Å; Y90-Q116 PolarHBondContact OH-O 2.88Å; Y90-I117 HydrophobicContact CE2-CD1 4.4Å; Y90-I117 HydrophobicContact CE2-CG1 4.24Å; Y90-I167 HydrophobicContact CD2-CD1 3.83Å; Y90-I167 HydrophobicContact CE2-CD1 3.73Å; Y90-M187 HydrophobicContact CE2-CG 4.01Å; Y90-M187 HydrophobicContact CE2-SD 4.05Å; Y90-M187 WeakPolarHBondContact OH-CG 3.29Å; Y90-R188 VanDerWaalsContact CE1-O 3.26Å; Y90-R188 WeakPolarHBondContact CE1-O 3.47Å; Y90-R188 VanDerWaalsContact OH-C 3.31Å; Y90-R188 PolarHBondContact OH-N 3.36Å; Y90-R188 PolarHBondContact OH-O 3.08Å
91	Y	94.1	Very high	95.4	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.016	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	45	55.1	-168	-74.7	-97.8	0	0	0	112.5	Y54 N55 Y56 S93 M187 G189 F191	Y54-Y91 AromaticContact CD1-CD1 4Å; Y54-Y91 HydrophobicContact CD1-CD1 4Å; Y54-Y91 HydrophobicContact CD1-CE1 4.09Å; Y54-Y91 HydrophobicContact CE1-CD1 4.26Å; Y54-Y91 WeakPolarHBondContact O-CE1 3.14Å; N55-Y91 HydrophobicContact CB-CD1 3.88Å; N55-Y91 HydrophobicContact CB-CE1 4.4Å; N55-Y91 WeakPolarHBondContact ND2-CA 3.42Å; Y56-Y91 HydrophobicContact CD2-CD1 4.23Å; Y56-Y91 HydrophobicContact CD2-CD2 4.29Å; Y56-Y91 HydrophobicContact CD2-CE1 4.02Å; Y56-Y91 HydrophobicContact CD2-CE2 4.1Å; Y56-Y91 HydrophobicContact CD2-CG 4.39Å; Y56-Y91 AromaticContact CD2-CZ 3.97Å; Y56-Y91 HydrophobicContact CE2-CD1 4.06Å; Y56-Y91 AromaticContact CE2-CD2 3.54Å; Y56-Y91 HydrophobicContact CE2-CD2 3.54Å; Y56-Y91 HydrophobicContact CE2-CE1 4.19Å; Y56-Y91 AromaticContact CE2-CE2 3.71Å; Y56-Y91 HydrophobicContact CE2-CE2 3.71Å; Y56-Y91 AromaticContact CE2-CG 3.77Å; Y56-Y91 HydrophobicContact CE2-CG 3.77Å; Y56-Y91 PolarHBondContact OH-N 3.21Å; Y56-Y91 VanDerWaalsContact OH-N 3.13Å; Y91-S93 PolarHBondContact O-N 2.94Å; Y91-M187 HydrophobicContact CE2-CE 3.74Å; Y91-M187 HydrophobicContact CE2-CG 4.27Å; Y91-G189 VanDerWaalsContact CE2-CA 3.46Å; Y91-F191 HydrophobicContact CD1-CE2 4.33Å; Y91-F191 AromaticContact CD1-CZ 3.78Å; Y91-F191 HydrophobicContact CD1-CZ 3.78Å; Y91-F191 HydrophobicContact CG-CZ 4.11Å
92	E	90.9	Very high	95.2	Very high	108 Å²	108	47.3 Å²	47.3	51%	0.505	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	-3.3	-176.7	-74	173	175.7	0	0	116.3	N55 Y90	N55-E92 WeakPolarHBondContact ND2-CG 3.31Å; N55-E92 PolarHBondContact ND2-N 3.4Å; Y90-E92 VanDerWaalsContact C-N 3.32Å; Y90-E92 PolarHBondContact O-N 3.4Å
93	S	92.9	Very high	94.8	Very high	36 Å²	36	51.7 Å²	51.7	25%	0.252	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	129.7	178.1	-70.6	0	0	0	0	111.4	K89 Y90 Y91 V95	K89-S93 CarbonylContact C-O 3.57Å; K89-S93 VanDerWaalsContact CA-O 3.29Å; K89-S93 WeakPolarHBondContact CA-O 3.39Å; Y90-S93 PolarHBondContact N-O 3.02Å; Y90-S93 WeakPolarHBondContact O-CB 3.28Å; Y90-S93 PolarHBondContact O-N 3.43Å; Y91-S93 PolarHBondContact O-N 2.94Å; S93-V95 PolarHBondContact O-N 3.28Å
94	Q	95.7	Very high	94.6	Very high	60 Å²	60	44.4 Å²	44.4	28%	0.28	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	125.4	175	-173.5	61.6	39	0	0	110.6	F88 K110	F88-Q94 PolarHBondContact O-NE2 3.18Å; F88-Q94 VanDerWaalsContact O-NE2 3.12Å; Q94-K110 WeakPolarHBondContact O-CG 3.42Å
95	V	97.7	Very high	94.4	Very high	9 Å²	9	43.9 Å²	43.9	6%	0.055	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-84.1	138.4	176.4	-177.8	0	0	0	0	109.9	F88 S93 N97 F98 I108 I114	F88-V95 HydrophobicContact CD1-CB 4.27Å; F88-V95 HydrophobicContact CD2-CG2 4.17Å; F88-V95 HydrophobicContact CE1-CB 3.74Å; F88-V95 HydrophobicContact CE1-CG1 3.81Å; F88-V95 HydrophobicContact CE1-CG2 4.04Å; F88-V95 HydrophobicContact CE2-CB 4.26Å; F88-V95 HydrophobicContact CE2-CG2 3.61Å; F88-V95 HydrophobicContact CZ-CB 3.75Å; F88-V95 HydrophobicContact CZ-CG1 3.74Å; F88-V95 HydrophobicContact CZ-CG2 3.55Å; F88-V95 PolarHBondContact O-N 2.96Å; S93-V95 PolarHBondContact O-N 3.28Å; V95-N97 WeakPolarHBondContact CG1-O 3.28Å; V95-F98 HydrophobicContact CG1-CD1 4.22Å; V95-I108 HydrophobicContact CB-CG2 4.45Å; V95-I108 HydrophobicContact CG1-CG2 3.94Å; V95-I108 HydrophobicContact CG2-CG2 3.65Å; V95-I114 HydrophobicContact CG2-CD1 4.19Å
96	N	97.1	Very high	94.4	Very high	78 Å²	78	39.3 Å²	39.3	42%	0.417	19%	0.187	S	C	.	.			trans	-101.3	-49.1	174.9	-74.1	-10.9	0	0	0	111.6	Q109 K110	N96-Q109 PolarHBondContact N-O 3.39Å; N96-K110 VanDerWaalsContact ND2-C 3.32Å; N96-K110 PolarHBondContact ND2-O 3.23Å
97	N	97.1	Very high	94.4	Very high	26 Å²	26	38.9 Å²	38.9	14%	0.139	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	173.1	177.9	68.1	45.3	0	0	0	108.8	E81 V82 V95 Q109	E81-N97 HydrophobicContact CG-CB 4.26Å; E81-N97 VanDerWaalsContact OE1-CG 3.28Å; E81-N97 PolarHBondContact OE1-ND2 3.45Å; V82-N97 CarbonylContact O-C 3.51Å; V82-N97 VanDerWaalsContact O-CA 3.28Å; V82-N97 WeakPolarHBondContact O-CA 3.42Å; V82-N97 WeakPolarHBondContact O-CB 3.12Å; V95-N97 WeakPolarHBondContact CG1-O 3.28Å; N97-Q109 PolarHBondContact O-N 2.87Å; N97-Q109 VanDerWaalsContact O-O 3.12Å; N97-Q109 VanDerWaalsContact OD1-CB 3.28Å; N97-Q109 WeakPolarHBondContact OD1-CB 3.15Å; N97-Q109 PolarHBondContact OD1-OE1 3.29Å
98	F	96.1	Very high	94.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	153.9	166.1	46.7	-109.1	0	0	0	110.9	V82 P84 F88 V95 V100 I106 D107 I108 F138 I161	V82-F98 HydrophobicContact CB-CD2 3.83Å; V82-F98 HydrophobicContact CB-CE2 3.48Å; V82-F98 VanDerWaalsContact CB-CE2 3.48Å; V82-F98 HydrophobicContact CB-CZ 4.23Å; V82-F98 HydrophobicContact CG1-CD2 4.41Å; V82-F98 HydrophobicContact CG1-CE2 3.6Å; V82-F98 HydrophobicContact CG1-CZ 3.89Å; V82-F98 HydrophobicContact CG2-CE2 4.17Å; V82-F98 PolarHBondContact N-O 3.15Å; V82-F98 PolarHBondContact O-N 3.42Å; P84-F98 HydrophobicContact CB-CE1 4.27Å; P84-F98 HydrophobicContact CG-CD1 4.08Å; P84-F98 HydrophobicContact CG-CE1 3.56Å; P84-F98 HydrophobicContact CG-CZ 4.26Å; F88-F98 HydrophobicContact CE1-CD1 4.39Å; F88-F98 HydrophobicContact CE1-CE1 4.02Å; F88-F98 HydrophobicContact CZ-CD1 4.19Å; F88-F98 HydrophobicContact CZ-CE1 4.06Å; V95-F98 HydrophobicContact CG1-CD1 4.22Å; F98-V100 HydrophobicContact CD2-CG2 3.87Å; F98-V100 HydrophobicContact CE2-CG2 3.98Å; F98-I106 HydrophobicContact CB-CG2 3.81Å; F98-I106 HydrophobicContact CD2-CG2 3.81Å; F98-I106 HydrophobicContact CG-CG2 3.91Å; F98-D107 CarbonylContact C-O 3.5Å; F98-D107 WeakPolarHBondContact CA-O 3.5Å; F98-D107 WeakPolarHBondContact CB-O 3.35Å; F98-I108 HydrophobicContact CB-CD1 3.9Å; F98-I108 HydrophobicContact CD1-CD1 4.29Å; F98-I108 HydrophobicContact CG-CD1 4.31Å; F98-F138 AromaticContact CE2-CD1 3.96Å; F98-F138 HydrophobicContact CE2-CD1 3.96Å; F98-F138 AromaticContact CE2-CD2 3.83Å; F98-F138 HydrophobicContact CE2-CD2 3.83Å; F98-F138 AromaticContact CE2-CE1 3.7Å; F98-F138 HydrophobicContact CE2-CE1 3.7Å; F98-F138 AromaticContact CE2-CE2 3.57Å; F98-F138 HydrophobicContact CE2-CE2 3.57Å; F98-F138 HydrophobicContact CE2-CG 4.03Å; F98-F138 AromaticContact CE2-CZ 3.51Å; F98-F138 HydrophobicContact CE2-CZ 3.51Å; F98-F138 HydrophobicContact CZ-CB 4.19Å; F98-F138 AromaticContact CZ-CD1 3.65Å; F98-F138 HydrophobicContact CZ-CD1 3.65Å; F98-F138 AromaticContact CZ-CD2 3.64Å; F98-F138 HydrophobicContact CZ-CD2 3.64Å; F98-F138 AromaticContact CZ-CE1 3.9Å; F98-F138 HydrophobicContact CZ-CE1 3.9Å; F98-F138 AromaticContact CZ-CE2 3.9Å; F98-F138 HydrophobicContact CZ-CE2 3.9Å; F98-F138 AromaticContact CZ-CG 3.52Å; F98-F138 HydrophobicContact CZ-CG 3.52Å; F98-F138 HydrophobicContact CZ-CZ 4.03Å; F98-I161 HydrophobicContact CE1-CD1 4.15Å; F98-I161 HydrophobicContact CZ-CD1 4.4Å
99	N	95.3	Very high	94.5	Very high	27 Å²	27	33.3 Å²	33.3	14%	0.144	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.6	174.8	-68.9	-61.9	0	0	0	110	E80 E81 Y101 I106 D107 Q109	E80-N99 CarbonylContact O-C 3.49Å; E80-N99 WeakPolarHBondContact O-CA 3.35Å; E81-N99 VanDerWaalsContact CA-OD1 3.31Å; E81-N99 WeakPolarHBondContact CA-OD1 2.84Å; E81-N99 VanDerWaalsContact CB-OD1 3.31Å; E81-N99 WeakPolarHBondContact CB-OD1 3.13Å; N99-Y101 HydrophobicContact CB-CD2 4.45Å; N99-Y101 HydrophobicContact CB-CE2 3.63Å; N99-I106 CarbonylContact O-C 3.57Å; N99-I106 VanDerWaalsContact O-CA 3.31Å; N99-I106 WeakPolarHBondContact O-CA 3.29Å; N99-D107 HydrophobicContact CB-CB 4.31Å; N99-D107 PolarHBondContact N-O 2.93Å; N99-D107 PolarHBondContact O-N 3Å; N99-Q109 PolarHBondContact ND2-NE2 3.05Å
100	V	94.4	Very high	94.3	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125	176.5	-172.2	0	0	0	0	108.3	N79 E80 V82 F98 V129 V131 F138 A140 W142	N79-V100 WeakPolarHBondContact CA-O 3.47Å; E80-V100 PolarHBondContact N-O 2.89Å; E80-V100 PolarHBondContact O-N 2.89Å; V82-V100 HydrophobicContact CG2-CG2 3.92Å; F98-V100 HydrophobicContact CD2-CG2 3.87Å; F98-V100 HydrophobicContact CE2-CG2 3.98Å; V100-V129 HydrophobicContact CG1-CG2 3.79Å; V100-V131 HydrophobicContact CG1-CG1 4.14Å; V100-V131 HydrophobicContact CG2-CG1 4.47Å; V100-F138 HydrophobicContact CG2-CE2 4.38Å; V100-F138 HydrophobicContact CG2-CZ 3.69Å; V100-A140 HydrophobicContact CG1-CB 4.25Å; V100-W142 HydrophobicContact CG1-CZ2 4.14Å
101	Y	92.1	Very high	94.1	Very high	46 Å²	46	38.2 Å²	38.2	18%	0.18	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	139.8	-178.5	-60.7	-88.2	0	0	0	111.2	N79 N99 Y103 G104 T105 D107 W142	N79-Y101 HydrophobicContact CB-CD1 4.18Å; N79-Y101 HydrophobicContact CB-CE1 4.38Å; N79-Y101 WeakPolarHBondContact OD1-CD1 3.47Å; N99-Y101 HydrophobicContact CB-CD2 4.45Å; N99-Y101 HydrophobicContact CB-CE2 3.63Å; Y101-Y103 VanDerWaalsContact CB-CE1 3.44Å; Y101-Y103 VanDerWaalsContact CB-CZ 3.45Å; Y101-Y103 AromaticContact CD1-CE1 3.59Å; Y101-Y103 HydrophobicContact CD1-CE1 3.59Å; Y101-Y103 AromaticContact CD1-CZ 3.64Å; Y101-Y103 VanDerWaalsContact CD1-OH 3.27Å; Y101-Y103 WeakPolarHBondContact CD1-OH 3.36Å; Y101-Y103 AromaticContact CG-CE1 3.72Å; Y101-Y103 HydrophobicContact CG-CE1 3.72Å; Y101-Y103 HydrophobicContact CG-CE2 4.18Å; Y101-Y103 AromaticContact CG-CZ 3.48Å; Y101-Y103 VanDerWaalsContact CG-CZ 3.48Å; Y101-Y103 VanDerWaalsContact CG-OH 3.31Å; Y101-Y103 PolarHBondContact O-N 2.83Å; Y101-Y103 VanDerWaalsContact O-N 3.1Å; Y101-G104 PolarHBondContact O-N 3.36Å; Y101-G104 VanDerWaalsContact O-N 3.09Å; Y101-T105 HydrophobicContact CD2-CG2 3.99Å; Y101-T105 WeakPolarHBondContact CD2-O 3.23Å; Y101-T105 PolarHBondContact N-O 3.45Å; Y101-D107 HydrophobicContact CE2-CB 3.69Å; Y101-W142 PolarHBondContact O-NE1 3.33Å
102	S	89.5	Confident	93.9	Very high	17 Å²	17	42.2 Å²	42.2	12%	0.119	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.9	178.4	60.3	0	0	0	0	114.1	T78 G104 G126 S127	T78-S102 VanDerWaalsContact O-CB 3.27Å; T78-S102 WeakPolarHBondContact O-CB 3.35Å; T78-S102 PolarHBondContact O-N 2.8Å; T78-S102 PolarHBondContact O-OG 2.6Å; S102-G104 VanDerWaalsContact C-N 3.26Å; S102-G104 PolarHBondContact O-N 3.07Å; S102-G126 CarbonylContact O-C 3.55Å; S102-G126 WeakPolarHBondContact O-CA 3.09Å; S102-S127 VanDerWaalsContact CB-O 3.28Å; S102-S127 WeakPolarHBondContact CB-O 3.3Å; S102-S127 PolarHBondContact O-N 3.14Å
103	Y	87.6	Confident	94.1	Very high	99 Å²	99	41.5 Å²	41.5	39%	0.388	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	12.2	177.8	58.6	-101.5	0	0	0	115.2	Y101 T105 F120 G126	Y101-Y103 VanDerWaalsContact CB-CE1 3.44Å; Y101-Y103 VanDerWaalsContact CB-CZ 3.45Å; Y101-Y103 AromaticContact CD1-CE1 3.59Å; Y101-Y103 HydrophobicContact CD1-CE1 3.59Å; Y101-Y103 AromaticContact CD1-CZ 3.64Å; Y101-Y103 VanDerWaalsContact CD1-OH 3.27Å; Y101-Y103 WeakPolarHBondContact CD1-OH 3.36Å; Y101-Y103 AromaticContact CG-CE1 3.72Å; Y101-Y103 HydrophobicContact CG-CE1 3.72Å; Y101-Y103 HydrophobicContact CG-CE2 4.18Å; Y101-Y103 AromaticContact CG-CZ 3.48Å; Y101-Y103 VanDerWaalsContact CG-CZ 3.48Å; Y101-Y103 VanDerWaalsContact CG-OH 3.31Å; Y101-Y103 PolarHBondContact O-N 2.83Å; Y101-Y103 VanDerWaalsContact O-N 3.1Å; Y103-T105 VanDerWaalsContact CE2-CB 3.49Å; Y103-T105 HydrophobicContact CE2-CG2 4.29Å; Y103-T105 VanDerWaalsContact CE2-OG1 3.32Å; Y103-T105 WeakPolarHBondContact CE2-OG1 3.18Å; Y103-F120 WeakPolarHBondContact O-CB 3.26Å; Y103-G126 VanDerWaalsContact CA-CA 3.44Å
104	G	90.6	Very high	94.2	Very high	2 Å²	2	40.4 Å²	40.4	2%	0.021	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	34.4	172.5	0	0	0	0	0	113.6	Y101 S102 I119	Y101-G104 PolarHBondContact O-N 3.36Å; Y101-G104 VanDerWaalsContact O-N 3.09Å; S102-G104 VanDerWaalsContact C-N 3.26Å; S102-G104 PolarHBondContact O-N 3.07Å; G104-I119 VanDerWaalsContact CA-O 3.29Å; G104-I119 WeakPolarHBondContact CA-O 3.11Å; G104-I119 CarbonylContact O-C 3.45Å; G104-I119 WeakPolarHBondContact O-CA 3.31Å; G104-I119 PolarHBondContact O-N 3.22Å
105	T	93	Very high	94.3	Very high	4 Å²	4	37.6 Å²	37.6	3%	0.025	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	141.3	177.1	-67.6	0	0	0	0	110.1	Y101 Y103 Q116 I117 D118	Y101-T105 HydrophobicContact CD2-CG2 3.99Å; Y101-T105 WeakPolarHBondContact CD2-O 3.23Å; Y101-T105 PolarHBondContact N-O 3.45Å; Y103-T105 VanDerWaalsContact CE2-CB 3.49Å; Y103-T105 HydrophobicContact CE2-CG2 4.29Å; Y103-T105 VanDerWaalsContact CE2-OG1 3.32Å; Y103-T105 WeakPolarHBondContact CE2-OG1 3.18Å; T105-Q116 HydrophobicContact CG2-CG 3.67Å; T105-I117 CarbonylContact C-O 3.59Å; T105-I117 VanDerWaalsContact CA-O 3.32Å; T105-I117 WeakPolarHBondContact CA-O 3.47Å; T105-D118 WeakPolarHBondContact CG2-OD1 3.29Å; T105-D118 PolarHBondContact OG1-OD1 3.01Å
106	I	96	Very high	94.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.6	164	-54.4	178.6	0	0	0	107.9	F98 N99 I108 Q116 I117 F138 A140 W142 C159 I161	F98-I106 HydrophobicContact CB-CG2 3.81Å; F98-I106 HydrophobicContact CD2-CG2 3.81Å; F98-I106 HydrophobicContact CG-CG2 3.91Å; N99-I106 CarbonylContact O-C 3.57Å; N99-I106 VanDerWaalsContact O-CA 3.31Å; N99-I106 WeakPolarHBondContact O-CA 3.29Å; I106-I108 HydrophobicContact CB-CD1 4.46Å; I106-I108 HydrophobicContact CG2-CD1 3.57Å; I106-Q116 CarbonylContact O-C 3.58Å; I106-Q116 VanDerWaalsContact O-CA 3.3Å; I106-Q116 WeakPolarHBondContact O-CA 3.48Å; I106-I117 HydrophobicContact CB-CB 4.31Å; I106-I117 PolarHBondContact N-O 3Å; I106-I117 PolarHBondContact O-N 3.19Å; I106-F138 HydrophobicContact CD1-CE1 3.96Å; I106-A140 HydrophobicContact CD1-CB 4.34Å; I106-W142 HydrophobicContact CD1-CH2 3.81Å; I106-W142 HydrophobicContact CD1-CZ2 4.27Å; I106-W142 HydrophobicContact CG1-CH2 3.83Å; I106-W142 HydrophobicContact CG1-CZ2 3.85Å; I106-C159 HydrophobicContact CD1-CB 4.22Å; I106-I161 HydrophobicContact CD1-CD1 4.41Å
107	D	96.8	Very high	94.3	Very high	15 Å²	15	35.1 Å²	35.1	8%	0.08	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.1	175	-177.7	49.8	0	0	0	110.3	F98 N99 Y101 Q109 R113	F98-D107 CarbonylContact C-O 3.5Å; F98-D107 WeakPolarHBondContact CA-O 3.5Å; F98-D107 WeakPolarHBondContact CB-O 3.35Å; N99-D107 HydrophobicContact CB-CB 4.31Å; N99-D107 PolarHBondContact N-O 2.93Å; N99-D107 PolarHBondContact O-N 3Å; Y101-D107 HydrophobicContact CE2-CB 3.69Å; D107-Q109 PolarHBondContact OD2-NE2 3.41Å; D107-R113 WeakPolarHBondContact OD1-CD 3.37Å; D107-R113 WeakPolarHBondContact OD1-CG 3.46Å
108	I	98.1	Very high	94.1	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	124.5	-171	-49.8	-66.7	0	0	0	110.1	Y90 V95 F98 I106 I114 G115 I117	Y90-I108 HydrophobicContact CD1-CB 4.36Å; Y90-I108 HydrophobicContact CD1-CG1 4.48Å; Y90-I108 HydrophobicContact CD1-CG2 4.1Å; Y90-I108 HydrophobicContact CD2-CG1 4.26Å; Y90-I108 HydrophobicContact CD2-CG2 4.47Å; Y90-I108 HydrophobicContact CE1-CG1 4.44Å; Y90-I108 HydrophobicContact CE2-CG1 4.2Å; Y90-I108 HydrophobicContact CG-CB 4.48Å; Y90-I108 HydrophobicContact CG-CG1 4.39Å; Y90-I108 HydrophobicContact CG-CG2 3.92Å; V95-I108 HydrophobicContact CB-CG2 4.45Å; V95-I108 HydrophobicContact CG1-CG2 3.94Å; V95-I108 HydrophobicContact CG2-CG2 3.65Å; F98-I108 HydrophobicContact CB-CD1 3.9Å; F98-I108 HydrophobicContact CD1-CD1 4.29Å; F98-I108 HydrophobicContact CG-CD1 4.31Å; I106-I108 HydrophobicContact CB-CD1 4.46Å; I106-I108 HydrophobicContact CG2-CD1 3.57Å; I108-I114 HydrophobicContact CB-CG1 4.33Å; I108-I114 HydrophobicContact CG2-CD1 4Å; I108-I114 HydrophobicContact CG2-CG1 3.88Å; I108-I114 WeakPolarHBondContact O-CG1 3.28Å; I108-I114 PolarHBondContact O-N 3.38Å; I108-G115 PolarHBondContact N-O 3.13Å; I108-G115 PolarHBondContact O-N 2.98Å; I108-I117 HydrophobicContact CD1-CD1 4.35Å
109	Q	96.6	Very high	93.9	Very high	48 Å²	48	34.5 Å²	34.5	22%	0.224	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149.6	-172.6	-44.3	-165.8	-12.3	0	0	114.2	N96 N97 N99 D107	N96-Q109 PolarHBondContact N-O 3.39Å; N97-Q109 PolarHBondContact O-N 2.87Å; N97-Q109 VanDerWaalsContact O-O 3.12Å; N97-Q109 VanDerWaalsContact OD1-CB 3.28Å; N97-Q109 WeakPolarHBondContact OD1-CB 3.15Å; N97-Q109 PolarHBondContact OD1-OE1 3.29Å; N99-Q109 PolarHBondContact ND2-NE2 3.05Å; D107-Q109 PolarHBondContact OD2-NE2 3.41Å
110	K	93.3	Very high	93.2	Very high	92 Å²	92	35.6 Å²	35.6	40%	0.4	17%	0.17	S	C	.	.	S	Bend	trans	-118.6	-107.8	166.2	-172.7	-176.2	-178.4	-178.7	0	109.1	Q94 N96 I112 I114	Q94-K110 WeakPolarHBondContact O-CG 3.42Å; N96-K110 VanDerWaalsContact ND2-C 3.32Å; N96-K110 PolarHBondContact ND2-O 3.23Å; K110-I112 PolarHBondContact N-O 3.48Å; K110-I114 HydrophobicContact CB-CD1 4.33Å; K110-I114 HydrophobicContact CB-CG2 3.91Å
111	V	90.4	Very high	92.3	Very high	131 Å²	131	36.1 Å²	36.1	79%	0.794	17%	0.172	S	C	*	.	S	Bend	trans	-86.6	-31.9	164.3	177.1	0	0	0	0	109.6
