G4LV60_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession G4LV60, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 270 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	44.1	Very low	53.8	Low	220 Å²	220	138.9 Å²	138.9	100%	1.084	67%	0.667	S	S	*	*				0	106	0	-75.4	170.3	177.9	0	0	108.2
2	R	45.4	Very low	54.1	Low	246 Å²	246	135.9 Å²	135.9	93%	0.928	66%	0.656	S	S	*	*			trans	-88.3	102.9	168.8	-74	-176.7	177.1	178.3	-0.9	106.5	N4	R2-N4 PolarHBondContact O-N 3.23Å
3	Y	54.5	Low	54.5	Low	187 Å²	187	130.2 Å²	130.2	73%	0.733	63%	0.634	S	S	*	*			trans	-71.6	108	172.4	-95.3	-88.7	0	0	0	108.1	F5	Y3-F5 PolarHBondContact O-N 3.06Å; Y3-F5 VanDerWaalsContact O-N 3.16Å
4	N	51.4	Low	54.7	Low	158 Å²	158	131.6 Å²	131.6	85%	0.845	63%	0.631	S	S	*	*			trans	-70.7	100.8	165.7	-76.1	-25.9	0	0	0	107.5	R2 S6	R2-N4 PolarHBondContact O-N 3.23Å; N4-S6 PolarHBondContact O-N 3.33Å
5	F	48.5	Very low	54.5	Low	144 Å²	144	129.9 Å²	129.9	63%	0.632	63%	0.626	S	S	*	*			trans	-70.3	121.4	168.3	-97.5	-91.3	0	0	0	109	Y3	Y3-F5 PolarHBondContact O-N 3.06Å; Y3-F5 VanDerWaalsContact O-N 3.16Å
6	S	57	Low	54.4	Low	53 Å²	53	129.5 Å²	129.5	37%	0.371	62%	0.621	S	S	.	*			trans	-60.2	134.3	177.4	175.2	0	0	0	0	111	N4 S8 L9	N4-S6 PolarHBondContact O-N 3.33Å; S6-S8 PolarHBondContact O-N 3.48Å; S6-S8 PolarHBondContact OG-N 3.41Å; S6-S8 PolarHBondContact OG-OG 2.81Å; S6-L9 PolarHBondContact O-N 3.31Å; S6-L9 VanDerWaalsContact O-N 3.11Å
7	P	60.1	Low	54.1	Low	103 Å²	103	129.7 Å²	129.7	67%	0.669	62%	0.618	S	S	*	*	H	α-helix	trans	-55.1	-24.2	173.9	-23.5	32.2	0	0	0	113.9	L9 W10 I11	P7-L9 VanDerWaalsContact C-N 3.31Å; P7-L9 PolarHBondContact O-N 3.11Å; P7-W10 PolarHBondContact O-N 3.41Å; P7-I11 PolarHBondContact O-N 3.16Å
8	S	59.9	Low	53.8	Low	68 Å²	68	127.3 Å²	127.3	48%	0.476	61%	0.613	S	S	.	*	H	α-helix	trans	-66.9	-28.7	178.9	63.9	0	0	0	0	113.8	S6 I11 L12	S6-S8 PolarHBondContact O-N 3.48Å; S6-S8 PolarHBondContact OG-N 3.41Å; S6-S8 PolarHBondContact OG-OG 2.81Å; S8-I11 PolarHBondContact O-N 3.11Å; S8-L12 PolarHBondContact O-N 3.36Å
9	L	54.9	Low	53.1	Low	89 Å²	89	130.6 Å²	130.6	47%	0.466	62%	0.619	S	S	.	*	H	α-helix	trans	-71.2	-33.6	177.2	-102.6	139.3	0	0	0	111.5	S6 P7 V13	S6-L9 PolarHBondContact O-N 3.31Å; S6-L9 VanDerWaalsContact O-N 3.11Å; P7-L9 VanDerWaalsContact C-N 3.31Å; P7-L9 PolarHBondContact O-N 3.11Å; L9-V13 WeakPolarHBondContact O-CB 3.48Å; L9-V13 VanDerWaalsContact O-CG2 3.23Å; L9-V13 WeakPolarHBondContact O-CG2 3.23Å; L9-V13 PolarHBondContact O-N 3.49Å; L9-V13 VanDerWaalsContact O-N 3.11Å
10	W	53.9	Low	52.5	Low	152 Å²	152	130.3 Å²	130.3	58%	0.576	62%	0.617	S	S	*	*	H	α-helix	trans	-66.9	-38.6	175.9	-77.4	90.6	0	0	0	111.9	P7 L12 V13 Y14	P7-W10 PolarHBondContact O-N 3.41Å; W10-L12 PolarHBondContact O-N 3.41Å; W10-V13 PolarHBondContact O-N 3.48Å; W10-Y14 HydrophobicContact CE3-CD2 4.37Å; W10-Y14 AromaticContact CE3-CE2 3.92Å; W10-Y14 HydrophobicContact CE3-CE2 3.92Å; W10-Y14 HydrophobicContact CZ3-CE2 4.44Å; W10-Y14 WeakPolarHBondContact O-CB 3.29Å; W10-Y14 VanDerWaalsContact O-CD2 3.29Å; W10-Y14 WeakPolarHBondContact O-CD2 3.42Å; W10-Y14 PolarHBondContact O-N 2.85Å
11	I	61.8	Low	52.1	Low	108 Å²	108	133.9 Å²	133.9	55%	0.554	63%	0.626	S	S	*	*	H	α-helix	trans	-64.9	-41.6	179.2	-61.2	171.5	0	0	0	111.3	P7 S8 Y14 L15	P7-I11 PolarHBondContact O-N 3.16Å; S8-I11 PolarHBondContact O-N 3.11Å; I11-Y14 PolarHBondContact O-N 3.37Å; I11-L15 HydrophobicContact CG2-CD1 3.98Å; I11-L15 WeakPolarHBondContact O-CB 3.07Å; I11-L15 WeakPolarHBondContact O-CG 3.45Å; I11-L15 PolarHBondContact O-N 2.85Å
12	L	57.3	Low	52	Low	103 Å²	103	130 Å²	130	54%	0.539	60%	0.603	S	S	.	*	H	α-helix	trans	-66.7	-40.9	177	-80.8	163.6	0	0	0	112.1	S8 W10 L15 F16	S8-L12 PolarHBondContact O-N 3.36Å; W10-L12 PolarHBondContact O-N 3.41Å; L12-L15 PolarHBondContact O-N 3.33Å; L12-F16 PolarHBondContact O-N 2.83Å
13	V	60	Low	52	Low	62 Å²	62	126.7 Å²	126.7	38%	0.376	59%	0.591	S	S	.	*	H	α-helix	trans	-64.9	-43.1	176.1	172	0	0	0	0	110.4	L9 W10 F16 F17	L9-V13 WeakPolarHBondContact O-CB 3.48Å; L9-V13 VanDerWaalsContact O-CG2 3.23Å; L9-V13 WeakPolarHBondContact O-CG2 3.23Å; L9-V13 PolarHBondContact O-N 3.49Å; L9-V13 VanDerWaalsContact O-N 3.11Å; W10-V13 PolarHBondContact O-N 3.48Å; V13-F16 PolarHBondContact O-N 2.86Å; V13-F17 HydrophobicContact CG1-CD2 3.44Å; V13-F17 VanDerWaalsContact CG1-CD2 3.44Å; V13-F17 HydrophobicContact CG1-CE2 3.38Å; V13-F17 WeakPolarHBondContact O-CB 3.41Å; V13-F17 WeakPolarHBondContact O-CD2 3.43Å; V13-F17 PolarHBondContact O-N 3.34Å
14	Y	56.6	Low	51.6	Low	150 Å²	150	123.7 Å²	123.7	59%	0.588	58%	0.581	S	S	*	*	H	α-helix	trans	-63.6	-40.5	173.5	-93.1	-77.2	0	0	0	112.5	W10 I11 F17 V18	W10-Y14 HydrophobicContact CE3-CD2 4.37Å; W10-Y14 AromaticContact CE3-CE2 3.92Å; W10-Y14 HydrophobicContact CE3-CE2 3.92Å; W10-Y14 HydrophobicContact CZ3-CE2 4.44Å; W10-Y14 WeakPolarHBondContact O-CB 3.29Å; W10-Y14 VanDerWaalsContact O-CD2 3.29Å; W10-Y14 WeakPolarHBondContact O-CD2 3.42Å; W10-Y14 PolarHBondContact O-N 2.85Å; I11-Y14 PolarHBondContact O-N 3.37Å; Y14-F17 PolarHBondContact O-N 2.78Å; Y14-V18 VanDerWaalsContact O-CB 3.23Å; Y14-V18 WeakPolarHBondContact O-CB 3.12Å; Y14-V18 WeakPolarHBondContact O-CG2 3.23Å; Y14-V18 PolarHBondContact O-N 3.42Å
15	L	52.2	Low	51.6	Low	106 Å²	106	119.9 Å²	119.9	56%	0.555	56%	0.561	S	S	*	*	H	α-helix	trans	-64.4	-41.8	175.1	-80.1	163.3	0	0	0	111.6	I11 L12 W19	I11-L15 HydrophobicContact CG2-CD1 3.98Å; I11-L15 WeakPolarHBondContact O-CB 3.07Å; I11-L15 WeakPolarHBondContact O-CG 3.45Å; I11-L15 PolarHBondContact O-N 2.85Å; L12-L15 PolarHBondContact O-N 3.33Å; L15-W19 WeakPolarHBondContact O-CB 3.13Å; L15-W19 PolarHBondContact O-N 2.89Å
16	F	53.6	Low	51.9	Low	123 Å²	123	113.9 Å²	113.9	54%	0.539	54%	0.537	S	S	.	.	H	α-helix	trans	-64.1	-42.7	174	-100.2	-86	0	0	0	112.2	L12 V13 W19 Q20	L12-F16 PolarHBondContact O-N 2.83Å; V13-F16 PolarHBondContact O-N 2.86Å; F16-W19 PolarHBondContact O-N 3.45Å; F16-Q20 WeakPolarHBondContact O-CB 3.35Å; F16-Q20 WeakPolarHBondContact O-CG 3.15Å; F16-Q20 PolarHBondContact O-N 3.37Å
17	F	49.5	Very low	51.9	Low	133 Å²	133	113.1 Å²	113.1	58%	0.583	53%	0.529	S	S	*	.	H	α-helix	trans	-69.8	-39.3	177.9	-82.5	-66	0	0	0	112.6	V13 Y14 Y21	V13-F17 HydrophobicContact CG1-CD2 3.44Å; V13-F17 VanDerWaalsContact CG1-CD2 3.44Å; V13-F17 HydrophobicContact CG1-CE2 3.38Å; V13-F17 WeakPolarHBondContact O-CB 3.41Å; V13-F17 WeakPolarHBondContact O-CD2 3.43Å; V13-F17 PolarHBondContact O-N 3.34Å; Y14-F17 PolarHBondContact O-N 2.78Å; F17-Y21 WeakPolarHBondContact O-CB 3.34Å; F17-Y21 PolarHBondContact O-N 3.2Å
18	V	48.5	Very low	52.2	Low	87 Å²	87	110.8 Å²	110.8	53%	0.527	51%	0.509	S	S	.	.	H	α-helix	trans	-69.3	-35.4	175.4	172.3	0	0	0	0	110.8	Y14 Y21 K22	Y14-V18 VanDerWaalsContact O-CB 3.23Å; Y14-V18 WeakPolarHBondContact O-CB 3.12Å; Y14-V18 WeakPolarHBondContact O-CG2 3.23Å; Y14-V18 PolarHBondContact O-N 3.42Å; V18-Y21 PolarHBondContact O-N 2.91Å; V18-K22 PolarHBondContact O-N 3.11Å
19	W	40.3	Very low	53.1	Low	189 Å²	189	107.6 Å²	107.6	72%	0.716	49%	0.487	S	S	*	.	H	α-helix	trans	-71.8	-40.6	177.1	-166	18.6	0	0	0	111.9	L15 F16 Y21 K22	L15-W19 WeakPolarHBondContact O-CB 3.13Å; L15-W19 PolarHBondContact O-N 2.89Å; F16-W19 PolarHBondContact O-N 3.45Å; W19-Y21 VanDerWaalsContact C-N 3.3Å; W19-Y21 PolarHBondContact O-N 3.47Å; W19-K22 PolarHBondContact O-N 3.04Å; W19-K22 VanDerWaalsContact O-N 3.11Å
20	Q	41.7	Very low	54.3	Low	125 Å²	125	104.4 Å²	104.4	58%	0.584	47%	0.472	S	S	*	.	H	α-helix	trans	-64.6	-32.9	170.6	-70.6	-82.6	-18.1	0	0	112.1	F16 K22 R23	F16-Q20 WeakPolarHBondContact O-CB 3.35Å; F16-Q20 WeakPolarHBondContact O-CG 3.15Å; F16-Q20 PolarHBondContact O-N 3.37Å; Q20-K22 VanDerWaalsContact C-N 3.27Å; Q20-K22 PolarHBondContact O-N 2.93Å; Q20-R23 PolarHBondContact O-N 2.71Å
21	Y	42.6	Very low	55.5	Low	206 Å²	206	102.5 Å²	102.5	81%	0.808	47%	0.473	S	S	*	.	H	α-helix	trans	-75	-14.4	173.2	-106	-87.5	0	0	0	114	F17 V18 W19 R23	F17-Y21 WeakPolarHBondContact O-CB 3.34Å; F17-Y21 PolarHBondContact O-N 3.2Å; V18-Y21 PolarHBondContact O-N 2.91Å; W19-Y21 VanDerWaalsContact C-N 3.3Å; W19-Y21 PolarHBondContact O-N 3.47Å; Y21-R23 PolarHBondContact O-N 2.95Å
22	K	42.4	Very low	56.3	Low	139 Å²	139	98.6 Å²	98.6	60%	0.604	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	26.3	170.8	-119.1	-172.2	-178.2	-168.9	0	112.5	V18 W19 Q20 F24	V18-K22 PolarHBondContact O-N 3.11Å; W19-K22 PolarHBondContact O-N 3.04Å; W19-K22 VanDerWaalsContact O-N 3.11Å; Q20-K22 VanDerWaalsContact C-N 3.27Å; Q20-K22 PolarHBondContact O-N 2.93Å; K22-F24 HydrophobicContact CD-CE2 4.05Å; K22-F24 HydrophobicContact CG-CD2 4.36Å; K22-F24 HydrophobicContact CG-CE2 3.89Å; K22-F24 WeakPolarHBondContact O-CD2 3.43Å; K22-F24 PolarHBondContact O-N 2.85Å
23	R	45.4	Very low	57.3	Low	176 Å²	176	96.8 Å²	96.8	66%	0.664	45%	0.447	S	S	*	.			trans	-61.5	89.8	156	-106.1	-176.2	172	176.8	-1.3	107.7	Q20 Y21 N25	Q20-R23 PolarHBondContact O-N 2.71Å; Y21-R23 PolarHBondContact O-N 2.95Å; R23-N25 PolarHBondContact O-N 3.26Å; R23-N25 VanDerWaalsContact O-N 3.11Å
24	F	46.1	Very low	58.2	Low	123 Å²	123	98 Å²	98	54%	0.539	45%	0.446	S	S	.	.			trans	-58	116.5	171.6	-87.7	-90.6	0	0	0	108.1	K22 C26	K22-F24 HydrophobicContact CD-CE2 4.05Å; K22-F24 HydrophobicContact CG-CD2 4.36Å; K22-F24 HydrophobicContact CG-CE2 3.89Å; K22-F24 WeakPolarHBondContact O-CD2 3.43Å; K22-F24 PolarHBondContact O-N 2.85Å; F24-C26 PolarHBondContact O-N 3.25Å; F24-C26 PolarHBondContact O-SG 2.81Å
25	N	50.9	Low	59.4	Low	79 Å²	79	91.1 Å²	91.1	42%	0.422	42%	0.419	S	S	.	.			trans	-75	72.9	169.3	-122	-7.2	0	0	0	107.2	R23 N27	R23-N25 PolarHBondContact O-N 3.26Å; R23-N25 VanDerWaalsContact O-N 3.11Å; N25-N27 PolarHBondContact O-N 2.96Å
26	C	56	Low	60.8	Low	18 Å²	18	91.3 Å²	91.3	12%	0.122	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-7.5	-179.5	-30.8	0	0	0	0	112.8	F24 L35 C250	F24-C26 PolarHBondContact O-N 3.25Å; F24-C26 PolarHBondContact O-SG 2.81Å; C26-L35 WeakPolarHBondContact O-CD1 3.36Å; C26-C250 HydrophobicContact CB-CB 3.86Å; C26-C250 WeakPolarHBondContact CB-SG 3.48Å; C26-C250 WeakPolarHBondContact SG-CB 3.5Å; C26-C250 CovalentContact SG-SG 2.03Å; C26-C250 PolarHBondContact SG-SG 2.87Å
27	N	56.7	Low	62.2	Low	36 Å²	36	90.2 Å²	90.2	19%	0.193	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-4.3	-166.8	-150.5	0.3	0	0	0	113.9	N25 Y54 F227 L229	N25-N27 PolarHBondContact O-N 2.96Å; N27-Y54 PolarHBondContact O-OH 3.25Å; N27-Y54 VanDerWaalsContact O-OH 3.13Å; N27-F227 HydrophobicContact CB-CB 4.48Å; N27-F227 WeakPolarHBondContact OD1-CD2 3.47Å; N27-F227 VanDerWaalsContact OD1-CE2 3.31Å; N27-F227 WeakPolarHBondContact OD1-CE2 3.18Å; N27-F227 WeakPolarHBondContact OD1-CG 3.32Å; N27-L229 HydrophobicContact CB-CD1 4.16Å; N27-L229 HydrophobicContact CB-CD2 3.83Å; N27-L229 HydrophobicContact CB-CG 4.42Å
28	E	66.5	Low	63.9	Low	54 Å²	54	84.5 Å²	84.5	25%	0.252	38%	0.38	S	S	.	.			trans	-126.3	113.5	-177.2	-66.5	-163.2	164.1	0	0	111.4	C30 N31 D32	E28-C30 HydrophobicContact CB-CB 3.88Å; E28-C30 PolarHBondContact O-N 2.96Å; E28-N31 PolarHBondContact O-N 3.36Å; E28-D32 PolarHBondContact O-N 3.3Å; E28-D32 VanDerWaalsContact O-N 3.12Å
29	I	78.2	Confident	65.8	Low	2 Å²	2	84 Å²	84	1%	0.01	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-43.6	-19.1	158.5	-168.8	170	0	0	0	113.6	D32 L35 R36 Y54 I194 K202 F204	I29-D32 WeakPolarHBondContact CA-O 3Å; I29-D32 CarbonylContact O-C 3.53Å; I29-L35 HydrophobicContact CB-CB 4.45Å; I29-R36 HydrophobicContact CD1-CB 3.57Å; I29-R36 HydrophobicContact CG1-CB 4.36Å; I29-Y54 HydrophobicContact CB-CE1 3.96Å; I29-Y54 HydrophobicContact CB-CE2 4.47Å; I29-Y54 HydrophobicContact CD1-CE1 4.38Å; I29-Y54 HydrophobicContact CG2-CE1 4.03Å; I29-Y54 WeakPolarHBondContact CG2-OH 3.4Å; I29-Y54 PolarHBondContact N-OH 3.43Å; I29-Y54 VanDerWaalsContact N-OH 3.12Å; I29-I194 HydrophobicContact CG2-CB 3.69Å; I29-I194 HydrophobicContact CG2-CG1 3.73Å; I29-I194 HydrophobicContact CG2-CG2 3.98Å; I29-K202 HydrophobicContact CB-CB 4.41Å; I29-K202 HydrophobicContact CD1-CB 4.11Å; I29-K202 HydrophobicContact CG1-CB 3.98Å; I29-K202 HydrophobicContact CG2-CB 3.66Å; I29-K202 HydrophobicContact CG2-CG 4.25Å; I29-F204 HydrophobicContact CD1-CB 3.92Å; I29-F204 HydrophobicContact CD1-CD1 4.37Å
30	C	80.7	Confident	68	Low	22 Å²	22	77 Å²	77	15%	0.149	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-43.7	172.3	-58.2	0	0	0	0	112.9	E28 C196	E28-C30 HydrophobicContact CB-CB 3.88Å; E28-C30 PolarHBondContact O-N 2.96Å; C30-C196 WeakPolarHBondContact CA-SG 3.37Å; C30-C196 HydrophobicContact CB-CB 3.62Å; C30-C196 WeakPolarHBondContact CB-SG 3.44Å; C30-C196 WeakPolarHBondContact SG-CA 3.49Å; C30-C196 WeakPolarHBondContact SG-CB 3.42Å; C30-C196 CovalentContact SG-SG 2.02Å; C30-C196 PolarHBondContact SG-SG 2.98Å
31	N	79.1	Confident	70.4	Confident	112 Å²	112	74 Å²	74	60%	0.599	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-28.8	179.6	-62.9	-44.5	0	0	0	112	E28	E28-N31 PolarHBondContact O-N 3.36Å
32	D	78.2	Confident	72.7	Confident	26 Å²	26	68.4 Å²	68.4	14%	0.139	32%	0.322	C	S	.	.			trans	-126.9	91	178.2	-164.5	-19.7	0	0	0	111.8	E28 I29 Y34 L35 K257	E28-D32 PolarHBondContact O-N 3.3Å; E28-D32 VanDerWaalsContact O-N 3.12Å; I29-D32 WeakPolarHBondContact CA-O 3Å; I29-D32 CarbonylContact O-C 3.53Å; D32-Y34 PolarHBondContact O-N 3.42Å; D32-Y34 VanDerWaalsContact O-N 3.09Å; D32-Y34 WeakPolarHBondContact OD1-CB 3.38Å; D32-Y34 PolarHBondContact OD1-N 2.96Å; D32-Y34 VanDerWaalsContact OD1-N 3.11Å; D32-L35 HydrophobicContact CB-CD1 3.92Å; D32-L35 HydrophobicContact CB-CG 4.03Å; D32-L35 WeakPolarHBondContact O-CB 3.45Å; D32-L35 WeakPolarHBondContact O-CG 3.15Å; D32-L35 PolarHBondContact O-N 3.43Å; D32-K257 VanDerWaalsContact CG-NZ 3.32Å; D32-K257 IonicContact OD1-NZ 3.4Å; D32-K257 PolarHBondContact OD1-NZ 2.85Å; D32-K257 WeakPolarHBondContact OD2-CD 3.49Å; D32-K257 WeakPolarHBondContact OD2-CE 3.43Å; D32-K257 IonicContact OD2-NZ 2.75Å; D32-K257 PolarHBondContact OD2-NZ 2.83Å