112	I	90.9	Very high	91.6	Very high	88 Å²	88	38.1 Å²	38.1	45%	0.451	19%	0.185	S	C	.	.	S	Bend	trans	-126.8	168.8	173.8	62.3	-174.6	0	0	0	107.8	K110 I114 W192	K110-I112 PolarHBondContact N-O 3.48Å; I112-I114 PolarHBondContact O-N 2.85Å; I112-W192 HydrophobicContact CD1-CG 3.95Å
113	R	94.1	Very high	90.6	Very high	93 Å²	93	41.3 Å²	41.3	35%	0.351	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	128.3	170.3	-176.7	178.4	66.5	177.5	3.7	110.3	D107 I190 E197	D107-R113 WeakPolarHBondContact OD1-CD 3.37Å; D107-R113 WeakPolarHBondContact OD1-CG 3.46Å; R113-I190 HydrophobicContact CG-CD1 4.03Å; R113-I190 VanDerWaalsContact NE-CD1 3.34Å; R113-E197 IonicContact NH2-OE1 3.83Å; R113-E197 IonicContact NH2-OE2 3.22Å
114	I	95.9	Very high	89.7	Confident	14 Å²	14	39.6 Å²	39.6	7%	0.072	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-7	179.1	59	166.4	0	0	0	112.9	V95 I108 K110 I112 I190	V95-I114 HydrophobicContact CG2-CD1 4.19Å; I108-I114 HydrophobicContact CB-CG1 4.33Å; I108-I114 HydrophobicContact CG2-CD1 4Å; I108-I114 HydrophobicContact CG2-CG1 3.88Å; I108-I114 WeakPolarHBondContact O-CG1 3.28Å; I108-I114 PolarHBondContact O-N 3.38Å; K110-I114 HydrophobicContact CB-CD1 4.33Å; K110-I114 HydrophobicContact CB-CG2 3.91Å; I112-I114 PolarHBondContact O-N 2.85Å; I114-I190 PolarHBondContact O-N 3.35Å
115	G	97.3	Very high	88.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.1	176.6	-178.9	0	0	0	0	0	114.4	I108 R188	I108-G115 PolarHBondContact N-O 3.13Å; I108-G115 PolarHBondContact O-N 2.98Å; G115-R188 CarbonylContact C-O 3.52Å; G115-R188 WeakPolarHBondContact CA-O 3.4Å
116	Q	97.1	Very high	87	Confident	35 Å²	35	47.9 Å²	47.9	16%	0.164	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	137.1	-178.8	-171.3	172.4	-20.6	0	0	109.6	Y90 T105 I106 D118 R188	Y90-Q116 PolarHBondContact OH-O 2.88Å; T105-Q116 HydrophobicContact CG2-CG 3.67Å; I106-Q116 CarbonylContact O-C 3.58Å; I106-Q116 VanDerWaalsContact O-CA 3.3Å; I106-Q116 WeakPolarHBondContact O-CA 3.48Å; Q116-D118 VanDerWaalsContact NE2-CG 3.28Å; Q116-D118 PolarHBondContact NE2-OD1 2.86Å; Q116-D118 PolarHBondContact NE2-OD2 2.71Å; Q116-D118 VanDerWaalsContact NE2-OD2 3.14Å; Q116-R188 HydrophobicContact CB-CB 4.37Å; Q116-R188 PolarHBondContact N-O 2.72Å; Q116-R188 PolarHBondContact O-N 2.86Å
117	I	97.4	Very high	85.9	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.9	167.7	-56.3	166.9	0	0	0	106.3	Y90 T105 I106 I108 I119 I161 I167 I169 M187	Y90-I117 HydrophobicContact CE2-CD1 4.4Å; Y90-I117 HydrophobicContact CE2-CG1 4.24Å; T105-I117 CarbonylContact C-O 3.59Å; T105-I117 VanDerWaalsContact CA-O 3.32Å; T105-I117 WeakPolarHBondContact CA-O 3.47Å; I106-I117 HydrophobicContact CB-CB 4.31Å; I106-I117 PolarHBondContact N-O 3Å; I106-I117 PolarHBondContact O-N 3.19Å; I108-I117 HydrophobicContact CD1-CD1 4.35Å; I117-I119 HydrophobicContact CG2-CD1 4.19Å; I117-I119 HydrophobicContact CG2-CG1 4.21Å; I117-I161 HydrophobicContact CD1-CD1 4.31Å; I117-I167 HydrophobicContact CD1-CD1 4.01Å; I117-I167 HydrophobicContact CD1-CG2 4.04Å; I117-I169 HydrophobicContact CG2-CD1 4.18Å; I117-M187 HydrophobicContact CG1-CG 4.34Å
118	D	94.2	Very high	85.4	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.3	-177.3	-74.6	-44.2	0	0	0	109.7	T105 Q116 F120 S185 K186	T105-D118 WeakPolarHBondContact CG2-OD1 3.29Å; T105-D118 PolarHBondContact OG1-OD1 3.01Å; Q116-D118 VanDerWaalsContact NE2-CG 3.28Å; Q116-D118 PolarHBondContact NE2-OD1 2.86Å; Q116-D118 PolarHBondContact NE2-OD2 2.71Å; Q116-D118 VanDerWaalsContact NE2-OD2 3.14Å; D118-F120 HydrophobicContact CB-CD1 3.79Å; D118-F120 HydrophobicContact CB-CE1 3.65Å; D118-S185 CarbonylContact O-C 3.56Å; D118-S185 WeakPolarHBondContact O-CA 3.44Å; D118-S185 PolarHBondContact O-OG 3.18Å; D118-K186 HydrophobicContact CB-CG 3.8Å; D118-K186 PolarHBondContact N-O 2.77Å; D118-K186 PolarHBondContact O-N 2.85Å; D118-K186 WeakPolarHBondContact OD2-CE 3.33Å; D118-K186 IonicContact OD2-NZ 2.8Å
119	I	90.7	Very high	85	Confident	9 Å²	9	51.2 Å²	51.2	5%	0.046	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	74.6	-177.3	-52.3	172.5	0	0	0	106.8	G104 I117 W142 V157 C159 I169 Y171	G104-I119 VanDerWaalsContact CA-O 3.29Å; G104-I119 WeakPolarHBondContact CA-O 3.11Å; G104-I119 CarbonylContact O-C 3.45Å; G104-I119 WeakPolarHBondContact O-CA 3.31Å; G104-I119 PolarHBondContact O-N 3.22Å; I117-I119 HydrophobicContact CG2-CD1 4.19Å; I117-I119 HydrophobicContact CG2-CG1 4.21Å; I119-W142 HydrophobicContact CD1-CH2 4.18Å; I119-W142 HydrophobicContact CD1-CZ3 3.74Å; I119-V157 HydrophobicContact CG2-CB 4.04Å; I119-V157 HydrophobicContact CG2-CG1 3.5Å; I119-V157 VanDerWaalsContact CG2-CG1 3.5Å; I119-V157 HydrophobicContact CG2-CG2 4.3Å; I119-C159 HydrophobicContact CD1-CB 3.81Å; I119-I169 HydrophobicContact CD1-CB 4.49Å; I119-I169 HydrophobicContact CD1-CD1 3.78Å; I119-I169 HydrophobicContact CD1-CG1 3.89Å; I119-I169 HydrophobicContact CD1-CG2 3.84Å; I119-I169 HydrophobicContact CG1-CD1 4Å; I119-I169 HydrophobicContact CG1-CG2 4.45Å; I119-Y171 HydrophobicContact CG2-CE1 4.35Å
120	F	80.8	Confident	84.7	Confident	51 Å²	51	50.7 Å²	50.7	22%	0.224	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	163	-171	66.3	-100.4	0	0	0	113.1	Y103 D118 L122 Y184	Y103-F120 WeakPolarHBondContact O-CB 3.26Å; D118-F120 HydrophobicContact CB-CD1 3.79Å; D118-F120 HydrophobicContact CB-CE1 3.65Å; F120-L122 HydrophobicContact CD2-CD2 4.48Å; F120-L122 HydrophobicContact CE2-CD2 3.64Å; F120-L122 HydrophobicContact CE2-CG 3.96Å; F120-Y184 AromaticContact CE1-CD1 3.91Å; F120-Y184 HydrophobicContact CE1-CD1 3.91Å; F120-Y184 HydrophobicContact CE2-CD1 4.39Å; F120-Y184 AromaticContact CZ-CD1 3.68Å; F120-Y184 HydrophobicContact CZ-CD1 3.68Å; F120-Y184 HydrophobicContact CZ-CE1 4.47Å; F120-Y184 HydrophobicContact CZ-CG 4.3Å; F120-Y184 PolarHBondContact N-O 3.19Å; F120-Y184 PolarHBondContact O-N 3.28Å
121	I	76.4	Confident	84.7	Confident	10 Å²	10	47 Å²	47	5%	0.051	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	122.5	169.9	-50.6	-164	0	0	0	107.6	G123 E124 I144 I178 L182 L183	I121-G123 PolarHBondContact O-N 3.34Å; I121-E124 HydrophobicContact CB-CB 4.4Å; I121-E124 PolarHBondContact O-N 2.75Å; I121-I144 HydrophobicContact CD1-CD1 4.2Å; I121-I144 HydrophobicContact CD1-CG2 3.58Å; I121-I144 HydrophobicContact CG1-CD1 4.26Å; I121-I144 HydrophobicContact CG1-CG2 4.17Å; I121-I178 HydrophobicContact CD1-CD1 3.58Å; I121-I178 HydrophobicContact CD1-CG1 4.32Å; I121-I178 HydrophobicContact CD1-CG2 4.24Å; I121-I178 HydrophobicContact CG2-CG2 4.32Å; I121-L182 CarbonylContact C-O 3.53Å; I121-L182 WeakPolarHBondContact CA-O 3.37Å; I121-L182 HydrophobicContact CG2-CB 3.85Å; I121-L183 HydrophobicContact CD1-CD2 3.83Å; I121-L183 HydrophobicContact CG1-CD2 3.86Å
122	L	76.5	Confident	84.8	Confident	88 Å²	88	41.7 Å²	41.7	46%	0.461	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	129.6	175.9	-76.6	169	0	0	0	110.9	F120 L182	F120-L122 HydrophobicContact CD2-CD2 4.48Å; F120-L122 HydrophobicContact CE2-CD2 3.64Å; F120-L122 HydrophobicContact CE2-CG 3.96Å; L122-L182 HydrophobicContact CB-CB 4.24Å; L122-L182 HydrophobicContact CB-CD2 3.95Å; L122-L182 PolarHBondContact N-O 3.1Å
123	G	68.2	Low	84.9	Confident	84 Å²	84	39.4 Å²	39.4	87%	0.866	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.1	8.9	176.8	0	0	0	0	0	115.4	I121	I121-G123 PolarHBondContact O-N 3.34Å
124	E	69.3	Low	84.9	Confident	63 Å²	63	39.9 Å²	39.9	29%	0.294	23%	0.227	S	C	.	.			trans	-110.3	127.8	173.7	-164.1	69.4	-143	0	0	110.7	I121 G126 K145 K146	I121-E124 HydrophobicContact CB-CB 4.4Å; I121-E124 PolarHBondContact O-N 2.75Å; E124-G126 PolarHBondContact O-N 2.94Å; E124-K145 WeakPolarHBondContact CG-O 3.35Å; E124-K146 WeakPolarHBondContact OE2-CG 3.32Å
125	D	63.1	Low	84.8	Confident	166 Å²	166	46.5 Å²	46.5	89%	0.888	26%	0.255	S	S	*	.			trans	-80.3	52.3	175.8	-70.1	-25.6	0	0	0	111.6
126	G	64.4	Low	84.6	Confident	14 Å²	14	52.6 Å²	52.6	14%	0.144	29%	0.288	C	S	.	.			trans	63.4	148.3	166.6	0	0	0	0	0	119.3	S102 Y103 E124	S102-G126 CarbonylContact O-C 3.55Å; S102-G126 WeakPolarHBondContact O-CA 3.09Å; Y103-G126 VanDerWaalsContact CA-CA 3.44Å; E124-G126 PolarHBondContact O-N 2.94Å
127	S	73.1	Confident	84.4	Confident	30 Å²	30	52.2 Å²	52.2	21%	0.21	29%	0.286	C	S	.	.			trans	-74.6	-177.9	171.8	-72.5	0	0	0	0	116.2	S102 S143	S102-S127 VanDerWaalsContact CB-O 3.28Å; S102-S127 WeakPolarHBondContact CB-O 3.3Å; S102-S127 PolarHBondContact O-N 3.14Å; S127-S143 WeakPolarHBondContact CA-O 3.31Å; S127-S143 WeakPolarHBondContact CB-O 3.43Å
128	E	85.2	Confident	84.3	Confident	53 Å²	53	52.1 Å²	52.1	25%	0.248	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	135.9	153.5	176.7	170.4	178.5	0	0	108.7	K75 S143	K75-E128 WeakPolarHBondContact CD-OE1 3.38Å; K75-E128 WeakPolarHBondContact CE-OE1 3.38Å; K75-E128 HydrophobicContact CG-CG 4.25Å; K75-E128 WeakPolarHBondContact CG-OE1 3Å; K75-E128 IonicContact NZ-OE1 3.37Å; K75-E128 PolarHBondContact NZ-OE1 2.97Å; K75-E128 IonicContact NZ-OE2 2.81Å; K75-E128 PolarHBondContact NZ-OE2 3.32Å; E128-S143 PolarHBondContact O-N 3.28Å
129	V	89.8	Confident	84.3	Confident	2 Å²	2	52 Å²	52	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	135.6	171.9	60.9	0	0	0	0	109.8	S76 V100 V131 R141 W142	S76-V129 PolarHBondContact N-O 3.22Å; V100-V129 HydrophobicContact CG1-CG2 3.79Å; V129-V131 HydrophobicContact CG2-CG1 4.19Å; V129-R141 WeakPolarHBondContact CA-O 3.34Å; V129-W142 HydrophobicContact CG2-CG 4.4Å
130	Q	91.5	Very high	84.5	Confident	37 Å²	37	51.6 Å²	51.6	17%	0.173	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	138	172.1	-53.2	173.7	-17.3	0	0	108.2	L73 L74 A140 R141	L73-Q130 HydrophobicContact CB-CB 3.72Å; L74-Q130 CarbonylContact O-C 3.45Å; L74-Q130 WeakPolarHBondContact O-CA 3.42Å; L74-Q130 WeakPolarHBondContact O-CB 3.49Å; Q130-A140 CarbonylContact O-C 3.53Å; Q130-A140 WeakPolarHBondContact O-CA 3.27Å; Q130-R141 HydrophobicContact CB-CB 4.45Å; Q130-R141 PolarHBondContact N-O 2.86Å; Q130-R141 PolarHBondContact O-N 2.9Å
131	V	92.3	Very high	85	Confident	14 Å²	14	52.2 Å²	52.2	9%	0.085	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.3	-176.6	-58.4	0	0	0	0	111.3	L74 E80 V100 V129 F138 A139	L74-V131 PolarHBondContact N-O 3.23Å; L74-V131 PolarHBondContact O-N 2.81Å; E80-V131 WeakPolarHBondContact OE2-CG2 3.4Å; V100-V131 HydrophobicContact CG1-CG1 4.14Å; V100-V131 HydrophobicContact CG2-CG1 4.47Å; V129-V131 HydrophobicContact CG2-CG1 4.19Å; V131-F138 HydrophobicContact CB-CE2 4.17Å; V131-F138 HydrophobicContact CG1-CE2 4.39Å; V131-F138 HydrophobicContact CG1-CZ 4.33Å; V131-A139 CarbonylContact C-O 3.59Å; V131-A139 VanDerWaalsContact CA-O 3.29Å; V131-A139 WeakPolarHBondContact CA-O 3.35Å
132	L	92.4	Very high	85.7	Confident	21 Å²	21	52 Å²	52	11%	0.11	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	132.3	167.2	-178.9	76.6	0	0	0	107.7	E71 L73 E134 L137 F138 A139	E71-L132 HydrophobicContact CB-CD2 3.91Å; E71-L132 HydrophobicContact CG-CD2 3.82Å; E71-L132 WeakPolarHBondContact OE2-CD2 3.48Å; L73-L132 HydrophobicContact CD2-CB 3.66Å; L73-L132 HydrophobicContact CG-CB 4.45Å; L132-E134 HydrophobicContact CD1-CG 3.87Å; L132-E134 HydrophobicContact CD2-CG 3.78Å; L132-E134 HydrophobicContact CG-CG 3.75Å; L132-L137 HydrophobicContact CD2-CD1 4.23Å; L132-F138 CarbonylContact O-C 3.55Å; L132-F138 VanDerWaalsContact O-CA 3.32Å; L132-F138 WeakPolarHBondContact O-CA 3.33Å; L132-F138 WeakPolarHBondContact O-CD2 3.47Å; L132-A139 HydrophobicContact CB-CB 4.27Å; L132-A139 PolarHBondContact N-O 3.34Å; L132-A139 PolarHBondContact O-N 3Å
133	N	93.5	Very high	86.2	Confident	40 Å²	40	49 Å²	49	21%	0.214	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	90.2	178.8	-179.9	22.5	0	0	0	108.8	V82 K83 P84 N85 F138	V82-N133 HydrophobicContact CG1-CB 4.25Å; K83-N133 PolarHBondContact O-ND2 3.32Å; P84-N133 WeakPolarHBondContact CA-OD1 3.4Å; N85-N133 PolarHBondContact N-OD1 2.98Å; N85-N133 PolarHBondContact ND2-O 3.12Å; N133-F138 HydrophobicContact CB-CD2 4.19Å
134	E	92.9	Very high	86.8	Confident	102 Å²	102	46 Å²	46	48%	0.477	23%	0.233	S	C	.	.			trans	-106.8	174.9	179.4	-69.6	-62.6	163.3	0	0	110.8	F86 L132 D136 L137	F86-E134 WeakPolarHBondContact CD1-O 3.09Å; F86-E134 WeakPolarHBondContact CE1-O 3.47Å; L132-E134 HydrophobicContact CD1-CG 3.87Å; L132-E134 HydrophobicContact CD2-CG 3.78Å; L132-E134 HydrophobicContact CG-CG 3.75Å; E134-D136 VanDerWaalsContact C-N 3.3Å; E134-D136 PolarHBondContact O-N 2.85Å; E134-L137 CarbonylContact C-O 3.5Å; E134-L137 WeakPolarHBondContact CA-O 3.32Å; E134-L137 PolarHBondContact N-O 2.86Å
135	K	94.5	Very high	87.2	Confident	154 Å²	154	47 Å²	47	67%	0.67	24%	0.236	S	C	*	.	S	Bend	trans	-69	-28.7	178	-67.7	-179	-179.3	176.4	0	113.4	F86	F86-K135 WeakPolarHBondContact CB-O 3.17Å; F86-K135 WeakPolarHBondContact CD1-O 3.05Å
136	D	92.6	Very high	87.6	Confident	128 Å²	128	40.5 Å²	40.5	68%	0.684	20%	0.2	S	C	*	.	S	Bend	trans	-100.1	-17.6	-172.5	-59.5	-32.7	0	0	0	112.9	E134 P163	E134-D136 VanDerWaalsContact C-N 3.3Å; E134-D136 PolarHBondContact O-N 2.85Å; D136-P163 WeakPolarHBondContact O-CD 3.24Å
137	L	94.4	Very high	87.8	Confident	26 Å²	26	46 Å²	46	14%	0.136	23%	0.226	C	C	.	.			trans	-164.2	157.8	173.8	66.4	92.2	0	0	0	112.1	F86 L132 E134 A139 I161 Y162	F86-L137 VanDerWaalsContact CE1-C 3.43Å; L132-L137 HydrophobicContact CD2-CD1 4.23Å; E134-L137 CarbonylContact C-O 3.5Å; E134-L137 WeakPolarHBondContact CA-O 3.32Å; E134-L137 PolarHBondContact N-O 2.86Å; L137-A139 HydrophobicContact CD1-CB 3.8Å; L137-I161 CarbonylContact C-O 3.54Å; L137-I161 WeakPolarHBondContact CA-O 3.37Å; L137-Y162 HydrophobicContact CB-CD1 3.95Å; L137-Y162 HydrophobicContact CB-CE1 4.04Å; L137-Y162 HydrophobicContact CD2-CE1 4.28Å
138	F	95.1	Very high	87.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	140.2	159.1	165.6	-92.8	0	0	0	108.8	V82 F86 F98 V100 I106 V131 L132 N133 A140 L160 I161	V82-F138 HydrophobicContact CG1-CD2 4.08Å; V82-F138 HydrophobicContact CG1-CE2 3.98Å; V82-F138 HydrophobicContact CG2-CE2 4.27Å; F86-F138 HydrophobicContact CE1-CB 4.03Å; F86-F138 HydrophobicContact CZ-CB 3.84Å; F98-F138 AromaticContact CE2-CD1 3.96Å; F98-F138 HydrophobicContact CE2-CD1 3.96Å; F98-F138 AromaticContact CE2-CD2 3.83Å; F98-F138 HydrophobicContact CE2-CD2 3.83Å; F98-F138 AromaticContact CE2-CE1 3.7Å; F98-F138 HydrophobicContact CE2-CE1 3.7Å; F98-F138 AromaticContact CE2-CE2 3.57Å; F98-F138 HydrophobicContact CE2-CE2 3.57Å; F98-F138 HydrophobicContact CE2-CG 4.03Å; F98-F138 AromaticContact CE2-CZ 3.51Å; F98-F138 HydrophobicContact CE2-CZ 3.51Å; F98-F138 HydrophobicContact CZ-CB 4.19Å; F98-F138 AromaticContact CZ-CD1 3.65Å; F98-F138 HydrophobicContact CZ-CD1 3.65Å; F98-F138 AromaticContact CZ-CD2 3.64Å; F98-F138 HydrophobicContact CZ-CD2 3.64Å; F98-F138 AromaticContact CZ-CE1 3.9Å; F98-F138 HydrophobicContact CZ-CE1 3.9Å; F98-F138 AromaticContact CZ-CE2 3.9Å; F98-F138 HydrophobicContact CZ-CE2 3.9Å; F98-F138 AromaticContact CZ-CG 3.52Å; F98-F138 HydrophobicContact CZ-CG 3.52Å; F98-F138 HydrophobicContact CZ-CZ 4.03Å; V100-F138 HydrophobicContact CG2-CE2 4.38Å; V100-F138 HydrophobicContact CG2-CZ 3.69Å; I106-F138 HydrophobicContact CD1-CE1 3.96Å; V131-F138 HydrophobicContact CB-CE2 4.17Å; V131-F138 HydrophobicContact CG1-CE2 4.39Å; V131-F138 HydrophobicContact CG1-CZ 4.33Å; L132-F138 CarbonylContact O-C 3.55Å; L132-F138 VanDerWaalsContact O-CA 3.32Å; L132-F138 WeakPolarHBondContact O-CA 3.33Å; L132-F138 WeakPolarHBondContact O-CD2 3.47Å; N133-F138 HydrophobicContact CB-CD2 4.19Å; F138-A140 HydrophobicContact CE1-CB 3.87Å; F138-A140 HydrophobicContact CZ-CB 3.87Å; F138-L160 CarbonylContact O-C 3.57Å; F138-L160 VanDerWaalsContact O-CA 3.28Å; F138-L160 WeakPolarHBondContact O-CA 3.31Å; F138-I161 HydrophobicContact CB-CB 4.33Å; F138-I161 HydrophobicContact CD1-CB 4.25Å; F138-I161 HydrophobicContact CD1-CD1 3.9Å; F138-I161 HydrophobicContact CD1-CG1 4.04Å; F138-I161 HydrophobicContact CE1-CD1 4.37Å; F138-I161 PolarHBondContact N-O 3.19Å; F138-I161 PolarHBondContact O-N 2.79Å
139	A	94.5	Very high	86.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.1	174.7	0	0	0	0	0	111.1	L73 V131 L132 L137 C159 L160	L73-A139 HydrophobicContact CD2-CB 4.06Å; V131-A139 CarbonylContact C-O 3.59Å; V131-A139 VanDerWaalsContact CA-O 3.29Å; V131-A139 WeakPolarHBondContact CA-O 3.35Å; L132-A139 HydrophobicContact CB-CB 4.27Å; L132-A139 PolarHBondContact N-O 3.34Å; L132-A139 PolarHBondContact O-N 3Å; L137-A139 HydrophobicContact CD1-CB 3.8Å; A139-C159 CarbonylContact C-O 3.59Å; A139-C159 WeakPolarHBondContact CA-O 3.19Å; A139-L160 HydrophobicContact CB-CD2 3.44Å; A139-L160 VanDerWaalsContact CB-CD2 3.44Å
140	A	93.3	Very high	85.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.8	167	0	0	0	0	0	109.1	V100 I106 Q130 F138 W142 F158 C159	V100-A140 HydrophobicContact CG1-CB 4.25Å; I106-A140 HydrophobicContact CD1-CB 4.34Å; Q130-A140 CarbonylContact O-C 3.53Å; Q130-A140 WeakPolarHBondContact O-CA 3.27Å; F138-A140 HydrophobicContact CE1-CB 3.87Å; F138-A140 HydrophobicContact CZ-CB 3.87Å; A140-W142 HydrophobicContact CB-CE3 4.47Å; A140-W142 HydrophobicContact CB-CH2 3.56Å; A140-W142 HydrophobicContact CB-CZ2 3.82Å; A140-W142 HydrophobicContact CB-CZ3 3.89Å; A140-F158 CarbonylContact O-C 3.52Å; A140-F158 VanDerWaalsContact O-CA 3.25Å; A140-F158 WeakPolarHBondContact O-CA 3.25Å; A140-C159 PolarHBondContact N-O 3.18Å; A140-C159 PolarHBondContact O-N 2.92Å