33	P	79.5	Confident	75.2	Confident	65 Å²	65	65.9 Å²	65.9	42%	0.422	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-59.9	-21.5	-179.6	-25.1	34.9	0	0	0	114.2	L35 R36	P33-L35 PolarHBondContact O-N 3.12Å; P33-R36 WeakPolarHBondContact O-CB 3.43Å; P33-R36 WeakPolarHBondContact O-CD 3.24Å; P33-R36 WeakPolarHBondContact O-CG 3.41Å; P33-R36 PolarHBondContact O-N 3.29Å
34	Y	78.9	Confident	77.7	Confident	88 Å²	88	61.6 Å²	61.6	35%	0.345	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-69.2	-22.9	-179.1	-69.5	-80	0	0	0	112.9	D32 R36 Y37 K257 I260 E261	D32-Y34 PolarHBondContact O-N 3.42Å; D32-Y34 VanDerWaalsContact O-N 3.09Å; D32-Y34 WeakPolarHBondContact OD1-CB 3.38Å; D32-Y34 PolarHBondContact OD1-N 2.96Å; D32-Y34 VanDerWaalsContact OD1-N 3.11Å; Y34-R36 PolarHBondContact O-N 3.35Å; Y34-Y37 PolarHBondContact O-N 3.06Å; Y34-K257 HydrophobicContact CD2-CG 4.49Å; Y34-K257 HydrophobicContact CG-CG 4.48Å; Y34-I260 HydrophobicContact CD1-CG2 4.17Å; Y34-E261 HydrophobicContact CD1-CG 4.17Å; Y34-E261 HydrophobicContact CD2-CG 4.4Å; Y34-E261 HydrophobicContact CE1-CG 3.73Å; Y34-E261 HydrophobicContact CE2-CG 3.95Å; Y34-E261 WeakPolarHBondContact CE2-OE1 3.42Å; Y34-E261 HydrophobicContact CG-CG 4.48Å
35	L	80.2	Confident	80.1	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-53.2	-27	174.3	-73	174.6	0	0	0	112.9	C26 I29 D32 P33 Y37 Y38 Y54 I253	C26-L35 WeakPolarHBondContact O-CD1 3.36Å; I29-L35 HydrophobicContact CB-CB 4.45Å; D32-L35 HydrophobicContact CB-CD1 3.92Å; D32-L35 HydrophobicContact CB-CG 4.03Å; D32-L35 WeakPolarHBondContact O-CB 3.45Å; D32-L35 WeakPolarHBondContact O-CG 3.15Å; D32-L35 PolarHBondContact O-N 3.43Å; P33-L35 PolarHBondContact O-N 3.12Å; L35-Y37 PolarHBondContact O-N 2.84Å; L35-Y37 VanDerWaalsContact O-N 3.12Å; L35-Y38 WeakPolarHBondContact O-CB 3.47Å; L35-Y38 PolarHBondContact O-N 3.39Å; L35-Y38 VanDerWaalsContact O-N 3.08Å; L35-Y54 HydrophobicContact CB-CD2 3.79Å; L35-Y54 HydrophobicContact CB-CE2 4.04Å; L35-Y54 HydrophobicContact CB-CG 4.35Å; L35-Y54 HydrophobicContact CD1-CD2 4.29Å; L35-Y54 HydrophobicContact CD1-CE2 3.88Å; L35-Y54 HydrophobicContact CD2-CD2 4.32Å; L35-Y54 HydrophobicContact CG-CD2 4.38Å; L35-Y54 HydrophobicContact CG-CE2 4.44Å; L35-Y54 VanDerWaalsContact O-CB 3.26Å; L35-Y54 WeakPolarHBondContact O-CB 3.08Å; L35-I253 HydrophobicContact CD2-CG2 3.33Å
36	R	81.4	Confident	82.2	Confident	110 Å²	110	62.2 Å²	62.2	42%	0.415	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-60.3	-21.3	175.8	78.8	-175.7	-84.8	-174.7	-7.3	114.5	I29 P33 Y34 F204	I29-R36 HydrophobicContact CD1-CB 3.57Å; I29-R36 HydrophobicContact CG1-CB 4.36Å; P33-R36 WeakPolarHBondContact O-CB 3.43Å; P33-R36 WeakPolarHBondContact O-CD 3.24Å; P33-R36 WeakPolarHBondContact O-CG 3.41Å; P33-R36 PolarHBondContact O-N 3.29Å; Y34-R36 PolarHBondContact O-N 3.35Å; R36-F204 HydrophobicContact CB-CB 4Å
37	Y	83.5	Confident	84.2	Confident	99 Å²	99	64.4 Å²	64.4	39%	0.388	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-109.1	2.6	-179.7	-55.3	-65.7	0	0	0	112.1	Y34 L35 E39 Y264	Y34-Y37 PolarHBondContact O-N 3.06Å; L35-Y37 PolarHBondContact O-N 2.84Å; L35-Y37 VanDerWaalsContact O-N 3.12Å; Y37-E39 PolarHBondContact O-N 3.46Å; Y37-E39 VanDerWaalsContact O-N 3.14Å; Y37-Y264 HydrophobicContact CD2-CE2 4.38Å; Y37-Y264 HydrophobicContact CG-CE2 4.45Å
38	Y	84.8	Confident	86.2	Confident	13 Å²	13	65.7 Å²	65.7	5%	0.051	33%	0.326	C	S	.	.			trans	-62.4	119.1	-178.6	175.7	-96.2	0	0	0	110.1	L35 N40 H52 H53 I253 K256	L35-Y38 WeakPolarHBondContact O-CB 3.47Å; L35-Y38 PolarHBondContact O-N 3.39Å; L35-Y38 VanDerWaalsContact O-N 3.08Å; Y38-N40 HydrophobicContact CE1-CB 4.31Å; Y38-N40 HydrophobicContact CE2-CB 4.42Å; Y38-N40 WeakPolarHBondContact OH-CB 3.44Å; Y38-H52 HydrophobicContact CE1-CB 4.35Å; Y38-H53 WeakPolarHBondContact O-CA 3.26Å; Y38-I253 HydrophobicContact CD2-CG2 4.37Å; Y38-I253 HydrophobicContact CE2-CB 4.44Å; Y38-I253 HydrophobicContact CE2-CG1 4.08Å; Y38-K256 HydrophobicContact CD2-CB 4.2Å; Y38-K256 HydrophobicContact CD2-CG 4.15Å; Y38-K256 HydrophobicContact CE2-CB 3.98Å; Y38-K256 HydrophobicContact CE2-CG 4.14Å
39	E	88.9	Confident	87.7	Confident	76 Å²	76	63.2 Å²	63.2	36%	0.355	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	130.4	171.2	174.9	171.8	-174.3	0	0	108.4	Y37 V41 H52 H53 K256	Y37-E39 PolarHBondContact O-N 3.46Å; Y37-E39 VanDerWaalsContact O-N 3.14Å; E39-V41 HydrophobicContact CG-CG2 4.32Å; E39-H52 CarbonylContact C-O 3.49Å; E39-H52 WeakPolarHBondContact CA-O 2.92Å; E39-H53 IonicContact OE1-CE1 3.85Å; E39-H53 IonicContact OE2-CE1 2.54Å; E39-K256 VanDerWaalsContact O-CE 3.23Å; E39-K256 WeakPolarHBondContact O-CE 3.1Å
40	N	87.5	Confident	88.6	Confident	44 Å²	44	65.8 Å²	65.8	24%	0.235	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	104.4	173.3	-175.8	5.1	0	0	0	109.3	Y38 I42 S51 H52	Y38-N40 HydrophobicContact CE1-CB 4.31Å; Y38-N40 HydrophobicContact CE2-CB 4.42Å; Y38-N40 WeakPolarHBondContact OH-CB 3.44Å; N40-I42 PolarHBondContact O-N 3.31Å; N40-S51 CarbonylContact O-C 3.46Å; N40-S51 VanDerWaalsContact O-CA 3.28Å; N40-S51 WeakPolarHBondContact O-CA 3.44Å; N40-H52 HydrophobicContact CB-CB 4.41Å; N40-H52 PolarHBondContact N-O 3.48Å; N40-H52 PolarHBondContact O-N 3.24Å
41	V	91.6	Very high	89.2	Confident	62 Å²	62	64.8 Å²	64.8	38%	0.376	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	114.7	176.9	177.5	0	0	0	0	109	E39 E44 L49	E39-V41 HydrophobicContact CG-CG2 4.32Å; V41-E44 HydrophobicContact CG1-CB 3.96Å; V41-L49 HydrophobicContact CG1-CD1 3.64Å; V41-L49 HydrophobicContact CG2-CD1 4.31Å
42	I	91.3	Very high	89.7	Confident	88 Å²	88	60.5 Å²	60.5	45%	0.451	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-41.9	-178.4	-56.2	-57.4	0	0	0	110.7	N40 Y50	N40-I42 PolarHBondContact O-N 3.31Å; I42-Y50 HydrophobicContact CB-CD1 3.88Å; I42-Y50 HydrophobicContact CB-CE1 4.49Å; I42-Y50 HydrophobicContact CG1-CD1 4.07Å; I42-Y50 HydrophobicContact CG1-CE1 4.26Å; I42-Y50 HydrophobicContact CG2-CD1 4.18Å; I42-Y50 PolarHBondContact N-O 3.22Å
43	I	94.7	Very high	90.3	Very high	85 Å²	85	59.7 Å²	59.7	44%	0.436	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	137.2	177.9	179.8	168.7	0	0	0	109.4	Y48 L49 Y50	I43-Y48 HydrophobicContact CG2-CD1 4.08Å; I43-Y48 HydrophobicContact CG2-CE1 3.65Å; I43-L49 WeakPolarHBondContact O-CA 2.92Å; I43-Y50 PolarHBondContact N-O 3.16Å; I43-Y50 PolarHBondContact O-N 2.02Å
44	E	97.2	Very high	90.5	Very high	87 Å²	87	56.8 Å²	56.8	41%	0.407	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	135.9	174.8	-176.8	165.6	-139.4	0	0	110.3	V41 Y48 L49 K211 W212	V41-E44 HydrophobicContact CG1-CB 3.96Å; E44-Y48 WeakPolarHBondContact CA-O 2.96Å; E44-L49 HydrophobicContact CB-CD1 3.79Å; E44-L49 HydrophobicContact CG-CD1 3.95Å; E44-K211 VanDerWaalsContact CD-NZ 3.28Å; E44-K211 WeakPolarHBondContact OE1-CE 3.29Å; E44-K211 IonicContact OE1-NZ 2.93Å; E44-K211 PolarHBondContact OE1-NZ 3.37Å; E44-K211 IonicContact OE2-NZ 3.26Å; E44-K211 PolarHBondContact OE2-NZ 3.25Å; E44-W212 HydrophobicContact CG-CZ2 4.2Å; E44-W212 WeakPolarHBondContact OE1-CZ2 3.19Å; E44-W212 PolarHBondContact OE1-NE1 3.11Å
45	N	96.6	Very high	90.8	Very high	75 Å²	75	54.9 Å²	54.9	40%	0.401	26%	0.263	S	S	.	.			trans	-143.2	-172.7	165.6	68.5	46.6	0	0	0	109.7	T47 Y48 W212	N45-T47 PolarHBondContact O-N 3.33Å; N45-T47 VanDerWaalsContact O-N 3.09Å; N45-T47 PolarHBondContact OD1-N 3.5Å; N45-T47 PolarHBondContact OD1-OG1 2.91Å; N45-T47 VanDerWaalsContact OD1-OG1 3.08Å; N45-Y48 PolarHBondContact N-O 3.36Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.46Å; N45-Y48 PolarHBondContact OD1-N 3.29Å; N45-W212 WeakPolarHBondContact O-CH2 3.21Å
46	D	95.5	Very high	91.2	Very high	140 Å²	140	54.6 Å²	54.6	75%	0.749	26%	0.262	S	S	*	.	S	Bend	trans	-64.6	-16.2	-175.3	-69.2	-23.2	0	0	0	115.7	R62	D46-R62 WeakPolarHBondContact O-CD 2.93Å; D46-R62 PolarHBondContact O-NH1 2.02Å
47	T	97.3	Very high	91.8	Very high	63 Å²	63	50 Å²	50	39%	0.387	25%	0.246	S	C	.	.	S	Bend	trans	-128.3	-11.6	-172.7	62.2	0	0	0	0	114.5	N45 Q61 R62	N45-T47 PolarHBondContact O-N 3.33Å; N45-T47 VanDerWaalsContact O-N 3.09Å; N45-T47 PolarHBondContact OD1-N 3.5Å; N45-T47 PolarHBondContact OD1-OG1 2.91Å; N45-T47 VanDerWaalsContact OD1-OG1 3.08Å; T47-Q61 WeakPolarHBondContact O-CA 3.09Å; T47-R62 PolarHBondContact O-N 3.13Å
48	Y	98	Very high	92.4	Very high	63 Å²	63	45.3 Å²	45.3	25%	0.247	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	135.3	-174.3	-173.9	-92.1	0	0	0	111.5	I43 E44 N45 K59 I60 Q61	I43-Y48 HydrophobicContact CG2-CD1 4.08Å; I43-Y48 HydrophobicContact CG2-CE1 3.65Å; E44-Y48 WeakPolarHBondContact CA-O 2.96Å; N45-Y48 PolarHBondContact N-O 3.36Å; N45-Y48 WeakPolarHBondContact OD1-CB 3.46Å; N45-Y48 PolarHBondContact OD1-N 3.29Å; Y48-K59 HydrophobicContact CE2-CD 4.3Å; Y48-K59 HydrophobicContact CE2-CG 4.02Å; Y48-I60 WeakPolarHBondContact CA-O 3.32Å; Y48-Q61 HydrophobicContact CD2-CG 3.86Å; Y48-Q61 HydrophobicContact CE2-CG 4.06Å
49	L	98.1	Very high	93.1	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.3	166.7	173.7	71	0	0	0	108.6	V41 I43 E44 M58 K59 I60 P209 W212	V41-L49 HydrophobicContact CG1-CD1 3.64Å; V41-L49 HydrophobicContact CG2-CD1 4.31Å; I43-L49 WeakPolarHBondContact O-CA 2.92Å; E44-L49 HydrophobicContact CB-CD1 3.79Å; E44-L49 HydrophobicContact CG-CD1 3.95Å; L49-M58 HydrophobicContact CD2-CE 3.96Å; L49-K59 CarbonylContact O-C 3.57Å; L49-K59 WeakPolarHBondContact O-CA 3.35Å; L49-I60 HydrophobicContact CB-CB 4.05Å; L49-I60 HydrophobicContact CB-CD1 4.49Å; L49-I60 HydrophobicContact CB-CG1 4.26Å; L49-I60 HydrophobicContact CD2-CD1 3.72Å; L49-I60 HydrophobicContact CD2-CG1 4.17Å; L49-I60 PolarHBondContact N-O 2.71Å; L49-I60 PolarHBondContact O-N 2.93Å; L49-P209 HydrophobicContact CD2-CG 4.43Å; L49-W212 HydrophobicContact CB-CH2 4.17Å; L49-W212 HydrophobicContact CB-CZ2 3.65Å
50	Y	96.8	Very high	93.5	Very high	57 Å²	57	43.8 Å²	43.8	22%	0.224	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.3	164.3	-177.6	-112.2	0	0	0	109.3	I42 I43 H52 M58 K59	I42-Y50 HydrophobicContact CB-CD1 3.88Å; I42-Y50 HydrophobicContact CB-CE1 4.49Å; I42-Y50 HydrophobicContact CG1-CD1 4.07Å; I42-Y50 HydrophobicContact CG1-CE1 4.26Å; I42-Y50 HydrophobicContact CG2-CD1 4.18Å; I42-Y50 PolarHBondContact N-O 3.22Å; I43-Y50 PolarHBondContact N-O 3.16Å; I43-Y50 PolarHBondContact O-N 2.02Å; Y50-H52 AromaticContact CE1-CD2 3.9Å; Y50-H52 AromaticContact CE1-NE2 3.28Å; Y50-H52 VanDerWaalsContact CE1-NE2 3.28Å; Y50-H52 WeakPolarHBondContact CE1-NE2 3.42Å; Y50-H52 AromaticContact CZ-CD2 3.84Å; Y50-H52 AromaticContact CZ-NE2 3.38Å; Y50-H52 PolarHBondContact OH-NE2 3.09Å; Y50-M58 WeakPolarHBondContact CA-O 3.32Å; Y50-K59 HydrophobicContact CD2-CB 4.07Å
51	S	93.9	Very high	94	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	153.5	-176.5	55.1	0	0	0	0	110.7	N40 H53 S57 M58	N40-S51 CarbonylContact O-C 3.46Å; N40-S51 VanDerWaalsContact O-CA 3.28Å; N40-S51 WeakPolarHBondContact O-CA 3.44Å; S51-H53 PolarHBondContact OG-NE2 3.4Å; S51-S57 WeakPolarHBondContact O-CA 3.5Å; S51-M58 PolarHBondContact N-O 3.19Å; S51-M58 PolarHBondContact O-N 3.18Å; S51-M58 WeakPolarHBondContact OG-CE 3.36Å
52	H	90.2	Very high	94.3	Very high	22 Å²	22	44.2 Å²	44.2	10%	0.102	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	136.4	173.9	-62.7	162.2	0	0	0	110.1	Y38 E39 N40 Y50 F248	Y38-H52 HydrophobicContact CE1-CB 4.35Å; E39-H52 CarbonylContact C-O 3.49Å; E39-H52 WeakPolarHBondContact CA-O 2.92Å; N40-H52 HydrophobicContact CB-CB 4.41Å; N40-H52 PolarHBondContact N-O 3.48Å; N40-H52 PolarHBondContact O-N 3.24Å; Y50-H52 AromaticContact CE1-CD2 3.9Å; Y50-H52 AromaticContact CE1-NE2 3.28Å; Y50-H52 VanDerWaalsContact CE1-NE2 3.28Å; Y50-H52 WeakPolarHBondContact CE1-NE2 3.42Å; Y50-H52 AromaticContact CZ-CD2 3.84Å; Y50-H52 AromaticContact CZ-NE2 3.38Å; Y50-H52 PolarHBondContact OH-NE2 3.09Å; H52-F248 HydrophobicContact CB-CE1 3.52Å; H52-F248 HydrophobicContact CB-CZ 3.64Å; H52-F248 AromaticContact CD2-CZ 3.67Å; H52-F248 AromaticContact CE1-CZ 3.5Å; H52-F248 VanDerWaalsContact CE1-CZ 3.5Å; H52-F248 WeakPolarHBondContact CE1-CZ 3Å; H52-F248 AromaticContact CG-CE1 3.59Å; H52-F248 AromaticContact CG-CZ 3.27Å; H52-F248 AromaticContact ND1-CE1 3.42Å; H52-F248 WeakPolarHBondContact ND1-CE1 3.45Å; H52-F248 AromaticContact ND1-CZ 3.16Å; H52-F248 WeakPolarHBondContact ND1-CZ 3.47Å; H52-F248 AromaticContact NE2-CZ 3.79Å
53	H	89.8	Confident	94.6	Very high	10 Å²	10	46.5 Å²	46.5	5%	0.046	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	172.3	-179.8	-64	-95.8	0	0	0	108.7	Y38 E39 S51 K55 Y56 I206	Y38-H53 WeakPolarHBondContact O-CA 3.26Å; E39-H53 IonicContact OE1-CE1 3.85Å; E39-H53 IonicContact OE2-CE1 2.54Å; S51-H53 PolarHBondContact OG-NE2 3.4Å; H53-K55 PolarHBondContact O-N 3.34Å; H53-Y56 CarbonylContact C-O 3.51Å; H53-Y56 WeakPolarHBondContact CA-O 3.33Å; H53-Y56 WeakPolarHBondContact CB-O 3.41Å; H53-Y56 PolarHBondContact N-O 3.47Å; H53-Y56 PolarHBondContact O-N 3.38Å; H53-Y56 VanDerWaalsContact O-N 3.13Å; H53-Y56 VanDerWaalsContact O-O 3.05Å; H53-I206 HydrophobicContact CB-CD1 3.64Å; H53-I206 HydrophobicContact CB-CG1 3.83Å; H53-I206 HydrophobicContact CB-CG2 4.14Å
54	Y	85.3	Confident	94.7	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.016	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	117.7	176.4	-178.4	-111.9	0	0	0	111.6	N27 I29 L35 Y56 I194 F204 F227	N27-Y54 PolarHBondContact O-OH 3.25Å; N27-Y54 VanDerWaalsContact O-OH 3.13Å; I29-Y54 HydrophobicContact CB-CE1 3.96Å; I29-Y54 HydrophobicContact CB-CE2 4.47Å; I29-Y54 HydrophobicContact CD1-CE1 4.38Å; I29-Y54 HydrophobicContact CG2-CE1 4.03Å; I29-Y54 WeakPolarHBondContact CG2-OH 3.4Å; I29-Y54 PolarHBondContact N-OH 3.43Å; I29-Y54 VanDerWaalsContact N-OH 3.12Å; L35-Y54 HydrophobicContact CB-CD2 3.79Å; L35-Y54 HydrophobicContact CB-CE2 4.04Å; L35-Y54 HydrophobicContact CB-CG 4.35Å; L35-Y54 HydrophobicContact CD1-CD2 4.29Å; L35-Y54 HydrophobicContact CD1-CE2 3.88Å; L35-Y54 HydrophobicContact CD2-CD2 4.32Å; L35-Y54 HydrophobicContact CG-CD2 4.38Å; L35-Y54 HydrophobicContact CG-CE2 4.44Å; L35-Y54 VanDerWaalsContact O-CB 3.26Å; L35-Y54 WeakPolarHBondContact O-CB 3.08Å; Y54-Y56 PolarHBondContact O-N 3.36Å; Y54-I194 HydrophobicContact CE1-CG1 4.09Å; Y54-F204 HydrophobicContact CD1-CB 4.19Å; Y54-F204 AromaticContact CD1-CD1 3.66Å; Y54-F204 HydrophobicContact CD1-CD1 3.66Å; Y54-F204 HydrophobicContact CD1-CD2 4.3Å; Y54-F204 HydrophobicContact CD1-CE1 4.26Å; Y54-F204 AromaticContact CD1-CG 3.73Å; Y54-F204 HydrophobicContact CD1-CG 3.73Å; Y54-F204 AromaticContact CE1-CD1 3.83Å; Y54-F204 HydrophobicContact CE1-CD1 3.83Å; Y54-F204 HydrophobicContact CE1-CE1 4.29Å; Y54-F204 HydrophobicContact CE1-CG 4.36Å; Y54-F227 HydrophobicContact CD2-CZ 4.45Å
55	K	83.6	Confident	94.7	Very high	47 Å²	47	46.2 Å²	46.2	20%	0.204	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	-3.6	-175	-65.9	-173.9	169.3	-166.9	0	116.7	H53 H92 I194 I224 F227	H53-K55 PolarHBondContact O-N 3.34Å; K55-H92 HydrophobicContact CD-CB 4.49Å; K55-I194 HydrophobicContact CD-CD1 4.19Å; K55-I224 PolarHBondContact O-N 3.23Å; K55-F227 HydrophobicContact CG-CE2 3.94Å
56	Y	90.6	Very high	94.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	142.4	-170.7	-85	-107.4	0	0	0	113.1	H53 Y54 H92 L190 I206 F221 Q222 A223 I224	H53-Y56 CarbonylContact C-O 3.51Å; H53-Y56 WeakPolarHBondContact CA-O 3.33Å; H53-Y56 WeakPolarHBondContact CB-O 3.41Å; H53-Y56 PolarHBondContact N-O 3.47Å; H53-Y56 PolarHBondContact O-N 3.38Å; H53-Y56 VanDerWaalsContact O-N 3.13Å; H53-Y56 VanDerWaalsContact O-O 3.05Å; Y54-Y56 PolarHBondContact O-N 3.36Å; Y56-H92 AromaticContact CD2-CE1 3.26Å; Y56-H92 WeakPolarHBondContact CD2-CE1 3.38Å; Y56-H92 AromaticContact CD2-ND1 3.21Å; Y56-H92 WeakPolarHBondContact CD2-ND1 3.28Å; Y56-H92 HydrophobicContact CE2-CB 4.32Å; Y56-H92 AromaticContact CE2-CE1 2.96Å; Y56-H92 WeakPolarHBondContact CE2-CE1 3.49Å; Y56-H92 AromaticContact CE2-CG 3.6Å; Y56-H92 AromaticContact CE2-ND1 2.72Å; Y56-H92 WeakPolarHBondContact CE2-ND1 3.41Å; Y56-H92 AromaticContact CE2-NE2 3.95Å; Y56-H92 AromaticContact CZ-CE1 3.25Å; Y56-H92 AromaticContact CZ-ND1 3.41Å; Y56-H92 AromaticContact CZ-NE2 3.88Å; Y56-H92 PolarHBondContact OH-N 3.06Å; Y56-L190 HydrophobicContact CD1-CD2 3.56Å; Y56-L190 HydrophobicContact CE1-CD2 3.51Å; Y56-L190 HydrophobicContact CG-CD2 4.04Å; Y56-I206 VanDerWaalsContact CB-CD1 3.44Å; Y56-I206 HydrophobicContact CG-CD1 4.03Å; Y56-F221 HydrophobicContact CD1-CB 3.94Å; Y56-F221 HydrophobicContact CE1-CB 4.38Å; Y56-Q222 WeakPolarHBondContact CA-O 3.34Å; Y56-A223 HydrophobicContact CE1-CB 4.24Å; Y56-A223 HydrophobicContact CE2-CB 4Å; Y56-I224 VanDerWaalsContact O-CD1 3.23Å; Y56-I224 WeakPolarHBondContact O-CD1 3.41Å
57	S	92.9	Very high	94.6	Very high	13 Å²	13	41.8 Å²	41.8	9%	0.091	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	141.8	163.9	60.7	0	0	0	0	108.8	S51 F221 Q222	S51-S57 WeakPolarHBondContact O-CA 3.5Å; S57-F221 WeakPolarHBondContact O-CA 3.5Å; S57-Q222 PolarHBondContact N-O 3.21Å; S57-Q222 PolarHBondContact O-N 2.84Å; S57-Q222 PolarHBondContact OG-O 3.29Å
58	M	96.9	Very high	94.5	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.9	173.6	179.9	176.9	64.6	0	0	108.8	L49 Y50 S51 I60 I206 V219 E220 F221	L49-M58 HydrophobicContact CD2-CE 3.96Å; Y50-M58 WeakPolarHBondContact CA-O 3.32Å; S51-M58 PolarHBondContact N-O 3.19Å; S51-M58 PolarHBondContact O-N 3.18Å; S51-M58 WeakPolarHBondContact OG-CE 3.36Å; M58-I60 HydrophobicContact CE-CD1 4.11Å; M58-I60 HydrophobicContact CG-CG1 4.14Å; M58-I60 HydrophobicContact SD-CD1 4.12Å; M58-I60 HydrophobicContact SD-CG1 4.36Å; M58-I206 HydrophobicContact SD-CG2 4.36Å; M58-V219 HydrophobicContact CG-CG1 3.95Å; M58-V219 HydrophobicContact SD-CG1 4.11Å; M58-E220 WeakPolarHBondContact CA-O 3.33Å; M58-F221 HydrophobicContact CB-CD1 4.14Å; M58-F221 HydrophobicContact CB-CE1 4.14Å; M58-F221 HydrophobicContact CG-CD1 4.14Å; M58-F221 HydrophobicContact CG-CE1 3.79Å; M58-F221 HydrophobicContact CG-CZ 4.43Å; M58-F221 HydrophobicContact SD-CE1 3.61Å; M58-F221 HydrophobicContact SD-CZ 4.02Å
59	K	98	Very high	94.4	Very high	58 Å²	58	39.1 Å²	39.1	25%	0.252	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.9	175.2	178.1	172.2	163	-117.8	0	109.1	Y48 L49 Y50 Q61 V219 E220	Y48-K59 HydrophobicContact CE2-CD 4.3Å; Y48-K59 HydrophobicContact CE2-CG 4.02Å; L49-K59 CarbonylContact O-C 3.57Å; L49-K59 WeakPolarHBondContact O-CA 3.35Å; Y50-K59 HydrophobicContact CD2-CB 4.07Å; K59-Q61 HydrophobicContact CG-CG 4.49Å; K59-V219 CarbonylContact O-C 3.49Å; K59-V219 WeakPolarHBondContact O-CA 3.49Å; K59-E220 HydrophobicContact CB-CB 4.38Å; K59-E220 PolarHBondContact N-O 2.75Å; K59-E220 IonicContact NZ-OE2 3.15Å; K59-E220 PolarHBondContact NZ-OE2 2.82Å; K59-E220 PolarHBondContact O-N 3.4Å
60	I	98.5	Very high	94.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.7	176.8	-48.5	-171.7	0	0	0	109.1	Y48 L49 M58 V208 W212 T217 L218 V219	Y48-I60 WeakPolarHBondContact CA-O 3.32Å; L49-I60 HydrophobicContact CB-CB 4.05Å; L49-I60 HydrophobicContact CB-CD1 4.49Å; L49-I60 HydrophobicContact CB-CG1 4.26Å; L49-I60 HydrophobicContact CD2-CD1 3.72Å; L49-I60 HydrophobicContact CD2-CG1 4.17Å; L49-I60 PolarHBondContact N-O 2.71Å; L49-I60 PolarHBondContact O-N 2.93Å; M58-I60 HydrophobicContact CE-CD1 4.11Å; M58-I60 HydrophobicContact CG-CG1 4.14Å; M58-I60 HydrophobicContact SD-CD1 4.12Å; M58-I60 HydrophobicContact SD-CG1 4.36Å; I60-V208 HydrophobicContact CD1-CG1 4.13Å; I60-W212 HydrophobicContact CB-CD2 4.3Å; I60-W212 HydrophobicContact CB-CE3 4.2Å; I60-W212 HydrophobicContact CD1-CB 3.89Å; I60-W212 HydrophobicContact CD1-CD2 4.18Å; I60-W212 HydrophobicContact CD1-CG 3.68Å; I60-W212 HydrophobicContact CG2-CB 4.01Å; I60-W212 HydrophobicContact CG2-CD2 3.76Å; I60-W212 HydrophobicContact CG2-CE3 3.43Å; I60-W212 VanDerWaalsContact CG2-CE3 3.43Å; I60-W212 HydrophobicContact CG2-CG 4.01Å; I60-W212 HydrophobicContact CG2-CZ3 4.13Å; I60-T217 HydrophobicContact CG2-CG2 3.39Å; I60-L218 CarbonylContact C-O 3.57Å; I60-L218 WeakPolarHBondContact CA-O 3.26Å; I60-V219 HydrophobicContact CD1-CG2 4.26Å; I60-V219 HydrophobicContact CG1-CG1 4.22Å; I60-V219 HydrophobicContact CG1-CG2 4.12Å; I60-V219 HydrophobicContact CG2-CG2 4.12Å
61	Q	98.5	Very high	94.2	Very high	47 Å²	47	44.8 Å²	44.8	22%	0.22	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	130.3	176.4	-66.3	-174.4	-112.5	0	0	110.7	T47 Y48 K59 Q64 T217 L218	T47-Q61 WeakPolarHBondContact O-CA 3.09Å; Y48-Q61 HydrophobicContact CD2-CG 3.86Å; Y48-Q61 HydrophobicContact CE2-CG 4.06Å; K59-Q61 HydrophobicContact CG-CG 4.49Å; Q61-Q64 HydrophobicContact CB-CG 3.73Å; Q61-Q64 WeakPolarHBondContact O-CG 2.94Å; Q61-T217 WeakPolarHBondContact O-CA 3.46Å; Q61-T217 WeakPolarHBondContact O-CG2 3.02Å; Q61-L218 PolarHBondContact N-O 3Å; Q61-L218 PolarHBondContact O-N 3.47Å
62	R	97.5	Very high	94.3	Very high	67 Å²	67	49 Å²	49	25%	0.253	25%	0.253	S	S	.	.	S	Bend	trans	-90	166.4	173	-68	-179	67	-148.2	-6.5	111.8	D46 T47 Q64 W212 G216 T217	D46-R62 WeakPolarHBondContact O-CD 2.93Å; D46-R62 PolarHBondContact O-NH1 2.02Å; T47-R62 PolarHBondContact O-N 3.13Å; R62-Q64 PolarHBondContact O-N 3.07Å; R62-Q64 PolarHBondContact O-NE2 2.86Å; R62-W212 HydrophobicContact CG-CE3 3.81Å; R62-W212 HydrophobicContact CG-CZ3 3.69Å; R62-G216 CarbonylContact C-O 3.59Å; R62-T217 HydrophobicContact CG-CG2 4.11Å
63	H	96.5	Very high	94.7	Very high	137 Å²	137	48.7 Å²	48.7	63%	0.634	25%	0.252	S	S	*	.	S	Bend	trans	58.4	31.9	176.7	-50.9	-68.5	0	0	0	113.6	G216	H63-G216 PolarHBondContact N-O 3.33Å
64	Q	97.9	Very high	95	Very high	64 Å²	64	54.1 Å²	54.1	30%	0.299	28%	0.281	S	S	.	.	P	Polyproline II helix	trans	-83.4	146.7	176	-58.4	-56	-68.3	0	0	110.2	Q61 R62 Y173 G216 L218	Q61-Q64 HydrophobicContact CB-CG 3.73Å; Q61-Q64 WeakPolarHBondContact O-CG 2.94Å; R62-Q64 PolarHBondContact O-N 3.07Å; R62-Q64 PolarHBondContact O-NE2 2.86Å; Q64-Y173 HydrophobicContact CB-CE2 4.26Å; Q64-Y173 PolarHBondContact O-OH 3.35Å; Q64-Y173 VanDerWaalsContact O-OH 3.11Å; Q64-G216 PolarHBondContact N-O 3.31Å; Q64-L218 HydrophobicContact CB-CB 4.12Å; Q64-L218 HydrophobicContact CG-CB 3.83Å
65	S	96.2	Very high	95.5	Very high	102 Å²	102	56.4 Å²	56.4	71%	0.713	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-71	161.9	167	55.2	0	0	0	0	110.6
66	Q	94.7	Very high	96.1	Very high	64 Å²	64	60.5 Å²	60.5	30%	0.299	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-58.2	127.3	173.9	-165.2	-178.6	9.9	0	0	109.8	V68 S70 Y173 D175	Q66-V68 VanDerWaalsContact C-N 3.26Å; Q66-V68 WeakPolarHBondContact CG-O 3.5Å; Q66-V68 PolarHBondContact NE2-O 3.18Å; Q66-V68 PolarHBondContact O-N 3.37Å; Q66-S70 PolarHBondContact NE2-OG 2.03Å; Q66-S70 PolarHBondContact OE1-OG 3.27Å; Q66-Y173 HydrophobicContact CB-CE1 3.95Å; Q66-Y173 HydrophobicContact CG-CD1 4.22Å; Q66-Y173 HydrophobicContact CG-CE1 3.83Å; Q66-Y173 PolarHBondContact N-OH 2.86Å; Q66-D175 VanDerWaalsContact CD-OD1 3.25Å; Q66-D175 WeakPolarHBondContact CG-OD1 2.99Å; Q66-D175 PolarHBondContact NE2-OD1 2.86Å
67	P	95	Very high	96.3	Very high	57 Å²	57	60.6 Å²	60.6	37%	0.37	31%	0.311	S	S	.	.	S	Bend	trans	-70.9	-23.8	-176.5	26.8	-34.7	0	0	0	112.8	L163 Y173	P67-L163 HydrophobicContact CB-CD1 4.05Å; P67-L163 HydrophobicContact CG-CD1 3.8Å; P67-Y173 VanDerWaalsContact CD-CG 3.45Å; P67-Y173 HydrophobicContact CG-CD1 4.38Å; P67-Y173 HydrophobicContact CG-CD2 4.48Å; P67-Y173 HydrophobicContact CG-CG 4.03Å
68	V	95.6	Very high	96.3	Very high	4 Å²	4	65.9 Å²	65.9	2%	0.024	34%	0.339	C	S	.	.	S	Bend	trans	-144.1	128.4	-176.4	-177	0	0	0	0	109.4	Q66 R72 F73 L135 L140 L163	Q66-V68 VanDerWaalsContact C-N 3.26Å; Q66-V68 WeakPolarHBondContact CG-O 3.5Å; Q66-V68 PolarHBondContact NE2-O 3.18Å; Q66-V68 PolarHBondContact O-N 3.37Å; V68-R72 HydrophobicContact CG1-CB 4.08Å; V68-R72 HydrophobicContact CG1-CG 4.42Å; V68-F73 HydrophobicContact CB-CE2 4.09Å; V68-F73 HydrophobicContact CB-CZ 4.44Å; V68-F73 HydrophobicContact CG1-CE2 3.87Å; V68-F73 HydrophobicContact CG1-CZ 4.36Å; V68-L135 HydrophobicContact CG1-CD1 4.24Å; V68-L140 HydrophobicContact CG2-CD2 3.52Å; V68-L163 HydrophobicContact CG2-CD1 3.7Å; V68-L163 HydrophobicContact CG2-CD2 4.06Å
69	P	95.9	Very high	96.1	Very high	66 Å²	66	67.6 Å²	67.6	43%	0.429	36%	0.356	S	S	.	.			trans	-53.3	140.3	173.7	-27.2	34.7	0	0	0	113	D71 R72	P69-D71 VanDerWaalsContact C-N 3.3Å; P69-D71 WeakPolarHBondContact CB-OD1 3.36Å; P69-D71 PolarHBondContact O-N 3.15Å; P69-R72 HydrophobicContact CB-CG 4.3Å; P69-R72 WeakPolarHBondContact O-CB 3.17Å; P69-R72 PolarHBondContact O-N 2.88Å
70	S	94.7	Very high	96	Very high	49 Å²	49	68.7 Å²	68.7	34%	0.343	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-64.3	-31.8	-172	-66.7	0	0	0	0	114.3	Q66 R72 F73 K144	Q66-S70 PolarHBondContact NE2-OG 2.03Å; Q66-S70 PolarHBondContact OE1-OG 3.27Å; S70-R72 PolarHBondContact O-N 3.11Å; S70-F73 PolarHBondContact O-N 2.83Å; S70-K144 VanDerWaalsContact CB-NZ 3.34Å; S70-K144 PolarHBondContact OG-NZ 3.03Å
71	D	95.3	Very high	95.9	Very high	129 Å²	129	71 Å²	71	69%	0.69	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-67.5	-18.2	179.5	57.2	-55.1	0	0	0	113.5	P69 F73	P69-D71 VanDerWaalsContact C-N 3.3Å; P69-D71 WeakPolarHBondContact CB-OD1 3.36Å; P69-D71 PolarHBondContact O-N 3.15Å; D71-F73 VanDerWaalsContact C-N 3.28Å; D71-F73 PolarHBondContact O-N 3.35Å
72	R	97.2	Very high	95.7	Very high	89 Å²	89	71.1 Å²	71.1	34%	0.336	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-72.9	-21	174.9	-59.8	-178.2	67	-175.1	19.1	113	V68 P69 S70 N74 L135 E137	V68-R72 HydrophobicContact CG1-CB 4.08Å; V68-R72 HydrophobicContact CG1-CG 4.42Å; P69-R72 HydrophobicContact CB-CG 4.3Å; P69-R72 WeakPolarHBondContact O-CB 3.17Å; P69-R72 PolarHBondContact O-N 2.88Å; S70-R72 PolarHBondContact O-N 3.11Å; R72-N74 PolarHBondContact O-N 3.4Å; R72-N74 VanDerWaalsContact O-N 3.12Å; R72-L135 HydrophobicContact CB-CD1 3.45Å; R72-L135 VanDerWaalsContact CB-CD1 3.45Å; R72-L135 WeakPolarHBondContact O-CD1 3.42Å; R72-E137 IonicContact CZ-OE1 3.24Å; R72-E137 IonicContact CZ-OE2 2.81Å; R72-E137 VanDerWaalsContact CZ-OE2 3.26Å; R72-E137 IonicContact NE-OE1 2.7Å; R72-E137 PolarHBondContact NE-OE1 3.4Å; R72-E137 IonicContact NE-OE2 2.88Å; R72-E137 IonicContact NH1-OE2 2.71Å; R72-E137 IonicContact NH2-OE1 3.95Å; R72-E137 PolarHBondContact NH2-OE1 3.36Å; R72-E137 IonicContact NH2-OE2 2.99Å; R72-E137 PolarHBondContact NH2-OE2 3.24Å
73	F	97.6	Very high	95.6	Very high	15 Å²	15	68 Å²	68	7%	0.066	37%	0.367	C	S	.	.			trans	-82.9	84.1	172.7	-63.1	-93.8	0	0	0	109.3	V68 S70 D71 A133 L135 K144 T161 L163	V68-F73 HydrophobicContact CB-CE2 4.09Å; V68-F73 HydrophobicContact CB-CZ 4.44Å; V68-F73 HydrophobicContact CG1-CE2 3.87Å; V68-F73 HydrophobicContact CG1-CZ 4.36Å; S70-F73 PolarHBondContact O-N 2.83Å; D71-F73 VanDerWaalsContact C-N 3.28Å; D71-F73 PolarHBondContact O-N 3.35Å; F73-A133 HydrophobicContact CB-CB 3.9Å; F73-A133 WeakPolarHBondContact CD1-O 3.46Å; F73-A133 WeakPolarHBondContact O-CB 3.4Å; F73-L135 HydrophobicContact CD1-CB 3.63Å; F73-L135 HydrophobicContact CE1-CB 3.64Å; F73-L135 HydrophobicContact CG-CB 4.26Å; F73-L135 HydrophobicContact CZ-CB 4.25Å; F73-K144 HydrophobicContact CB-CB 4.2Å; F73-K144 HydrophobicContact CD1-CB 3.58Å; F73-K144 HydrophobicContact CD2-CB 4.04Å; F73-K144 HydrophobicContact CD2-CD 4.12Å; F73-K144 HydrophobicContact CE1-CB 3.88Å; F73-K144 HydrophobicContact CE2-CB 4.31Å; F73-K144 HydrophobicContact CE2-CD 4.49Å; F73-K144 HydrophobicContact CG-CB 3.67Å; F73-K144 HydrophobicContact CG-CD 4.43Å; F73-K144 HydrophobicContact CZ-CB 4.24Å; F73-T161 HydrophobicContact CE1-CG2 4.02Å; F73-T161 HydrophobicContact CE2-CG2 4.15Å; F73-T161 HydrophobicContact CZ-CG2 3.39Å; F73-L163 HydrophobicContact CE1-CD2 4.39Å; F73-L163 HydrophobicContact CZ-CD2 3.93Å