141	R	92.3	Very high	84.6	Confident	65 Å²	65	62.7 Å²	62.7	25%	0.245	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	118.2	175.5	-177.6	-171	-172.9	-163.8	8.6	109.4	L73 V129 Q130 T156 V157 F158 E172	L73-R141 HydrophobicContact CD1-CB 3.88Å; L73-R141 HydrophobicContact CD1-CG 4.5Å; V129-R141 WeakPolarHBondContact CA-O 3.34Å; Q130-R141 HydrophobicContact CB-CB 4.45Å; Q130-R141 PolarHBondContact N-O 2.86Å; Q130-R141 PolarHBondContact O-N 2.9Å; R141-T156 HydrophobicContact CG-CG2 3.9Å; R141-T156 VanDerWaalsContact NE-CG2 3.3Å; R141-V157 WeakPolarHBondContact CA-O 3.37Å; R141-F158 HydrophobicContact CB-CD1 3.87Å; R141-F158 HydrophobicContact CB-CE1 3.82Å; R141-F158 HydrophobicContact CB-CZ 4.44Å; R141-F158 HydrophobicContact CG-CD1 3.95Å; R141-F158 HydrophobicContact CG-CD2 4.49Å; R141-F158 HydrophobicContact CG-CE1 3.58Å; R141-F158 HydrophobicContact CG-CE2 4.14Å; R141-F158 HydrophobicContact CG-CG 4.4Å; R141-F158 HydrophobicContact CG-CZ 3.68Å; R141-E172 IonicContact NH2-OE2 2.66Å; R141-E172 PolarHBondContact NH2-OE2 3Å
142	W	90.7	Very high	83.6	Confident	4 Å²	4	66.5 Å²	66.5	2%	0.015	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	124	171.5	-61.1	-89.6	0	0	0	109.6	V100 Y101 I106 I119 V129 A140 T156 V157 C159	V100-W142 HydrophobicContact CG1-CZ2 4.14Å; Y101-W142 PolarHBondContact O-NE1 3.33Å; I106-W142 HydrophobicContact CD1-CH2 3.81Å; I106-W142 HydrophobicContact CD1-CZ2 4.27Å; I106-W142 HydrophobicContact CG1-CH2 3.83Å; I106-W142 HydrophobicContact CG1-CZ2 3.85Å; I119-W142 HydrophobicContact CD1-CH2 4.18Å; I119-W142 HydrophobicContact CD1-CZ3 3.74Å; V129-W142 HydrophobicContact CG2-CG 4.4Å; A140-W142 HydrophobicContact CB-CE3 4.47Å; A140-W142 HydrophobicContact CB-CH2 3.56Å; A140-W142 HydrophobicContact CB-CZ2 3.82Å; A140-W142 HydrophobicContact CB-CZ3 3.89Å; W142-T156 WeakPolarHBondContact O-CA 3.48Å; W142-V157 PolarHBondContact N-O 2.66Å; W142-V157 PolarHBondContact O-N 3.47Å; W142-C159 HydrophobicContact CH2-CB 3.67Å; W142-C159 HydrophobicContact CZ3-CB 3.45Å; W142-C159 VanDerWaalsContact CZ3-CB 3.45Å
143	S	87.6	Confident	82.9	Confident	25 Å²	25	66.1 Å²	66.1	18%	0.175	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	105.6	165.5	-62.6	0	0	0	0	107.1	S127 E128 G155	S127-S143 WeakPolarHBondContact CA-O 3.31Å; S127-S143 WeakPolarHBondContact CB-O 3.43Å; E128-S143 PolarHBondContact O-N 3.28Å; S143-G155 CarbonylContact C-O 3.55Å; S143-G155 WeakPolarHBondContact CA-O 3.26Å
144	I	80.6	Confident	82.4	Confident	22 Å²	22	70 Å²	70	11%	0.113	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	135.7	177.6	-56.6	166.2	0	0	0	108.8	I121 K154 G155 V157	I121-I144 HydrophobicContact CD1-CD1 4.2Å; I121-I144 HydrophobicContact CD1-CG2 3.58Å; I121-I144 HydrophobicContact CG1-CD1 4.26Å; I121-I144 HydrophobicContact CG1-CG2 4.17Å; I144-K154 CarbonylContact O-C 3.55Å; I144-K154 VanDerWaalsContact O-CA 3.23Å; I144-K154 WeakPolarHBondContact O-CA 3.47Å; I144-G155 PolarHBondContact N-O 2.87Å; I144-G155 PolarHBondContact O-N 3.02Å; I144-V157 HydrophobicContact CD1-CG2 3.84Å
145	K	76.9	Confident	82.2	Confident	84 Å²	84	65.2 Å²	65.2	37%	0.365	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	131.4	170.7	-68.6	174.2	-172.4	165.9	0	106.4	E124 L152 V153	E124-K145 WeakPolarHBondContact CG-O 3.35Å; K145-L152 HydrophobicContact CB-CD1 4.09Å; K145-L152 HydrophobicContact CG-CD1 4.49Å; K145-V153 CarbonylContact C-O 3.56Å; K145-V153 WeakPolarHBondContact CA-O 3.32Å
146	K	71.7	Confident	82	Confident	30 Å²	30	58.9 Å²	58.9	13%	0.13	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.5	173.7	177.8	173.1	-176.5	-179.2	0	108.9	E124 D148 V153 I178	E124-K146 WeakPolarHBondContact OE2-CG 3.32Å; K146-D148 PolarHBondContact O-N 3.13Å; K146-V153 HydrophobicContact CB-CB 4.47Å; K146-V153 PolarHBondContact N-O 3.36Å; K146-V153 PolarHBondContact O-N 3.25Å; K146-I178 HydrophobicContact CD-CG1 4.33Å
147	N	68.4	Low	82	Confident	128 Å²	128	52.9 Å²	52.9	68%	0.684	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	104.1	167	-79.7	-18.9	0	0	0	108.5
148	D	66.2	Low	81.9	Confident	47 Å²	47	51.9 Å²	51.9	25%	0.251	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115.4	173.2	-174.7	32.2	0	0	0	109.7	K146 S150 K151 V153	K146-D148 PolarHBondContact O-N 3.13Å; D148-S150 VanDerWaalsContact C-N 3.27Å; D148-S150 PolarHBondContact O-N 3.14Å; D148-S150 VanDerWaalsContact O-N 3.11Å; D148-K151 PolarHBondContact N-O 2.7Å; D148-K151 PolarHBondContact O-N 2.73Å; D148-V153 HydrophobicContact CB-CG2 4.33Å
149	N	67.7	Low	82	Confident	144 Å²	144	51.9 Å²	51.9	77%	0.77	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.2	45.1	177.3	-64	-39.1	0	0	0	114.6	K151	N149-K151 VanDerWaalsContact C-N 3.29Å; N149-K151 PolarHBondContact O-N 2.92Å
150	S	66.5	Low	82	Confident	129 Å²	129	51.9 Å²	51.9	90%	0.902	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	5.5	-177.1	-37.9	0	0	0	0	116.3	D148	D148-S150 VanDerWaalsContact C-N 3.27Å; D148-S150 PolarHBondContact O-N 3.14Å; D148-S150 VanDerWaalsContact O-N 3.11Å
151	K	72.1	Confident	82.2	Confident	153 Å²	153	51.9 Å²	51.9	67%	0.665	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.8	168.7	-67.8	-176.8	179.1	179.1	0	109.7	D148 N149 V153	D148-K151 PolarHBondContact N-O 2.7Å; D148-K151 PolarHBondContact O-N 2.73Å; N149-K151 VanDerWaalsContact C-N 3.29Å; N149-K151 PolarHBondContact O-N 2.92Å; K151-V153 PolarHBondContact O-N 3.09Å
152	L	71.9	Confident	82.4	Confident	94 Å²	94	51.4 Å²	51.4	49%	0.492	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	110	168.3	179.9	66.2	0	0	0	108.4	K145 K154	K145-L152 HydrophobicContact CB-CD1 4.09Å; K145-L152 HydrophobicContact CG-CD1 4.49Å; L152-K154 HydrophobicContact CD2-CG 4.48Å; L152-K154 HydrophobicContact CG-CG 4.28Å
153	V	77.5	Confident	82.6	Confident	13 Å²	13	53.7 Å²	53.7	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	127.7	176.9	171.2	0	0	0	0	107.8	K145 K146 D148 K151 P175 E177 I178	K145-V153 CarbonylContact C-O 3.56Å; K145-V153 WeakPolarHBondContact CA-O 3.32Å; K146-V153 HydrophobicContact CB-CB 4.47Å; K146-V153 PolarHBondContact N-O 3.36Å; K146-V153 PolarHBondContact O-N 3.25Å; D148-V153 HydrophobicContact CB-CG2 4.33Å; K151-V153 PolarHBondContact O-N 3.09Å; V153-P175 HydrophobicContact CG1-CB 3.09Å; V153-P175 HydrophobicContact CG1-CG 3.17Å; V153-E177 HydrophobicContact CG2-CB 4.48Å; V153-I178 HydrophobicContact CG1-CD1 4.21Å; V153-I178 HydrophobicContact CG1-CG1 4.13Å
154	K	83.6	Confident	82.9	Confident	122 Å²	122	56 Å²	56	53%	0.53	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.9	-178	-64.6	-178.5	-176.1	175.1	0	110	I144 L152 P175	I144-K154 CarbonylContact O-C 3.55Å; I144-K154 VanDerWaalsContact O-CA 3.23Å; I144-K154 WeakPolarHBondContact O-CA 3.47Å; L152-K154 HydrophobicContact CD2-CG 4.48Å; L152-K154 HydrophobicContact CG-CG 4.28Å; K154-P175 WeakPolarHBondContact O-CG 2.91Å
155	G	87.4	Confident	83.6	Confident	2 Å²	2	55 Å²	55	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	164.8	170	0	0	0	0	0	110.8	S143 I144 D173	S143-G155 CarbonylContact C-O 3.55Å; S143-G155 WeakPolarHBondContact CA-O 3.26Å; I144-G155 PolarHBondContact N-O 2.87Å; I144-G155 PolarHBondContact O-N 3.02Å; G155-D173 CarbonylContact C-O 3.36Å; G155-D173 WeakPolarHBondContact CA-O 3.12Å
156	T	90.2	Very high	84.5	Confident	20 Å²	20	52.8 Å²	52.8	12%	0.123	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	129.6	174.6	-54.4	0	0	0	0	110	R141 W142 F158 E172 D173	R141-T156 HydrophobicContact CG-CG2 3.9Å; R141-T156 VanDerWaalsContact NE-CG2 3.3Å; W142-T156 WeakPolarHBondContact O-CA 3.48Å; T156-F158 HydrophobicContact CG2-CD2 4.31Å; T156-F158 HydrophobicContact CG2-CE2 3.66Å; T156-F158 HydrophobicContact CG2-CZ 4.23Å; T156-E172 HydrophobicContact CG2-CB 4.34Å; T156-E172 VanDerWaalsContact CG2-OE2 3.28Å; T156-E172 WeakPolarHBondContact CG2-OE2 3.42Å; T156-E172 PolarHBondContact O-N 3.2Å; T156-D173 PolarHBondContact N-O 3.38Å; T156-D173 PolarHBondContact O-N 2.76Å; T156-D173 VanDerWaalsContact O-N 3.13Å
157	V	92.6	Very high	85.7	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.012	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	142	177.5	-166.4	0	0	0	0	110.2	I119 R141 W142 I144 I169 Y170 Y171 I174	I119-V157 HydrophobicContact CG2-CB 4.04Å; I119-V157 HydrophobicContact CG2-CG1 3.5Å; I119-V157 VanDerWaalsContact CG2-CG1 3.5Å; I119-V157 HydrophobicContact CG2-CG2 4.3Å; R141-V157 WeakPolarHBondContact CA-O 3.37Å; W142-V157 PolarHBondContact N-O 2.66Å; W142-V157 PolarHBondContact O-N 3.47Å; I144-V157 HydrophobicContact CD1-CG2 3.84Å; V157-I169 HydrophobicContact CG1-CG2 3.93Å; V157-Y170 WeakPolarHBondContact CA-O 3.37Å; V157-Y170 WeakPolarHBondContact CG1-O 3.29Å; V157-Y171 HydrophobicContact CG1-CD1 3.78Å; V157-Y171 HydrophobicContact CG1-CE1 3.89Å; V157-Y171 HydrophobicContact CG2-CD1 3.88Å; V157-Y171 HydrophobicContact CG2-CE1 4.32Å; V157-I174 HydrophobicContact CG2-CD1 3.73Å
158	F	94	Very high	87.1	Confident	6 Å²	6	45.5 Å²	45.5	3%	0.026	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	143.8	175.6	-63.9	-105.2	0	0	0	110.2	N66 L73 A140 R141 T156 I169 Y170 E172	N66-F158 WeakPolarHBondContact ND2-CE2 3.41Å; L73-F158 HydrophobicContact CD1-CE1 3.95Å; A140-F158 CarbonylContact O-C 3.52Å; A140-F158 VanDerWaalsContact O-CA 3.25Å; A140-F158 WeakPolarHBondContact O-CA 3.25Å; R141-F158 HydrophobicContact CB-CD1 3.87Å; R141-F158 HydrophobicContact CB-CE1 3.82Å; R141-F158 HydrophobicContact CB-CZ 4.44Å; R141-F158 HydrophobicContact CG-CD1 3.95Å; R141-F158 HydrophobicContact CG-CD2 4.49Å; R141-F158 HydrophobicContact CG-CE1 3.58Å; R141-F158 HydrophobicContact CG-CE2 4.14Å; R141-F158 HydrophobicContact CG-CG 4.4Å; R141-F158 HydrophobicContact CG-CZ 3.68Å; T156-F158 HydrophobicContact CG2-CD2 4.31Å; T156-F158 HydrophobicContact CG2-CE2 3.66Å; T156-F158 HydrophobicContact CG2-CZ 4.23Å; F158-I169 CarbonylContact O-C 3.53Å; F158-I169 VanDerWaalsContact O-CA 3.28Å; F158-I169 WeakPolarHBondContact O-CA 3.37Å; F158-Y170 HydrophobicContact CD2-CD1 4.16Å; F158-Y170 PolarHBondContact N-O 3.22Å; F158-Y170 PolarHBondContact O-N 2.82Å; F158-E172 HydrophobicContact CD2-CB 4.2Å; F158-E172 HydrophobicContact CE2-CB 3.84Å; F158-E172 HydrophobicContact CE2-CG 4.38Å; F158-E172 WeakPolarHBondContact CE2-OE2 3.47Å
159	C	95.5	Very high	88.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.3	162.1	-178.8	0	0	0	0	108.8	I106 I119 A139 A140 W142 S168	I106-C159 HydrophobicContact CD1-CB 4.22Å; I119-C159 HydrophobicContact CD1-CB 3.81Å; A139-C159 CarbonylContact C-O 3.59Å; A139-C159 WeakPolarHBondContact CA-O 3.19Å; A140-C159 PolarHBondContact N-O 3.18Å; A140-C159 PolarHBondContact O-N 2.92Å; W142-C159 HydrophobicContact CH2-CB 3.67Å; W142-C159 HydrophobicContact CZ3-CB 3.45Å; W142-C159 VanDerWaalsContact CZ3-CB 3.45Å; C159-S168 CarbonylContact C-O 3.42Å; C159-S168 WeakPolarHBondContact CA-O 3.26Å
160	L	95.9	Very high	89.9	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	137.1	-179.8	-46.4	175.3	0	0	0	108.7	P67 V68 F138 A139 Y162 I167 S168	P67-L160 HydrophobicContact CB-CD1 4.2Å; P67-L160 HydrophobicContact CG-CD1 3.82Å; V68-L160 HydrophobicContact CG2-CD1 3.58Å; V68-L160 HydrophobicContact CG2-CD2 3.38Å; V68-L160 HydrophobicContact CG2-CG 4.1Å; F138-L160 CarbonylContact O-C 3.57Å; F138-L160 VanDerWaalsContact O-CA 3.28Å; F138-L160 WeakPolarHBondContact O-CA 3.31Å; A139-L160 HydrophobicContact CB-CD2 3.44Å; A139-L160 VanDerWaalsContact CB-CD2 3.44Å; L160-Y162 HydrophobicContact CB-CE2 3.88Å; L160-Y162 VanDerWaalsContact CD1-OH 3.28Å; L160-Y162 WeakPolarHBondContact CD1-OH 3.21Å; L160-I167 CarbonylContact O-C 3.54Å; L160-I167 VanDerWaalsContact O-CA 3.26Å; L160-I167 WeakPolarHBondContact O-CA 3.22Å; L160-S168 PolarHBondContact N-O 3.43Å; L160-S168 PolarHBondContact O-N 3.15Å
161	I	97.3	Very high	91.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.7	176.1	-55	177.7	0	0	0	107.7	F86 F88 F98 I106 I117 L137 F138 I167	F86-I161 HydrophobicContact CE2-CG2 4.3Å; F86-I161 HydrophobicContact CZ-CG2 4.42Å; F86-I161 WeakPolarHBondContact CZ-O 2.99Å; F88-I161 HydrophobicContact CD1-CG2 4.43Å; F88-I161 HydrophobicContact CD2-CG2 3.87Å; F88-I161 HydrophobicContact CE1-CG2 4.16Å; F88-I161 HydrophobicContact CE2-CG2 3.56Å; F88-I161 HydrophobicContact CG-CG2 4.29Å; F88-I161 HydrophobicContact CZ-CG2 3.71Å; F98-I161 HydrophobicContact CE1-CD1 4.15Å; F98-I161 HydrophobicContact CZ-CD1 4.4Å; I106-I161 HydrophobicContact CD1-CD1 4.41Å; I117-I161 HydrophobicContact CD1-CD1 4.31Å; L137-I161 CarbonylContact C-O 3.54Å; L137-I161 WeakPolarHBondContact CA-O 3.37Å; F138-I161 HydrophobicContact CB-CB 4.33Å; F138-I161 HydrophobicContact CD1-CB 4.25Å; F138-I161 HydrophobicContact CD1-CD1 3.9Å; F138-I161 HydrophobicContact CD1-CG1 4.04Å; F138-I161 HydrophobicContact CE1-CD1 4.37Å; F138-I161 PolarHBondContact N-O 3.19Å; F138-I161 PolarHBondContact O-N 2.79Å; I161-I167 HydrophobicContact CG1-CG1 4.35Å
162	Y	96.1	Very high	92.2	Very high	54 Å²	54	27 Å²	27	21%	0.212	14%	0.14	C	C	.	.			trans	-108.1	158	-177	-60.5	-85.7	0	0	0	111.8	L137 L160 S164 G165 K166	L137-Y162 HydrophobicContact CB-CD1 3.95Å; L137-Y162 HydrophobicContact CB-CE1 4.04Å; L137-Y162 HydrophobicContact CD2-CE1 4.28Å; L160-Y162 HydrophobicContact CB-CE2 3.88Å; L160-Y162 VanDerWaalsContact CD1-OH 3.28Å; L160-Y162 WeakPolarHBondContact CD1-OH 3.21Å; Y162-S164 PolarHBondContact O-N 2.99Å; Y162-S164 VanDerWaalsContact O-N 3.14Å; Y162-G165 PolarHBondContact O-N 2.81Å; Y162-K166 HydrophobicContact CD2-CB 3.96Å; Y162-K166 HydrophobicContact CD2-CD 4.27Å; Y162-K166 HydrophobicContact CD2-CG 3.9Å; Y162-K166 WeakPolarHBondContact CD2-O 3.4Å; Y162-K166 HydrophobicContact CE2-CD 4.5Å; Y162-K166 HydrophobicContact CE2-CG 4.37Å; Y162-K166 PolarHBondContact N-O 3.09Å
163	P	95.9	Very high	93.1	Very high	53 Å²	53	26 Å²	26	34%	0.344	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-30.1	174.6	-27.4	33.3	0	0	0	114.5	F86 D136 G165	F86-P163 HydrophobicContact CB-CB 4.24Å; F86-P163 HydrophobicContact CB-CG 3.93Å; F86-P163 HydrophobicContact CD1-CG 4.31Å; F86-P163 HydrophobicContact CD2-CB 4.12Å; F86-P163 HydrophobicContact CD2-CG 3.95Å; F86-P163 HydrophobicContact CG-CB 4.3Å; F86-P163 HydrophobicContact CG-CG 3.8Å; D136-P163 WeakPolarHBondContact O-CD 3.24Å; P163-G165 PolarHBondContact O-N 2.87Å
164	S	93.5	Very high	93.6	Very high	73 Å²	73	26 Å²	26	51%	0.51	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-9.7	175.2	59.5	0	0	0	0	113.9	Y162 K166	Y162-S164 PolarHBondContact O-N 2.99Å; Y162-S164 VanDerWaalsContact O-N 3.14Å; S164-K166 VanDerWaalsContact C-N 3.25Å; S164-K166 WeakPolarHBondContact OG-CB 3.23Å; S164-K166 PolarHBondContact OG-N 3.17Å
165	G	94.9	Very high	93.6	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.01	11%	0.113	C	C	.	.	S	Bend	trans	81.3	3	-170	0	0	0	0	0	113.6	Y162 P163 P219	Y162-G165 PolarHBondContact O-N 2.81Å; P163-G165 PolarHBondContact O-N 2.87Å; G165-P219 WeakPolarHBondContact O-CG 2.95Å
166	K	95.3	Very high	93.5	Very high	38 Å²	38	26.5 Å²	26.5	17%	0.165	15%	0.148	C	C	.	.			trans	-62.7	139.6	167.9	177.4	172.4	-179.9	155	0	109.8	Y162 S164 E216 Y217 E218	Y162-K166 HydrophobicContact CD2-CB 3.96Å; Y162-K166 HydrophobicContact CD2-CD 4.27Å; Y162-K166 HydrophobicContact CD2-CG 3.9Å; Y162-K166 WeakPolarHBondContact CD2-O 3.4Å; Y162-K166 HydrophobicContact CE2-CD 4.5Å; Y162-K166 HydrophobicContact CE2-CG 4.37Å; Y162-K166 PolarHBondContact N-O 3.09Å; S164-K166 VanDerWaalsContact C-N 3.25Å; S164-K166 WeakPolarHBondContact OG-CB 3.23Å; S164-K166 PolarHBondContact OG-N 3.17Å; K166-E216 VanDerWaalsContact CE-OE1 3.23Å; K166-E216 WeakPolarHBondContact CE-OE1 3.36Å; K166-E216 IonicContact NZ-OE1 3.03Å; K166-E216 PolarHBondContact NZ-OE1 2.85Å; K166-Y217 VanDerWaalsContact CA-O 3.3Å; K166-Y217 WeakPolarHBondContact CA-O 3.49Å; K166-E218 HydrophobicContact CB-CG 4.49Å; K166-E218 HydrophobicContact CD-CG 4.03Å; K166-E218 HydrophobicContact CG-CG 4.04Å; K166-E218 IonicContact NZ-OE1 2.94Å; K166-E218 PolarHBondContact NZ-OE1 3.1Å
167	I	97.4	Very high	92.9	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	130.3	175.4	-61.1	161.1	0	0	0	108	Y90 I117 L160 I161 M187 E216 Y217	Y90-I167 HydrophobicContact CD2-CD1 3.83Å; Y90-I167 HydrophobicContact CE2-CD1 3.73Å; I117-I167 HydrophobicContact CD1-CD1 4.01Å; I117-I167 HydrophobicContact CD1-CG2 4.04Å; L160-I167 CarbonylContact O-C 3.54Å; L160-I167 VanDerWaalsContact O-CA 3.26Å; L160-I167 WeakPolarHBondContact O-CA 3.22Å; I161-I167 HydrophobicContact CG1-CG1 4.35Å; I167-M187 HydrophobicContact CD1-SD 3.75Å; I167-E216 WeakPolarHBondContact O-CA 3.38Å; I167-Y217 HydrophobicContact CB-CD2 4.21Å; I167-Y217 HydrophobicContact CG2-CD2 4.18Å; I167-Y217 PolarHBondContact N-O 3.35Å; I167-Y217 PolarHBondContact O-N 2.95Å
168	S	96.8	Very high	92.2	Very high	3 Å²	3	31 Å²	31	2%	0.021	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.7	176.7	-66.1	0	0	0	0	110.7	C159 L160 V215	C159-S168 CarbonylContact C-O 3.42Å; C159-S168 WeakPolarHBondContact CA-O 3.26Å; L160-S168 PolarHBondContact N-O 3.43Å; L160-S168 PolarHBondContact O-N 3.15Å; S168-V215 CarbonylContact C-O 3.56Å; S168-V215 WeakPolarHBondContact CA-O 3.17Å