74	N	95.9	Very high	95.4	Very high	125 Å²	125	67.5 Å²	67.5	67%	0.668	36%	0.36	S	S	*	.			trans	-110.6	-3.8	-167.9	61.5	2.8	0	0	0	114.2	R72 V134	R72-N74 PolarHBondContact O-N 3.4Å; R72-N74 VanDerWaalsContact O-N 3.12Å; N74-V134 PolarHBondContact N-O 2.02Å
75	I	97.1	Very high	95.1	Very high	51 Å²	51	65.6 Å²	65.6	26%	0.262	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	108.8	179	-60.9	161.2	0	0	0	109.6	A133 V134 D136	I75-A133 CarbonylContact O-C 3.46Å; I75-A133 VanDerWaalsContact O-CA 3.23Å; I75-A133 WeakPolarHBondContact O-CA 3.41Å; I75-V134 HydrophobicContact CB-CB 4.11Å; I75-V134 HydrophobicContact CG2-CB 4.43Å; I75-V134 PolarHBondContact N-O 3.25Å; I75-V134 PolarHBondContact O-N 3.34Å; I75-D136 HydrophobicContact CD1-CB 3.94Å
76	K	95.6	Very high	94.6	Very high	134 Å²	134	67.5 Å²	67.5	58%	0.583	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	137.5	175.2	-173.7	179.6	177	-172.9	0	111.2
77	I	94.9	Very high	94.1	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	34%	0.342	C	S	.	.			trans	-87.6	129.8	172.3	-47.1	-176	0	0	0	109.7	H81 F101 E103 S132 V134 V143	I77-H81 HydrophobicContact CG1-CB 4.16Å; I77-H81 HydrophobicContact CG2-CB 4.07Å; I77-F101 HydrophobicContact CD1-CB 3.72Å; I77-E103 HydrophobicContact CB-CB 4.25Å; I77-E103 HydrophobicContact CG2-CB 3.81Å; I77-S132 PolarHBondContact N-O 3Å; I77-V134 HydrophobicContact CD1-CG2 3.62Å; I77-V134 HydrophobicContact CG1-CG2 3.68Å; I77-V143 HydrophobicContact CD1-CG2 3.89Å
78	N	91.7	Very high	93.4	Very high	125 Å²	125	69.1 Å²	69.1	67%	0.668	36%	0.362	S	S	*	.	S	Bend	trans	-118.7	98.9	166.7	-63.9	-28.1	0	0	0	107.5	I80	N78-I80 PolarHBondContact O-N 2.99Å
79	G	94.1	Very high	92.6	Very high	35 Å²	35	69 Å²	69	36%	0.361	36%	0.361	S	S	.	.	S	Bend	trans	76	-76.3	-172.9	0	0	0	0	0	113.5	E103	G79-E103 PolarHBondContact N-OE2 3.37Å; G79-E103 PolarHBondContact O-N 3.14Å
80	I	95.1	Very high	91.7	Very high	82 Å²	82	67.8 Å²	67.8	42%	0.421	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	134.9	-178.3	-50	175.7	0	0	0	110	N78 M100 F101 Y102	N78-I80 PolarHBondContact O-N 2.99Å; I80-M100 HydrophobicContact CD1-CE 4.12Å; I80-M100 HydrophobicContact CG2-CB 4.13Å; I80-M100 HydrophobicContact CG2-CE 3.75Å; I80-F101 WeakPolarHBondContact CA-O 3.28Å; I80-Y102 HydrophobicContact CD1-CD1 3.88Å; I80-Y102 HydrophobicContact CD1-CE1 3.41Å; I80-Y102 VanDerWaalsContact CD1-CE1 3.41Å; I80-Y102 HydrophobicContact CG1-CD1 3.7Å; I80-Y102 HydrophobicContact CG1-CE1 3.79Å; I80-Y102 HydrophobicContact CG1-CG 4.47Å
81	H	96.1	Very high	90.9	Very high	48 Å²	48	65.8 Å²	65.8	22%	0.222	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.9	169.2	-171.4	76.7	0	0	0	109.9	I77 F101 V134	I77-H81 HydrophobicContact CG1-CB 4.16Å; I77-H81 HydrophobicContact CG2-CB 4.07Å; H81-F101 PolarHBondContact N-O 3.11Å; H81-F101 PolarHBondContact O-N 3.19Å; H81-V134 HydrophobicContact CB-CG2 4.31Å
82	T	95.7	Very high	90	Very high	49 Å²	49	60.3 Å²	60.3	30%	0.301	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.2	-179.2	-57.9	0	0	0	0	109.9	Y84 K98 I99 M100	T82-Y84 HydrophobicContact CG2-CD2 4.46Å; T82-Y84 HydrophobicContact CG2-CE2 3.81Å; T82-K98 HydrophobicContact CG2-CB 4.12Å; T82-K98 HydrophobicContact CG2-CD 3.94Å; T82-I99 WeakPolarHBondContact CA-O 3.36Å; T82-M100 HydrophobicContact CG2-CG 4.22Å
83	V	94.4	Very high	89	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.006	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	142.5	175.5	176.9	0	0	0	0	109.9	K98 I99 F101 V134 D136 I141	V83-K98 CarbonylContact O-C 3.44Å; V83-K98 VanDerWaalsContact O-CA 3.28Å; V83-K98 WeakPolarHBondContact O-CA 3.34Å; V83-K98 WeakPolarHBondContact O-CB 3.46Å; V83-I99 PolarHBondContact N-O 2.98Å; V83-I99 PolarHBondContact O-N 3.46Å; V83-F101 HydrophobicContact CB-CE2 4.17Å; V83-F101 HydrophobicContact CG2-CD2 3.94Å; V83-F101 HydrophobicContact CG2-CE2 3.76Å; V83-V134 HydrophobicContact CG2-CG1 3.99Å; V83-D136 HydrophobicContact CG1-CB 4.35Å; V83-D136 VanDerWaalsContact CG1-CG 3.48Å; V83-D136 WeakPolarHBondContact CG1-OD1 3.44Å; V83-D136 HydrophobicContact CG2-CB 4.14Å; V83-I141 HydrophobicContact CB-CG2 4.25Å; V83-I141 HydrophobicContact CG1-CD1 3.44Å; V83-I141 VanDerWaalsContact CG1-CD1 3.44Å; V83-I141 HydrophobicContact CG1-CG1 3.87Å; V83-I141 HydrophobicContact CG1-CG2 3.82Å; V83-I141 HydrophobicContact CG2-CG2 4.39Å
84	Y	93.6	Very high	88.1	Confident	128 Å²	128	60 Å²	60	50%	0.502	33%	0.334	S	S	.	.			trans	-113.8	105.7	172.9	-63.4	-88.7	0	0	0	108.5	T82 Q86 H97 K98	T82-Y84 HydrophobicContact CG2-CD2 4.46Å; T82-Y84 HydrophobicContact CG2-CE2 3.81Å; Y84-Q86 PolarHBondContact O-N 3.13Å; Y84-H97 WeakPolarHBondContact CD1-O 3.23Å; Y84-H97 AromaticContact CE1-NE2 3.87Å; Y84-K98 HydrophobicContact CD1-CB 3.81Å; Y84-K98 HydrophobicContact CE1-CB 3.74Å; Y84-K98 HydrophobicContact CE1-CD 4.32Å
85	P	90.7	Very high	87.7	Confident	23 Å²	23	59.9 Å²	59.9	15%	0.149	33%	0.329	C	S	.	.			trans	-53.2	128.7	179.4	-27	35	0	0	0	113	F87 V96 I99 I141	P85-F87 HydrophobicContact CB-CD1 4.41Å; P85-F87 HydrophobicContact CB-CD2 4.21Å; P85-F87 HydrophobicContact CB-CE1 4.34Å; P85-F87 HydrophobicContact CB-CE2 4.15Å; P85-F87 HydrophobicContact CB-CG 4.41Å; P85-F87 HydrophobicContact CB-CZ 4.24Å; P85-F87 PolarHBondContact O-N 3.27Å; P85-V96 HydrophobicContact CG-CG1 4.08Å; P85-I99 HydrophobicContact CG-CD1 3.8Å; P85-I141 HydrophobicContact CB-CD1 3.83Å; P85-I141 HydrophobicContact CG-CD1 3.8Å
86	Q	86.7	Confident	87.3	Confident	142 Å²	142	58.2 Å²	58.2	66%	0.664	32%	0.321	S	S	*	.	S	Bend	trans	-83.7	8.9	173.4	-58.8	-177.5	25.1	0	0	112.3	Y84	Y84-Q86 PolarHBondContact O-N 3.13Å
87	F	84.1	Confident	87.2	Confident	28 Å²	28	54.2 Å²	54.2	12%	0.123	30%	0.304	C	S	.	.	S	Bend	trans	-131.1	154.2	-180	53.9	-98.5	0	0	0	110.2	P85 C89 E138 I141 I164 H165 P166	P85-F87 HydrophobicContact CB-CD1 4.41Å; P85-F87 HydrophobicContact CB-CD2 4.21Å; P85-F87 HydrophobicContact CB-CE1 4.34Å; P85-F87 HydrophobicContact CB-CE2 4.15Å; P85-F87 HydrophobicContact CB-CG 4.41Å; P85-F87 HydrophobicContact CB-CZ 4.24Å; P85-F87 PolarHBondContact O-N 3.27Å; F87-C89 HydrophobicContact CD2-CB 3.79Å; F87-C89 HydrophobicContact CE2-CB 3.65Å; F87-C89 VanDerWaalsContact CE2-SG 3.53Å; F87-C89 PolarHBondContact O-N 2.99Å; F87-E138 VanDerWaalsContact CD1-O 3.25Å; F87-E138 WeakPolarHBondContact CD1-O 3.45Å; F87-I141 HydrophobicContact CE1-CD1 3.66Å; F87-I141 HydrophobicContact CE1-CG1 3.99Å; F87-I141 HydrophobicContact CZ-CD1 3.83Å; F87-I141 HydrophobicContact CZ-CG1 4.25Å; F87-I164 HydrophobicContact CE2-CG2 4.45Å; F87-I164 HydrophobicContact CZ-CG2 4.49Å; F87-H165 WeakPolarHBondContact CE2-O 3.39Å; F87-P166 HydrophobicContact CB-CB 4.22Å; F87-P166 HydrophobicContact CD1-CG 4.4Å; F87-P166 VanDerWaalsContact CD2-CA 3.41Å; F87-P166 HydrophobicContact CD2-CB 4.13Å; F87-P166 HydrophobicContact CD2-CG 4.49Å; F87-P166 HydrophobicContact CG-CB 4.14Å; F87-P166 HydrophobicContact CG-CG 4.27Å
88	T	78.7	Confident	87.1	Confident	127 Å²	127	55.7 Å²	55.7	78%	0.779	31%	0.31	S	S	*	.			trans	-80.5	100.5	175	51.1	0	0	0	0	110.1
89	C	80	Confident	87.2	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.014	28%	0.279	C	S	.	.			trans	-109.9	149.3	166.1	58.5	0	0	0	0	111.4	F87 V96	F87-C89 HydrophobicContact CD2-CB 3.79Å; F87-C89 HydrophobicContact CE2-CB 3.65Å; F87-C89 VanDerWaalsContact CE2-SG 3.53Å; F87-C89 PolarHBondContact O-N 2.99Å; C89-V96 PolarHBondContact O-N 3.15Å; C89-V96 VanDerWaalsContact SG-CB 3.55Å
90	S	77.5	Confident	87.3	Confident	41 Å²	41	49.3 Å²	49.3	29%	0.287	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	148.6	173.4	59.7	0	0	0	0	110.5	S94	S90-S94 CarbonylContact C-O 3.53Å; S90-S94 VanDerWaalsContact CA-O 3.23Å; S90-S94 WeakPolarHBondContact CA-O 3.37Å
91	Y	76.6	Confident	87.4	Confident	7 Å²	7	45.4 Å²	45.4	3%	0.027	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	108.8	177.5	-161.8	-90.8	0	0	0	106.9	G93 S94 V109 I117 N120 V170 L190 T191	Y91-G93 PolarHBondContact O-N 3Å; Y91-G93 VanDerWaalsContact O-N 3.13Å; Y91-S94 PolarHBondContact N-O 3.45Å; Y91-S94 PolarHBondContact O-N 3.09Å; Y91-V109 HydrophobicContact CD1-CB 4.49Å; Y91-V109 HydrophobicContact CD1-CG1 4.48Å; Y91-V109 HydrophobicContact CD2-CG1 4.29Å; Y91-V109 HydrophobicContact CD2-CG2 4.24Å; Y91-V109 HydrophobicContact CE2-CG2 4.02Å; Y91-V109 HydrophobicContact CG-CB 4.49Å; Y91-V109 HydrophobicContact CG-CG1 4.1Å; Y91-I117 HydrophobicContact CD1-CD1 4.33Å; Y91-I117 HydrophobicContact CD1-CG1 4.2Å; Y91-I117 HydrophobicContact CG-CD1 4.44Å; Y91-N120 VanDerWaalsContact CE2-OD1 3.27Å; Y91-N120 WeakPolarHBondContact CE2-OD1 3.13Å; Y91-N120 PolarHBondContact OH-OD1 3.33Å; Y91-V170 HydrophobicContact CD2-CG2 4.39Å; Y91-V170 HydrophobicContact CE2-CG2 4.01Å; Y91-L190 HydrophobicContact CE2-CD1 3.87Å; Y91-L190 WeakPolarHBondContact OH-CD1 3.34Å; Y91-L190 WeakPolarHBondContact OH-CG 3.47Å; Y91-T191 WeakPolarHBondContact CE1-O 3.04Å; Y91-T191 PolarHBondContact OH-O 3.02Å; Y91-T191 VanDerWaalsContact OH-O 3.06Å
92	H	76.2	Confident	87.3	Confident	13 Å²	13	45.5 Å²	45.5	6%	0.06	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	27.2	-173.7	-51.7	-75.6	0	0	0	116.2	K55 Y56 I194 F204	K55-H92 HydrophobicContact CD-CB 4.49Å; Y56-H92 AromaticContact CD2-CE1 3.26Å; Y56-H92 WeakPolarHBondContact CD2-CE1 3.38Å; Y56-H92 AromaticContact CD2-ND1 3.21Å; Y56-H92 WeakPolarHBondContact CD2-ND1 3.28Å; Y56-H92 HydrophobicContact CE2-CB 4.32Å; Y56-H92 AromaticContact CE2-CE1 2.96Å; Y56-H92 WeakPolarHBondContact CE2-CE1 3.49Å; Y56-H92 AromaticContact CE2-CG 3.6Å; Y56-H92 AromaticContact CE2-ND1 2.72Å; Y56-H92 WeakPolarHBondContact CE2-ND1 3.41Å; Y56-H92 AromaticContact CE2-NE2 3.95Å; Y56-H92 AromaticContact CZ-CE1 3.25Å; Y56-H92 AromaticContact CZ-ND1 3.41Å; Y56-H92 AromaticContact CZ-NE2 3.88Å; Y56-H92 PolarHBondContact OH-N 3.06Å; H92-I194 HydrophobicContact CB-CD1 4.48Å; H92-F204 HydrophobicContact CB-CZ 4.33Å; H92-F204 AromaticContact CD2-CZ 3.55Å; H92-F204 AromaticContact CE1-CE2 3.18Å; H92-F204 WeakPolarHBondContact CE1-CE2 3.27Å; H92-F204 AromaticContact CE1-CZ 3.11Å; H92-F204 WeakPolarHBondContact CE1-CZ 3.45Å; H92-F204 AromaticContact CG-CZ 3.4Å; H92-F204 AromaticContact ND1-CE2 3.49Å; H92-F204 WeakPolarHBondContact ND1-CE2 3.36Å; H92-F204 AromaticContact ND1-CZ 3.02Å; H92-F204 WeakPolarHBondContact ND1-CZ 3.47Å; H92-F204 AromaticContact NE2-CE2 3.69Å; H92-F204 AromaticContact NE2-CZ 3.4Å; H92-F204 WeakPolarHBondContact NE2-CZ 3.21Å
93	G	75.7	Confident	87.1	Confident	64 Å²	64	46 Å²	46	66%	0.66	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	99	-13.8	-178.5	0	0	0	0	0	114.1	Y91	Y91-G93 PolarHBondContact O-N 3Å; Y91-G93 VanDerWaalsContact O-N 3.13Å
94	S	80.8	Confident	86.7	Confident	35 Å²	35	50.3 Å²	50.3	25%	0.245	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	138.5	174.2	-75.6	0	0	0	0	111.4	S90 Y91 V96 E111	S90-S94 CarbonylContact C-O 3.53Å; S90-S94 VanDerWaalsContact CA-O 3.23Å; S90-S94 WeakPolarHBondContact CA-O 3.37Å; Y91-S94 PolarHBondContact N-O 3.45Å; Y91-S94 PolarHBondContact O-N 3.09Å; S94-V96 PolarHBondContact O-N 3.46Å; S94-E111 WeakPolarHBondContact CB-OE2 3.43Å; S94-E111 PolarHBondContact OG-OE2 2.92Å
95	H	86.5	Confident	86.4	Confident	122 Å²	122	48.5 Å²	48.5	57%	0.565	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	127.5	173.7	-71.5	-56.1	0	0	0	111.1	H97 E111	H95-H97 PolarHBondContact O-N 3.02Å; H95-E111 WeakPolarHBondContact O-CA 3.16Å; H95-E111 WeakPolarHBondContact O-CB 3.39Å
96	V	89.6	Confident	86.4	Confident	15 Å²	15	47.4 Å²	47.4	9%	0.091	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	125.5	177.7	-178.8	0	0	0	0	109.3	P85 C89 S94 I99 V109 I117	P85-V96 HydrophobicContact CG-CG1 4.08Å; C89-V96 PolarHBondContact O-N 3.15Å; C89-V96 VanDerWaalsContact SG-CB 3.55Å; S94-V96 PolarHBondContact O-N 3.46Å; V96-I99 HydrophobicContact CG1-CD1 4.19Å; V96-I99 HydrophobicContact CG1-CG1 3.89Å; V96-V109 HydrophobicContact CB-CG1 4.25Å; V96-V109 HydrophobicContact CG1-CG1 3.67Å; V96-V109 HydrophobicContact CG2-CG1 3.67Å; V96-I117 HydrophobicContact CG2-CD1 4.47Å
97	H	91.9	Very high	86.7	Confident	50 Å²	50	40.7 Å²	40.7	23%	0.231	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-44.3	174.6	174	52.6	0	0	0	111.9	Y84 H95 Y110 E111 Y112	Y84-H97 WeakPolarHBondContact CD1-O 3.23Å; Y84-H97 AromaticContact CE1-NE2 3.87Å; H95-H97 PolarHBondContact O-N 3.02Å; H97-Y110 PolarHBondContact N-O 2.79Å; H97-E111 VanDerWaalsContact CB-C 3.47Å; H97-Y112 HydrophobicContact CB-CD1 4.31Å; H97-Y112 HydrophobicContact CB-CD2 3.92Å; H97-Y112 HydrophobicContact CB-CE2 4.14Å; H97-Y112 HydrophobicContact CB-CG 4.01Å; H97-Y112 AromaticContact CE1-CD1 3.98Å; H97-Y112 AromaticContact CE1-CE1 3.61Å; H97-Y112 AromaticContact CG-CD1 3.86Å; H97-Y112 AromaticContact CG-CE1 3.94Å; H97-Y112 AromaticContact ND1-CD1 3.53Å; H97-Y112 AromaticContact ND1-CE1 3.15Å; H97-Y112 WeakPolarHBondContact ND1-CE1 3.37Å; H97-Y112 AromaticContact ND1-CE2 3.96Å; H97-Y112 AromaticContact ND1-CZ 3.4Å
98	K	93.7	Very high	87.2	Confident	33 Å²	33	40.9 Å²	40.9	14%	0.143	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	156	177.7	65.9	171	-177.5	161.8	0	111.4	T82 V83 Y84 M100 Y110	T82-K98 HydrophobicContact CG2-CB 4.12Å; T82-K98 HydrophobicContact CG2-CD 3.94Å; V83-K98 CarbonylContact O-C 3.44Å; V83-K98 VanDerWaalsContact O-CA 3.28Å; V83-K98 WeakPolarHBondContact O-CA 3.34Å; V83-K98 WeakPolarHBondContact O-CB 3.46Å; Y84-K98 HydrophobicContact CD1-CB 3.81Å; Y84-K98 HydrophobicContact CE1-CB 3.74Å; Y84-K98 HydrophobicContact CE1-CD 4.32Å; K98-M100 PolarHBondContact NZ-SD 2.98Å; K98-Y110 HydrophobicContact CG-CD2 4.15Å; K98-Y110 HydrophobicContact CG-CG 4.23Å; K98-Y110 PolarHBondContact N-O 3.13Å; K98-Y110 PolarHBondContact O-N 2.87Å