169	I	96.8	Very high	91.6	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.4	172.6	-59.3	174.3	0	0	0	107.8	I117 I119 V157 F158 Y171 I204 V215 Y217	I117-I169 HydrophobicContact CG2-CD1 4.18Å; I119-I169 HydrophobicContact CD1-CB 4.49Å; I119-I169 HydrophobicContact CD1-CD1 3.78Å; I119-I169 HydrophobicContact CD1-CG1 3.89Å; I119-I169 HydrophobicContact CD1-CG2 3.84Å; I119-I169 HydrophobicContact CG1-CD1 4Å; I119-I169 HydrophobicContact CG1-CG2 4.45Å; V157-I169 HydrophobicContact CG1-CG2 3.93Å; F158-I169 CarbonylContact O-C 3.53Å; F158-I169 VanDerWaalsContact O-CA 3.28Å; F158-I169 WeakPolarHBondContact O-CA 3.37Å; I169-Y171 HydrophobicContact CG2-CD2 4.45Å; I169-Y171 HydrophobicContact CG2-CE1 4.22Å; I169-Y171 HydrophobicContact CG2-CE2 3.87Å; I169-I204 HydrophobicContact CD1-CD1 4.3Å; I169-V215 HydrophobicContact CB-CB 4.35Å; I169-V215 PolarHBondContact N-O 3.03Å; I169-V215 PolarHBondContact O-N 3.17Å; I169-Y217 HydrophobicContact CD1-CE2 3.91Å; I169-Y217 HydrophobicContact CG1-CE2 4.46Å
170	Y	96.3	Very high	91	Very high	17 Å²	17	41 Å²	41	7%	0.067	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.6	178.2	-178	-108.2	0	0	0	111.2	Q64 P65 N66 P67 V157 F158 E172 T213 L214	Q64-Y170 HydrophobicContact CB-CE2 4.4Å; Q64-Y170 WeakPolarHBondContact O-CE2 3.49Å; Q64-Y170 PolarHBondContact O-OH 2.85Å; P65-Y170 WeakPolarHBondContact O-CE2 3.2Å; N66-Y170 VanDerWaalsContact CA-CE1 3.41Å; N66-Y170 VanDerWaalsContact CA-CZ 3.49Å; N66-Y170 HydrophobicContact CB-CD1 4.06Å; N66-Y170 HydrophobicContact CB-CE1 3.47Å; N66-Y170 VanDerWaalsContact CB-CE1 3.47Å; N66-Y170 PolarHBondContact N-OH 2.77Å; P67-Y170 HydrophobicContact CG-CG 4.27Å; V157-Y170 WeakPolarHBondContact CA-O 3.37Å; V157-Y170 WeakPolarHBondContact CG1-O 3.29Å; F158-Y170 HydrophobicContact CD2-CD1 4.16Å; F158-Y170 PolarHBondContact N-O 3.22Å; F158-Y170 PolarHBondContact O-N 2.82Å; Y170-E172 HydrophobicContact CD1-CB 3.96Å; Y170-E172 VanDerWaalsContact CE1-CA 3.46Å; Y170-E172 HydrophobicContact CE1-CB 3.66Å; Y170-E172 HydrophobicContact CE1-CG 4.29Å; Y170-E172 PolarHBondContact O-N 2.84Å; Y170-T213 WeakPolarHBondContact CD2-O 3.45Å; Y170-L214 HydrophobicContact CD2-CB 4.14Å; Y170-L214 HydrophobicContact CD2-CD1 4.28Å
171	Y	94.7	Very high	90.4	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	90.3	176.3	-62.6	-77	0	0	0	108.8	I119 V157 I169 I174 S185 I204 I209 K210 S211 G212 T213 V215	I119-Y171 HydrophobicContact CG2-CE1 4.35Å; V157-Y171 HydrophobicContact CG1-CD1 3.78Å; V157-Y171 HydrophobicContact CG1-CE1 3.89Å; V157-Y171 HydrophobicContact CG2-CD1 3.88Å; V157-Y171 HydrophobicContact CG2-CE1 4.32Å; I169-Y171 HydrophobicContact CG2-CD2 4.45Å; I169-Y171 HydrophobicContact CG2-CE1 4.22Å; I169-Y171 HydrophobicContact CG2-CE2 3.87Å; Y171-I174 HydrophobicContact CD1-CD1 3.66Å; Y171-I174 HydrophobicContact CD1-CG1 3.89Å; Y171-I174 HydrophobicContact CG-CD1 4.43Å; Y171-I174 HydrophobicContact CG-CG1 4.21Å; Y171-S185 WeakPolarHBondContact OH-CB 3.19Å; Y171-S185 PolarHBondContact OH-OG 2.89Å; Y171-I204 HydrophobicContact CE2-CD1 4.38Å; Y171-I204 WeakPolarHBondContact OH-CD1 3.41Å; Y171-I209 HydrophobicContact CD1-CG2 3.92Å; Y171-I209 HydrophobicContact CE1-CG2 3.61Å; Y171-K210 VanDerWaalsContact CB-O 3.26Å; Y171-K210 WeakPolarHBondContact CB-O 3.42Å; Y171-S211 CarbonylContact O-C 3.5Å; Y171-S211 WeakPolarHBondContact O-CA 3.49Å; Y171-G212 PolarHBondContact O-N 2.85Å; Y171-T213 HydrophobicContact CD2-CG2 3.88Å; Y171-T213 WeakPolarHBondContact CD2-O 3.12Å; Y171-T213 HydrophobicContact CE2-CG2 4.3Å; Y171-T213 PolarHBondContact N-O 2.82Å; Y171-V215 HydrophobicContact CE2-CG2 4.16Å
172	E	93.1	Very high	89.8	Confident	65 Å²	65	49.1 Å²	49.1	30%	0.304	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	-51.8	-179.2	175.4	167.4	-106	0	0	110.9	N66 R141 T156 F158 Y170	N66-E172 PolarHBondContact ND2-OE1 2.94Å; R141-E172 IonicContact NH2-OE2 2.66Å; R141-E172 PolarHBondContact NH2-OE2 3Å; T156-E172 HydrophobicContact CG2-CB 4.34Å; T156-E172 VanDerWaalsContact CG2-OE2 3.28Å; T156-E172 WeakPolarHBondContact CG2-OE2 3.42Å; T156-E172 PolarHBondContact O-N 3.2Å; F158-E172 HydrophobicContact CD2-CB 4.2Å; F158-E172 HydrophobicContact CE2-CB 3.84Å; F158-E172 HydrophobicContact CE2-CG 4.38Å; F158-E172 WeakPolarHBondContact CE2-OE2 3.47Å; Y170-E172 HydrophobicContact CD1-CB 3.96Å; Y170-E172 VanDerWaalsContact CE1-CA 3.46Å; Y170-E172 HydrophobicContact CE1-CB 3.66Å; Y170-E172 HydrophobicContact CE1-CG 4.29Å; Y170-E172 PolarHBondContact O-N 2.84Å
173	D	90.1	Very high	89.4	Confident	73 Å²	73	47.3 Å²	47.3	39%	0.39	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	117.7	179	-168.1	11.4	0	0	0	110.6	G155 T156	G155-D173 CarbonylContact C-O 3.36Å; G155-D173 WeakPolarHBondContact CA-O 3.12Å; T156-D173 PolarHBondContact N-O 3.38Å; T156-D173 PolarHBondContact O-N 2.76Å; T156-D173 VanDerWaalsContact O-N 3.13Å
174	I	89.2	Confident	89.2	Confident	12 Å²	12	48.4 Å²	48.4	6%	0.062	25%	0.246	C	C	.	.			trans	-124.8	106.4	175.7	-56.7	-64.1	0	0	0	108.4	V157 Y171 T176 L183 S211	V157-I174 HydrophobicContact CG2-CD1 3.73Å; Y171-I174 HydrophobicContact CD1-CD1 3.66Å; Y171-I174 HydrophobicContact CD1-CG1 3.89Å; Y171-I174 HydrophobicContact CG-CD1 4.43Å; Y171-I174 HydrophobicContact CG-CG1 4.21Å; I174-T176 PolarHBondContact O-N 3.33Å; I174-L183 HydrophobicContact CG2-CD1 3.92Å; I174-S211 PolarHBondContact N-OG 2.63Å; I174-S211 PolarHBondContact O-OG 3.33Å
175	P	83	Confident	89.2	Confident	14 Å²	14	45 Å²	45	9%	0.091	22%	0.222	C	C	.	.			trans	-56.2	134.3	178.6	-29.9	35.6	0	0	0	113.2	V153 K154 E177 I178	V153-P175 HydrophobicContact CG1-CB 3.09Å; V153-P175 HydrophobicContact CG1-CG 3.17Å; K154-P175 WeakPolarHBondContact O-CG 2.91Å; P175-E177 PolarHBondContact O-N 2.82Å; P175-I178 HydrophobicContact CB-CD1 3.72Å; P175-I178 HydrophobicContact CB-CG1 4.09Å; P175-I178 HydrophobicContact CG-CD1 3.81Å; P175-I178 PolarHBondContact O-N 3.39Å
176	T	84.5	Confident	89.3	Confident	121 Å²	121	46.4 Å²	46.4	74%	0.742	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-18.9	-179.7	56.7	0	0	0	0	113.3	I174	I174-T176 PolarHBondContact O-N 3.33Å
177	E	78.8	Confident	89.4	Confident	107 Å²	107	44.6 Å²	44.6	50%	0.5	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-22.7	-179	-61.9	88	158	0	0	112.3	V153 P175 N179	V153-E177 HydrophobicContact CG2-CB 4.48Å; P175-E177 PolarHBondContact O-N 2.82Å; E177-N179 PolarHBondContact O-N 3.01Å
178	I	77.1	Confident	89.3	Confident	8 Å²	8	46.6 Å²	46.6	4%	0.041	23%	0.228	C	C	.	.	S	Bend	trans	-65	126.9	176.5	-66.8	157.9	0	0	0	108.6	I121 K146 V153 P175 R180 L183	I121-I178 HydrophobicContact CD1-CD1 3.58Å; I121-I178 HydrophobicContact CD1-CG1 4.32Å; I121-I178 HydrophobicContact CD1-CG2 4.24Å; I121-I178 HydrophobicContact CG2-CG2 4.32Å; K146-I178 HydrophobicContact CD-CG1 4.33Å; V153-I178 HydrophobicContact CG1-CD1 4.21Å; V153-I178 HydrophobicContact CG1-CG1 4.13Å; P175-I178 HydrophobicContact CB-CD1 3.72Å; P175-I178 HydrophobicContact CB-CG1 4.09Å; P175-I178 HydrophobicContact CG-CD1 3.81Å; P175-I178 PolarHBondContact O-N 3.39Å; I178-R180 PolarHBondContact O-N 2.85Å; I178-L183 HydrophobicContact CG2-CD2 3.78Å; I178-L183 HydrophobicContact CG2-CG 3.97Å
179	N	81.9	Confident	89.3	Confident	87 Å²	87	46.5 Å²	46.5	47%	0.465	23%	0.227	S	C	.	.			trans	-54.8	112.7	167.6	179	-6.5	0	0	0	108.6	E177 N181 L182	E177-N179 PolarHBondContact O-N 3.01Å; N179-N181 PolarHBondContact O-N 3.24Å; N179-N181 VanDerWaalsContact O-N 3.07Å; N179-N181 WeakPolarHBondContact OD1-CB 3.32Å; N179-N181 PolarHBondContact OD1-N 2.82Å; N179-L182 HydrophobicContact CB-CD1 4.02Å; N179-L182 HydrophobicContact CB-CG 4.11Å; N179-L182 WeakPolarHBondContact O-CB 3.01Å; N179-L182 PolarHBondContact O-N 3.33Å
180	R	82.7	Confident	89.2	Confident	131 Å²	131	46.8 Å²	46.8	49%	0.494	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-53.8	-34.4	-175.8	-69.2	-171.4	-179.6	-175.7	-0.4	112.1	I178 L182 L183 I206	I178-R180 PolarHBondContact O-N 2.85Å; R180-L182 PolarHBondContact O-N 3.02Å; R180-L183 VanDerWaalsContact O-CB 3.32Å; R180-L183 WeakPolarHBondContact O-CB 3.27Å; R180-L183 PolarHBondContact O-N 3.22Å; R180-I206 HydrophobicContact CB-CD1 4.01Å; R180-I206 HydrophobicContact CB-CG1 4.02Å; R180-I206 WeakPolarHBondContact O-CD1 3.39Å; R180-I206 WeakPolarHBondContact O-CG1 3.37Å
181	N	84.2	Confident	89	Confident	123 Å²	123	47.8 Å²	47.8	66%	0.658	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-63.2	-11.8	179.8	-62.1	-10.2	0	0	0	113.8	N179	N179-N181 PolarHBondContact O-N 3.24Å; N179-N181 VanDerWaalsContact O-N 3.07Å; N179-N181 WeakPolarHBondContact OD1-CB 3.32Å; N179-N181 PolarHBondContact OD1-N 2.82Å
182	L	84.4	Confident	88.7	Confident	47 Å²	47	54.6 Å²	54.6	25%	0.246	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-91.2	-17.3	173.2	-56	176.9	0	0	0	112.6	I121 L122 N179 R180	I121-L182 CarbonylContact C-O 3.53Å; I121-L182 WeakPolarHBondContact CA-O 3.37Å; I121-L182 HydrophobicContact CG2-CB 3.85Å; L122-L182 HydrophobicContact CB-CB 4.24Å; L122-L182 HydrophobicContact CB-CD2 3.95Å; L122-L182 PolarHBondContact N-O 3.1Å; N179-L182 HydrophobicContact CB-CD1 4.02Å; N179-L182 HydrophobicContact CB-CG 4.11Å; N179-L182 WeakPolarHBondContact O-CB 3.01Å; N179-L182 PolarHBondContact O-N 3.33Å; R180-L182 PolarHBondContact O-N 3.02Å
183	L	88	Confident	88.3	Confident	15 Å²	15	52.1 Å²	52.1	8%	0.079	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	123.5	177.8	-62.5	176	0	0	0	109.3	I121 I174 I178 R180 I209	I121-L183 HydrophobicContact CD1-CD2 3.83Å; I121-L183 HydrophobicContact CG1-CD2 3.86Å; I174-L183 HydrophobicContact CG2-CD1 3.92Å; I178-L183 HydrophobicContact CG2-CD2 3.78Å; I178-L183 HydrophobicContact CG2-CG 3.97Å; R180-L183 VanDerWaalsContact O-CB 3.32Å; R180-L183 WeakPolarHBondContact O-CB 3.27Å; R180-L183 PolarHBondContact O-N 3.22Å; L183-I209 HydrophobicContact CB-CD1 4.43Å; L183-I209 HydrophobicContact CB-CG2 4.38Å; L183-I209 HydrophobicContact CD1-CB 4.49Å; L183-I209 HydrophobicContact CD1-CG2 4.03Å
184	Y	89.8	Confident	87.9	Confident	76 Å²	76	58.2 Å²	58.2	30%	0.298	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	127.8	179.2	-161.4	-105.8	0	0	0	110.4	F120 K186 T203	F120-Y184 AromaticContact CE1-CD1 3.91Å; F120-Y184 HydrophobicContact CE1-CD1 3.91Å; F120-Y184 HydrophobicContact CE2-CD1 4.39Å; F120-Y184 AromaticContact CZ-CD1 3.68Å; F120-Y184 HydrophobicContact CZ-CD1 3.68Å; F120-Y184 HydrophobicContact CZ-CE1 4.47Å; F120-Y184 HydrophobicContact CZ-CG 4.3Å; F120-Y184 PolarHBondContact N-O 3.19Å; F120-Y184 PolarHBondContact O-N 3.28Å; Y184-K186 HydrophobicContact CD1-CD 4.5Å; Y184-K186 HydrophobicContact CD1-CG 4.26Å; Y184-K186 HydrophobicContact CE1-CB 4.22Å; Y184-K186 HydrophobicContact CE1-CD 3.43Å; Y184-K186 VanDerWaalsContact CE1-CD 3.43Å; Y184-K186 VanDerWaalsContact CE1-CE 3.5Å; Y184-K186 HydrophobicContact CE1-CG 3.58Å; Y184-T203 HydrophobicContact CE2-CG2 4.2Å
185	S	94.8	Very high	87.5	Confident	2 Å²	2	64.2 Å²	64.2	1%	0.014	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	124.3	175.1	-171.1	0	0	0	0	111	D118 Y171 I204	D118-S185 CarbonylContact O-C 3.56Å; D118-S185 WeakPolarHBondContact O-CA 3.44Å; D118-S185 PolarHBondContact O-OG 3.18Å; Y171-S185 WeakPolarHBondContact OH-CB 3.19Å; Y171-S185 PolarHBondContact OH-OG 2.89Å; S185-I204 PolarHBondContact O-N 3.2Å; S185-I204 VanDerWaalsContact OG-CD1 3.28Å; S185-I204 WeakPolarHBondContact OG-CD1 3.26Å
186	K	95.9	Very high	87.6	Confident	30 Å²	30	66.3 Å²	66.3	13%	0.13	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	158.3	-179.4	66	166.8	174.9	-151.5	0	112.6	D118 Y184 I202	D118-K186 HydrophobicContact CB-CG 3.8Å; D118-K186 PolarHBondContact N-O 2.77Å; D118-K186 PolarHBondContact O-N 2.85Å; D118-K186 WeakPolarHBondContact OD2-CE 3.33Å; D118-K186 IonicContact OD2-NZ 2.8Å; Y184-K186 HydrophobicContact CD1-CD 4.5Å; Y184-K186 HydrophobicContact CD1-CG 4.26Å; Y184-K186 HydrophobicContact CE1-CB 4.22Å; Y184-K186 HydrophobicContact CE1-CD 3.43Å; Y184-K186 VanDerWaalsContact CE1-CD 3.43Å; Y184-K186 VanDerWaalsContact CE1-CE 3.5Å; Y184-K186 HydrophobicContact CE1-CG 3.58Å; K186-I202 CarbonylContact C-O 3.51Å; K186-I202 WeakPolarHBondContact CA-O 3.43Å; K186-I202 WeakPolarHBondContact CB-O 3.38Å
187	M	97.5	Very high	87.8	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.7	166	-170.5	176.8	80.6	0	0	108.9	Y56 Y90 Y91 I117 I167 R201 I202 Y217	Y56-M187 HydrophobicContact CD1-CE 3.85Å; Y56-M187 HydrophobicContact CD2-CE 3.38Å; Y56-M187 HydrophobicContact CE1-CE 4.1Å; Y56-M187 HydrophobicContact CE2-CE 3.68Å; Y56-M187 HydrophobicContact CG-CE 3.48Å; Y56-M187 VanDerWaalsContact CG-CE 3.48Å; Y90-M187 HydrophobicContact CE2-CG 4.01Å; Y90-M187 HydrophobicContact CE2-SD 4.05Å; Y90-M187 WeakPolarHBondContact OH-CG 3.29Å; Y91-M187 HydrophobicContact CE2-CE 3.74Å; Y91-M187 HydrophobicContact CE2-CG 4.27Å; I117-M187 HydrophobicContact CG1-CG 4.34Å; I167-M187 HydrophobicContact CD1-SD 3.75Å; M187-R201 WeakPolarHBondContact O-CA 3.3Å; M187-I202 HydrophobicContact CE-CD1 3.66Å; M187-I202 PolarHBondContact N-O 2.87Å; M187-I202 PolarHBondContact O-N 2.79Å; M187-Y217 HydrophobicContact CB-CE1 4.44Å; M187-Y217 HydrophobicContact CB-CE2 4.42Å; M187-Y217 HydrophobicContact CE-CD1 3.97Å; M187-Y217 HydrophobicContact CE-CG 4.12Å; M187-Y217 HydrophobicContact SD-CD1 4.18Å; M187-Y217 HydrophobicContact SD-CD2 4.01Å; M187-Y217 HydrophobicContact SD-CE2 4.47Å; M187-Y217 HydrophobicContact SD-CG 3.85Å
188	R	96.7	Very high	88.5	Confident	44 Å²	44	59.8 Å²	59.8	17%	0.166	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.3	-177.9	-178.9	-174.2	173	150.5	11.1	111.1	Y90 G115 Q116 I190 E197 E199 S200 R201	Y90-R188 VanDerWaalsContact CE1-O 3.26Å; Y90-R188 WeakPolarHBondContact CE1-O 3.47Å; Y90-R188 VanDerWaalsContact OH-C 3.31Å; Y90-R188 PolarHBondContact OH-N 3.36Å; Y90-R188 PolarHBondContact OH-O 3.08Å; G115-R188 CarbonylContact C-O 3.52Å; G115-R188 WeakPolarHBondContact CA-O 3.4Å; Q116-R188 HydrophobicContact CB-CB 4.37Å; Q116-R188 PolarHBondContact N-O 2.72Å; Q116-R188 PolarHBondContact O-N 2.86Å; R188-I190 HydrophobicContact CG-CG1 3.99Å; R188-I190 VanDerWaalsContact NE-CG1 3.31Å; R188-E197 IonicContact CZ-OE1 3.9Å; R188-E197 IonicContact NH2-OE1 3.96Å; R188-E197 PolarHBondContact NH2-OE1 3.48Å; R188-E199 WeakPolarHBondContact CD-OE2 3.39Å; R188-E199 HydrophobicContact CG-CB 4.16Å; R188-E199 WeakPolarHBondContact CG-OE2 2.93Å; R188-E199 VanDerWaalsContact CZ-CD 3.48Å; R188-E199 IonicContact CZ-OE2 3.95Å; R188-E199 IonicContact NE-OE2 2.72Å; R188-E199 PolarHBondContact NE-OE2 2.85Å; R188-E199 IonicContact NH1-OE2 3.75Å; R188-E199 PolarHBondContact NH1-OE2 3.33Å; R188-E199 IonicContact NH2-OE2 3.65Å; R188-E199 PolarHBondContact NH2-OE2 2.9Å; R188-S200 CarbonylContact C-O 3.54Å; R188-S200 VanDerWaalsContact CA-O 3.23Å; R188-S200 WeakPolarHBondContact CA-O 3.26Å; R188-R201 HydrophobicContact CG-CG 4.46Å
189	G	96.5	Very high	89.3	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	135.3	165.5	0	0	0	0	0	110.3	Y91 E199 S200	Y91-G189 VanDerWaalsContact CE2-CA 3.46Å; G189-E199 CarbonylContact O-C 3.2Å; G189-E199 WeakPolarHBondContact O-CA 3.2Å; G189-S200 PolarHBondContact N-O 2.82Å; G189-S200 PolarHBondContact O-N 3.48Å
190	I	94.8	Very high	89.9	Confident	6 Å²	6	57.2 Å²	57.2	3%	0.031	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.8	-177.2	-62.3	174.3	0	0	0	109.8	R113 I114 R188 E197	R113-I190 HydrophobicContact CG-CD1 4.03Å; R113-I190 VanDerWaalsContact NE-CD1 3.34Å; I114-I190 PolarHBondContact O-N 3.35Å; R188-I190 HydrophobicContact CG-CG1 3.99Å; R188-I190 VanDerWaalsContact NE-CG1 3.31Å; I190-E197 VanDerWaalsContact CG2-CD 3.47Å; I190-E197 HydrophobicContact CG2-CG 3.5Å; I190-E197 WeakPolarHBondContact CG2-OE1 3.45Å
191	F	91.6	Very high	90.5	Very high	38 Å²	38	56.2 Å²	56.2	17%	0.167	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.3	-179.3	-49.3	-93.7	0	0	0	110	V29 L36 Y54 Y91 V198	V29-F191 HydrophobicContact CG1-CG 4.43Å; L36-F191 HydrophobicContact CD1-CD2 4.27Å; L36-F191 HydrophobicContact CD2-CD2 3.67Å; L36-F191 HydrophobicContact CD2-CE2 3.42Å; L36-F191 VanDerWaalsContact CD2-CE2 3.42Å; L36-F191 HydrophobicContact CD2-CZ 4.15Å; Y54-F191 HydrophobicContact CD1-CZ 4.35Å; Y54-F191 HydrophobicContact CE1-CE1 4.31Å; Y54-F191 HydrophobicContact CE1-CE2 4.25Å; Y54-F191 AromaticContact CE1-CZ 3.69Å; Y54-F191 HydrophobicContact CE1-CZ 3.69Å; Y91-F191 HydrophobicContact CD1-CE2 4.33Å; Y91-F191 AromaticContact CD1-CZ 3.78Å; Y91-F191 HydrophobicContact CD1-CZ 3.78Å; Y91-F191 HydrophobicContact CG-CZ 4.11Å; F191-V198 HydrophobicContact CB-CG2 3.87Å; F191-V198 PolarHBondContact N-O 3.01Å; F191-V198 PolarHBondContact O-N 3.35Å
192	W	87.7	Confident	91.1	Very high	147 Å²	147	50.4 Å²	50.4	56%	0.557	24%	0.24	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-103.4	113.4	179.4	-71.5	86.8	0	0	0	110.1	I112 E197	I112-W192 HydrophobicContact CD1-CG 3.95Å; W192-E197 HydrophobicContact CE3-CB 4.42Å; W192-E197 HydrophobicContact CH2-CB 4.43Å; W192-E197 HydrophobicContact CZ2-CG 4.49Å; W192-E197 HydrophobicContact CZ3-CB 4.3Å
193	C	85.1	Confident	91.6	Very high	14 Å²	14	51.3 Å²	51.3	10%	0.095	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	91.7	179.1	-68.5	0	0	0	0	109.9	C30 T195 S196	C30-C193 WeakPolarHBondContact CA-SG 3.21Å; C30-C193 HydrophobicContact CB-CB 3.78Å; C30-C193 WeakPolarHBondContact CB-SG 3.39Å; C30-C193 WeakPolarHBondContact SG-CA 3.14Å; C30-C193 WeakPolarHBondContact SG-CB 3.44Å; C30-C193 CovalentContact SG-SG 2.04Å; C30-C193 PolarHBondContact SG-SG 2.9Å; C193-T195 PolarHBondContact O-N 3.3Å; C193-S196 PolarHBondContact N-O 2.94Å; C193-S196 PolarHBondContact O-N 3.03Å; C193-S196 PolarHBondContact O-OG 3.1Å