99	I	94.4	Very high	87.8	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.8	171.9	-60.5	142.9	0	0	0	107.6	T82 V83 P85 V96 F101 D107 D108 V109 I141 I164	T82-I99 WeakPolarHBondContact CA-O 3.36Å; V83-I99 PolarHBondContact N-O 2.98Å; V83-I99 PolarHBondContact O-N 3.46Å; P85-I99 HydrophobicContact CG-CD1 3.8Å; V96-I99 HydrophobicContact CG1-CD1 4.19Å; V96-I99 HydrophobicContact CG1-CG1 3.89Å; I99-F101 HydrophobicContact CB-CE2 4.35Å; I99-F101 HydrophobicContact CB-CZ 4.39Å; I99-F101 HydrophobicContact CG2-CD1 4.27Å; I99-F101 HydrophobicContact CG2-CD2 4.29Å; I99-F101 HydrophobicContact CG2-CE1 3.79Å; I99-F101 HydrophobicContact CG2-CE2 3.81Å; I99-F101 HydrophobicContact CG2-CG 4.49Å; I99-F101 HydrophobicContact CG2-CZ 3.53Å; I99-D107 HydrophobicContact CG2-CB 4.42Å; I99-D108 CarbonylContact C-O 3.58Å; I99-D108 WeakPolarHBondContact CA-O 3.42Å; I99-V109 HydrophobicContact CG1-CG1 4.42Å; I99-I141 HydrophobicContact CD1-CG2 4.38Å; I99-I164 HydrophobicContact CD1-CD1 3.42Å; I99-I164 VanDerWaalsContact CD1-CD1 3.42Å; I99-I164 HydrophobicContact CD1-CG2 4.49Å; I99-I164 HydrophobicContact CG1-CD1 3.96Å; I99-I164 HydrophobicContact CG2-CD1 4.2Å
100	M	95.6	Very high	88.4	Confident	24 Å²	24	36.4 Å²	36.4	12%	0.118	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	109.9	176.4	-68.1	179	59.8	0	0	108.8	I80 T82 K98 Y102 D107 D108 Y110	I80-M100 HydrophobicContact CD1-CE 4.12Å; I80-M100 HydrophobicContact CG2-CB 4.13Å; I80-M100 HydrophobicContact CG2-CE 3.75Å; T82-M100 HydrophobicContact CG2-CG 4.22Å; K98-M100 PolarHBondContact NZ-SD 2.98Å; M100-Y102 HydrophobicContact CB-CE2 3.92Å; M100-Y102 WeakPolarHBondContact O-CD2 3.42Å; M100-D107 WeakPolarHBondContact O-CA 2.77Å; M100-D108 PolarHBondContact N-O 2.87Å; M100-D108 PolarHBondContact O-N 3.12Å; M100-Y110 HydrophobicContact CB-CE2 4.22Å; M100-Y110 HydrophobicContact CG-CD2 4.28Å; M100-Y110 HydrophobicContact CG-CE2 3.91Å; M100-Y110 HydrophobicContact SD-CD2 4.14Å; M100-Y110 HydrophobicContact SD-CE2 3.46Å; M100-Y110 WeakPolarHBondContact SD-CE2 3.28Å
101	F	96.2	Very high	89	Confident	1 Å²	1	36.1 Å²	36.1	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	111.5	173.8	-64.1	-68.6	0	0	0	109.2	I77 I80 H81 V83 I99 D107 V134 I141 V143	I77-F101 HydrophobicContact CD1-CB 3.72Å; I80-F101 WeakPolarHBondContact CA-O 3.28Å; H81-F101 PolarHBondContact N-O 3.11Å; H81-F101 PolarHBondContact O-N 3.19Å; V83-F101 HydrophobicContact CB-CE2 4.17Å; V83-F101 HydrophobicContact CG2-CD2 3.94Å; V83-F101 HydrophobicContact CG2-CE2 3.76Å; I99-F101 HydrophobicContact CB-CE2 4.35Å; I99-F101 HydrophobicContact CB-CZ 4.39Å; I99-F101 HydrophobicContact CG2-CD1 4.27Å; I99-F101 HydrophobicContact CG2-CD2 4.29Å; I99-F101 HydrophobicContact CG2-CE1 3.79Å; I99-F101 HydrophobicContact CG2-CE2 3.81Å; I99-F101 HydrophobicContact CG2-CG 4.49Å; I99-F101 HydrophobicContact CG2-CZ 3.53Å; F101-D107 HydrophobicContact CD1-CB 3.73Å; F101-D107 VanDerWaalsContact CD1-CG 3.47Å; F101-D107 WeakPolarHBondContact CD1-OD1 3.15Å; F101-D107 HydrophobicContact CE1-CB 3.82Å; F101-V134 HydrophobicContact CB-CG2 4.07Å; F101-V134 HydrophobicContact CD2-CG1 4.17Å; F101-V134 HydrophobicContact CD2-CG2 3.87Å; F101-V134 HydrophobicContact CE2-CG1 4.25Å; F101-V134 HydrophobicContact CG-CG2 4.05Å; F101-I141 HydrophobicContact CE2-CG2 3.63Å; F101-I141 HydrophobicContact CZ-CG2 3.68Å; F101-V143 HydrophobicContact CD1-CB 3.63Å; F101-V143 HydrophobicContact CD1-CG1 3.5Å; F101-V143 HydrophobicContact CD1-CG2 4.38Å; F101-V143 HydrophobicContact CE1-CB 3.88Å; F101-V143 HydrophobicContact CE1-CG1 3.61Å; F101-V143 HydrophobicContact CG-CB 4.22Å
102	Y	94.1	Very high	89.2	Confident	50 Å²	50	43.8 Å²	43.8	20%	0.196	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	139.6	174.2	-67.4	-99.4	0	0	0	109.8	I80 M100 D104 N105 A106 D108 R145	I80-Y102 HydrophobicContact CD1-CD1 3.88Å; I80-Y102 HydrophobicContact CD1-CE1 3.41Å; I80-Y102 VanDerWaalsContact CD1-CE1 3.41Å; I80-Y102 HydrophobicContact CG1-CD1 3.7Å; I80-Y102 HydrophobicContact CG1-CE1 3.79Å; I80-Y102 HydrophobicContact CG1-CG 4.47Å; M100-Y102 HydrophobicContact CB-CE2 3.92Å; M100-Y102 WeakPolarHBondContact O-CD2 3.42Å; Y102-D104 VanDerWaalsContact C-N 3.34Å; Y102-D104 PolarHBondContact O-N 3.19Å; Y102-N105 HydrophobicContact CG-CB 4.21Å; Y102-A106 VanDerWaalsContact CD2-O 3.3Å; Y102-A106 WeakPolarHBondContact CD2-O 3.31Å; Y102-D108 HydrophobicContact CE2-CB 4Å; Y102-D108 WeakPolarHBondContact CE2-OD2 3.49Å; Y102-R145 PolarHBondContact O-NH2 2.86Å
103	E	91.3	Very high	89.4	Confident	59 Å²	59	46.6 Å²	46.6	28%	0.276	26%	0.256	S	S	.	.	S	Bend	trans	-58.8	-49.5	179.6	-176.5	175.9	179.7	0	0	110.7	I77 G79 L130 S132	I77-E103 HydrophobicContact CB-CB 4.25Å; I77-E103 HydrophobicContact CG2-CB 3.81Å; G79-E103 PolarHBondContact N-OE2 3.37Å; G79-E103 PolarHBondContact O-N 3.14Å; E103-L130 WeakPolarHBondContact O-CD2 3.39Å; E103-S132 PolarHBondContact O-OG 3.02Å
104	D	86.8	Confident	89.2	Confident	92 Å²	92	53.5 Å²	53.5	49%	0.492	26%	0.263	S	S	.	.	S	Bend	trans	-113.1	20.4	-171.7	68.8	-17.8	0	0	0	113.8	Y102 Y123 Y127 L130	Y102-D104 VanDerWaalsContact C-N 3.34Å; Y102-D104 PolarHBondContact O-N 3.19Å; D104-Y123 VanDerWaalsContact C-CE2 3.41Å; D104-Y123 WeakPolarHBondContact CA-OH 3.45Å; D104-Y123 WeakPolarHBondContact O-CE2 3.41Å; D104-Y123 PolarHBondContact O-OH 3.14Å; D104-Y127 WeakPolarHBondContact CB-OH 3.5Å; D104-L130 HydrophobicContact CB-CD2 4.24Å
105	N	87.4	Confident	89.4	Confident	89 Å²	89	53.6 Å²	53.6	48%	0.476	26%	0.263	S	S	.	.	S	Bend	trans	-146.9	-165.7	178.5	-147.7	-31.4	0	0	0	111.3	Y102 R145	Y102-N105 HydrophobicContact CG-CB 4.21Å; N105-R145 PolarHBondContact O-NE 3.11Å; N105-R145 PolarHBondContact O-NH2 3.09Å
106	A	90.5	Very high	89.6	Confident	1 Å²	1	51 Å²	51	1%	0.008	25%	0.249	C	C	.	.			trans	-78.4	-173.6	178.4	0	0	0	0	0	112.9	Y102 T119 N120 H121	Y102-A106 VanDerWaalsContact CD2-O 3.3Å; Y102-A106 WeakPolarHBondContact CD2-O 3.31Å; A106-T119 HydrophobicContact CB-CG2 3.24Å; A106-N120 WeakPolarHBondContact CB-O 3.3Å; A106-H121 HydrophobicContact CB-CB 4.31Å; A106-H121 VanDerWaalsContact CB-ND1 3.34Å; A106-H121 WeakPolarHBondContact CB-ND1 3.26Å
107	D	93.2	Very high	89.6	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	109.9	-174.9	-38	-40.1	0	0	0	110	I99 M100 F101 T119 N120 V143 R145	I99-D107 HydrophobicContact CG2-CB 4.42Å; M100-D107 WeakPolarHBondContact O-CA 2.77Å; F101-D107 HydrophobicContact CD1-CB 3.73Å; F101-D107 VanDerWaalsContact CD1-CG 3.47Å; F101-D107 WeakPolarHBondContact CD1-OD1 3.15Å; F101-D107 HydrophobicContact CE1-CB 3.82Å; D107-T119 CarbonylContact O-C 3.5Å; D107-T119 VanDerWaalsContact O-CA 3.3Å; D107-T119 WeakPolarHBondContact O-CA 3.46Å; D107-N120 HydrophobicContact CB-CB 4.16Å; D107-N120 PolarHBondContact N-O 3.42Å; D107-N120 PolarHBondContact O-N 3.11Å; D107-V143 WeakPolarHBondContact OD2-CG1 3.47Å; D107-R145 IonicContact OD1-CZ 3.98Å; D107-R145 IonicContact OD1-NH1 2.79Å; D107-R145 PolarHBondContact OD1-NH1 3.05Å; D107-R145 IonicContact OD1-NH2 2.62Å; D107-R145 PolarHBondContact OD1-NH2 3.09Å; D107-R145 IonicContact OD2-NH1 2.64Å
108	D	94.1	Very high	89.7	Confident	31 Å²	31	48.2 Å²	48.2	17%	0.166	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	135.2	-177.3	-71.4	-11.2	0	0	0	111.2	I99 M100 Y102 Y110 Y116 T119	I99-D108 CarbonylContact C-O 3.58Å; I99-D108 WeakPolarHBondContact CA-O 3.42Å; M100-D108 PolarHBondContact N-O 2.87Å; M100-D108 PolarHBondContact O-N 3.12Å; Y102-D108 HydrophobicContact CE2-CB 4Å; Y102-D108 WeakPolarHBondContact CE2-OD2 3.49Å; D108-Y110 HydrophobicContact CB-CD2 4.45Å; D108-Y110 HydrophobicContact CB-CE2 3.63Å; D108-Y116 HydrophobicContact CB-CD2 4.16Å; D108-Y116 HydrophobicContact CB-CE2 4.1Å; D108-T119 WeakPolarHBondContact OD1-CG2 3.42Å; D108-T119 PolarHBondContact OD1-OG1 3.42Å
109	V	92.4	Very high	89.7	Confident	1 Å²	1	47 Å²	47	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	133.9	-177.8	-168.5	0	0	0	0	108.9	Y91 V96 I99 I117 G118	Y91-V109 HydrophobicContact CD1-CB 4.49Å; Y91-V109 HydrophobicContact CD1-CG1 4.48Å; Y91-V109 HydrophobicContact CD2-CG1 4.29Å; Y91-V109 HydrophobicContact CD2-CG2 4.24Å; Y91-V109 HydrophobicContact CE2-CG2 4.02Å; Y91-V109 HydrophobicContact CG-CB 4.49Å; Y91-V109 HydrophobicContact CG-CG1 4.1Å; V96-V109 HydrophobicContact CB-CG1 4.25Å; V96-V109 HydrophobicContact CG1-CG1 3.67Å; V96-V109 HydrophobicContact CG2-CG1 3.67Å; I99-V109 HydrophobicContact CG1-CG1 4.42Å; V109-I117 HydrophobicContact CB-CG1 4.06Å; V109-I117 HydrophobicContact CG1-CD1 3.89Å; V109-I117 HydrophobicContact CG1-CG1 3.9Å; V109-I117 VanDerWaalsContact O-CG1 3.3Å; V109-I117 WeakPolarHBondContact O-CG1 3.37Å; V109-I117 PolarHBondContact O-N 2.93Å; V109-G118 PolarHBondContact N-O 3.02Å
110	Y	91.9	Very high	89.7	Confident	35 Å²	35	46.9 Å²	46.9	14%	0.137	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.6	-179.3	-63.8	-97.6	0	0	0	111.4	H97 K98 M100 D108 S115	H97-Y110 PolarHBondContact N-O 2.79Å; K98-Y110 HydrophobicContact CG-CD2 4.15Å; K98-Y110 HydrophobicContact CG-CG 4.23Å; K98-Y110 PolarHBondContact N-O 3.13Å; K98-Y110 PolarHBondContact O-N 2.87Å; M100-Y110 HydrophobicContact CB-CE2 4.22Å; M100-Y110 HydrophobicContact CG-CD2 4.28Å; M100-Y110 HydrophobicContact CG-CE2 3.91Å; M100-Y110 HydrophobicContact SD-CD2 4.14Å; M100-Y110 HydrophobicContact SD-CE2 3.46Å; M100-Y110 WeakPolarHBondContact SD-CE2 3.28Å; D108-Y110 HydrophobicContact CB-CD2 4.45Å; D108-Y110 HydrophobicContact CB-CE2 3.63Å; Y110-S115 VanDerWaalsContact CA-O 3.28Å; Y110-S115 WeakPolarHBondContact CA-O 3.11Å
111	E	89.3	Confident	89.7	Confident	34 Å²	34	47.6 Å²	47.6	16%	0.159	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	173.7	167.1	65	-175.8	-175.2	0	0	111.9	S94 H95 H97 R114 S115 I117 K195	S94-E111 WeakPolarHBondContact CB-OE2 3.43Å; S94-E111 PolarHBondContact OG-OE2 2.92Å; H95-E111 WeakPolarHBondContact O-CA 3.16Å; H95-E111 WeakPolarHBondContact O-CB 3.39Å; H97-E111 VanDerWaalsContact CB-C 3.47Å; E111-R114 PolarHBondContact O-N 2.9Å; E111-S115 PolarHBondContact N-O 2.81Å; E111-S115 VanDerWaalsContact OE1-CB 3.22Å; E111-S115 WeakPolarHBondContact OE1-CB 3.19Å; E111-I117 HydrophobicContact CB-CD1 4.22Å; E111-I117 HydrophobicContact CB-CG2 3.86Å; E111-I117 HydrophobicContact CG-CG2 3.57Å; E111-K195 IonicContact OE1-NZ 3.16Å; E111-K195 PolarHBondContact OE1-NZ 3.24Å
112	Y	82.3	Confident	89.6	Confident	168 Å²	168	47.6 Å²	47.6	66%	0.659	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	141.8	171.7	-80	-84	0	0	0	110.7	H97	H97-Y112 HydrophobicContact CB-CD1 4.31Å; H97-Y112 HydrophobicContact CB-CD2 3.92Å; H97-Y112 HydrophobicContact CB-CE2 4.14Å; H97-Y112 HydrophobicContact CB-CG 4.01Å; H97-Y112 AromaticContact CE1-CD1 3.98Å; H97-Y112 AromaticContact CE1-CE1 3.61Å; H97-Y112 AromaticContact CG-CD1 3.86Å; H97-Y112 AromaticContact CG-CE1 3.94Å; H97-Y112 AromaticContact ND1-CD1 3.53Å; H97-Y112 AromaticContact ND1-CE1 3.15Å; H97-Y112 WeakPolarHBondContact ND1-CE1 3.37Å; H97-Y112 AromaticContact ND1-CE2 3.96Å; H97-Y112 AromaticContact ND1-CZ 3.4Å
113	G	79	Confident	89.4	Confident	72 Å²	72	46 Å²	46	74%	0.742	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.6	11.9	-171.7	0	0	0	0	0	114.3	S115	G113-S115 PolarHBondContact O-N 3.35Å
114	R	72.3	Confident	89.3	Confident	209 Å²	209	43.2 Å²	43.2	79%	0.789	21%	0.214	S	C	*	.	S	Bend	trans	63.1	19.7	174.5	-52.4	178.8	178.3	-178.7	-0.2	114.4	E111 Y116	E111-R114 PolarHBondContact O-N 2.9Å; R114-Y116 PolarHBondContact O-N 2.87Å
115	S	84.9	Confident	89.2	Confident	37 Å²	37	42 Å²	42	26%	0.259	21%	0.207	S	C	.	.			trans	-74.5	126.3	172.7	-71.3	0	0	0	0	109.4	Y110 E111 G113 K195	Y110-S115 VanDerWaalsContact CA-O 3.28Å; Y110-S115 WeakPolarHBondContact CA-O 3.11Å; E111-S115 PolarHBondContact N-O 2.81Å; E111-S115 VanDerWaalsContact OE1-CB 3.22Å; E111-S115 WeakPolarHBondContact OE1-CB 3.19Å; G113-S115 PolarHBondContact O-N 3.35Å; S115-K195 VanDerWaalsContact CB-NZ 3.33Å; S115-K195 PolarHBondContact OG-NZ 2.74Å
116	Y	90.1	Very high	89	Confident	68 Å²	68	44.3 Å²	44.3	27%	0.267	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	131.2	169.7	165.3	-99	0	0	0	109	D108 R114 G118 T119 I193	D108-Y116 HydrophobicContact CB-CD2 4.16Å; D108-Y116 HydrophobicContact CB-CE2 4.1Å; R114-Y116 PolarHBondContact O-N 2.87Å; Y116-G118 WeakPolarHBondContact CE2-O 2.94Å; Y116-G118 VanDerWaalsContact CZ-C 3.45Å; Y116-G118 VanDerWaalsContact CZ-CA 3.49Å; Y116-G118 VanDerWaalsContact OH-C 3.24Å; Y116-G118 WeakPolarHBondContact OH-CA 3.49Å; Y116-T119 WeakPolarHBondContact CE2-OG1 2.96Å; Y116-T119 PolarHBondContact OH-N 3.25Å; Y116-T119 PolarHBondContact OH-OG1 2.9Å; Y116-I193 HydrophobicContact CD1-CD1 3.33Å; Y116-I193 HydrophobicContact CD1-CG1 4.07Å; Y116-I193 HydrophobicContact CE1-CD1 3.39Å; Y116-I193 HydrophobicContact CE1-CG1 3.76Å
117	I	90.4	Very high	88.9	Confident	6 Å²	6	47.7 Å²	47.7	3%	0.031	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	-9.2	-175.8	59.8	174.4	0	0	0	113.4	Y91 V96 V109 E111 G192 I193	Y91-I117 HydrophobicContact CD1-CD1 4.33Å; Y91-I117 HydrophobicContact CD1-CG1 4.2Å; Y91-I117 HydrophobicContact CG-CD1 4.44Å; V96-I117 HydrophobicContact CG2-CD1 4.47Å; V109-I117 HydrophobicContact CB-CG1 4.06Å; V109-I117 HydrophobicContact CG1-CD1 3.89Å; V109-I117 HydrophobicContact CG1-CG1 3.9Å; V109-I117 VanDerWaalsContact O-CG1 3.3Å; V109-I117 WeakPolarHBondContact O-CG1 3.37Å; V109-I117 PolarHBondContact O-N 2.93Å; E111-I117 HydrophobicContact CB-CD1 4.22Å; E111-I117 HydrophobicContact CB-CG2 3.86Å; E111-I117 HydrophobicContact CG-CG2 3.57Å; I117-G192 VanDerWaalsContact O-CA 3.29Å; I117-G192 WeakPolarHBondContact O-CA 3.34Å; I117-I193 PolarHBondContact O-N 2.69Å
118	G	92.9	Very high	88.8	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.6	177.1	175	0	0	0	0	0	114.1	V109 Y116 T191	V109-G118 PolarHBondContact N-O 3.02Å; Y116-G118 WeakPolarHBondContact CE2-O 2.94Å; Y116-G118 VanDerWaalsContact CZ-C 3.45Å; Y116-G118 VanDerWaalsContact CZ-CA 3.49Å; Y116-G118 VanDerWaalsContact OH-C 3.24Å; Y116-G118 WeakPolarHBondContact OH-CA 3.49Å; G118-T191 CarbonylContact C-O 3.53Å; G118-T191 WeakPolarHBondContact CA-O 3.27Å