194	Q	82.7	Confident	92	Very high	201 Å²	201	50.8 Å²	50.8	94%	0.939	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	-69.8	179.4	-64	-176	2.6	0	0	116
195	T	79.2	Confident	92.2	Very high	138 Å²	138	48.9 Å²	48.9	85%	0.847	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.4	-10	-179.1	58.2	0	0	0	0	114.5	C193	C193-T195 PolarHBondContact O-N 3.3Å
196	S	86.2	Confident	92.1	Very high	57 Å²	57	51.5 Å²	51.5	40%	0.399	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	145.7	-177.3	59.5	0	0	0	0	112.7	C193	C193-S196 PolarHBondContact N-O 2.94Å; C193-S196 PolarHBondContact O-N 3.03Å; C193-S196 PolarHBondContact O-OG 3.1Å
197	E	89	Confident	91.9	Very high	64 Å²	64	55 Å²	55	30%	0.299	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	128.9	165.3	-169.9	-173.6	129.8	0	0	108.1	R113 R188 I190 W192	R113-E197 IonicContact NH2-OE1 3.83Å; R113-E197 IonicContact NH2-OE2 3.22Å; R188-E197 IonicContact CZ-OE1 3.9Å; R188-E197 IonicContact NH2-OE1 3.96Å; R188-E197 PolarHBondContact NH2-OE1 3.48Å; I190-E197 VanDerWaalsContact CG2-CD 3.47Å; I190-E197 HydrophobicContact CG2-CG 3.5Å; I190-E197 WeakPolarHBondContact CG2-OE1 3.45Å; W192-E197 HydrophobicContact CE3-CB 4.42Å; W192-E197 HydrophobicContact CH2-CB 4.43Å; W192-E197 HydrophobicContact CZ2-CG 4.49Å; W192-E197 HydrophobicContact CZ3-CB 4.3Å
198	V	91.9	Very high	91.7	Very high	27 Å²	27	56.1 Å²	56.1	16%	0.164	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.7	170.3	-62.7	0	0	0	0	109.1	V29 L36 F191	V29-V198 HydrophobicContact CG1-CG2 3.99Å; L36-V198 HydrophobicContact CD1-CB 3.68Å; L36-V198 HydrophobicContact CD1-CG2 3.55Å; F191-V198 HydrophobicContact CB-CG2 3.87Å; F191-V198 PolarHBondContact N-O 3.01Å; F191-V198 PolarHBondContact O-N 3.35Å
199	E	93.9	Very high	91.5	Very high	40 Å²	40	54.4 Å²	54.4	19%	0.187	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	143.4	-173.9	59.2	168.4	171.2	0	0	112.5	L36 Q37 R188 G189 R201	L36-E199 WeakPolarHBondContact CB-O 3.38Å; Q37-E199 PolarHBondContact NE2-O 3.37Å; R188-E199 WeakPolarHBondContact CD-OE2 3.39Å; R188-E199 HydrophobicContact CG-CB 4.16Å; R188-E199 WeakPolarHBondContact CG-OE2 2.93Å; R188-E199 VanDerWaalsContact CZ-CD 3.48Å; R188-E199 IonicContact CZ-OE2 3.95Å; R188-E199 IonicContact NE-OE2 2.72Å; R188-E199 PolarHBondContact NE-OE2 2.85Å; R188-E199 IonicContact NH1-OE2 3.75Å; R188-E199 PolarHBondContact NH1-OE2 3.33Å; R188-E199 IonicContact NH2-OE2 3.65Å; R188-E199 PolarHBondContact NH2-OE2 2.9Å; G189-E199 CarbonylContact O-C 3.2Å; G189-E199 WeakPolarHBondContact O-CA 3.2Å; E199-R201 HydrophobicContact CG-CG 4.24Å; E199-R201 WeakPolarHBondContact OE1-CD 3.28Å; E199-R201 IonicContact OE1-CZ 3.98Å; E199-R201 IonicContact OE1-NE 2.72Å; E199-R201 IonicContact OE1-NH1 3.16Å; E199-R201 PolarHBondContact OE1-NH1 3.32Å; E199-R201 WeakPolarHBondContact OE2-CD 3.28Å; E199-R201 WeakPolarHBondContact OE2-CG 3.29Å
200	S	95.1	Very high	91.4	Very high	2 Å²	2	58.3 Å²	58.3	1%	0.014	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	140.6	160.1	179.2	0	0	0	0	108.7	L36 R188 G189	L36-S200 WeakPolarHBondContact O-CA 3.5Å; L36-S200 VanDerWaalsContact O-CB 3.29Å; L36-S200 WeakPolarHBondContact O-CB 3.34Å; L36-S200 PolarHBondContact O-OG 2.95Å; R188-S200 CarbonylContact C-O 3.54Å; R188-S200 VanDerWaalsContact CA-O 3.23Å; R188-S200 WeakPolarHBondContact CA-O 3.26Å; G189-S200 PolarHBondContact N-O 2.82Å; G189-S200 PolarHBondContact O-N 3.48Å
201	R	95.7	Very high	91.3	Very high	109 Å²	109	60.3 Å²	60.3	41%	0.411	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	123.9	180	-66.4	-179.7	-65.9	-151.9	7.2	110	M187 R188 E199	M187-R201 WeakPolarHBondContact O-CA 3.3Å; R188-R201 HydrophobicContact CG-CG 4.46Å; E199-R201 HydrophobicContact CG-CG 4.24Å; E199-R201 WeakPolarHBondContact OE1-CD 3.28Å; E199-R201 IonicContact OE1-CZ 3.98Å; E199-R201 IonicContact OE1-NE 2.72Å; E199-R201 IonicContact OE1-NH1 3.16Å; E199-R201 PolarHBondContact OE1-NH1 3.32Å; E199-R201 WeakPolarHBondContact OE2-CD 3.28Å; E199-R201 WeakPolarHBondContact OE2-CG 3.29Å
202	I	96.6	Very high	91.5	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	108.8	170.4	-49.3	-179.7	0	0	0	107.4	H53 M58 K186 M187 Y217	H53-I202 HydrophobicContact CB-CD1 3.42Å; H53-I202 VanDerWaalsContact CB-CD1 3.42Å; H53-I202 HydrophobicContact CB-CG1 3.86Å; M58-I202 HydrophobicContact CB-CG2 4.49Å; M58-I202 HydrophobicContact CE-CG2 4.19Å; M58-I202 HydrophobicContact SD-CG2 3.66Å; K186-I202 CarbonylContact C-O 3.51Å; K186-I202 WeakPolarHBondContact CA-O 3.43Å; K186-I202 WeakPolarHBondContact CB-O 3.38Å; M187-I202 HydrophobicContact CE-CD1 3.66Å; M187-I202 PolarHBondContact N-O 2.87Å; M187-I202 PolarHBondContact O-N 2.79Å; I202-Y217 HydrophobicContact CB-CE1 4.15Å; I202-Y217 HydrophobicContact CD1-CD1 4.29Å; I202-Y217 HydrophobicContact CD1-CE1 4.34Å; I202-Y217 HydrophobicContact CG2-CE1 3.7Å
203	T	95.6	Very high	91.9	Very high	66 Å²	66	52.1 Å²	52.1	41%	0.405	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.2	-178.5	-55.2	0	0	0	0	109.8	Y184	Y184-T203 HydrophobicContact CE2-CG2 4.2Å
204	I	95.6	Very high	92.5	Very high	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-77.4	128.9	176.6	-60	177.7	0	0	0	108.6	M58 I60 I169 Y171 S185 I206 R208 I209 V215 Y217	M58-I204 HydrophobicContact SD-CG1 4.49Å; I60-I204 HydrophobicContact CD1-CG2 3.94Å; I169-I204 HydrophobicContact CD1-CD1 4.3Å; Y171-I204 HydrophobicContact CE2-CD1 4.38Å; Y171-I204 WeakPolarHBondContact OH-CD1 3.41Å; S185-I204 PolarHBondContact O-N 3.2Å; S185-I204 VanDerWaalsContact OG-CD1 3.28Å; S185-I204 WeakPolarHBondContact OG-CD1 3.26Å; I204-I206 PolarHBondContact O-N 2.89Å; I204-R208 HydrophobicContact CG2-CB 4.44Å; I204-I209 HydrophobicContact CB-CD1 4.42Å; I204-I209 HydrophobicContact CB-CG1 4.38Å; I204-I209 HydrophobicContact CG2-CD1 4.33Å; I204-I209 HydrophobicContact CG2-CG1 3.77Å; I204-V215 HydrophobicContact CD1-CB 4.05Å; I204-V215 HydrophobicContact CD1-CG1 3.86Å; I204-V215 HydrophobicContact CD1-CG2 3.8Å; I204-V215 HydrophobicContact CG1-CG1 4.3Å; I204-V215 HydrophobicContact CG2-CG2 4.39Å; I204-Y217 WeakPolarHBondContact CD1-OH 3.38Å; I204-Y217 VanDerWaalsContact CG1-OH 3.27Å; I204-Y217 WeakPolarHBondContact CG1-OH 3.36Å
205	P	94	Very high	93.2	Very high	37 Å²	37	42.7 Å²	42.7	24%	0.24	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-59.2	131.3	176.2	-23.2	33.1	0	0	0	111.6	L49 E207 R208	L49-P205 HydrophobicContact CD2-CG 4.28Å; P205-E207 VanDerWaalsContact CB-CD 3.49Å; P205-E207 WeakPolarHBondContact CB-OE1 3.03Å; P205-E207 WeakPolarHBondContact CB-OE2 3.11Å; P205-E207 PolarHBondContact O-N 3.15Å; P205-R208 HydrophobicContact CB-CG 4.06Å; P205-R208 HydrophobicContact CG-CG 4.47Å; P205-R208 VanDerWaalsContact O-CB 3.31Å; P205-R208 WeakPolarHBondContact O-CB 3Å; P205-R208 PolarHBondContact O-N 3.5Å
206	I	92.4	Very high	94	Very high	57 Å²	57	37.4 Å²	37.4	29%	0.292	19%	0.194	S	C	.	.	G	3₁₀ helix	trans	-58.5	-33.9	-170.5	-166.3	166.3	0	0	0	113.3	R180 I204 R208 I209	R180-I206 HydrophobicContact CB-CD1 4.01Å; R180-I206 HydrophobicContact CB-CG1 4.02Å; R180-I206 WeakPolarHBondContact O-CD1 3.39Å; R180-I206 WeakPolarHBondContact O-CG1 3.37Å; I204-I206 PolarHBondContact O-N 2.89Å; I206-R208 PolarHBondContact O-N 2.84Å; I206-I209 PolarHBondContact O-N 3.37Å
207	E	91.8	Very high	94.5	Very high	102 Å²	102	34.7 Å²	34.7	48%	0.477	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-69.7	-14.3	178.2	71.5	-78.1	-178.3	0	0	113.6	P205	P205-E207 VanDerWaalsContact CB-CD 3.49Å; P205-E207 WeakPolarHBondContact CB-OE1 3.03Å; P205-E207 WeakPolarHBondContact CB-OE2 3.11Å; P205-E207 PolarHBondContact O-N 3.15Å
208	R	93.6	Very high	94.8	Very high	25 Å²	25	32.5 Å²	32.5	9%	0.094	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-93.5	-18.5	176.8	-55.4	-66.7	-179.7	157.3	2	112.5	N45 K46 I60 I204 P205 I206 K210 T213	N45-R208 PolarHBondContact O-NH1 3.39Å; N45-R208 PolarHBondContact O-NH2 2.72Å; K46-R208 PolarHBondContact O-NH1 3.27Å; I60-R208 HydrophobicContact CD1-CB 4.34Å; I60-R208 HydrophobicContact CD1-CG 4.36Å; I60-R208 HydrophobicContact CG2-CB 4.11Å; I60-R208 HydrophobicContact CG2-CG 4.45Å; I204-R208 HydrophobicContact CG2-CB 4.44Å; P205-R208 HydrophobicContact CB-CG 4.06Å; P205-R208 HydrophobicContact CG-CG 4.47Å; P205-R208 VanDerWaalsContact O-CB 3.31Å; P205-R208 WeakPolarHBondContact O-CB 3Å; P205-R208 PolarHBondContact O-N 3.5Å; I206-R208 PolarHBondContact O-N 2.84Å; R208-K210 PolarHBondContact O-N 2.92Å; R208-T213 WeakPolarHBondContact O-CB 3.41Å; R208-T213 VanDerWaalsContact O-CG2 3.31Å; R208-T213 WeakPolarHBondContact O-CG2 3.43Å; R208-T213 PolarHBondContact O-OG1 3.14Å
209	I	93.4	Very high	94.8	Very high	8 Å²	8	32 Å²	32	4%	0.041	16%	0.163	C	C	.	.			trans	-77.2	93.6	178	-55.9	176.7	0	0	0	109	Y171 L183 I204 I206	Y171-I209 HydrophobicContact CD1-CG2 3.92Å; Y171-I209 HydrophobicContact CE1-CG2 3.61Å; L183-I209 HydrophobicContact CB-CD1 4.43Å; L183-I209 HydrophobicContact CB-CG2 4.38Å; L183-I209 HydrophobicContact CD1-CB 4.49Å; L183-I209 HydrophobicContact CD1-CG2 4.03Å; I204-I209 HydrophobicContact CB-CD1 4.42Å; I204-I209 HydrophobicContact CB-CG1 4.38Å; I204-I209 HydrophobicContact CG2-CD1 4.33Å; I204-I209 HydrophobicContact CG2-CG1 3.77Å; I206-I209 PolarHBondContact O-N 3.37Å
210	K	93	Very high	94.3	Very high	81 Å²	81	31.5 Å²	31.5	35%	0.352	16%	0.161	S	C	.	.	S	Bend	trans	-155.7	166.1	178.7	62.6	-179.2	-177	-179.1	0	110.6	Y171 R208 G212 T213	Y171-K210 VanDerWaalsContact CB-O 3.26Å; Y171-K210 WeakPolarHBondContact CB-O 3.42Å; R208-K210 PolarHBondContact O-N 2.92Å; K210-G212 PolarHBondContact O-N 3.49Å; K210-T213 VanDerWaalsContact O-CB 3.32Å; K210-T213 WeakPolarHBondContact O-CB 3.28Å; K210-T213 PolarHBondContact O-N 2.89Å; K210-T213 PolarHBondContact O-OG1 2.75Å; K210-T213 VanDerWaalsContact O-OG1 3.1Å
211	S	94.2	Very high	93.5	Very high	49 Å²	49	32.9 Å²	32.9	34%	0.343	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	137.9	178.5	-46	0	0	0	0	112	Y171 I174 T213	Y171-S211 CarbonylContact O-C 3.5Å; Y171-S211 WeakPolarHBondContact O-CA 3.49Å; I174-S211 PolarHBondContact N-OG 2.63Å; I174-S211 PolarHBondContact O-OG 3.33Å; S211-T213 VanDerWaalsContact C-N 3.33Å
212	G	95.3	Very high	92.6	Very high	12 Å²	12	32.3 Å²	32.3	12%	0.124	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.9	10.2	-177.4	0	0	0	0	0	115	L62 N63 Q64 Y171 K210	L62-G212 CarbonylContact C-O 3.57Å; N63-G212 WeakPolarHBondContact CA-O 3.48Å; N63-G212 PolarHBondContact N-O 2.51Å; Q64-G212 PolarHBondContact N-O 2.84Å; Y171-G212 PolarHBondContact O-N 2.85Å; K210-G212 PolarHBondContact O-N 3.49Å
213	T	96.4	Very high	91.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	129.4	173.8	-64	0	0	0	0	110.8	I60 T61 L62 Y170 Y171 R208 K210 S211 V215	I60-T213 HydrophobicContact CG2-CG2 3.7Å; T61-T213 WeakPolarHBondContact O-CA 3.33Å; L62-T213 HydrophobicContact CD2-CG2 3.93Å; L62-T213 WeakPolarHBondContact CD2-OG1 3.28Å; Y170-T213 WeakPolarHBondContact CD2-O 3.45Å; Y171-T213 HydrophobicContact CD2-CG2 3.88Å; Y171-T213 WeakPolarHBondContact CD2-O 3.12Å; Y171-T213 HydrophobicContact CE2-CG2 4.3Å; Y171-T213 PolarHBondContact N-O 2.82Å; R208-T213 WeakPolarHBondContact O-CB 3.41Å; R208-T213 VanDerWaalsContact O-CG2 3.31Å; R208-T213 WeakPolarHBondContact O-CG2 3.43Å; R208-T213 PolarHBondContact O-OG1 3.14Å; K210-T213 VanDerWaalsContact O-CB 3.32Å; K210-T213 WeakPolarHBondContact O-CB 3.28Å; K210-T213 PolarHBondContact O-N 2.89Å; K210-T213 PolarHBondContact O-OG1 2.75Å; K210-T213 VanDerWaalsContact O-OG1 3.1Å; S211-T213 VanDerWaalsContact C-N 3.33Å; T213-V215 HydrophobicContact CG2-CG2 3.98Å
214	L	97.1	Very high	91.3	Very high	18 Å²	18	29.1 Å²	29.1	9%	0.094	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	129.8	168.1	178.4	64.9	0	0	0	109.4	I60 T61 Q64 P67 Y170 E216	I60-L214 WeakPolarHBondContact CA-O 3.17Å; T61-L214 PolarHBondContact N-O 3.25Å; T61-L214 PolarHBondContact O-N 3.03Å; Q64-L214 HydrophobicContact CB-CB 3.98Å; Q64-L214 HydrophobicContact CG-CB 3.89Å; Q64-L214 HydrophobicContact CG-CD2 4.44Å; P67-L214 HydrophobicContact CG-CD1 4.18Å; Y170-L214 HydrophobicContact CD2-CB 4.14Å; Y170-L214 HydrophobicContact CD2-CD1 4.28Å; L214-E216 HydrophobicContact CD1-CG 4.43Å; L214-E216 HydrophobicContact CD2-CG 4.09Å; L214-E216 HydrophobicContact CG-CG 3.93Å
215	V	97.6	Very high	90.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.4	172	-179.1	0	0	0	0	108.7	M58 R59 I60 S168 I169 Y171 I204 T213 Y217	M58-V215 HydrophobicContact CG-CG1 3.99Å; M58-V215 HydrophobicContact SD-CG1 4.22Å; R59-V215 CarbonylContact O-C 3.52Å; R59-V215 WeakPolarHBondContact O-CA 3.48Å; I60-V215 HydrophobicContact CB-CG2 4.31Å; I60-V215 HydrophobicContact CD1-CG2 4.26Å; I60-V215 HydrophobicContact CG1-CB 4.46Å; I60-V215 HydrophobicContact CG1-CG1 4.13Å; I60-V215 HydrophobicContact CG1-CG2 3.82Å; I60-V215 HydrophobicContact CG2-CG2 4.03Å; S168-V215 CarbonylContact C-O 3.56Å; S168-V215 WeakPolarHBondContact CA-O 3.17Å; I169-V215 HydrophobicContact CB-CB 4.35Å; I169-V215 PolarHBondContact N-O 3.03Å; I169-V215 PolarHBondContact O-N 3.17Å; Y171-V215 HydrophobicContact CE2-CG2 4.16Å; I204-V215 HydrophobicContact CD1-CB 4.05Å; I204-V215 HydrophobicContact CD1-CG1 3.86Å; I204-V215 HydrophobicContact CD1-CG2 3.8Å; I204-V215 HydrophobicContact CG1-CG1 4.3Å; I204-V215 HydrophobicContact CG2-CG2 4.39Å; T213-V215 HydrophobicContact CG2-CG2 3.98Å; V215-Y217 HydrophobicContact CG1-CD2 4.44Å; V215-Y217 HydrophobicContact CG1-CE1 4.35Å; V215-Y217 HydrophobicContact CG1-CE2 3.8Å
216	E	96.5	Very high	90.2	Very high	26 Å²	26	32.5 Å²	32.5	12%	0.121	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123.7	-178.3	-53.7	-178.7	102.4	0	0	109.1	M58 R59 K166 I167 L214	M58-E216 CarbonylContact C-O 3.54Å; M58-E216 WeakPolarHBondContact CA-O 3.27Å; R59-E216 HydrophobicContact CB-CB 4.4Å; R59-E216 WeakPolarHBondContact CD-OE2 3.48Å; R59-E216 IonicContact CZ-OE2 2.7Å; R59-E216 PolarHBondContact N-O 3.37Å; R59-E216 IonicContact NH1-OE2 3.89Å; R59-E216 PolarHBondContact NH1-OE2 2.86Å; R59-E216 PolarHBondContact O-N 2.83Å; K166-E216 VanDerWaalsContact CE-OE1 3.23Å; K166-E216 WeakPolarHBondContact CE-OE1 3.36Å; K166-E216 IonicContact NZ-OE1 3.03Å; K166-E216 PolarHBondContact NZ-OE1 2.85Å; I167-E216 WeakPolarHBondContact O-CA 3.38Å; L214-E216 HydrophobicContact CD1-CG 4.43Å; L214-E216 HydrophobicContact CD2-CG 4.09Å; L214-E216 HydrophobicContact CG-CG 3.93Å
217	Y	96.6	Very high	89.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	123.1	169.3	-56.5	-79.5	0	0	0	109	T57 M58 K166 I167 I169 M187 I202 I204 V215	T57-Y217 VanDerWaalsContact O-CA 3.28Å; T57-Y217 WeakPolarHBondContact O-CA 3.28Å; M58-Y217 HydrophobicContact CB-CD1 3.98Å; M58-Y217 HydrophobicContact CB-CE1 3.98Å; M58-Y217 HydrophobicContact CG-CD1 4.01Å; M58-Y217 HydrophobicContact CG-CE1 3.63Å; M58-Y217 HydrophobicContact SD-CE1 3.63Å; K166-Y217 VanDerWaalsContact CA-O 3.3Å; K166-Y217 WeakPolarHBondContact CA-O 3.49Å; I167-Y217 HydrophobicContact CB-CD2 4.21Å; I167-Y217 HydrophobicContact CG2-CD2 4.18Å; I167-Y217 PolarHBondContact N-O 3.35Å; I167-Y217 PolarHBondContact O-N 2.95Å; I169-Y217 HydrophobicContact CD1-CE2 3.91Å; I169-Y217 HydrophobicContact CG1-CE2 4.46Å; M187-Y217 HydrophobicContact CB-CE1 4.44Å; M187-Y217 HydrophobicContact CB-CE2 4.42Å; M187-Y217 HydrophobicContact CE-CD1 3.97Å; M187-Y217 HydrophobicContact CE-CG 4.12Å; M187-Y217 HydrophobicContact SD-CD1 4.18Å; M187-Y217 HydrophobicContact SD-CD2 4.01Å; M187-Y217 HydrophobicContact SD-CE2 4.47Å; M187-Y217 HydrophobicContact SD-CG 3.85Å; I202-Y217 HydrophobicContact CB-CE1 4.15Å; I202-Y217 HydrophobicContact CD1-CD1 4.29Å; I202-Y217 HydrophobicContact CD1-CE1 4.34Å; I202-Y217 HydrophobicContact CG2-CE1 3.7Å; I204-Y217 WeakPolarHBondContact CD1-OH 3.38Å; I204-Y217 VanDerWaalsContact CG1-OH 3.27Å; I204-Y217 WeakPolarHBondContact CG1-OH 3.36Å; V215-Y217 HydrophobicContact CG1-CD2 4.44Å; V215-Y217 HydrophobicContact CG1-CE1 4.35Å; V215-Y217 HydrophobicContact CG1-CE2 3.8Å
218	E	93.7	Very high	89.6	Confident	18 Å²	18	34.1 Å²	34.1	8%	0.084	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.5	177.5	-69.7	-176.5	177.1	0	0	110.1	Y56 T57 K166 M220	Y56-E218 CarbonylContact C-O 3.56Å; Y56-E218 WeakPolarHBondContact CA-O 3.29Å; T57-E218 PolarHBondContact N-O 3.3Å; T57-E218 PolarHBondContact O-N 2.84Å; K166-E218 HydrophobicContact CB-CG 4.49Å; K166-E218 HydrophobicContact CD-CG 4.03Å; K166-E218 HydrophobicContact CG-CG 4.04Å; K166-E218 IonicContact NZ-OE1 2.94Å; K166-E218 PolarHBondContact NZ-OE1 3.1Å; E218-M220 PolarHBondContact O-N 2.93Å
219	P	92.9	Very high	89.3	Confident	18 Å²	18	36.1 Å²	36.1	12%	0.117	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	129.8	177.4	-27.1	35.1	0	0	0	112	N55 Y56 G165 G221 E222 S223	N55-P219 WeakPolarHBondContact O-CA 3.45Å; Y56-P219 HydrophobicContact CD1-CG 4.48Å; Y56-P219 HydrophobicContact CE1-CB 4.47Å; Y56-P219 HydrophobicContact CE1-CG 3.9Å; G165-P219 WeakPolarHBondContact O-CG 2.95Å; P219-G221 VanDerWaalsContact C-N 3.27Å; P219-G221 PolarHBondContact O-N 2.99Å; P219-E222 HydrophobicContact CB-CG 4.33Å; P219-E222 PolarHBondContact O-N 3.38Å; P219-S223 PolarHBondContact O-N 2.84Å
220	M	84.2	Confident	89.1	Confident	28 Å²	28	37.1 Å²	37.1	14%	0.138	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-58.2	-40.2	-175.2	-168.8	69.9	74.1	0	0	111.9	H52 H53 N55 Y56 T57 E218 E222 S223 A225	H52-M220 HydrophobicContact CB-CE 4.03Å; H53-M220 VanDerWaalsContact O-CE 3.26Å; H53-M220 WeakPolarHBondContact O-CE 3.01Å; N55-M220 PolarHBondContact O-N 3.09Å; Y56-M220 WeakPolarHBondContact O-CE 3.24Å; T57-M220 HydrophobicContact CG2-CE 3.89Å; T57-M220 HydrophobicContact CG2-SD 3.71Å; E218-M220 PolarHBondContact O-N 2.93Å; M220-E222 PolarHBondContact O-N 3Å; M220-S223 PolarHBondContact O-N 3.03Å; M220-S223 PolarHBondContact O-OG 2.01Å; M220-A225 HydrophobicContact CE-CB 4.45Å; M220-A225 HydrophobicContact SD-CB 3.19Å; M220-A225 WeakPolarHBondContact SD-CB 3.48Å
221	G	77.9	Confident	88.9	Confident	32 Å²	32	38.7 Å²	38.7	33%	0.33	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-60.7	-24.6	178.1	0	0	0	0	0	114.6	P219 K226	P219-G221 VanDerWaalsContact C-N 3.27Å; P219-G221 PolarHBondContact O-N 2.99Å; G221-K226 WeakPolarHBondContact O-CD 3.2Å; G221-K226 PolarHBondContact O-NZ 2.77Å
222	E	75.9	Confident	88.8	Confident	96 Å²	96	38.1 Å²	38.1	45%	0.449	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-93.2	-7.8	177.4	-62.8	-58.3	145.7	0	0	112.5	P219 M220 S239 I241	P219-E222 HydrophobicContact CB-CG 4.33Å; P219-E222 PolarHBondContact O-N 3.38Å; M220-E222 PolarHBondContact O-N 3Å; E222-S239 PolarHBondContact OE2-OG 2.95Å; E222-S239 VanDerWaalsContact OE2-OG 3.09Å; E222-I241 VanDerWaalsContact O-CD1 3.26Å; E222-I241 WeakPolarHBondContact O-CD1 3.39Å
223	S	80.6	Confident	88.5	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.007	20%	0.202	C	C	.	.	S	Bend	trans	-102.8	163.9	179.7	71.7	0	0	0	0	112.9	P219 M220 A225 K226 D254	P219-S223 PolarHBondContact O-N 2.84Å; M220-S223 PolarHBondContact O-N 3.03Å; M220-S223 PolarHBondContact O-OG 2.01Å; S223-A225 PolarHBondContact O-N 2.7Å; S223-A225 WeakPolarHBondContact OG-CB 3.09Å; S223-A225 PolarHBondContact OG-N 3.5Å; S223-K226 WeakPolarHBondContact O-CG 3.29Å; S223-D254 WeakPolarHBondContact CB-OD2 3.16Å
224	C	85	Confident	88	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-61.6	-21.2	169.2	-65.3	0	0	0	0	112.5	K226 Y227 C243 C252 I253 D254	C224-K226 PolarHBondContact O-N 3Å; C224-K226 VanDerWaalsContact O-N 3.1Å; C224-Y227 VanDerWaalsContact O-CD2 3.25Å; C224-Y227 WeakPolarHBondContact O-CD2 2.98Å; C224-Y227 PolarHBondContact O-N 2.93Å; C224-C243 HydrophobicContact CB-CB 3.7Å; C224-C243 WeakPolarHBondContact CB-SG 3.32Å; C224-C243 WeakPolarHBondContact SG-CA 3.15Å; C224-C243 WeakPolarHBondContact SG-CB 3.15Å; C224-C243 CovalentContact SG-SG 2.01Å; C224-C243 PolarHBondContact SG-SG 2.86Å; C224-C252 WeakPolarHBondContact O-CB 3.35Å; C224-C252 PolarHBondContact O-SG 3.3Å; C224-I253 VanDerWaalsContact CB-C 3.46Å; C224-I253 WeakPolarHBondContact CB-O 3.48Å; C224-D254 WeakPolarHBondContact CB-OD1 3.1Å; C224-D254 PolarHBondContact N-OD1 2.84Å; C224-D254 PolarHBondContact SG-OD1 2.91Å
225	A	84	Confident	87.5	Confident	17 Å²	17	46.6 Å²	46.6	14%	0.14	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-66.4	-13.2	-176.5	0	0	0	0	0	114.3	H52 T57 M220 S223 Y227 C252	H52-A225 WeakPolarHBondContact CE1-CB 3.16Å; T57-A225 HydrophobicContact CG2-CB 3.94Å; M220-A225 HydrophobicContact CE-CB 4.45Å; M220-A225 HydrophobicContact SD-CB 3.19Å; M220-A225 WeakPolarHBondContact SD-CB 3.48Å; S223-A225 PolarHBondContact O-N 2.7Å; S223-A225 WeakPolarHBondContact OG-CB 3.09Å; S223-A225 PolarHBondContact OG-N 3.5Å; A225-Y227 PolarHBondContact O-N 2.98Å; A225-C252 WeakPolarHBondContact CA-O 3.34Å
226	K	81.8	Confident	86.9	Confident	94 Å²	94	47 Å²	47	41%	0.409	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-66.9	-19	169	72.9	-169.2	173.1	-173.9	0	114.7	G221 S223 C224	G221-K226 WeakPolarHBondContact O-CD 3.2Å; G221-K226 PolarHBondContact O-NZ 2.77Å; S223-K226 WeakPolarHBondContact O-CG 3.29Å; C224-K226 PolarHBondContact O-N 3Å; C224-K226 VanDerWaalsContact O-N 3.1Å
227	Y	86	Confident	86.3	Confident	60 Å²	60	55.3 Å²	55.3	24%	0.235	28%	0.282	C	S	.	.			trans	-89.4	117.8	-178.7	-59.8	-73.8	0	0	0	110.8	C224 A225 A236 P238 C252	C224-Y227 VanDerWaalsContact O-CD2 3.25Å; C224-Y227 WeakPolarHBondContact O-CD2 2.98Å; C224-Y227 PolarHBondContact O-N 2.93Å; A225-Y227 PolarHBondContact O-N 2.98Å; Y227-A236 HydrophobicContact CD1-CB 4.21Å; Y227-A236 HydrophobicContact CD2-CB 3.46Å; Y227-A236 VanDerWaalsContact CD2-CB 3.46Å; Y227-A236 HydrophobicContact CE1-CB 3.89Å; Y227-A236 HydrophobicContact CE2-CB 3.13Å; Y227-A236 HydrophobicContact CG-CB 4Å; Y227-P238 HydrophobicContact CE2-CG 4.3Å; Y227-C252 WeakPolarHBondContact O-CB 3.32Å
228	N	85.7	Confident	85.4	Confident	134 Å²	134	55.7 Å²	55.7	72%	0.717	28%	0.284	S	S	*	.			trans	-98.5	2.5	-172.2	65	-3.6	0	0	0	114.3	W245	N228-W245 WeakPolarHBondContact O-CH2 3.37Å
229	T	88.3	Confident	84.5	Confident	66 Å²	66	58.8 Å²	58.8	41%	0.405	31%	0.307	S	S	.	.	S	Bend	trans	-130.3	151.6	176	67	0	0	0	0	111.4	E231 S232 C233	T229-E231 VanDerWaalsContact C-N 3.27Å; T229-E231 PolarHBondContact O-N 2.72Å; T229-S232 PolarHBondContact N-OG 2.85Å; T229-S232 PolarHBondContact O-N 3.39Å; T229-S232 PolarHBondContact O-OG 2.98Å; T229-S232 WeakPolarHBondContact OG1-CB 3.4Å; T229-S232 PolarHBondContact OG1-N 2.8Å; T229-S232 PolarHBondContact OG1-OG 2.88Å; T229-C233 VanDerWaalsContact O-CB 3.24Å; T229-C233 WeakPolarHBondContact O-CB 3.28Å; T229-C233 PolarHBondContact O-N 2.96Å
230	S	89.5	Confident	83.8	Confident	30 Å²	30	65.3 Å²	65.3	21%	0.21	34%	0.342	C	S	.	.	H	α-helix	trans	-58.3	-39.6	176.2	-163.2	0	0	0	0	112.6	C233 Q234 W245	S230-C233 PolarHBondContact O-N 2.98Å; S230-Q234 WeakPolarHBondContact O-CB 3.42Å; S230-Q234 VanDerWaalsContact O-CG 3.23Å; S230-Q234 WeakPolarHBondContact O-CG 3.45Å; S230-Q234 PolarHBondContact O-N 2.87Å; S230-Q234 PolarHBondContact OG-NE2 3.42Å; S230-W245 VanDerWaalsContact CA-CD2 3.44Å; S230-W245 VanDerWaalsContact OG-CD1 3.24Å; S230-W245 VanDerWaalsContact OG-CG 3.29Å
231	E	88.6	Confident	83.7	Confident	114 Å²	114	64.9 Å²	64.9	53%	0.533	34%	0.34	S	S	.	.	H	α-helix	trans	-66.1	-45.1	179.7	-176	176	-171.5	0	0	112	T229 N235 K285	T229-E231 VanDerWaalsContact C-N 3.27Å; T229-E231 PolarHBondContact O-N 2.72Å; E231-N235 PolarHBondContact O-ND2 3.02Å; E231-K285 IonicContact OE1-NZ 2.71Å; E231-K285 PolarHBondContact OE1-NZ 2.91Å; E231-K285 IonicContact OE2-NZ 2.74Å; E231-K285 PolarHBondContact OE2-NZ 3.19Å
232	S	90.6	Very high	84	Confident	37 Å²	37	65.7 Å²	65.7	26%	0.259	34%	0.343	S	S	.	.	H	α-helix	trans	-67.7	-39.9	177.5	61	0	0	0	0	111.6	T229 A236	T229-S232 PolarHBondContact N-OG 2.85Å; T229-S232 PolarHBondContact O-N 3.39Å; T229-S232 PolarHBondContact O-OG 2.98Å; T229-S232 WeakPolarHBondContact OG1-CB 3.4Å; T229-S232 PolarHBondContact OG1-N 2.8Å; T229-S232 PolarHBondContact OG1-OG 2.88Å; S232-A236 VanDerWaalsContact O-CB 3.26Å; S232-A236 WeakPolarHBondContact O-CB 2.68Å; S232-A236 PolarHBondContact O-N 3.31Å
233	C	90	Very high	84.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.5	-47	177.5	-177.5	0	0	0	0	113.2	T229 S230 N235 A236 C243 I244 W245 C252	T229-C233 VanDerWaalsContact O-CB 3.24Å; T229-C233 WeakPolarHBondContact O-CB 3.28Å; T229-C233 PolarHBondContact O-N 2.96Å; S230-C233 PolarHBondContact O-N 2.98Å; C233-N235 VanDerWaalsContact C-N 3.26Å; C233-N235 PolarHBondContact O-N 2.02Å; C233-A236 WeakPolarHBondContact O-CB 3.09Å; C233-A236 PolarHBondContact O-N 3.33Å; C233-C243 WeakPolarHBondContact O-CB 3.36Å; C233-I244 PolarHBondContact SG-O 2.85Å; C233-I244 VanDerWaalsContact SG-O 3.42Å; C233-W245 HydrophobicContact CB-CB 4.3Å; C233-W245 HydrophobicContact CB-CE3 3.68Å; C233-W245 HydrophobicContact CB-CZ3 4.45Å; C233-C252 WeakPolarHBondContact CA-SG 3.25Å; C233-C252 HydrophobicContact CB-CB 3.56Å; C233-C252 WeakPolarHBondContact CB-SG 3.28Å; C233-C252 VanDerWaalsContact SG-CA 3.55Å; C233-C252 WeakPolarHBondContact SG-CB 3.31Å; C233-C252 CovalentContact SG-SG 2.02Å; C233-C252 PolarHBondContact SG-SG 2.92Å
234	Q	86.3	Confident	84.9	Confident	78 Å²	78	62.3 Å²	62.3	36%	0.364	33%	0.329	S	S	.	.	H	α-helix	trans	-65	-29.7	-176.6	-76.5	176.8	32.2	0	0	113.3	S230 K271	S230-Q234 WeakPolarHBondContact O-CB 3.42Å; S230-Q234 VanDerWaalsContact O-CG 3.23Å; S230-Q234 WeakPolarHBondContact O-CG 3.45Å; S230-Q234 PolarHBondContact O-N 2.87Å; S230-Q234 PolarHBondContact OG-NE2 3.42Å; Q234-K271 VanDerWaalsContact OE1-NZ 3.14Å
235	N	85.1	Confident	85.1	Confident	130 Å²	130	63 Å²	63	70%	0.695	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-4.9	179.8	-64.4	-53.1	0	0	0	112.8	E231 C233	E231-N235 PolarHBondContact O-ND2 3.02Å; C233-N235 VanDerWaalsContact C-N 3.26Å; C233-N235 PolarHBondContact O-N 2.02Å
236	A	85.7	Confident	85.3	Confident	8 Å²	8	62.2 Å²	62.2	7%	0.066	33%	0.325	C	S	.	.			trans	-82.4	141.3	-174.8	0	0	0	0	0	112.9	Y227 S232 C233 C243	Y227-A236 HydrophobicContact CD1-CB 4.21Å; Y227-A236 HydrophobicContact CD2-CB 3.46Å; Y227-A236 VanDerWaalsContact CD2-CB 3.46Å; Y227-A236 HydrophobicContact CE1-CB 3.89Å; Y227-A236 HydrophobicContact CE2-CB 3.13Å; Y227-A236 HydrophobicContact CG-CB 4Å; S232-A236 VanDerWaalsContact O-CB 3.26Å; S232-A236 WeakPolarHBondContact O-CB 2.68Å; S232-A236 PolarHBondContact O-N 3.31Å; C233-A236 WeakPolarHBondContact O-CB 3.09Å; C233-A236 PolarHBondContact O-N 3.33Å; A236-C243 HydrophobicContact CB-CB 4.42Å; A236-C243 PolarHBondContact O-SG 3.05Å
237	R	83	Confident	85.4	Confident	201 Å²	201	60.1 Å²	60.1	76%	0.758	32%	0.319	S	S	*	.			trans	-142.9	71.5	168.3	-63.9	-175.2	-177	171.2	-0.1	110	S239 I241	R237-S239 PolarHBondContact O-N 2.85Å; R237-I241 WeakPolarHBondContact CA-O 3.21Å
238	P	78.8	Confident	85.3	Confident	8 Å²	8	62.7 Å²	62.7	5%	0.052	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-63.9	125.6	174.8	28.6	-30.1	0	0	0	108.4	Y227 D240 I241 C243	Y227-P238 HydrophobicContact CE2-CG 4.3Å; P238-D240 PolarHBondContact O-N 3.49Å; P238-I241 HydrophobicContact CG-CB 4.35Å; P238-I241 WeakPolarHBondContact O-CB 3.28Å; P238-I241 WeakPolarHBondContact O-CD1 3.5Å; P238-I241 WeakPolarHBondContact O-CG1 3.46Å; P238-I241 PolarHBondContact O-N 2.92Å; P238-C243 WeakPolarHBondContact CD-SG 3.34Å
239	S	75.5	Confident	85.1	Confident	82 Å²	82	57.7 Å²	57.7	57%	0.573	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	50.4	38.4	173.8	-54.9	0	0	0	0	113.6	E222 R237 I241	E222-S239 PolarHBondContact OE2-OG 2.95Å; E222-S239 VanDerWaalsContact OE2-OG 3.09Å; R237-S239 PolarHBondContact O-N 2.85Å; S239-I241 PolarHBondContact O-N 2.99Å
240	D	77.2	Confident	85	Confident	156 Å²	156	60 Å²	60	83%	0.834	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	64.1	12.2	-176.3	-60.7	-49	0	0	0	116.6	P238	P238-D240 PolarHBondContact O-N 3.49Å
241	I	81.7	Confident	84.9	Confident	19 Å²	19	59 Å²	59	10%	0.097	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-77.3	127.7	176.7	-54	160.9	0	0	0	109.3	E222 R237 P238 S239 D254 Y256	E222-I241 VanDerWaalsContact O-CD1 3.26Å; E222-I241 WeakPolarHBondContact O-CD1 3.39Å; R237-I241 WeakPolarHBondContact CA-O 3.21Å; P238-I241 HydrophobicContact CG-CB 4.35Å; P238-I241 WeakPolarHBondContact O-CB 3.28Å; P238-I241 WeakPolarHBondContact O-CD1 3.5Å; P238-I241 WeakPolarHBondContact O-CG1 3.46Å; P238-I241 PolarHBondContact O-N 2.92Å; S239-I241 PolarHBondContact O-N 2.99Å; I241-D254 HydrophobicContact CG2-CB 3.71Å; I241-Y256 HydrophobicContact CD1-CE2 4.37Å; I241-Y256 WeakPolarHBondContact CD1-OH 3.37Å; I241-Y256 HydrophobicContact CG1-CE1 4.44Å; I241-Y256 WeakPolarHBondContact CG1-OH 3.23Å; I241-Y256 HydrophobicContact CG2-CE1 4.43Å; I241-Y256 HydrophobicContact CG2-CE2 3.87Å
242	A	85.3	Confident	84.8	Confident	49 Å²	49	53.5 Å²	53.5	41%	0.405	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-75.2	130.6	174.4	0	0	0	0	0	110.6	I255	A242-I255 HydrophobicContact CB-CB 4.23Å; A242-I255 HydrophobicContact CB-CD1 3.92Å; A242-I255 HydrophobicContact CB-CG1 4.37Å; A242-I255 WeakPolarHBondContact O-CB 3.12Å; A242-I255 WeakPolarHBondContact O-CG1 3.43Å; A242-I255 PolarHBondContact O-N 2.82Å
243	C	87.5	Confident	84.6	Confident	20 Å²	20	51.9 Å²	51.9	14%	0.135	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	146.9	-179.6	-58.8	0	0	0	0	112.3	C224 C233 A236 P238 I253	C224-C243 HydrophobicContact CB-CB 3.7Å; C224-C243 WeakPolarHBondContact CB-SG 3.32Å; C224-C243 WeakPolarHBondContact SG-CA 3.15Å; C224-C243 WeakPolarHBondContact SG-CB 3.15Å; C224-C243 CovalentContact SG-SG 2.01Å; C224-C243 PolarHBondContact SG-SG 2.86Å; C233-C243 WeakPolarHBondContact O-CB 3.36Å; A236-C243 HydrophobicContact CB-CB 4.42Å; A236-C243 PolarHBondContact O-SG 3.05Å; P238-C243 WeakPolarHBondContact CD-SG 3.34Å; C243-I253 WeakPolarHBondContact CA-O 2.97Å
244	I	88.2	Confident	84.2	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	142.1	170.7	-175.4	165.4	0	0	0	111.4	C233 I253 I255 L263 C268 R269 V270	C233-I244 PolarHBondContact SG-O 2.85Å; C233-I244 VanDerWaalsContact SG-O 3.42Å; I244-I253 HydrophobicContact CG2-CD1 3.43Å; I244-I253 VanDerWaalsContact CG2-CD1 3.43Å; I244-I253 HydrophobicContact CG2-CG1 3.43Å; I244-I253 VanDerWaalsContact CG2-CG1 3.43Å; I244-I253 PolarHBondContact N-O 2.84Å; I244-I253 VanDerWaalsContact O-CG1 3.28Å; I244-I253 WeakPolarHBondContact O-CG1 3.33Å; I244-I253 PolarHBondContact O-N 3.05Å; I244-I255 HydrophobicContact CB-CD1 3.98Å; I244-I255 HydrophobicContact CB-CG1 3.92Å; I244-I255 HydrophobicContact CG2-CD1 4.23Å; I244-I255 HydrophobicContact CG2-CG1 3.62Å; I244-L263 HydrophobicContact CD1-CD2 4.21Å; I244-L263 HydrophobicContact CG2-CD2 3.97Å; I244-C268 HydrophobicContact CD1-CB 3.8Å; I244-C268 HydrophobicContact CG1-CB 4.03Å; I244-R269 VanDerWaalsContact CD1-C 3.4Å; I244-R269 WeakPolarHBondContact CD1-O 3.38Å; I244-R269 WeakPolarHBondContact CG1-O 3.44Å; I244-V270 HydrophobicContact CD1-CB 4.11Å; I244-V270 HydrophobicContact CD1-CG2 3.38Å
245	W	89.2	Confident	83.8	Confident	14 Å²	14	52 Å²	52	5%	0.053	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	130.8	177.1	-176.4	-97.8	0	0	0	111.1	N228 S230 C233 D247 N250 C252 C268 R269	N228-W245 WeakPolarHBondContact O-CH2 3.37Å; S230-W245 VanDerWaalsContact CA-CD2 3.44Å; S230-W245 VanDerWaalsContact OG-CD1 3.24Å; S230-W245 VanDerWaalsContact OG-CG 3.29Å; C233-W245 HydrophobicContact CB-CB 4.3Å; C233-W245 HydrophobicContact CB-CE3 3.68Å; C233-W245 HydrophobicContact CB-CZ3 4.45Å; W245-D247 PolarHBondContact NE1-OD1 2.9Å; W245-N250 HydrophobicContact CZ2-CB 4.21Å; W245-C252 HydrophobicContact CE3-CB 3.93Å; W245-C252 HydrophobicContact CZ3-CB 4.17Å; W245-C268 WeakPolarHBondContact O-CA 3.47Å; W245-R269 PolarHBondContact O-N 2.95Å
246	C	86.7	Confident	82.8	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	109.1	175.8	-57.5	0	0	0	0	110.5	K248 N249 N250 T251 I253 N266 C268	C246-K248 VanDerWaalsContact C-N 3.35Å; C246-K248 PolarHBondContact O-N 3.03Å; C246-N249 PolarHBondContact O-N 3.44Å; C246-N250 PolarHBondContact O-N 3.44Å; C246-T251 HydrophobicContact CB-CG2 4.19Å; C246-T251 PolarHBondContact N-O 3.25Å; C246-T251 PolarHBondContact O-N 3.5Å; C246-I253 VanDerWaalsContact SG-CD1 3.58Å; C246-N266 HydrophobicContact CB-CB 4.42Å; C246-C268 HydrophobicContact CB-CB 4.08Å; C246-C268 WeakPolarHBondContact CB-SG 3.38Å; C246-C268 WeakPolarHBondContact SG-CB 3.46Å; C246-C268 CovalentContact SG-SG 2.04Å; C246-C268 PolarHBondContact SG-SG 2.97Å
247	D	85.5	Confident	81.4	Confident	50 Å²	50	59.4 Å²	59.4	27%	0.267	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-65.6	-37.1	-174.7	-74	-35.2	0	0	0	112.1	W245 N249 N250 N267 R269	W245-D247 PolarHBondContact NE1-OD1 2.9Å; D247-N249 PolarHBondContact O-N 3.34Å; D247-N250 PolarHBondContact O-N 3.21Å; D247-N250 PolarHBondContact O-OD1 3.27Å; D247-N267 PolarHBondContact N-O 2.72Å; D247-R269 IonicContact OD1-NE 3.19Å; D247-R269 IonicContact OD1-NH2 2.86Å; D247-R269 IonicContact OD2-CZ 3.56Å; D247-R269 IonicContact OD2-NE 2.73Å; D247-R269 PolarHBondContact OD2-NE 3.28Å; D247-R269 IonicContact OD2-NH2 3.47Å; D247-R269 PolarHBondContact OD2-NH2 2.85Å
248	K	83	Confident	79.8	Confident	115 Å²	115	58.1 Å²	58.1	50%	0.5	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-57.2	-38.5	-177.9	-172.5	-174.9	-174.8	-179.2	0	112.2	C246 E265 N266	C246-K248 VanDerWaalsContact C-N 3.35Å; C246-K248 PolarHBondContact O-N 3.03Å; K248-E265 WeakPolarHBondContact CD-O 3.4Å; K248-E265 PolarHBondContact NZ-O 3.21Å; K248-N266 WeakPolarHBondContact CB-O 3.42Å
249	N	81.4	Confident	78.9	Confident	29 Å²	29	60.3 Å²	60.3	16%	0.155	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-107.3	-1.3	-174.9	-65.4	44.6	0	0	0	112.1	K40 I42 C246 D247 T251 N266	K40-N249 WeakPolarHBondContact CE-O 3.22Å; K40-N249 PolarHBondContact NZ-O 3.2Å; I42-N249 PolarHBondContact O-ND2 3.27Å; C246-N249 PolarHBondContact O-N 3.44Å; D247-N249 PolarHBondContact O-N 3.34Å; N249-T251 VanDerWaalsContact C-N 3.31Å; N249-T251 HydrophobicContact CB-CG2 3.74Å; N249-T251 PolarHBondContact O-N 2.8Å; N249-N266 PolarHBondContact OD1-OD1 2.98Å
250	N	87	Confident	78.3	Confident	113 Å²	113	59.5 Å²	59.5	60%	0.604	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	53.5	-172.2	-66	-52.4	0	0	0	111.9	W245 C246 D247	W245-N250 HydrophobicContact CZ2-CB 4.21Å; C246-N250 PolarHBondContact O-N 3.44Å; D247-N250 PolarHBondContact O-N 3.21Å; D247-N250 PolarHBondContact O-OD1 3.27Å