119	T	94.6	Very high	88.8	Confident	7 Å²	7	55.9 Å²	55.9	4%	0.043	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	133.1	-176.9	-60.4	0	0	0	0	110.3	A106 D107 D108 Y116 H121 T191	A106-T119 HydrophobicContact CB-CG2 3.24Å; D107-T119 CarbonylContact O-C 3.5Å; D107-T119 VanDerWaalsContact O-CA 3.3Å; D107-T119 WeakPolarHBondContact O-CA 3.46Å; D108-T119 WeakPolarHBondContact OD1-CG2 3.42Å; D108-T119 PolarHBondContact OD1-OG1 3.42Å; Y116-T119 WeakPolarHBondContact CE2-OG1 2.96Å; Y116-T119 PolarHBondContact OH-N 3.25Å; Y116-T119 PolarHBondContact OH-OG1 2.9Å; T119-H121 WeakPolarHBondContact CB-NE2 3Å; T119-H121 VanDerWaalsContact CG2-CE1 3.47Å; T119-H121 WeakPolarHBondContact CG2-CE1 3.42Å; T119-H121 VanDerWaalsContact CG2-NE2 3.31Å; T119-H121 WeakPolarHBondContact CG2-NE2 3.49Å; T119-H121 PolarHBondContact O-CD2 3.24Å; T119-T191 WeakPolarHBondContact CB-OG1 3.37Å; T119-T191 PolarHBondContact N-O 2.96Å; T119-T191 PolarHBondContact N-OG1 2.82Å; T119-T191 VanDerWaalsContact N-OG1 3.16Å; T119-T191 PolarHBondContact O-N 3.06Å; T119-T191 PolarHBondContact O-OG1 2.92Å; T119-T191 VanDerWaalsContact O-OG1 3.08Å
120	N	94.7	Very high	88.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	109.3	166.3	-55.3	-40.4	0	0	0	108.8	Y91 A106 D107 F172 L190	Y91-N120 VanDerWaalsContact CE2-OD1 3.27Å; Y91-N120 WeakPolarHBondContact CE2-OD1 3.13Å; Y91-N120 PolarHBondContact OH-OD1 3.33Å; A106-N120 WeakPolarHBondContact CB-O 3.3Å; D107-N120 HydrophobicContact CB-CB 4.16Å; D107-N120 PolarHBondContact N-O 3.42Å; D107-N120 PolarHBondContact O-N 3.11Å; N120-F172 HydrophobicContact CB-CE1 4.04Å; N120-F172 HydrophobicContact CB-CZ 4.04Å; N120-L190 WeakPolarHBondContact OD1-CD1 3.39Å
121	H	94.5	Very high	89	Confident	38 Å²	38	60.3 Å²	60.3	18%	0.176	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.3	174.9	-59	-98.3	0	0	0	108.9	A106 T119 F172 S188 K189	A106-H121 HydrophobicContact CB-CB 4.31Å; A106-H121 VanDerWaalsContact CB-ND1 3.34Å; A106-H121 WeakPolarHBondContact CB-ND1 3.26Å; T119-H121 WeakPolarHBondContact CB-NE2 3Å; T119-H121 VanDerWaalsContact CG2-CE1 3.47Å; T119-H121 WeakPolarHBondContact CG2-CE1 3.42Å; T119-H121 VanDerWaalsContact CG2-NE2 3.31Å; T119-H121 WeakPolarHBondContact CG2-NE2 3.49Å; T119-H121 PolarHBondContact O-CD2 3.24Å; H121-F172 VanDerWaalsContact O-CE2 3.27Å; H121-F172 WeakPolarHBondContact O-CE2 3.32Å; H121-F172 WeakPolarHBondContact O-CZ 3.32Å; H121-S188 CarbonylContact O-C 3.56Å; H121-S188 WeakPolarHBondContact O-CA 3.3Å; H121-K189 HydrophobicContact CB-CG 3.65Å; H121-K189 WeakPolarHBondContact CB-O 3.37Å; H121-K189 WeakPolarHBondContact CD2-CE 3.4Å; H121-K189 PolarHBondContact N-O 2.85Å; H121-K189 WeakPolarHBondContact NE2-CE 3.37Å; H121-K189 PolarHBondContact O-N 2.87Å
122	N	94.3	Very high	89.4	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	78.1	167.5	-166.8	17.8	0	0	0	108.3	M160 T161 S162 F172 Y174 S188	N122-M160 PolarHBondContact OD1-SD 3.37Å; N122-T161 PolarHBondContact ND2-O 3.25Å; N122-S162 WeakPolarHBondContact CB-OG 3.48Å; N122-S162 PolarHBondContact ND2-OG 3.19Å; N122-F172 HydrophobicContact CB-CD1 3.96Å; N122-F172 HydrophobicContact CB-CD2 4.32Å; N122-F172 HydrophobicContact CB-CE1 4.1Å; N122-F172 HydrophobicContact CB-CE2 4.44Å; N122-F172 HydrophobicContact CB-CG 4.1Å; N122-F172 HydrophobicContact CB-CZ 4.34Å; N122-Y174 WeakPolarHBondContact OD1-CE1 3.39Å; N122-S188 PolarHBondContact OD1-OG 2.75Å
123	Y	90.6	Very high	90.1	Very high	18 Å²	18	51.6 Å²	51.6	7%	0.071	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	156.5	-159.8	-164.8	-92.9	0	0	0	112	D104 Y127 L130 F147 I187	D104-Y123 VanDerWaalsContact C-CE2 3.41Å; D104-Y123 WeakPolarHBondContact CA-OH 3.45Å; D104-Y123 WeakPolarHBondContact O-CE2 3.41Å; D104-Y123 PolarHBondContact O-OH 3.14Å; Y123-Y127 HydrophobicContact CE1-CE1 4.04Å; Y123-Y127 AromaticContact CZ-CE1 3.74Å; Y123-Y127 WeakPolarHBondContact OH-CE1 3.32Å; Y123-Y127 VanDerWaalsContact OH-CZ 3.22Å; Y123-Y127 PolarHBondContact OH-OH 3.12Å; Y123-L130 HydrophobicContact CE2-CD2 4.02Å; Y123-F147 HydrophobicContact CD1-CE1 4.41Å; Y123-F147 AromaticContact CD2-CE1 3.84Å; Y123-F147 HydrophobicContact CD2-CE1 3.84Å; Y123-F147 AromaticContact CD2-CZ 3.62Å; Y123-F147 HydrophobicContact CD2-CZ 3.62Å; Y123-F147 HydrophobicContact CE1-CE1 4.17Å; Y123-F147 AromaticContact CE2-CE1 3.57Å; Y123-F147 HydrophobicContact CE2-CE1 3.57Å; Y123-F147 AromaticContact CE2-CZ 3.79Å; Y123-F147 HydrophobicContact CE2-CZ 3.79Å; Y123-F147 HydrophobicContact CG-CE1 4.25Å; Y123-F147 HydrophobicContact CG-CZ 4.08Å; Y123-F147 AromaticContact CZ-CE1 3.74Å; Y123-I187 PolarHBondContact N-O 3.01Å; Y123-I187 PolarHBondContact O-N 2.98Å
124	L	88.7	Confident	90.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.7	179.1	177.9	150.2	0	0	0	109.7	Y127 F147 I149 A158 M160 L181 V184	L124-Y127 VanDerWaalsContact O-CD1 3.32Å; L124-Y127 WeakPolarHBondContact O-CD1 3.39Å; L124-F147 HydrophobicContact CB-CD1 3.95Å; L124-F147 HydrophobicContact CB-CD2 4.13Å; L124-F147 HydrophobicContact CB-CE1 4.08Å; L124-F147 HydrophobicContact CB-CE2 4.28Å; L124-F147 HydrophobicContact CB-CG 3.98Å; L124-F147 HydrophobicContact CB-CZ 4.25Å; L124-F147 HydrophobicContact CD2-CB 4.15Å; L124-F147 HydrophobicContact CD2-CD1 4.15Å; L124-F147 HydrophobicContact CD2-CG 4.24Å; L124-F147 WeakPolarHBondContact O-CE1 3.23Å; L124-I149 HydrophobicContact CD1-CD1 4.42Å; L124-I149 HydrophobicContact CD1-CG2 4.25Å; L124-I149 HydrophobicContact CD2-CG2 3.3Å; L124-I149 HydrophobicContact CG-CG2 4.43Å; L124-A158 HydrophobicContact CD1-CB 3.97Å; L124-M160 HydrophobicContact CB-CE 3.95Å; L124-L181 HydrophobicContact CD1-CD1 4.49Å; L124-V184 HydrophobicContact CD1-CG1 3.8Å; L124-V184 HydrophobicContact CD2-CG1 3.81Å; L124-V184 HydrophobicContact CG-CG1 3.67Å
125	N	85.2	Confident	92.1	Very high	66 Å²	66	38.3 Å²	38.3	35%	0.353	20%	0.196	S	C	.	.	S	Bend	trans	-88	163.4	175	-65.7	-24.5	0	0	0	111.7	V184	N125-V184 WeakPolarHBondContact O-CG1 3.09Å
126	N	83.8	Confident	92.6	Very high	137 Å²	137	39.2 Å²	39.2	73%	0.733	20%	0.198	S	C	*	.	S	Bend	trans	62.7	41.1	175.7	-53.9	-29.1	0	0	0	114.6
127	Y	88.8	Confident	92.8	Very high	73 Å²	73	38.9 Å²	38.9	29%	0.286	20%	0.199	S	C	.	.			trans	-90.8	160.2	172.7	62.9	-84.2	0	0	0	112	D104 Y123 L124 K129 L130 F147 S148	D104-Y127 WeakPolarHBondContact CB-OH 3.5Å; Y123-Y127 HydrophobicContact CE1-CE1 4.04Å; Y123-Y127 AromaticContact CZ-CE1 3.74Å; Y123-Y127 WeakPolarHBondContact OH-CE1 3.32Å; Y123-Y127 VanDerWaalsContact OH-CZ 3.22Å; Y123-Y127 PolarHBondContact OH-OH 3.12Å; L124-Y127 VanDerWaalsContact O-CD1 3.32Å; L124-Y127 WeakPolarHBondContact O-CD1 3.39Å; Y127-K129 WeakPolarHBondContact CD2-O 3.37Å; Y127-L130 HydrophobicContact CD2-CB 3.82Å; Y127-L130 HydrophobicContact CE2-CB 3.49Å; Y127-L130 VanDerWaalsContact CE2-CB 3.49Å; Y127-L130 HydrophobicContact CE2-CD2 4.13Å; Y127-L130 HydrophobicContact CE2-CG 4.49Å; Y127-F147 AromaticContact CD1-CD1 3.84Å; Y127-F147 HydrophobicContact CD1-CD1 3.84Å; Y127-F147 HydrophobicContact CD1-CE1 4.24Å; Y127-F147 AromaticContact CG-CD1 3.87Å; Y127-F147 HydrophobicContact CG-CD1 3.87Å; Y127-S148 CarbonylContact C-O 3.58Å; Y127-S148 WeakPolarHBondContact CA-O 3.32Å; Y127-S148 WeakPolarHBondContact CB-O 3.18Å
128	V	91.1	Very high	92.9	Very high	86 Å²	86	44.4 Å²	44.4	52%	0.521	22%	0.224	S	C	.	.	S	Bend	trans	-92.7	-42.5	176.1	-174.6	0	0	0	0	110.7	S148 N150	V128-S148 PolarHBondContact N-O 2.9Å; V128-N150 HydrophobicContact CG2-CB 4.17Å
129	K	93.5	Very high	92.8	Very high	118 Å²	118	51.4 Å²	51.4	51%	0.513	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	150.4	178.2	-56.9	172.5	-171.2	143.1	0	109.9	Y127 F147 S148 E155	Y127-K129 WeakPolarHBondContact CD2-O 3.37Å; K129-F147 WeakPolarHBondContact O-CA 3.21Å; K129-S148 PolarHBondContact N-O 2.99Å; K129-S148 PolarHBondContact O-N 3.08Å; K129-E155 IonicContact NZ-OE1 3.3Å; K129-E155 PolarHBondContact NZ-OE1 3.19Å; K129-E155 IonicContact NZ-OE2 3.52Å
130	L	94.4	Very high	92.8	Very high	31 Å²	31	52 Å²	52	16%	0.162	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	134.7	176.5	175.6	55	0	0	0	108.9	E103 D104 Y123 Y127 R145 T146 F147	E103-L130 WeakPolarHBondContact O-CD2 3.39Å; D104-L130 HydrophobicContact CB-CD2 4.24Å; Y123-L130 HydrophobicContact CE2-CD2 4.02Å; Y127-L130 HydrophobicContact CD2-CB 3.82Å; Y127-L130 HydrophobicContact CE2-CB 3.49Å; Y127-L130 VanDerWaalsContact CE2-CB 3.49Å; Y127-L130 HydrophobicContact CE2-CD2 4.13Å; Y127-L130 HydrophobicContact CE2-CG 4.49Å; L130-R145 HydrophobicContact CD1-CB 4.11Å; L130-T146 WeakPolarHBondContact CA-O 3.4Å; L130-F147 HydrophobicContact CD1-CD1 3.7Å; L130-F147 HydrophobicContact CD1-CD2 4.38Å; L130-F147 HydrophobicContact CD1-CE1 3.59Å; L130-F147 HydrophobicContact CD1-CE2 4.26Å; L130-F147 HydrophobicContact CD1-CG 4.11Å; L130-F147 HydrophobicContact CD1-CZ 3.87Å; L130-F147 HydrophobicContact CD2-CE1 4.13Å; L130-F147 HydrophobicContact CG-CE1 4.44Å
131	N	94.8	Very high	92.9	Very high	97 Å²	97	52 Å²	52	52%	0.519	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	122.7	167.4	-171.6	10.8	0	0	0	108.7	R145 T146	N131-R145 WeakPolarHBondContact O-CA 3.38Å; N131-T146 PolarHBondContact N-O 2.86Å; N131-T146 PolarHBondContact O-N 2.96Å
132	S	96.1	Very high	92.9	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.007	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.5	-177	-62	0	0	0	0	109.4	I77 E103 K144	I77-S132 PolarHBondContact N-O 3Å; E103-S132 PolarHBondContact O-OG 3.02Å; S132-K144 WeakPolarHBondContact CA-O 3.42Å
133	A	96.9	Very high	93.1	Very high	19 Å²	19	50.1 Å²	50.1	16%	0.157	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140.8	177.6	0	0	0	0	0	111.1	F73 I75 V143 K144	F73-A133 HydrophobicContact CB-CB 3.9Å; F73-A133 WeakPolarHBondContact CD1-O 3.46Å; F73-A133 WeakPolarHBondContact O-CB 3.4Å; I75-A133 CarbonylContact O-C 3.46Å; I75-A133 VanDerWaalsContact O-CA 3.23Å; I75-A133 WeakPolarHBondContact O-CA 3.41Å; A133-V143 CarbonylContact O-C 3.59Å; A133-V143 WeakPolarHBondContact O-CA 3.43Å; A133-K144 PolarHBondContact N-O 3.13Å; A133-K144 PolarHBondContact O-N 2.75Å
134	V	97.5	Very high	93.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	143.7	-176.8	172.5	0	0	0	0	110.4	N74 I75 I77 H81 V83 F101 D136 G142 V143	N74-V134 PolarHBondContact N-O 2.02Å; I75-V134 HydrophobicContact CB-CB 4.11Å; I75-V134 HydrophobicContact CG2-CB 4.43Å; I75-V134 PolarHBondContact N-O 3.25Å; I75-V134 PolarHBondContact O-N 3.34Å; I77-V134 HydrophobicContact CD1-CG2 3.62Å; I77-V134 HydrophobicContact CG1-CG2 3.68Å; H81-V134 HydrophobicContact CB-CG2 4.31Å; V83-V134 HydrophobicContact CG2-CG1 3.99Å; F101-V134 HydrophobicContact CB-CG2 4.07Å; F101-V134 HydrophobicContact CD2-CG1 4.17Å; F101-V134 HydrophobicContact CD2-CG2 3.87Å; F101-V134 HydrophobicContact CE2-CG1 4.25Å; F101-V134 HydrophobicContact CG-CG2 4.05Å; V134-D136 HydrophobicContact CG1-CB 4.21Å; V134-G142 CarbonylContact C-O 3.49Å; V134-G142 WeakPolarHBondContact CA-O 3.46Å; V134-G142 WeakPolarHBondContact CG1-O 3.33Å; V134-V143 HydrophobicContact CG2-CB 4.44Å; V134-V143 HydrophobicContact CG2-CG2 4.34Å
135	L	96.9	Very high	93.7	Very high	1 Å²	1	51 Å²	51	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	119.7	162.2	176.3	100.6	0	0	0	106.7	V68 R72 F73 E137 L140 I141 G142 L163	V68-L135 HydrophobicContact CG1-CD1 4.24Å; R72-L135 HydrophobicContact CB-CD1 3.45Å; R72-L135 VanDerWaalsContact CB-CD1 3.45Å; R72-L135 WeakPolarHBondContact O-CD1 3.42Å; F73-L135 HydrophobicContact CD1-CB 3.63Å; F73-L135 HydrophobicContact CE1-CB 3.64Å; F73-L135 HydrophobicContact CG-CB 4.26Å; F73-L135 HydrophobicContact CZ-CB 4.25Å; L135-E137 HydrophobicContact CD1-CG 4.08Å; L135-E137 HydrophobicContact CG-CG 4.13Å; L135-L140 HydrophobicContact CD2-CB 3.86Å; L135-L140 HydrophobicContact CD2-CD2 3.68Å; L135-L140 HydrophobicContact CD2-CG 3.52Å; L135-I141 CarbonylContact O-C 3.58Å; L135-I141 VanDerWaalsContact O-CA 3.28Å; L135-I141 WeakPolarHBondContact O-CA 3.19Å; L135-G142 PolarHBondContact N-O 2.94Å; L135-G142 PolarHBondContact O-N 2.62Å; L135-L163 HydrophobicContact CD2-CD2 4.34Å
136	D	95.3	Very high	94.2	Very high	57 Å²	57	49.4 Å²	49.4	31%	0.305	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	89.8	176.7	-177.4	15	0	0	0	109.2	I75 V83 V134	I75-D136 HydrophobicContact CD1-CB 3.94Å; V83-D136 HydrophobicContact CG1-CB 4.35Å; V83-D136 VanDerWaalsContact CG1-CG 3.48Å; V83-D136 WeakPolarHBondContact CG1-OD1 3.44Å; V83-D136 HydrophobicContact CG2-CB 4.14Å; V134-D136 HydrophobicContact CG1-CB 4.21Å
137	E	94.4	Very high	94.7	Very high	61 Å²	61	42.9 Å²	42.9	29%	0.285	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	159.9	-178.8	-60.1	174.3	156.7	0	0	111.1	R72 L135 K139 L140	R72-E137 IonicContact CZ-OE1 3.24Å; R72-E137 IonicContact CZ-OE2 2.81Å; R72-E137 VanDerWaalsContact CZ-OE2 3.26Å; R72-E137 IonicContact NE-OE1 2.7Å; R72-E137 PolarHBondContact NE-OE1 3.4Å; R72-E137 IonicContact NE-OE2 2.88Å; R72-E137 IonicContact NH1-OE2 2.71Å; R72-E137 IonicContact NH2-OE1 3.95Å; R72-E137 PolarHBondContact NH2-OE1 3.36Å; R72-E137 IonicContact NH2-OE2 2.99Å; R72-E137 PolarHBondContact NH2-OE2 3.24Å; L135-E137 HydrophobicContact CD1-CG 4.08Å; L135-E137 HydrophobicContact CG-CG 4.13Å; E137-K139 PolarHBondContact O-N 3.08Å; E137-L140 WeakPolarHBondContact CB-O 3.4Å; E137-L140 PolarHBondContact N-O 3.44Å; E137-L140 PolarHBondContact O-N 3.12Å; E137-L140 VanDerWaalsContact O-O 3.13Å
138	E	91.2	Very high	94.9	Very high	122 Å²	122	40 Å²	40	57%	0.57	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-29.9	-176.3	-166.8	-162.6	154.2	0	0	114.1	F87	F87-E138 VanDerWaalsContact CD1-O 3.25Å; F87-E138 WeakPolarHBondContact CD1-O 3.45Å