251	T	86.7	Confident	77.8	Confident	9 Å²	9	56.9 Å²	56.9	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	144.8	-174	-165.3	0	0	0	0	111.2	I42 H52 C246 N249 I253	I42-T251 HydrophobicContact CD1-CG2 4.2Å; I42-T251 HydrophobicContact CG2-CG2 3.99Å; H52-T251 PolarHBondContact CE1-OG1 3.02Å; C246-T251 HydrophobicContact CB-CG2 4.19Å; C246-T251 PolarHBondContact N-O 3.25Å; C246-T251 PolarHBondContact O-N 3.5Å; N249-T251 VanDerWaalsContact C-N 3.31Å; N249-T251 HydrophobicContact CB-CG2 3.74Å; N249-T251 PolarHBondContact O-N 2.8Å; T251-I253 HydrophobicContact CG2-CG2 3.98Å
252	C	86.6	Confident	77.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	143.3	166.8	-167	0	0	0	0	109.5	C224 A225 Y227 C233 W245	C224-C252 WeakPolarHBondContact O-CB 3.35Å; C224-C252 PolarHBondContact O-SG 3.3Å; A225-C252 WeakPolarHBondContact CA-O 3.34Å; Y227-C252 WeakPolarHBondContact O-CB 3.32Å; C233-C252 WeakPolarHBondContact CA-SG 3.25Å; C233-C252 HydrophobicContact CB-CB 3.56Å; C233-C252 WeakPolarHBondContact CB-SG 3.28Å; C233-C252 VanDerWaalsContact SG-CA 3.55Å; C233-C252 WeakPolarHBondContact SG-CB 3.31Å; C233-C252 CovalentContact SG-SG 2.02Å; C233-C252 PolarHBondContact SG-SG 2.92Å; W245-C252 HydrophobicContact CE3-CB 3.93Å; W245-C252 HydrophobicContact CZ3-CB 4.17Å
253	I	85.4	Confident	76.5	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	156.2	-176.4	53.9	147.7	0	0	0	111.2	I42 Y50 C224 C243 I244 C246 T251 Y262 L263	I42-I253 HydrophobicContact CG2-CG2 4.42Å; Y50-I253 HydrophobicContact CE1-CB 4.45Å; Y50-I253 HydrophobicContact CE1-CG2 3.73Å; C224-I253 VanDerWaalsContact CB-C 3.46Å; C224-I253 WeakPolarHBondContact CB-O 3.48Å; C243-I253 WeakPolarHBondContact CA-O 2.97Å; I244-I253 HydrophobicContact CG2-CD1 3.43Å; I244-I253 VanDerWaalsContact CG2-CD1 3.43Å; I244-I253 HydrophobicContact CG2-CG1 3.43Å; I244-I253 VanDerWaalsContact CG2-CG1 3.43Å; I244-I253 PolarHBondContact N-O 2.84Å; I244-I253 VanDerWaalsContact O-CG1 3.28Å; I244-I253 WeakPolarHBondContact O-CG1 3.33Å; I244-I253 PolarHBondContact O-N 3.05Å; C246-I253 VanDerWaalsContact SG-CD1 3.58Å; T251-I253 HydrophobicContact CG2-CG2 3.98Å; I253-Y262 HydrophobicContact CD1-CD1 4.47Å; I253-Y262 HydrophobicContact CD1-CE1 3.37Å; I253-Y262 WeakPolarHBondContact CD1-OH 3.48Å; I253-L263 HydrophobicContact CD1-CD2 3.9Å
254	D	82.8	Confident	75.7	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.064	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	136.3	175	-51.3	-44.9	0	0	0	110.9	S223 C224 I241 Y256	S223-D254 WeakPolarHBondContact CB-OD2 3.16Å; C224-D254 WeakPolarHBondContact CB-OD1 3.1Å; C224-D254 PolarHBondContact N-OD1 2.84Å; C224-D254 PolarHBondContact SG-OD1 2.91Å; I241-D254 HydrophobicContact CG2-CB 3.71Å; D254-Y256 VanDerWaalsContact C-N 3.34Å; D254-Y256 HydrophobicContact CB-CD2 3.25Å; D254-Y256 HydrophobicContact CB-CE2 3.39Å; D254-Y256 HydrophobicContact CB-CG 4.32Å; D254-Y256 PolarHBondContact O-N 2.83Å
255	I	76.8	Confident	74.8	Confident	70 Å²	70	65.9 Å²	65.9	36%	0.359	31%	0.311	S	S	.	.			trans	-86.7	76.7	170.1	-51.7	173.4	0	0	0	107.9	A242 I244	A242-I255 HydrophobicContact CB-CB 4.23Å; A242-I255 HydrophobicContact CB-CD1 3.92Å; A242-I255 HydrophobicContact CB-CG1 4.37Å; A242-I255 WeakPolarHBondContact O-CB 3.12Å; A242-I255 WeakPolarHBondContact O-CG1 3.43Å; A242-I255 PolarHBondContact O-N 2.82Å; I244-I255 HydrophobicContact CB-CD1 3.98Å; I244-I255 HydrophobicContact CB-CG1 3.92Å; I244-I255 HydrophobicContact CG2-CD1 4.23Å; I244-I255 HydrophobicContact CG2-CG1 3.62Å
256	Y	65.2	Low	73.8	Confident	86 Å²	86	65.4 Å²	65.4	34%	0.337	31%	0.31	S	S	.	.			trans	-84.8	-32.3	178.1	-86.3	-66.2	0	0	0	114.1	I241 D254	I241-Y256 HydrophobicContact CD1-CE2 4.37Å; I241-Y256 WeakPolarHBondContact CD1-OH 3.37Å; I241-Y256 HydrophobicContact CG1-CE1 4.44Å; I241-Y256 WeakPolarHBondContact CG1-OH 3.23Å; I241-Y256 HydrophobicContact CG2-CE1 4.43Å; I241-Y256 HydrophobicContact CG2-CE2 3.87Å; D254-Y256 VanDerWaalsContact C-N 3.34Å; D254-Y256 HydrophobicContact CB-CD2 3.25Å; D254-Y256 HydrophobicContact CB-CE2 3.39Å; D254-Y256 HydrophobicContact CB-CG 4.32Å; D254-Y256 PolarHBondContact O-N 2.83Å
257	Y	54.9	Low	73.3	Confident	206 Å²	206	70.5 Å²	70.5	81%	0.808	34%	0.337	S	S	*	.	S	Bend	trans	-151	148.5	174.2	-78.1	-80.5	0	0	0	109.4	D259	Y257-D259 PolarHBondContact O-N 2.84Å
258	Q	50.6	Low	73.1	Confident	174 Å²	174	68.9 Å²	68.9	81%	0.813	33%	0.329	S	S	*	.			trans	-65.6	50.3	179.1	-64.3	171.9	-25.8	0	0	112.6	T260	Q258-T260 HydrophobicContact CB-CG2 4.48Å; Q258-T260 PolarHBondContact O-N 2.76Å
259	D	59.7	Low	72.5	Confident	54 Å²	54	70.5 Å²	70.5	29%	0.289	33%	0.332	S	S	.	.			trans	-70.7	81.7	163	-165.5	-22.7	0	0	0	107.5	Y257 D261 Y262 L263	Y257-D259 PolarHBondContact O-N 2.84Å; D259-D261 PolarHBondContact O-N 3.01Å; D259-D261 WeakPolarHBondContact OD1-CB 3.36Å; D259-D261 PolarHBondContact OD1-N 2.86Å; D259-Y262 WeakPolarHBondContact O-CB 3.15Å; D259-Y262 PolarHBondContact O-N 2.92Å; D259-Y262 PolarHBondContact OD1-N 2.86Å; D259-Y262 VanDerWaalsContact OD1-N 3.14Å; D259-L263 PolarHBondContact O-N 3.18Å; D259-L263 VanDerWaalsContact O-N 3.16Å
260	T	63.1	Low	71.5	Confident	66 Å²	66	72.6 Å²	72.6	41%	0.405	35%	0.346	S	S	.	.	H	α-helix	trans	-63.4	-24.5	-178.3	61.1	0	0	0	0	111.1	Q258 K264	Q258-T260 HydrophobicContact CB-CG2 4.48Å; Q258-T260 PolarHBondContact O-N 2.76Å; T260-K264 VanDerWaalsContact O-CB 3.28Å; T260-K264 WeakPolarHBondContact O-CB 3.34Å; T260-K264 VanDerWaalsContact O-CD 3.31Å; T260-K264 WeakPolarHBondContact O-CD 3.41Å; T260-K264 WeakPolarHBondContact O-CG 2.9Å; T260-K264 PolarHBondContact O-N 2.81Å
261	D	66.8	Low	69.8	Low	101 Å²	101	74.7 Å²	74.7	54%	0.54	35%	0.35	S	S	.	.	H	α-helix	trans	-72.9	-43.8	-179.9	-65.9	-13.8	0	0	0	109.6	D259 L263 K264 E265	D259-D261 PolarHBondContact O-N 3.01Å; D259-D261 WeakPolarHBondContact OD1-CB 3.36Å; D259-D261 PolarHBondContact OD1-N 2.86Å; D261-L263 PolarHBondContact O-N 2.82Å; D261-K264 PolarHBondContact O-N 2.81Å; D261-E265 VanDerWaalsContact O-CB 3.31Å; D261-E265 WeakPolarHBondContact O-CB 3.45Å; D261-E265 PolarHBondContact O-N 3.28Å
262	Y	67.5	Low	67.6	Low	15 Å²	15	81.5 Å²	81.5	6%	0.059	38%	0.38	C	S	.	.	H	α-helix	trans	-56.1	-50.2	170.1	165.5	-122	0	0	0	112.6	I42 Y43 I253 D259 K264 E265 N266	I42-Y262 HydrophobicContact CG2-CE2 4.36Å; I42-Y262 WeakPolarHBondContact CG2-OH 3.29Å; Y43-Y262 VanDerWaalsContact CB-CD2 3.45Å; Y43-Y262 AromaticContact CD1-CD2 3.42Å; Y43-Y262 HydrophobicContact CD1-CD2 3.42Å; Y43-Y262 VanDerWaalsContact CD1-CD2 3.42Å; Y43-Y262 HydrophobicContact CD1-CE2 4.23Å; Y43-Y262 AromaticContact CD1-CG 3.94Å; Y43-Y262 HydrophobicContact CD1-CG 3.94Å; Y43-Y262 AromaticContact CD2-CD2 3.68Å; Y43-Y262 HydrophobicContact CD2-CD2 3.68Å; Y43-Y262 HydrophobicContact CD2-CE2 4.26Å; Y43-Y262 HydrophobicContact CE1-CD2 4.07Å; Y43-Y262 HydrophobicContact CE1-CG 4.33Å; Y43-Y262 HydrophobicContact CE2-CD2 4.27Å; Y43-Y262 AromaticContact CG-CD2 3.23Å; Y43-Y262 HydrophobicContact CG-CD2 3.23Å; Y43-Y262 AromaticContact CG-CE2 3.73Å; Y43-Y262 HydrophobicContact CG-CE2 3.73Å; Y43-Y262 HydrophobicContact CG-CG 4.2Å; I253-Y262 HydrophobicContact CD1-CD1 4.47Å; I253-Y262 HydrophobicContact CD1-CE1 3.37Å; I253-Y262 WeakPolarHBondContact CD1-OH 3.48Å; D259-Y262 WeakPolarHBondContact O-CB 3.15Å; D259-Y262 PolarHBondContact O-N 2.92Å; D259-Y262 PolarHBondContact OD1-N 2.86Å; D259-Y262 VanDerWaalsContact OD1-N 3.14Å; Y262-K264 VanDerWaalsContact C-N 3.34Å; Y262-K264 PolarHBondContact O-N 2.78Å; Y262-E265 PolarHBondContact O-N 2.86Å; Y262-N266 WeakPolarHBondContact CD2-ND2 3.44Å; Y262-N266 HydrophobicContact CE2-CB 4.18Å; Y262-N266 WeakPolarHBondContact CE2-ND2 3.49Å; Y262-N266 PolarHBondContact O-N 2.94Å; Y262-N266 VanDerWaalsContact O-N 3.15Å; Y262-N266 PolarHBondContact O-ND2 2.7Å
263	L	71.7	Confident	65	Low	22 Å²	22	88 Å²	88	12%	0.115	42%	0.421	C	S	.	.	H	α-helix	trans	-62.9	-40.1	-178.5	-66.5	178.9	0	0	0	112	I244 I253 D259 D261 N267 C268 V270	I244-L263 HydrophobicContact CD1-CD2 4.21Å; I244-L263 HydrophobicContact CG2-CD2 3.97Å; I253-L263 HydrophobicContact CD1-CD2 3.9Å; D259-L263 PolarHBondContact O-N 3.18Å; D259-L263 VanDerWaalsContact O-N 3.16Å; D261-L263 PolarHBondContact O-N 2.82Å; L263-N267 PolarHBondContact O-N 2.98Å; L263-C268 HydrophobicContact CB-CB 4.24Å; L263-C268 HydrophobicContact CD2-CB 3.81Å; L263-C268 WeakPolarHBondContact O-CB 3.28Å; L263-C268 PolarHBondContact O-N 2.04Å; L263-V270 HydrophobicContact CD1-CG2 4.16Å
264	K	70.9	Confident	62.4	Low	141 Å²	141	93.4 Å²	93.4	61%	0.613	45%	0.454	S	S	*	.	H	α-helix	trans	-66.8	-48.2	176.4	-74.5	166.6	-171	166.5	0	111.6	T260 D261 Y262 N266 N267	T260-K264 VanDerWaalsContact O-CB 3.28Å; T260-K264 WeakPolarHBondContact O-CB 3.34Å; T260-K264 VanDerWaalsContact O-CD 3.31Å; T260-K264 WeakPolarHBondContact O-CD 3.41Å; T260-K264 WeakPolarHBondContact O-CG 2.9Å; T260-K264 PolarHBondContact O-N 2.81Å; D261-K264 PolarHBondContact O-N 2.81Å; Y262-K264 VanDerWaalsContact C-N 3.34Å; Y262-K264 PolarHBondContact O-N 2.78Å; K264-N266 PolarHBondContact O-N 2.8Å; K264-N267 PolarHBondContact O-N 2.81Å
265	E	69	Low	59.9	Low	104 Å²	104	100.2 Å²	100.2	49%	0.486	49%	0.49	S	S	.	.	H	α-helix	trans	-66.2	-25.3	-175.5	-168.2	176.9	165	0	0	113.2	Y43 K248 D261 Y262	Y43-E265 VanDerWaalsContact CE2-OE2 3.24Å; Y43-E265 WeakPolarHBondContact CE2-OE2 3.21Å; Y43-E265 PolarHBondContact OH-OE2 3.14Å; K248-E265 WeakPolarHBondContact CD-O 3.4Å; K248-E265 PolarHBondContact NZ-O 3.21Å; D261-E265 VanDerWaalsContact O-CB 3.31Å; D261-E265 WeakPolarHBondContact O-CB 3.45Å; D261-E265 PolarHBondContact O-N 3.28Å; Y262-E265 PolarHBondContact O-N 2.86Å
266	N	68.2	Low	57.5	Low	4 Å²	4	100 Å²	100	2%	0.021	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	10.5	179.3	-68.1	-81.7	0	0	0	114.1	I42 Y43 C246 K248 N249 Y262 K264 C268	I42-N266 PolarHBondContact O-OD1 3.04Å; Y43-N266 WeakPolarHBondContact CD2-ND2 3.41Å; C246-N266 HydrophobicContact CB-CB 4.42Å; K248-N266 WeakPolarHBondContact CB-O 3.42Å; N249-N266 PolarHBondContact OD1-OD1 2.98Å; Y262-N266 WeakPolarHBondContact CD2-ND2 3.44Å; Y262-N266 HydrophobicContact CE2-CB 4.18Å; Y262-N266 WeakPolarHBondContact CE2-ND2 3.49Å; Y262-N266 PolarHBondContact O-N 2.94Å; Y262-N266 VanDerWaalsContact O-N 3.15Å; Y262-N266 PolarHBondContact O-ND2 2.7Å; K264-N266 PolarHBondContact O-N 2.8Å; N266-C268 PolarHBondContact O-N 3.01Å
267	N	76.5	Confident	55.8	Low	108 Å²	108	103.5 Å²	103.5	58%	0.578	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	45.3	-177.8	-66.2	-22.8	0	0	0	112	D247 L263 K264	D247-N267 PolarHBondContact N-O 2.72Å; L263-N267 PolarHBondContact O-N 2.98Å; K264-N267 PolarHBondContact O-N 2.81Å
268	C	81.1	Confident	54.5	Low	15 Å²	15	99.8 Å²	99.8	10%	0.101	53%	0.526	C	S	.	.	B	Isolated β-bridge	trans	-79	126.1	178.7	-52.5	0	0	0	0	109.9	I244 W245 C246 L263 N266 V270	I244-C268 HydrophobicContact CD1-CB 3.8Å; I244-C268 HydrophobicContact CG1-CB 4.03Å; W245-C268 WeakPolarHBondContact O-CA 3.47Å; C246-C268 HydrophobicContact CB-CB 4.08Å; C246-C268 WeakPolarHBondContact CB-SG 3.38Å; C246-C268 WeakPolarHBondContact SG-CB 3.46Å; C246-C268 CovalentContact SG-SG 2.04Å; C246-C268 PolarHBondContact SG-SG 2.97Å; L263-C268 HydrophobicContact CB-CB 4.24Å; L263-C268 HydrophobicContact CD2-CB 3.81Å; L263-C268 WeakPolarHBondContact O-CB 3.28Å; L263-C268 PolarHBondContact O-N 2.04Å; N266-C268 PolarHBondContact O-N 3.01Å; C268-V270 PolarHBondContact O-N 3Å; C268-V270 VanDerWaalsContact O-N 3.14Å
269	R	70.1	Confident	53.5	Low	150 Å²	150	100.4 Å²	100.4	57%	0.566	53%	0.529	S	S	*	.			trans	-81	96.1	-177.2	-64.1	-172.7	-166.9	-178.8	6	110.7	I244 W245 D247 K271	I244-R269 VanDerWaalsContact CD1-C 3.4Å; I244-R269 WeakPolarHBondContact CD1-O 3.38Å; I244-R269 WeakPolarHBondContact CG1-O 3.44Å; W245-R269 PolarHBondContact O-N 2.95Å; D247-R269 IonicContact OD1-NE 3.19Å; D247-R269 IonicContact OD1-NH2 2.86Å; D247-R269 IonicContact OD2-CZ 3.56Å; D247-R269 IonicContact OD2-NE 2.73Å; D247-R269 PolarHBondContact OD2-NE 3.28Å; D247-R269 IonicContact OD2-NH2 3.47Å; D247-R269 PolarHBondContact OD2-NH2 2.85Å; R269-K271 PolarHBondContact O-N 2.91Å
270	V	61.4	Low	52.1	Low	72 Å²	72	105.6 Å²	105.6	44%	0.436	55%	0.552	S	S	.	*			trans	-76.3	102.7	162.9	-173.6	0	0	0	0	106.1	I244 L263 C268 H272	I244-V270 HydrophobicContact CD1-CB 4.11Å; I244-V270 HydrophobicContact CD1-CG2 3.38Å; L263-V270 HydrophobicContact CD1-CG2 4.16Å; C268-V270 PolarHBondContact O-N 3Å; C268-V270 VanDerWaalsContact O-N 3.14Å; V270-H272 VanDerWaalsContact C-N 3.26Å; V270-H272 PolarHBondContact O-N 3.26Å
271	K	51.8	Low	50.7	Low	158 Å²	158	107.3 Å²	107.3	69%	0.687	56%	0.559	S	S	*	*			trans	-67.7	97.8	160.1	-83.8	-176.8	177.8	168.3	0	105.8	Q234 R269 T273	Q234-K271 VanDerWaalsContact OE1-NZ 3.14Å; R269-K271 PolarHBondContact O-N 2.91Å; K271-T273 PolarHBondContact O-N 3.07Å
272	H	39.7	Very low	49.3	Very low	151 Å²	151	105.6 Å²	105.6	70%	0.699	56%	0.564	S	S	*	*			trans	-58.1	112.6	160.5	-74.9	-78.4	0	0	0	106.1	V270 T274	V270-H272 VanDerWaalsContact C-N 3.26Å; V270-H272 PolarHBondContact O-N 3.26Å; H272-T274 PolarHBondContact O-N 3.17Å
273	T	31.7	Very low	48	Very low	138 Å²	138	112.3 Å²	112.3	85%	0.847	60%	0.596	S	S	*	*			trans	-71.4	72.9	166	-42.7	0	0	0	0	107	K271	K271-T273 PolarHBondContact O-N 3.07Å
274	T	30.8	Very low	46.8	Very low	115 Å²	115	116.4 Å²	116.4	71%	0.706	62%	0.619	S	S	*	*			trans	-86.7	105.7	157.5	-43.1	0	0	0	0	104.8	H272	H272-T274 PolarHBondContact O-N 3.17Å
275	D	29.5	Very low	45.7	Very low	155 Å²	155	115.7 Å²	115.7	83%	0.829	62%	0.615	S	S	*	*	S	Bend	trans	16.8	106.7	164	-59	-34.2	0	0	0	117
276	G	28.2	Very low	45.1	Very low	64 Å²	64	113.7 Å²	113.7	66%	0.66	61%	0.613	S	S	*	*			trans	178.4	73.6	172.4	0	0	0	0	0	110.8	T278	G276-T278 VanDerWaalsContact C-N 3.33Å; G276-T278 PolarHBondContact O-N 2.92Å
277	I	29.4	Very low	44.5	Very low	161 Å²	161	117 Å²	117	83%	0.826	63%	0.631	S	S	*	*			trans	-60	101.8	160.9	-61.4	168.5	0	0	0	106.3	E279	I277-E279 HydrophobicContact CG2-CG 4.48Å
278	T	26.6	Very low	43.8	Very low	127 Å²	127	118.1 Å²	118.1	78%	0.779	63%	0.632	S	S	*	*			trans	-123.2	93.4	153.4	25.4	0	0	0	0	106.9	G276 E280	G276-T278 VanDerWaalsContact C-N 3.33Å; G276-T278 PolarHBondContact O-N 2.92Å; T278-E280 PolarHBondContact O-N 3.42Å
279	E	29.5	Very low	43.1	Very low	187 Å²	187	125.2 Å²	125.2	87%	0.874	66%	0.658	S	S	*	*			trans	-53.4	101	157.2	-73.9	-179.6	138.8	0	0	108.1	I277	I277-E279 HydrophobicContact CG2-CG 4.48Å
280	E	30.9	Very low	43.1	Very low	163 Å²	163	122.4 Å²	122.4	76%	0.762	65%	0.653	S	S	*	*			trans	-129.4	118.7	160.5	-94.4	-163.6	154.7	0	0	111.3	T278	T278-E280 PolarHBondContact O-N 3.42Å
281	N	32.6	Very low	43.8	Very low	103 Å²	103	127 Å²	127	55%	0.551	66%	0.664	S	S	*	*			trans	80.8	48	148.6	-60.2	-31.3	0	0	0	118.9
282	G	38.8	Very low	45	Very low	64 Å²	64	124.4 Å²	124.4	66%	0.66	66%	0.657	S	S	*	*	H	α-helix	trans	-74.9	-23.1	154.9	0	0	0	0	0	114.3
283	Q	40.7	Very low	46.7	Very low	156 Å²	156	119.4 Å²	119.4	73%	0.729	64%	0.637	S	S	*	*	H	α-helix	trans	-71.7	-41.8	-175.9	-91.3	178.4	-27.3	0	0	113.6	S286 L287	Q283-S286 PolarHBondContact O-N 3.04Å; Q283-S286 PolarHBondContact O-OG 3.15Å; Q283-S286 VanDerWaalsContact O-OG 3.05Å; Q283-L287 PolarHBondContact O-N 2.79Å
284	N	45	Very low	49	Very low	109 Å²	109	117.2 Å²	117.2	58%	0.583	62%	0.619	S	S	*	*	H	α-helix	trans	-68.6	-38	-174.4	-83.5	-11.8	0	0	0	113.9	Q288	N284-Q288 PolarHBondContact O-N 2.89Å; N284-Q288 VanDerWaalsContact O-N 3.13Å
285	K	48.4	Very low	51.5	Low	125 Å²	125	115.2 Å²	115.2	54%	0.543	61%	0.608	S	S	.	*	H	α-helix	trans	-69.3	-37.4	177.1	-78.9	-173.1	178.5	-173.3	0	112.2	E231 L287 Q288 Y289	E231-K285 IonicContact OE1-NZ 2.71Å; E231-K285 PolarHBondContact OE1-NZ 2.91Å; E231-K285 IonicContact OE2-NZ 2.74Å; E231-K285 PolarHBondContact OE2-NZ 3.19Å; K285-L287 VanDerWaalsContact C-N 3.34Å; K285-L287 PolarHBondContact O-N 3.03Å; K285-Q288 PolarHBondContact O-N 3.25Å; K285-Y289 WeakPolarHBondContact O-CB 3.42Å; K285-Y289 PolarHBondContact O-N 3.37Å
286	S	55.2	Low	53.9	Low	62 Å²	62	113.4 Å²	113.4	43%	0.434	60%	0.598	S	S	.	*	H	α-helix	trans	-65.2	-39	178.4	82.9	0	0	0	0	112	Q283 L290	Q283-S286 PolarHBondContact O-N 3.04Å; Q283-S286 PolarHBondContact O-OG 3.15Å; Q283-S286 VanDerWaalsContact O-OG 3.05Å; S286-L290 WeakPolarHBondContact O-CB 3.43Å; S286-L290 PolarHBondContact O-N 3.37Å
287	L	56.1	Low	56.5	Low	75 Å²	75	113.6 Å²	113.6	39%	0.393	59%	0.586	S	S	.	*	H	α-helix	trans	-64.9	-46.6	175.1	-85	155.4	0	0	0	110.7	Q283 K285 Y289 L290 Y291	Q283-L287 PolarHBondContact O-N 2.79Å; K285-L287 VanDerWaalsContact C-N 3.34Å; K285-L287 PolarHBondContact O-N 3.03Å; L287-Y289 VanDerWaalsContact C-N 3.32Å; L287-Y289 PolarHBondContact O-N 2.81Å; L287-L290 WeakPolarHBondContact O-CB 3.4Å; L287-L290 PolarHBondContact O-N 3.04Å; L287-Y291 HydrophobicContact CB-CD2 4.48Å; L287-Y291 HydrophobicContact CB-CE2 4.31Å; L287-Y291 HydrophobicContact CD2-CE2 3.86Å; L287-Y291 WeakPolarHBondContact O-CD2 3.36Å; L287-Y291 PolarHBondContact O-N 2.83Å
288	Q	63.1	Low	59.2	Low	131 Å²	131	110.2 Å²	110.2	61%	0.612	57%	0.572	S	S	*	*	H	α-helix	trans	-64	-37.4	-179.4	-148.1	173.6	19.5	0	0	112.4	N284 K285 Y291 I292	N284-Q288 PolarHBondContact O-N 2.89Å; N284-Q288 VanDerWaalsContact O-N 3.13Å; K285-Q288 PolarHBondContact O-N 3.25Å; Q288-Y291 PolarHBondContact O-N 2.87Å; Q288-I292 WeakPolarHBondContact O-CG1 3.42Å; Q288-I292 PolarHBondContact O-N 3.13Å