139	K	91.6	Very high	94.8	Very high	147 Å²	147	36 Å²	36	64%	0.639	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-124.8	8	-175.4	-64.3	-177.9	-177.5	173.5	0	113.6	E137 P166	E137-K139 PolarHBondContact O-N 3.08Å; K139-P166 HydrophobicContact CB-CG 4.19Å; K139-P166 WeakPolarHBondContact O-CD 3.48Å; K139-P166 WeakPolarHBondContact O-CG 3.37Å
140	L	94.6	Very high	94.5	Very high	19 Å²	19	35 Å²	35	10%	0.099	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	127.9	179.6	-165.6	61.4	0	0	0	110.3	V68 L135 E137 L163 H165	V68-L140 HydrophobicContact CG2-CD2 3.52Å; L135-L140 HydrophobicContact CD2-CB 3.86Å; L135-L140 HydrophobicContact CD2-CD2 3.68Å; L135-L140 HydrophobicContact CD2-CG 3.52Å; E137-L140 WeakPolarHBondContact CB-O 3.4Å; E137-L140 PolarHBondContact N-O 3.44Å; E137-L140 PolarHBondContact O-N 3.12Å; E137-L140 VanDerWaalsContact O-O 3.13Å; L140-L163 HydrophobicContact CD1-CB 4.32Å; L140-L163 HydrophobicContact CD1-CD2 4.5Å; L140-L163 HydrophobicContact CD2-CD2 4.3Å; L140-L163 HydrophobicContact CG-CD2 4.32Å; L140-H165 WeakPolarHBondContact CD1-ND1 3.23Å
141	I	95.8	Very high	94	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	146.7	173.9	-66.9	162.7	0	0	0	107.8	V83 P85 F87 I99 F101 L135 L163 I164	V83-I141 HydrophobicContact CB-CG2 4.25Å; V83-I141 HydrophobicContact CG1-CD1 3.44Å; V83-I141 VanDerWaalsContact CG1-CD1 3.44Å; V83-I141 HydrophobicContact CG1-CG1 3.87Å; V83-I141 HydrophobicContact CG1-CG2 3.82Å; V83-I141 HydrophobicContact CG2-CG2 4.39Å; P85-I141 HydrophobicContact CB-CD1 3.83Å; P85-I141 HydrophobicContact CG-CD1 3.8Å; F87-I141 HydrophobicContact CE1-CD1 3.66Å; F87-I141 HydrophobicContact CE1-CG1 3.99Å; F87-I141 HydrophobicContact CZ-CD1 3.83Å; F87-I141 HydrophobicContact CZ-CG1 4.25Å; I99-I141 HydrophobicContact CD1-CG2 4.38Å; F101-I141 HydrophobicContact CE2-CG2 3.63Å; F101-I141 HydrophobicContact CZ-CG2 3.68Å; L135-I141 CarbonylContact O-C 3.58Å; L135-I141 VanDerWaalsContact O-CA 3.28Å; L135-I141 WeakPolarHBondContact O-CA 3.19Å; I141-L163 CarbonylContact O-C 3.56Å; I141-L163 WeakPolarHBondContact O-CA 3.36Å; I141-I164 PolarHBondContact N-O 2.87Å; I141-I164 PolarHBondContact O-N 2.84Å
142	G	96.3	Very high	93.4	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.1	177.3	175	0	0	0	0	0	114.2	V134 L135 S162	V134-G142 CarbonylContact C-O 3.49Å; V134-G142 WeakPolarHBondContact CA-O 3.46Å; V134-G142 WeakPolarHBondContact CG1-O 3.33Å; L135-G142 PolarHBondContact N-O 2.94Å; L135-G142 PolarHBondContact O-N 2.62Å; G142-S162 CarbonylContact C-O 3.53Å; G142-S162 WeakPolarHBondContact CA-O 3.27Å
143	V	97.2	Very high	92.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	137.5	176.4	60.3	0	0	0	0	109.4	I77 F101 D107 A133 V134 R145 T161 S162	I77-V143 HydrophobicContact CD1-CG2 3.89Å; F101-V143 HydrophobicContact CD1-CB 3.63Å; F101-V143 HydrophobicContact CD1-CG1 3.5Å; F101-V143 HydrophobicContact CD1-CG2 4.38Å; F101-V143 HydrophobicContact CE1-CB 3.88Å; F101-V143 HydrophobicContact CE1-CG1 3.61Å; F101-V143 HydrophobicContact CG-CB 4.22Å; D107-V143 WeakPolarHBondContact OD2-CG1 3.47Å; A133-V143 CarbonylContact O-C 3.59Å; A133-V143 WeakPolarHBondContact O-CA 3.43Å; V134-V143 HydrophobicContact CG2-CB 4.44Å; V134-V143 HydrophobicContact CG2-CG2 4.34Å; V143-R145 HydrophobicContact CG2-CG 4.14Å; V143-T161 WeakPolarHBondContact O-CA 3.21Å; V143-S162 PolarHBondContact N-O 3.17Å; V143-S162 PolarHBondContact O-N 2.79Å
144	K	96.8	Very high	92.4	Very high	33 Å²	33	41.2 Å²	41.2	14%	0.143	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.4	172.2	-176.3	174.9	-175.5	-174.5	0	108.8	S70 F73 S132 A133 T159 M160	S70-K144 VanDerWaalsContact CB-NZ 3.34Å; S70-K144 PolarHBondContact OG-NZ 3.03Å; F73-K144 HydrophobicContact CB-CB 4.2Å; F73-K144 HydrophobicContact CD1-CB 3.58Å; F73-K144 HydrophobicContact CD2-CB 4.04Å; F73-K144 HydrophobicContact CD2-CD 4.12Å; F73-K144 HydrophobicContact CE1-CB 3.88Å; F73-K144 HydrophobicContact CE2-CB 4.31Å; F73-K144 HydrophobicContact CE2-CD 4.49Å; F73-K144 HydrophobicContact CG-CB 3.67Å; F73-K144 HydrophobicContact CG-CD 4.43Å; F73-K144 HydrophobicContact CZ-CB 4.24Å; S132-K144 WeakPolarHBondContact CA-O 3.42Å; A133-K144 PolarHBondContact N-O 3.13Å; A133-K144 PolarHBondContact O-N 2.75Å; K144-T159 HydrophobicContact CD-CG2 4.34Å; K144-T159 HydrophobicContact CG-CG2 4.18Å; K144-M160 WeakPolarHBondContact CA-O 2.72Å
145	R	96.1	Very high	92	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128	179.9	-62.8	-168.5	170.7	85	4.4	110.3	Y102 N105 D107 L130 N131 V143 F147 T159 M160	Y102-R145 PolarHBondContact O-NH2 2.86Å; N105-R145 PolarHBondContact O-NE 3.11Å; N105-R145 PolarHBondContact O-NH2 3.09Å; D107-R145 IonicContact OD1-CZ 3.98Å; D107-R145 IonicContact OD1-NH1 2.79Å; D107-R145 PolarHBondContact OD1-NH1 3.05Å; D107-R145 IonicContact OD1-NH2 2.62Å; D107-R145 PolarHBondContact OD1-NH2 3.09Å; D107-R145 IonicContact OD2-NH1 2.64Å; L130-R145 HydrophobicContact CD1-CB 4.11Å; N131-R145 WeakPolarHBondContact O-CA 3.38Å; V143-R145 HydrophobicContact CG2-CG 4.14Å; R145-F147 HydrophobicContact CB-CD2 4.3Å; R145-F147 HydrophobicContact CB-CE2 3.44Å; R145-F147 VanDerWaalsContact CB-CE2 3.44Å; R145-F147 HydrophobicContact CB-CZ 3.79Å; R145-F147 HydrophobicContact CG-CZ 4.47Å; R145-T159 WeakPolarHBondContact O-CA 3.49Å; R145-M160 PolarHBondContact N-O 3.02Å; R145-M160 PolarHBondContact O-N 2.93Å
146	T	95.5	Very high	91.8	Very high	33 Å²	33	48.2 Å²	48.2	20%	0.202	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	115.8	173.3	-57.6	0	0	0	0	109.3	L130 N131 E157 A158 T159	L130-T146 WeakPolarHBondContact CA-O 3.4Å; N131-T146 PolarHBondContact N-O 2.86Å; N131-T146 PolarHBondContact O-N 2.96Å; T146-E157 HydrophobicContact CG2-CB 4.33Å; T146-E157 HydrophobicContact CG2-CG 4.42Å; T146-A158 CarbonylContact C-O 3.46Å; T146-A158 WeakPolarHBondContact CA-O 3.18Å; T146-T159 WeakPolarHBondContact CG2-OG1 3.41Å; T146-T159 WeakPolarHBondContact OG1-CG2 2.96Å; T146-T159 PolarHBondContact OG1-OG1 3.45Å
147	F	93.9	Very high	91.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.1	-179.2	-56.8	-97.5	0	0	0	109.1	Y123 L124 Y127 K129 L130 R145 I149 E157 A158 M160	Y123-F147 HydrophobicContact CD1-CE1 4.41Å; Y123-F147 AromaticContact CD2-CE1 3.84Å; Y123-F147 HydrophobicContact CD2-CE1 3.84Å; Y123-F147 AromaticContact CD2-CZ 3.62Å; Y123-F147 HydrophobicContact CD2-CZ 3.62Å; Y123-F147 HydrophobicContact CE1-CE1 4.17Å; Y123-F147 AromaticContact CE2-CE1 3.57Å; Y123-F147 HydrophobicContact CE2-CE1 3.57Å; Y123-F147 AromaticContact CE2-CZ 3.79Å; Y123-F147 HydrophobicContact CE2-CZ 3.79Å; Y123-F147 HydrophobicContact CG-CE1 4.25Å; Y123-F147 HydrophobicContact CG-CZ 4.08Å; Y123-F147 AromaticContact CZ-CE1 3.74Å; L124-F147 HydrophobicContact CB-CD1 3.95Å; L124-F147 HydrophobicContact CB-CD2 4.13Å; L124-F147 HydrophobicContact CB-CE1 4.08Å; L124-F147 HydrophobicContact CB-CE2 4.28Å; L124-F147 HydrophobicContact CB-CG 3.98Å; L124-F147 HydrophobicContact CB-CZ 4.25Å; L124-F147 HydrophobicContact CD2-CB 4.15Å; L124-F147 HydrophobicContact CD2-CD1 4.15Å; L124-F147 HydrophobicContact CD2-CG 4.24Å; L124-F147 WeakPolarHBondContact O-CE1 3.23Å; Y127-F147 AromaticContact CD1-CD1 3.84Å; Y127-F147 HydrophobicContact CD1-CD1 3.84Å; Y127-F147 HydrophobicContact CD1-CE1 4.24Å; Y127-F147 AromaticContact CG-CD1 3.87Å; Y127-F147 HydrophobicContact CG-CD1 3.87Å; K129-F147 WeakPolarHBondContact O-CA 3.21Å; L130-F147 HydrophobicContact CD1-CD1 3.7Å; L130-F147 HydrophobicContact CD1-CD2 4.38Å; L130-F147 HydrophobicContact CD1-CE1 3.59Å; L130-F147 HydrophobicContact CD1-CE2 4.26Å; L130-F147 HydrophobicContact CD1-CG 4.11Å; L130-F147 HydrophobicContact CD1-CZ 3.87Å; L130-F147 HydrophobicContact CD2-CE1 4.13Å; L130-F147 HydrophobicContact CG-CE1 4.44Å; R145-F147 HydrophobicContact CB-CD2 4.3Å; R145-F147 HydrophobicContact CB-CE2 3.44Å; R145-F147 VanDerWaalsContact CB-CE2 3.44Å; R145-F147 HydrophobicContact CB-CZ 3.79Å; R145-F147 HydrophobicContact CG-CZ 4.47Å; F147-I149 HydrophobicContact CB-CG2 4.5Å; F147-E157 CarbonylContact O-C 3.51Å; F147-E157 VanDerWaalsContact O-CA 3.23Å; F147-E157 WeakPolarHBondContact O-CA 3.02Å; F147-A158 HydrophobicContact CB-CB 4.5Å; F147-A158 PolarHBondContact N-O 2.87Å; F147-A158 PolarHBondContact O-N 3.4Å; F147-M160 HydrophobicContact CD2-CE 3.8Å; F147-M160 HydrophobicContact CE2-CE 3.23Å; F147-M160 HydrophobicContact CZ-CE 3.95Å
148	S	93.1	Very high	91.6	Very high	14 Å²	14	46.7 Å²	46.7	10%	0.098	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	127.1	161.1	-71.6	0	0	0	0	109.1	Y127 V128 K129 E155	Y127-S148 CarbonylContact C-O 3.58Å; Y127-S148 WeakPolarHBondContact CA-O 3.32Å; Y127-S148 WeakPolarHBondContact CB-O 3.18Å; V128-S148 PolarHBondContact N-O 2.9Å; K129-S148 PolarHBondContact N-O 2.99Å; K129-S148 PolarHBondContact O-N 3.08Å; S148-E155 WeakPolarHBondContact CB-OE1 3.4Å; S148-E155 PolarHBondContact OG-OE1 2.98Å
149	I	89.5	Confident	91.8	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	147.2	-179	47.8	170.4	0	0	0	109.9	L124 F147 V151 E155 V156 L181	L124-I149 HydrophobicContact CD1-CD1 4.42Å; L124-I149 HydrophobicContact CD1-CG2 4.25Å; L124-I149 HydrophobicContact CD2-CG2 3.3Å; L124-I149 HydrophobicContact CG-CG2 4.43Å; F147-I149 HydrophobicContact CB-CG2 4.5Å; I149-V151 HydrophobicContact CD1-CG2 3.97Å; I149-V151 HydrophobicContact CG1-CG2 4.29Å; I149-E155 WeakPolarHBondContact O-CA 3.44Å; I149-V156 HydrophobicContact CD1-CG2 3.76Å; I149-V156 HydrophobicContact CG1-CG2 3.55Å; I149-V156 WeakPolarHBondContact CG1-O 3.11Å; I149-V156 PolarHBondContact N-O 3.06Å; I149-V156 PolarHBondContact O-N 2.82Å; I149-L181 HydrophobicContact CD1-CD1 4.33Å; I149-L181 HydrophobicContact CD1-CD2 3.05Å; I149-L181 HydrophobicContact CD1-CG 4.13Å
150	N	87.5	Confident	92	Very high	98 Å²	98	34.5 Å²	34.5	52%	0.524	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	116.3	173.6	-169.1	-48.4	0	0	0	109.6	V128 G153	V128-N150 HydrophobicContact CG2-CB 4.17Å; N150-G153 VanDerWaalsContact OD1-CA 3.25Å; N150-G153 WeakPolarHBondContact OD1-CA 3.13Å; N150-G153 PolarHBondContact OD1-N 3.32Å
151	V	82.9	Confident	92.1	Very high	21 Å²	21	33.6 Å²	33.6	13%	0.127	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	107.7	174.4	-179.5	0	0	0	0	108.4	I149 G153 A154 V156 K180 L181	I149-V151 HydrophobicContact CD1-CG2 3.97Å; I149-V151 HydrophobicContact CG1-CG2 4.29Å; V151-G153 VanDerWaalsContact C-N 3.28Å; V151-G153 PolarHBondContact O-N 2.88Å; V151-A154 PolarHBondContact N-O 2.8Å; V151-A154 PolarHBondContact O-N 2.85Å; V151-A154 VanDerWaalsContact O-N 3.15Å; V151-V156 HydrophobicContact CB-CG2 4.11Å; V151-V156 HydrophobicContact CG2-CG2 3.61Å; V151-K180 HydrophobicContact CG1-CB 3.9Å; V151-L181 HydrophobicContact CG2-CD2 4.35Å
152	N	83.2	Confident	92.2	Very high	139 Å²	139	33.8 Å²	33.8	74%	0.743	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	41.4	-179.3	-57.8	-18.4	0	0	0	113.4	A154	N152-A154 VanDerWaalsContact C-N 3.3Å; N152-A154 PolarHBondContact O-N 2.84Å
153	G	84.2	Confident	92.2	Very high	66 Å²	66	33.9 Å²	33.9	68%	0.68	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	86	-8.6	178.9	0	0	0	0	0	114.8	N150 V151	N150-G153 VanDerWaalsContact OD1-CA 3.25Å; N150-G153 WeakPolarHBondContact OD1-CA 3.13Å; N150-G153 PolarHBondContact OD1-N 3.32Å; V151-G153 VanDerWaalsContact C-N 3.28Å; V151-G153 PolarHBondContact O-N 2.88Å
154	A	87.5	Confident	92	Very high	51 Å²	51	34.4 Å²	34.4	42%	0.421	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	132.4	174.6	0	0	0	0	0	111	V151 N152 V156	V151-A154 PolarHBondContact N-O 2.8Å; V151-A154 PolarHBondContact O-N 2.85Å; V151-A154 VanDerWaalsContact O-N 3.15Å; N152-A154 VanDerWaalsContact C-N 3.3Å; N152-A154 PolarHBondContact O-N 2.84Å; A154-V156 PolarHBondContact O-N 2.88Å
155	E	89	Confident	91.9	Very high	103 Å²	103	34.6 Å²	34.6	48%	0.481	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	120.5	169.3	-168.5	173	168.2	0	0	108.6	K129 S148 I149	K129-E155 IonicContact NZ-OE1 3.3Å; K129-E155 PolarHBondContact NZ-OE1 3.19Å; K129-E155 IonicContact NZ-OE2 3.52Å; S148-E155 WeakPolarHBondContact CB-OE1 3.4Å; S148-E155 PolarHBondContact OG-OE1 2.98Å; I149-E155 WeakPolarHBondContact O-CA 3.44Å
156	V	91.6	Very high	91.5	Very high	45 Å²	45	36.9 Å²	36.9	27%	0.273	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	154	174.2	-58.5	0	0	0	0	109.4	I149 V151 A154 P178	I149-V156 HydrophobicContact CD1-CG2 3.76Å; I149-V156 HydrophobicContact CG1-CG2 3.55Å; I149-V156 WeakPolarHBondContact CG1-O 3.11Å; I149-V156 PolarHBondContact N-O 3.06Å; I149-V156 PolarHBondContact O-N 2.82Å; V151-V156 HydrophobicContact CB-CG2 4.11Å; V151-V156 HydrophobicContact CG2-CG2 3.61Å; A154-V156 PolarHBondContact O-N 2.88Å; V156-P178 HydrophobicContact CB-CG 4.26Å; V156-P178 HydrophobicContact CG2-CB 4.17Å; V156-P178 HydrophobicContact CG2-CG 3.86Å
157	E	93	Very high	91	Very high	86 Å²	86	39.6 Å²	39.6	40%	0.402	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	139.9	-178.8	-63.3	172.6	146.5	0	0	111.9	T146 F147 K176 P178	T146-E157 HydrophobicContact CG2-CB 4.33Å; T146-E157 HydrophobicContact CG2-CG 4.42Å; F147-E157 CarbonylContact O-C 3.51Å; F147-E157 VanDerWaalsContact O-CA 3.23Å; F147-E157 WeakPolarHBondContact O-CA 3.02Å; E157-K176 HydrophobicContact CB-CD 4.48Å; E157-K176 IonicContact OE2-NZ 2.74Å; E157-K176 PolarHBondContact OE2-NZ 3.42Å; E157-P178 WeakPolarHBondContact O-CD 3.41Å; E157-P178 WeakPolarHBondContact O-CG 3.29Å
158	A	93.8	Very high	90.7	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.2	162.9	0	0	0	0	0	109.7	L124 T146 F147 K176	L124-A158 HydrophobicContact CD1-CB 3.97Å; T146-A158 CarbonylContact C-O 3.46Å; T146-A158 WeakPolarHBondContact CA-O 3.18Å; F147-A158 HydrophobicContact CB-CB 4.5Å; F147-A158 PolarHBondContact N-O 2.87Å; F147-A158 PolarHBondContact O-N 3.4Å; A158-K176 CarbonylContact C-O 3.51Å; A158-K176 WeakPolarHBondContact CA-O 3.45Å