289	Y	64.9	Low	61.9	Low	164 Å²	164	107.3 Å²	107.3	64%	0.643	56%	0.557	S	S	*	*	H	α-helix	trans	-63.7	-45.5	172.4	-176.2	-94.6	0	0	0	112	K285 L287 Y291 I292 V293	K285-Y289 WeakPolarHBondContact O-CB 3.42Å; K285-Y289 PolarHBondContact O-N 3.37Å; L287-Y289 VanDerWaalsContact C-N 3.32Å; L287-Y289 PolarHBondContact O-N 2.81Å; Y289-Y291 VanDerWaalsContact C-N 3.32Å; Y289-Y291 PolarHBondContact O-N 2.8Å; Y289-I292 PolarHBondContact O-N 2.71Å; Y289-V293 HydrophobicContact CD1-CG2 4.1Å; Y289-V293 HydrophobicContact CD2-CG2 3.98Å; Y289-V293 HydrophobicContact CE1-CB 4.38Å; Y289-V293 HydrophobicContact CE1-CG2 3.84Å; Y289-V293 HydrophobicContact CE2-CG2 3.71Å; Y289-V293 HydrophobicContact CG-CG2 4.17Å; Y289-V293 WeakPolarHBondContact O-CB 3.4Å; Y289-V293 VanDerWaalsContact O-CG2 3.31Å; Y289-V293 WeakPolarHBondContact O-CG2 3.44Å; Y289-V293 PolarHBondContact O-N 2.99Å
290	L	70.2	Confident	64.5	Low	90 Å²	90	104.4 Å²	104.4	47%	0.471	54%	0.542	S	S	.	.	H	α-helix	trans	-57.6	-43	175.1	-90.3	157.1	0	0	0	112.1	S286 L287 I292 I294	S286-L290 WeakPolarHBondContact O-CB 3.43Å; S286-L290 PolarHBondContact O-N 3.37Å; L287-L290 WeakPolarHBondContact O-CB 3.4Å; L287-L290 PolarHBondContact O-N 3.04Å; L290-I292 PolarHBondContact O-N 2.82Å; L290-I294 HydrophobicContact CB-CD1 4.45Å; L290-I294 HydrophobicContact CD2-CD1 3.56Å; L290-I294 HydrophobicContact CD2-CG1 4.32Å; L290-I294 WeakPolarHBondContact O-CB 3.23Å; L290-I294 WeakPolarHBondContact O-CD1 3.41Å; L290-I294 VanDerWaalsContact O-CG1 3.24Å; L290-I294 WeakPolarHBondContact O-CG1 3.04Å; L290-I294 PolarHBondContact O-N 2.75Å
291	Y	75.8	Confident	67.1	Low	170 Å²	170	102.4 Å²	102.4	67%	0.667	53%	0.531	S	S	*	.	H	α-helix	trans	-70.5	-25.1	-179.4	-77.6	-66.4	0	0	0	114.5	L287 Q288 Y289 P295	L287-Y291 HydrophobicContact CB-CD2 4.48Å; L287-Y291 HydrophobicContact CB-CE2 4.31Å; L287-Y291 HydrophobicContact CD2-CE2 3.86Å; L287-Y291 WeakPolarHBondContact O-CD2 3.36Å; L287-Y291 PolarHBondContact O-N 2.83Å; Q288-Y291 PolarHBondContact O-N 2.87Å; Y289-Y291 VanDerWaalsContact C-N 3.32Å; Y289-Y291 PolarHBondContact O-N 2.8Å; Y291-P295 WeakPolarHBondContact O-CD 3.45Å; Y291-P295 WeakPolarHBondContact O-CG 3.26Å
292	I	77.6	Confident	69.6	Low	103 Å²	103	100.5 Å²	100.5	53%	0.528	53%	0.529	S	S	.	.	H	α-helix	trans	-91	-41.5	179.4	-64.6	169	0	0	0	110.9	Q288 Y289 L290 P295 L296	Q288-I292 WeakPolarHBondContact O-CG1 3.42Å; Q288-I292 PolarHBondContact O-N 3.13Å; Y289-I292 PolarHBondContact O-N 2.71Å; L290-I292 PolarHBondContact O-N 2.82Å; I292-P295 WeakPolarHBondContact O-CD 3.5Å; I292-L296 HydrophobicContact CG2-CD1 4.09Å
293	V	76	Confident	71.9	Confident	46 Å²	46	102.8 Å²	102.8	28%	0.279	53%	0.526	S	S	.	.	H	α-helix	trans	-76.1	-39.1	-173.5	177.7	0	0	0	0	111.9	Y289 L296 V297	Y289-V293 HydrophobicContact CD1-CG2 4.1Å; Y289-V293 HydrophobicContact CD2-CG2 3.98Å; Y289-V293 HydrophobicContact CE1-CB 4.38Å; Y289-V293 HydrophobicContact CE1-CG2 3.84Å; Y289-V293 HydrophobicContact CE2-CG2 3.71Å; Y289-V293 HydrophobicContact CG-CG2 4.17Å; Y289-V293 WeakPolarHBondContact O-CB 3.4Å; Y289-V293 VanDerWaalsContact O-CG2 3.31Å; Y289-V293 WeakPolarHBondContact O-CG2 3.44Å; Y289-V293 PolarHBondContact O-N 2.99Å; V293-L296 PolarHBondContact O-N 3.04Å; V293-V297 HydrophobicContact CG1-CG2 4.15Å; V293-V297 VanDerWaalsContact O-CG2 3.3Å; V293-V297 WeakPolarHBondContact O-CG2 3.39Å; V293-V297 PolarHBondContact O-N 2.88Å
294	I	80.6	Confident	74	Confident	92 Å²	92	97.8 Å²	97.8	47%	0.472	51%	0.508	S	S	.	.	H	α-helix	trans	-60.8	-49.6	-179.4	-67.7	170.9	0	0	0	111.7	L290 L296 V297 V298	L290-I294 HydrophobicContact CB-CD1 4.45Å; L290-I294 HydrophobicContact CD2-CD1 3.56Å; L290-I294 HydrophobicContact CD2-CG1 4.32Å; L290-I294 WeakPolarHBondContact O-CB 3.23Å; L290-I294 WeakPolarHBondContact O-CD1 3.41Å; L290-I294 VanDerWaalsContact O-CG1 3.24Å; L290-I294 WeakPolarHBondContact O-CG1 3.04Å; L290-I294 PolarHBondContact O-N 2.75Å; I294-L296 VanDerWaalsContact C-N 3.33Å; I294-L296 PolarHBondContact O-N 2.92Å; I294-V297 PolarHBondContact O-N 3.18Å; I294-V298 HydrophobicContact CG2-CG2 4.22Å; I294-V298 VanDerWaalsContact O-CG2 3.27Å; I294-V298 WeakPolarHBondContact O-CG2 3.17Å; I294-V298 PolarHBondContact O-N 2.88Å
295	P	82	Confident	76.1	Confident	72 Å²	72	97.5 Å²	97.5	47%	0.468	51%	0.505	S	S	.	.	H	α-helix	trans	-63.6	-35.6	178.6	-24.7	35.9	0	0	0	113.6	Y291 I292 V298 S299	Y291-P295 WeakPolarHBondContact O-CD 3.45Å; Y291-P295 WeakPolarHBondContact O-CG 3.26Å; I292-P295 WeakPolarHBondContact O-CD 3.5Å; P295-V298 PolarHBondContact O-N 2.75Å; P295-S299 VanDerWaalsContact O-CB 3.23Å; P295-S299 WeakPolarHBondContact O-CB 3.32Å; P295-S299 PolarHBondContact O-N 2.95Å
296	L	80.8	Confident	77.7	Confident	118 Å²	118	93.3 Å²	93.3	62%	0.618	50%	0.497	S	S	*	.	H	α-helix	trans	-62.7	-45.7	175.9	-84.2	167.1	0	0	0	111.3	I292 V293 I294 S299 F300	I292-L296 HydrophobicContact CG2-CD1 4.09Å; V293-L296 PolarHBondContact O-N 3.04Å; I294-L296 VanDerWaalsContact C-N 3.33Å; I294-L296 PolarHBondContact O-N 2.92Å; L296-S299 PolarHBondContact O-N 3.48Å; L296-F300 WeakPolarHBondContact O-CB 3.31Å; L296-F300 PolarHBondContact O-N 2.8Å
297	V	82.6	Confident	79	Confident	68 Å²	68	93.8 Å²	93.8	41%	0.412	50%	0.499	S	S	.	.	H	α-helix	trans	-64.6	-44.5	177.2	173.7	0	0	0	0	110.8	V293 I294 S299 F300 F301	V293-V297 HydrophobicContact CG1-CG2 4.15Å; V293-V297 VanDerWaalsContact O-CG2 3.3Å; V293-V297 WeakPolarHBondContact O-CG2 3.39Å; V293-V297 PolarHBondContact O-N 2.88Å; I294-V297 PolarHBondContact O-N 3.18Å; V297-S299 PolarHBondContact O-N 2.96Å; V297-F300 PolarHBondContact O-N 3.37Å; V297-F301 HydrophobicContact CG1-CD2 3.71Å; V297-F301 HydrophobicContact CG1-CE2 3.45Å; V297-F301 VanDerWaalsContact CG1-CE2 3.45Å; V297-F301 WeakPolarHBondContact O-CD2 3.44Å; V297-F301 PolarHBondContact O-N 3.1Å
298	V	86	Confident	80.2	Confident	90 Å²	90	95 Å²	95	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-42.2	177.7	173	0	0	0	0	111.8	I294 P295 F300 F301 A302	I294-V298 HydrophobicContact CG2-CG2 4.22Å; I294-V298 VanDerWaalsContact O-CG2 3.27Å; I294-V298 WeakPolarHBondContact O-CG2 3.17Å; I294-V298 PolarHBondContact O-N 2.88Å; P295-V298 PolarHBondContact O-N 2.75Å; V298-F300 VanDerWaalsContact C-N 3.35Å; V298-F300 PolarHBondContact O-N 3.46Å; V298-F301 PolarHBondContact O-N 3.06Å; V298-A302 WeakPolarHBondContact O-CB 3.28Å; V298-A302 PolarHBondContact O-N 2.93Å
299	S	83.3	Confident	81.2	Confident	65 Å²	65	92.9 Å²	92.9	46%	0.455	50%	0.502	S	S	.	.	H	α-helix	trans	-61.8	-42.6	176.2	-178	0	0	0	0	111.7	P295 L296 V297 A302 L303	P295-S299 VanDerWaalsContact O-CB 3.23Å; P295-S299 WeakPolarHBondContact O-CB 3.32Å; P295-S299 PolarHBondContact O-N 2.95Å; L296-S299 PolarHBondContact O-N 3.48Å; V297-S299 PolarHBondContact O-N 2.96Å; S299-A302 PolarHBondContact O-N 2.93Å; S299-L303 WeakPolarHBondContact O-CB 3.33Å; S299-L303 WeakPolarHBondContact O-CG 3.12Å; S299-L303 PolarHBondContact O-N 3.16Å
300	F	83.4	Confident	81.9	Confident	126 Å²	126	93.9 Å²	93.9	55%	0.553	51%	0.505	S	S	*	.	H	α-helix	trans	-60.7	-46.3	175.1	-177.3	-98.9	0	0	0	111.9	L296 V297 V298 A302 L303 C304	L296-F300 WeakPolarHBondContact O-CB 3.31Å; L296-F300 PolarHBondContact O-N 2.8Å; V297-F300 PolarHBondContact O-N 3.37Å; V298-F300 VanDerWaalsContact C-N 3.35Å; V298-F300 PolarHBondContact O-N 3.46Å; F300-A302 PolarHBondContact O-N 2.8Å; F300-L303 PolarHBondContact O-N 3.49Å; F300-C304 PolarHBondContact O-N 3.39Å; F300-C304 PolarHBondContact O-SG 3.15Å
301	F	86.4	Confident	82.2	Confident	122 Å²	122	99 Å²	99	54%	0.535	52%	0.517	S	S	.	.	H	α-helix	trans	-63.8	-40.5	176	-79.1	-67.1	0	0	0	112.7	V297 V298 L303 C304 I305	V297-F301 HydrophobicContact CG1-CD2 3.71Å; V297-F301 HydrophobicContact CG1-CE2 3.45Å; V297-F301 VanDerWaalsContact CG1-CE2 3.45Å; V297-F301 WeakPolarHBondContact O-CD2 3.44Å; V297-F301 PolarHBondContact O-N 3.1Å; V298-F301 PolarHBondContact O-N 3.06Å; F301-L303 PolarHBondContact O-N 2.7Å; F301-C304 PolarHBondContact O-N 3.25Å; F301-I305 WeakPolarHBondContact O-CB 3.48Å; F301-I305 WeakPolarHBondContact O-CD1 3.38Å; F301-I305 WeakPolarHBondContact O-CG1 3.24Å; F301-I305 PolarHBondContact O-N 3.44Å
302	A	85.6	Confident	82.3	Confident	62 Å²	62	99 Å²	99	51%	0.512	52%	0.516	S	S	.	.	H	α-helix	trans	-62.4	-41.8	176.4	0	0	0	0	0	111.9	V298 S299 F300 I305 G306	V298-A302 WeakPolarHBondContact O-CB 3.28Å; V298-A302 PolarHBondContact O-N 2.93Å; S299-A302 PolarHBondContact O-N 2.93Å; F300-A302 PolarHBondContact O-N 2.8Å; A302-I305 PolarHBondContact O-N 3.28Å; A302-G306 PolarHBondContact O-N 2.96Å
303	L	86.5	Confident	82.5	Confident	113 Å²	113	98.6 Å²	98.6	59%	0.592	52%	0.515	S	S	*	.	H	α-helix	trans	-63	-45.6	173.8	-76.2	168	0	0	0	111.6	S299 F300 F301 I305 G306 C307	S299-L303 WeakPolarHBondContact O-CB 3.33Å; S299-L303 WeakPolarHBondContact O-CG 3.12Å; S299-L303 PolarHBondContact O-N 3.16Å; F300-L303 PolarHBondContact O-N 3.49Å; F301-L303 PolarHBondContact O-N 2.7Å; L303-I305 PolarHBondContact O-N 3.14Å; L303-G306 PolarHBondContact O-N 3.38Å; L303-C307 PolarHBondContact O-N 3.43Å; L303-C307 PolarHBondContact O-SG 3.29Å; L303-C307 VanDerWaalsContact O-SG 3.34Å
304	C	85.2	Confident	82.5	Confident	51 Å²	51	103.7 Å²	103.7	35%	0.345	53%	0.53	S	S	.	.	H	α-helix	trans	-60.2	-45.6	176.6	-70.4	0	0	0	0	112	F300 F301 C307 V308	F300-C304 PolarHBondContact O-N 3.39Å; F300-C304 PolarHBondContact O-SG 3.15Å; F301-C304 PolarHBondContact O-N 3.25Å; C304-C307 PolarHBondContact O-N 2.95Å; C304-V308 VanDerWaalsContact O-CG2 3.3Å; C304-V308 WeakPolarHBondContact O-CG2 3.31Å; C304-V308 PolarHBondContact O-N 2.94Å
305	I	87.6	Confident	82.2	Confident	102 Å²	102	105.3 Å²	105.3	52%	0.523	54%	0.538	S	S	.	.	H	α-helix	trans	-63.2	-44.1	177.4	-67.1	164.7	0	0	0	110.2	F301 A302 L303 C307 V308 I309	F301-I305 WeakPolarHBondContact O-CB 3.48Å; F301-I305 WeakPolarHBondContact O-CD1 3.38Å; F301-I305 WeakPolarHBondContact O-CG1 3.24Å; F301-I305 PolarHBondContact O-N 3.44Å; A302-I305 PolarHBondContact O-N 3.28Å; L303-I305 PolarHBondContact O-N 3.14Å; I305-C307 PolarHBondContact O-N 3.24Å; I305-V308 PolarHBondContact O-N 2.8Å; I305-I309 HydrophobicContact CG2-CD1 3.7Å; I305-I309 HydrophobicContact CG2-CG1 4.3Å; I305-I309 WeakPolarHBondContact O-CG1 3.46Å; I305-I309 PolarHBondContact O-N 2.83Å
306	G	82.9	Confident	81.9	Confident	37 Å²	37	107.6 Å²	107.6	38%	0.381	54%	0.54	S	S	.	.	H	α-helix	trans	-57.6	-45.3	175	0	0	0	0	0	112.5	A302 L303 V308 I309 W310	A302-G306 PolarHBondContact O-N 2.96Å; L303-G306 PolarHBondContact O-N 3.38Å; G306-V308 PolarHBondContact O-N 3.02Å; G306-I309 PolarHBondContact O-N 3.25Å; G306-W310 VanDerWaalsContact O-CB 3.29Å; G306-W310 WeakPolarHBondContact O-CB 3.47Å; G306-W310 PolarHBondContact O-N 3.26Å
307	C	81.9	Confident	81.5	Confident	72 Å²	72	109.4 Å²	109.4	49%	0.486	54%	0.543	S	S	.	.	H	α-helix	trans	-62.9	-39.5	175.4	-72.1	0	0	0	0	112.7	L303 C304 I305 R311	L303-C307 PolarHBondContact O-N 3.43Å; L303-C307 PolarHBondContact O-SG 3.29Å; L303-C307 VanDerWaalsContact O-SG 3.34Å; C304-C307 PolarHBondContact O-N 2.95Å; I305-C307 PolarHBondContact O-N 3.24Å; C307-R311 WeakPolarHBondContact O-CB 3.36Å; C307-R311 WeakPolarHBondContact O-CG 3.02Å; C307-R311 PolarHBondContact O-N 3.09Å
308	V	81.7	Confident	80.8	Confident	100 Å²	100	113.2 Å²	113.2	61%	0.606	55%	0.554	S	S	*	*	H	α-helix	trans	-67.3	-46.1	177.7	172.4	0	0	0	0	110.9	C304 I305 G306 W310 R311 W312	C304-V308 VanDerWaalsContact O-CG2 3.3Å; C304-V308 WeakPolarHBondContact O-CG2 3.31Å; C304-V308 PolarHBondContact O-N 2.94Å; I305-V308 PolarHBondContact O-N 2.8Å; G306-V308 PolarHBondContact O-N 3.02Å; V308-W310 VanDerWaalsContact C-N 3.35Å; V308-W310 PolarHBondContact O-N 3.03Å; V308-R311 PolarHBondContact O-N 2.84Å; V308-W312 WeakPolarHBondContact O-CB 3.35Å; V308-W312 PolarHBondContact O-N 3.37Å
309	I	83.2	Confident	79.7	Confident	87 Å²	87	119.7 Å²	119.7	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-62.6	-44.3	177.3	-66.2	170	0	0	0	110.2	I305 G306 W312 L313	I305-I309 HydrophobicContact CG2-CD1 3.7Å; I305-I309 HydrophobicContact CG2-CG1 4.3Å; I305-I309 WeakPolarHBondContact O-CG1 3.46Å; I305-I309 PolarHBondContact O-N 2.83Å; G306-I309 PolarHBondContact O-N 3.25Å; I309-W312 PolarHBondContact O-N 2.82Å; I309-L313 HydrophobicContact CG2-CD1 3.94Å; I309-L313 HydrophobicContact CG2-CG 4.34Å; I309-L313 WeakPolarHBondContact O-CB 3.2Å; I309-L313 WeakPolarHBondContact O-CG 3.5Å; I309-L313 PolarHBondContact O-N 3.25Å
310	W	81.6	Confident	78.4	Confident	186 Å²	186	123.2 Å²	123.2	71%	0.705	58%	0.582	S	S	*	*	H	α-helix	trans	-62	-46.4	177.4	-175.1	11.8	0	0	0	111.7	G306 V308 W312 L313 Y314	G306-W310 VanDerWaalsContact O-CB 3.29Å; G306-W310 WeakPolarHBondContact O-CB 3.47Å; G306-W310 PolarHBondContact O-N 3.26Å; V308-W310 VanDerWaalsContact C-N 3.35Å; V308-W310 PolarHBondContact O-N 3.03Å; W310-W312 VanDerWaalsContact C-N 3.29Å; W310-W312 PolarHBondContact O-N 3.26Å; W310-L313 PolarHBondContact O-N 2.79Å; W310-Y314 WeakPolarHBondContact O-CB 3.28Å; W310-Y314 PolarHBondContact O-N 2.86Å
311	R	76.4	Confident	76.8	Confident	196 Å²	196	126.8 Å²	126.8	74%	0.74	61%	0.606	S	S	*	*	H	α-helix	trans	-58.9	-41.8	173.8	-83.7	-173.1	167.3	-163.6	-1.9	111.9	C307 V308 Y314 M315	C307-R311 WeakPolarHBondContact O-CB 3.36Å; C307-R311 WeakPolarHBondContact O-CG 3.02Å; C307-R311 PolarHBondContact O-N 3.09Å; V308-R311 PolarHBondContact O-N 2.84Å; R311-Y314 PolarHBondContact O-N 2.89Å; R311-M315 WeakPolarHBondContact O-CB 3.31Å; R311-M315 WeakPolarHBondContact O-CG 3.09Å; R311-M315 PolarHBondContact O-N 2.92Å
312	W	78	Confident	76.4	Confident	170 Å²	170	127.1 Å²	127.1	64%	0.644	61%	0.61	S	S	*	*	H	α-helix	trans	-64.7	-43.7	179.1	-169.1	65.8	0	0	0	112.1	V308 I309 W310 M315 K316	V308-W312 WeakPolarHBondContact O-CB 3.35Å; V308-W312 PolarHBondContact O-N 3.37Å; I309-W312 PolarHBondContact O-N 2.82Å; W310-W312 VanDerWaalsContact C-N 3.29Å; W310-W312 PolarHBondContact O-N 3.26Å; W312-M315 PolarHBondContact O-N 2.84Å; W312-K316 WeakPolarHBondContact O-CB 3.47Å; W312-K316 PolarHBondContact O-N 3.49Å
313	L	79.9	Confident	75.9	Confident	96 Å²	96	130.5 Å²	130.5	50%	0.503	62%	0.615	S	S	.	*	H	α-helix	trans	-66	-39.8	175.3	-70.2	173.8	0	0	0	112.3	I309 W310 K316 K317	I309-L313 HydrophobicContact CG2-CD1 3.94Å; I309-L313 HydrophobicContact CG2-CG 4.34Å; I309-L313 WeakPolarHBondContact O-CB 3.2Å; I309-L313 WeakPolarHBondContact O-CG 3.5Å; I309-L313 PolarHBondContact O-N 3.25Å; W310-L313 PolarHBondContact O-N 2.79Å; L313-K316 PolarHBondContact O-N 2.99Å; L313-K317 PolarHBondContact O-N 2.76Å
314	Y	77.3	Confident	75.3	Confident	152 Å²	152	131.4 Å²	131.4	60%	0.596	62%	0.616	S	S	*	*	H	α-helix	trans	-63	-44.3	176.5	-173.9	-96.8	0	0	0	111.5	W310 R311 K316 K317 K318	W310-Y314 WeakPolarHBondContact O-CB 3.28Å; W310-Y314 PolarHBondContact O-N 2.86Å; R311-Y314 PolarHBondContact O-N 2.89Å; Y314-K316 VanDerWaalsContact C-N 3.31Å; Y314-K316 PolarHBondContact O-N 3.36Å; Y314-K317 PolarHBondContact O-N 3.42Å; Y314-K318 PolarHBondContact O-N 2.83Å
315	M	74	Confident	74.7	Confident	127 Å²	127	136.2 Å²	136.2	63%	0.626	63%	0.632	S	S	*	*	H	α-helix	trans	-64.4	-35.8	175.4	-69.9	-70.7	-86.9	0	0	112.1	R311 W312 K318 R319	R311-M315 WeakPolarHBondContact O-CB 3.31Å; R311-M315 WeakPolarHBondContact O-CG 3.09Å; R311-M315 PolarHBondContact O-N 2.92Å; W312-M315 PolarHBondContact O-N 2.84Å; M315-K318 PolarHBondContact O-N 3.25Å; M315-R319 PolarHBondContact O-N 3.44Å
316	K	74.8	Confident	73.9	Confident	120 Å²	120	138.3 Å²	138.3	52%	0.522	64%	0.639	S	S	.	*	H	α-helix	trans	-67.9	-38.3	176	-159.6	175.3	-177.2	-180	0	112	W312 L313 Y314 R319	W312-K316 WeakPolarHBondContact O-CB 3.47Å; W312-K316 PolarHBondContact O-N 3.49Å; L313-K316 PolarHBondContact O-N 2.99Å; Y314-K316 VanDerWaalsContact C-N 3.31Å; Y314-K316 PolarHBondContact O-N 3.36Å; K316-R319 PolarHBondContact O-N 3.43Å
317	K	72.4	Confident	73.3	Confident	155 Å²	155	145.1 Å²	145.1	67%	0.674	66%	0.656	S	S	*	*	H	α-helix	trans	-67.2	-37.7	175.9	-166.3	174.5	-177.2	179.9	0	112.3	L313 Y314 R319 N320	L313-K317 PolarHBondContact O-N 2.76Å; Y314-K317 PolarHBondContact O-N 3.42Å; K317-R319 VanDerWaalsContact C-N 3.3Å; K317-R319 PolarHBondContact O-N 3.2Å; K317-N320 PolarHBondContact O-N 3.11Å
318	K	67.7	Low	72.7	Confident	149 Å²	149	150.3 Å²	150.3	65%	0.648	67%	0.668	S	S	*	*	H	α-helix	trans	-70.1	-22.4	177.8	-166.3	175.1	179.9	-180	0	113.9	Y314 M315	Y314-K318 PolarHBondContact O-N 2.83Å; M315-K318 PolarHBondContact O-N 3.25Å
319	R	64.1	Low	72	Confident	226 Å²	226	154.2 Å²	154.2	85%	0.853	67%	0.673	S	S	*	*	H	α-helix	trans	-83.6	-15.4	175.5	-97.1	-178.7	160.3	171.6	-5.3	114.3	M315 K316 K317	M315-R319 PolarHBondContact O-N 3.44Å; K316-R319 PolarHBondContact O-N 3.43Å; K317-R319 VanDerWaalsContact C-N 3.3Å; K317-R319 PolarHBondContact O-N 3.2Å
320	N	56.5	Low	71.1	Confident	139 Å²	139	159.8 Å²	159.8	74%	0.743	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	20.3	-179.4	-74.5	-5.2	0	0	0	112.6	K317	K317-N320 PolarHBondContact O-N 3.11Å
321	L	50.1	Low	70.1	Confident	201 Å²	201	157.4 Å²	157.4	100%	1.052	69%	0.691	S	S	*	*			trans	-133.6	0	179.4	-142.1	149.8	0	0	0	108

Retrieved 321 of 321 residues in 231.5 ms (Link to these results)

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