159	T	95.2	Very high	90.6	Very high	11 Å²	11	41 Å²	41	7%	0.067	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.8	-178.4	-56.1	0	0	0	0	110.1	K144 R145 T146 D175 K176	K144-T159 HydrophobicContact CD-CG2 4.34Å; K144-T159 HydrophobicContact CG-CG2 4.18Å; R145-T159 WeakPolarHBondContact O-CA 3.49Å; T146-T159 WeakPolarHBondContact CG2-OG1 3.41Å; T146-T159 WeakPolarHBondContact OG1-CG2 2.96Å; T146-T159 PolarHBondContact OG1-OG1 3.45Å; T159-D175 HydrophobicContact CG2-CB 3.76Å; T159-D175 PolarHBondContact O-N 2.82Å; T159-K176 PolarHBondContact N-O 2.97Å; T159-K176 PolarHBondContact O-N 2.85Å; T159-K176 VanDerWaalsContact O-N 3.13Å
160	M	95.6	Very high	90.9	Very high	2 Å²	2	41 Å²	41	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	145.7	-176.9	-56.1	-176.3	-75.8	0	0	110.1	N122 L124 K144 R145 F147 Y173 Y174 I177 L186	N122-M160 PolarHBondContact OD1-SD 3.37Å; L124-M160 HydrophobicContact CB-CE 3.95Å; K144-M160 WeakPolarHBondContact CA-O 2.72Å; R145-M160 PolarHBondContact N-O 3.02Å; R145-M160 PolarHBondContact O-N 2.93Å; F147-M160 HydrophobicContact CD2-CE 3.8Å; F147-M160 HydrophobicContact CE2-CE 3.23Å; F147-M160 HydrophobicContact CZ-CE 3.95Å; M160-Y173 WeakPolarHBondContact CA-O 3.26Å; M160-Y174 HydrophobicContact CG-CD1 3.95Å; M160-Y174 HydrophobicContact SD-CD1 4Å; M160-Y174 HydrophobicContact SD-CE1 4.07Å; M160-I177 HydrophobicContact CG-CD1 3.87Å; M160-I177 HydrophobicContact SD-CD1 4.2Å; M160-L186 HydrophobicContact CE-CD1 4.33Å; M160-L186 HydrophobicContact CE-CG 4.27Å; M160-L186 HydrophobicContact SD-CD1 3.52Å; M160-L186 VanDerWaalsContact SD-CD1 3.52Å; M160-L186 HydrophobicContact SD-CD2 3.87Å; M160-L186 HydrophobicContact SD-CG 3.79Å
161	T	96.9	Very high	91.4	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	132.8	-178.5	-58.2	0	0	0	0	109.6	F73 N122 V143 L163 F172 Y173 D175	F73-T161 HydrophobicContact CE1-CG2 4.02Å; F73-T161 HydrophobicContact CE2-CG2 4.15Å; F73-T161 HydrophobicContact CZ-CG2 3.39Å; N122-T161 PolarHBondContact ND2-O 3.25Å; V143-T161 WeakPolarHBondContact O-CA 3.21Å; T161-L163 HydrophobicContact CG2-CD2 4.05Å; T161-L163 HydrophobicContact CG2-CG 4.07Å; T161-F172 CarbonylContact O-C 3.55Å; T161-F172 WeakPolarHBondContact O-CA 3.41Å; T161-Y173 PolarHBondContact N-O 2.95Å; T161-Y173 PolarHBondContact O-N 3.26Å; T161-D175 PolarHBondContact OG1-OD2 2.79Å
162	S	97	Very high	92.1	Very high	4 Å²	4	35.4 Å²	35.4	3%	0.028	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.2	169.7	-61.6	0	0	0	0	109.4	N122 G142 V143 S171 F172	N122-S162 WeakPolarHBondContact CB-OG 3.48Å; N122-S162 PolarHBondContact ND2-OG 3.19Å; G142-S162 CarbonylContact C-O 3.53Å; G142-S162 WeakPolarHBondContact CA-O 3.27Å; V143-S162 PolarHBondContact N-O 3.17Å; V143-S162 PolarHBondContact O-N 2.79Å; S162-S171 CarbonylContact C-O 3.51Å; S162-S171 WeakPolarHBondContact CA-O 3.47Å; S162-F172 WeakPolarHBondContact OG-CD1 3.26Å
163	L	96.1	Very high	92.8	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.3	179.5	-60.9	172.8	0	0	0	110.4	P67 V68 F73 L135 L140 I141 T161 V170 S171	P67-L163 HydrophobicContact CB-CD1 4.05Å; P67-L163 HydrophobicContact CG-CD1 3.8Å; V68-L163 HydrophobicContact CG2-CD1 3.7Å; V68-L163 HydrophobicContact CG2-CD2 4.06Å; F73-L163 HydrophobicContact CE1-CD2 4.39Å; F73-L163 HydrophobicContact CZ-CD2 3.93Å; L135-L163 HydrophobicContact CD2-CD2 4.34Å; L140-L163 HydrophobicContact CD1-CB 4.32Å; L140-L163 HydrophobicContact CD1-CD2 4.5Å; L140-L163 HydrophobicContact CD2-CD2 4.3Å; L140-L163 HydrophobicContact CG-CD2 4.32Å; I141-L163 CarbonylContact O-C 3.56Å; I141-L163 WeakPolarHBondContact O-CA 3.36Å; T161-L163 HydrophobicContact CG2-CD2 4.05Å; T161-L163 HydrophobicContact CG2-CG 4.07Å; L163-V170 CarbonylContact O-C 3.45Å; L163-V170 WeakPolarHBondContact O-CA 3.12Å; L163-S171 PolarHBondContact N-O 2.81Å; L163-S171 PolarHBondContact O-N 3.03Å
164	I	94.4	Very high	93.4	Very high	10 Å²	10	26.5 Å²	26.5	5%	0.051	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.9	173	-62	165.2	0	0	0	107.3	F87 I99 I141 V170	F87-I164 HydrophobicContact CE2-CG2 4.45Å; F87-I164 HydrophobicContact CZ-CG2 4.49Å; I99-I164 HydrophobicContact CD1-CD1 3.42Å; I99-I164 VanDerWaalsContact CD1-CD1 3.42Å; I99-I164 HydrophobicContact CD1-CG2 4.49Å; I99-I164 HydrophobicContact CG1-CD1 3.96Å; I99-I164 HydrophobicContact CG2-CD1 4.2Å; I141-I164 PolarHBondContact N-O 2.87Å; I141-I164 PolarHBondContact O-N 2.84Å; I164-V170 HydrophobicContact CG1-CG2 4.43Å
165	H	93.2	Very high	93.8	Very high	38 Å²	38	25.5 Å²	25.5	18%	0.176	13%	0.131	C	C	.	.			trans	-98.6	162	-175.2	-62.3	-92	0	0	0	112	F87 L140 N167 G168 K169 S171	F87-H165 WeakPolarHBondContact CE2-O 3.39Å; L140-H165 WeakPolarHBondContact CD1-ND1 3.23Å; H165-N167 WeakPolarHBondContact CB-OD1 3.39Å; H165-N167 PolarHBondContact O-N 3.06Å; H165-N167 VanDerWaalsContact O-N 3.11Å; H165-G168 PolarHBondContact O-N 2.93Å; H165-K169 HydrophobicContact CB-CB 4.08Å; H165-K169 PolarHBondContact CD2-O 2.88Å; H165-K169 PolarHBondContact N-O 2.78Å; H165-S171 PolarHBondContact CD2-OG 3.48Å; H165-S171 PolarHBondContact NE2-OG 2.88Å
166	P	89.4	Confident	94	Very high	50 Å²	50	25 Å²	25	33%	0.325	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.4	-179.3	-30	38.2	0	0	0	115.2	F87 K139 G168	F87-P166 HydrophobicContact CB-CB 4.22Å; F87-P166 HydrophobicContact CD1-CG 4.4Å; F87-P166 VanDerWaalsContact CD2-CA 3.41Å; F87-P166 HydrophobicContact CD2-CB 4.13Å; F87-P166 HydrophobicContact CD2-CG 4.49Å; F87-P166 HydrophobicContact CG-CB 4.14Å; F87-P166 HydrophobicContact CG-CG 4.27Å; K139-P166 HydrophobicContact CB-CG 4.19Å; K139-P166 WeakPolarHBondContact O-CD 3.48Å; K139-P166 WeakPolarHBondContact O-CG 3.37Å; P166-G168 PolarHBondContact O-N 2.96Å
167	N	84.7	Confident	94.1	Very high	89 Å²	89	23.7 Å²	23.7	48%	0.476	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	13.5	179.4	72.1	-22.9	0	0	0	113.9	H165 K169 Q222	H165-N167 WeakPolarHBondContact CB-OD1 3.39Å; H165-N167 PolarHBondContact O-N 3.06Å; H165-N167 VanDerWaalsContact O-N 3.11Å; N167-K169 PolarHBondContact O-N 2.91Å; N167-K169 WeakPolarHBondContact OD1-CB 3.37Å; N167-K169 PolarHBondContact OD1-N 2.78Å; N167-K169 VanDerWaalsContact OD1-N 3.11Å; N167-Q222 PolarHBondContact ND2-OE1 3.43Å; N167-Q222 PolarHBondContact O-NE2 3.49Å
168	G	86.4	Confident	93.8	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.01	11%	0.108	C	C	.	.	S	Bend	trans	76	2	-176.6	0	0	0	0	0	115	H165 P166 V170	H165-G168 PolarHBondContact O-N 2.93Å; P166-G168 PolarHBondContact O-N 2.96Å; G168-V170 PolarHBondContact O-N 3.13Å
169	K	92.2	Very high	93.3	Very high	42 Å²	42	31 Å²	31	18%	0.183	15%	0.152	C	C	.	.			trans	-63.2	133	173	-167.2	174.5	63.9	171.9	0	109.8	H165 N167 E220 F221 Q222	H165-K169 HydrophobicContact CB-CB 4.08Å; H165-K169 PolarHBondContact CD2-O 2.88Å; H165-K169 PolarHBondContact N-O 2.78Å; N167-K169 PolarHBondContact O-N 2.91Å; N167-K169 WeakPolarHBondContact OD1-CB 3.37Å; N167-K169 PolarHBondContact OD1-N 2.78Å; N167-K169 VanDerWaalsContact OD1-N 3.11Å; K169-E220 HydrophobicContact CD-CB 4.22Å; K169-E220 HydrophobicContact CD-CG 4.46Å; K169-E220 WeakPolarHBondContact CE-OE1 3.28Å; K169-E220 IonicContact NZ-OE1 2.68Å; K169-E220 PolarHBondContact NZ-OE1 2.62Å; K169-F221 WeakPolarHBondContact CA-O 3.45Å; K169-F221 WeakPolarHBondContact CG-O 3.25Å; K169-Q222 VanDerWaalsContact CB-OE1 3.28Å
170	V	95.2	Very high	92.1	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.006	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.6	170.4	-179	0	0	0	0	108.1	Y91 L163 I164 G168 F172 L190 F221	Y91-V170 HydrophobicContact CD2-CG2 4.39Å; Y91-V170 HydrophobicContact CE2-CG2 4.01Å; L163-V170 CarbonylContact O-C 3.45Å; L163-V170 WeakPolarHBondContact O-CA 3.12Å; I164-V170 HydrophobicContact CG1-CG2 4.43Å; G168-V170 PolarHBondContact O-N 3.13Å; V170-F172 HydrophobicContact CG1-CD1 4.37Å; V170-F172 HydrophobicContact CG1-CE1 3.73Å; V170-F172 HydrophobicContact CG1-CZ 4.26Å; V170-L190 HydrophobicContact CB-CD1 4.16Å; V170-L190 HydrophobicContact CG1-CD1 4.12Å; V170-L190 HydrophobicContact CG2-CD1 4.11Å; V170-F221 HydrophobicContact CB-CB 4.32Å; V170-F221 HydrophobicContact CB-CD2 4.46Å; V170-F221 PolarHBondContact N-O 2.98Å; V170-F221 PolarHBondContact O-N 3.47Å
171	S	97.1	Very high	90.8	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.021	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.5	-179.9	-49.4	0	0	0	0	110.9	S162 L163 H165 V219	S162-S171 CarbonylContact C-O 3.51Å; S162-S171 WeakPolarHBondContact CA-O 3.47Å; L163-S171 PolarHBondContact N-O 2.81Å; L163-S171 PolarHBondContact O-N 3.03Å; H165-S171 PolarHBondContact CD2-OG 3.48Å; H165-S171 PolarHBondContact NE2-OG 2.88Å; S171-V219 CarbonylContact C-O 3.59Å; S171-V219 WeakPolarHBondContact CA-O 3.2Å
172	F	98	Very high	88.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.7	167.2	-58.6	-24.7	0	0	0	109.3	N120 H121 N122 T161 S162 V170 V208 L218 V219 F221	N120-F172 HydrophobicContact CB-CE1 4.04Å; N120-F172 HydrophobicContact CB-CZ 4.04Å; H121-F172 VanDerWaalsContact O-CE2 3.27Å; H121-F172 WeakPolarHBondContact O-CE2 3.32Å; H121-F172 WeakPolarHBondContact O-CZ 3.32Å; N122-F172 HydrophobicContact CB-CD1 3.96Å; N122-F172 HydrophobicContact CB-CD2 4.32Å; N122-F172 HydrophobicContact CB-CE1 4.1Å; N122-F172 HydrophobicContact CB-CE2 4.44Å; N122-F172 HydrophobicContact CB-CG 4.1Å; N122-F172 HydrophobicContact CB-CZ 4.34Å; T161-F172 CarbonylContact O-C 3.55Å; T161-F172 WeakPolarHBondContact O-CA 3.41Å; S162-F172 WeakPolarHBondContact OG-CD1 3.26Å; V170-F172 HydrophobicContact CG1-CD1 4.37Å; V170-F172 HydrophobicContact CG1-CE1 3.73Å; V170-F172 HydrophobicContact CG1-CZ 4.26Å; F172-V208 HydrophobicContact CD2-CG2 4.26Å; F172-L218 WeakPolarHBondContact O-CA 3.15Å; F172-V219 HydrophobicContact CB-CB 4.28Å; F172-V219 PolarHBondContact N-O 2.89Å; F172-V219 PolarHBondContact O-N 3Å; F172-F221 AromaticContact CD2-CE2 3.64Å; F172-F221 HydrophobicContact CD2-CE2 3.64Å; F172-F221 HydrophobicContact CD2-CZ 4.4Å; F172-F221 HydrophobicContact CE2-CD2 4.44Å; F172-F221 AromaticContact CE2-CE2 3.55Å; F172-F221 HydrophobicContact CE2-CE2 3.55Å; F172-F221 HydrophobicContact CE2-CZ 4.23Å; F172-F221 HydrophobicContact CG-CE2 4.36Å; F172-F221 HydrophobicContact CZ-CE2 4.19Å
173	Y	98.1	Very high	87	Confident	17 Å²	17	54.7 Å²	54.7	7%	0.067	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.3	174.1	-179.2	-104.3	0	0	0	110	Q64 Q66 P67 M160 T161 D175 T217 L218	Q64-Y173 HydrophobicContact CB-CE2 4.26Å; Q64-Y173 PolarHBondContact O-OH 3.35Å; Q64-Y173 VanDerWaalsContact O-OH 3.11Å; Q66-Y173 HydrophobicContact CB-CE1 3.95Å; Q66-Y173 HydrophobicContact CG-CD1 4.22Å; Q66-Y173 HydrophobicContact CG-CE1 3.83Å; Q66-Y173 PolarHBondContact N-OH 2.86Å; P67-Y173 VanDerWaalsContact CD-CG 3.45Å; P67-Y173 HydrophobicContact CG-CD1 4.38Å; P67-Y173 HydrophobicContact CG-CD2 4.48Å; P67-Y173 HydrophobicContact CG-CG 4.03Å; M160-Y173 WeakPolarHBondContact CA-O 3.26Å; T161-Y173 PolarHBondContact N-O 2.95Å; T161-Y173 PolarHBondContact O-N 3.26Å; Y173-D175 HydrophobicContact CD1-CB 4.33Å; Y173-D175 WeakPolarHBondContact CD1-OD2 3.18Å; Y173-D175 HydrophobicContact CE1-CB 4.05Å; Y173-T217 WeakPolarHBondContact CD2-O 3.42Å; Y173-L218 HydrophobicContact CD2-CB 4.21Å; Y173-L218 HydrophobicContact CD2-CD1 4.28Å
174	Y	96.9	Very high	85.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	90	-179.5	-58	-66.7	0	0	0	109.5	N122 M160 I177 L186 S188 I213 K214 S215 G216 T217 V219	N122-Y174 WeakPolarHBondContact OD1-CE1 3.39Å; M160-Y174 HydrophobicContact CG-CD1 3.95Å; M160-Y174 HydrophobicContact SD-CD1 4Å; M160-Y174 HydrophobicContact SD-CE1 4.07Å; Y174-I177 HydrophobicContact CD1-CD1 4.06Å; Y174-I177 HydrophobicContact CD1-CG1 4.33Å; Y174-I177 HydrophobicContact CG-CD1 4.49Å; Y174-I177 HydrophobicContact CG-CG1 4.28Å; Y174-L186 HydrophobicContact CE1-CD2 4.35Å; Y174-S188 WeakPolarHBondContact CE1-OG 3.19Å; Y174-S188 WeakPolarHBondContact OH-CB 3.45Å; Y174-S188 PolarHBondContact OH-OG 2.79Å; Y174-I213 HydrophobicContact CD1-CG2 3.98Å; Y174-I213 HydrophobicContact CE1-CG2 3.66Å; Y174-I213 HydrophobicContact CE2-CB 4.44Å; Y174-I213 HydrophobicContact CE2-CG1 4.32Å; Y174-I213 HydrophobicContact CE2-CG2 4.36Å; Y174-I213 HydrophobicContact CG-CG2 4.48Å; Y174-K214 WeakPolarHBondContact CB-O 3.47Å; Y174-S215 CarbonylContact O-C 3.59Å; Y174-S215 VanDerWaalsContact O-CA 3.29Å; Y174-S215 WeakPolarHBondContact O-CA 3.37Å; Y174-G216 PolarHBondContact O-N 2.71Å; Y174-T217 HydrophobicContact CD2-CG2 4.45Å; Y174-T217 WeakPolarHBondContact CD2-O 3.48Å; Y174-T217 PolarHBondContact N-O 3.45Å; Y174-V219 HydrophobicContact CE2-CG2 3.89Å
175	D	95.8	Very high	84.7	Confident	31 Å²	31	62 Å²	62	17%	0.166	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	-47.4	-177.4	-57.6	-109.7	0	0	0	111.9	Q66 T159 T161 Y173	Q66-D175 VanDerWaalsContact CD-OD1 3.25Å; Q66-D175 WeakPolarHBondContact CG-OD1 2.99Å; Q66-D175 PolarHBondContact NE2-OD1 2.86Å; T159-D175 HydrophobicContact CG2-CB 3.76Å; T159-D175 PolarHBondContact O-N 2.82Å; T161-D175 PolarHBondContact OG1-OD2 2.79Å; Y173-D175 HydrophobicContact CD1-CB 4.33Å; Y173-D175 WeakPolarHBondContact CD1-OD2 3.18Å; Y173-D175 HydrophobicContact CE1-CB 4.05Å
176	K	93.9	Very high	84.4	Confident	93 Å²	93	61.5 Å²	61.5	40%	0.404	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	112.7	-176.9	179.8	-179.2	172.6	-175.3	0	109.9	E157 A158 T159	E157-K176 HydrophobicContact CB-CD 4.48Å; E157-K176 IonicContact OE2-NZ 2.74Å; E157-K176 PolarHBondContact OE2-NZ 3.42Å; A158-K176 CarbonylContact C-O 3.51Å; A158-K176 WeakPolarHBondContact CA-O 3.45Å; T159-K176 PolarHBondContact N-O 2.97Å; T159-K176 PolarHBondContact O-N 2.85Å; T159-K176 VanDerWaalsContact O-N 3.13Å
177	I	92.5	Very high	84.4	Confident	17 Å²	17	61.4 Å²	61.4	9%	0.087	28%	0.276	C	S	.	.			trans	-123.1	110.2	176.3	-54.3	-61.5	0	0	0	108.4	M160 Y174 K179 L181 L186 S215	M160-I177 HydrophobicContact CG-CD1 3.87Å; M160-I177 HydrophobicContact SD-CD1 4.2Å; Y174-I177 HydrophobicContact CD1-CD1 4.06Å; Y174-I177 HydrophobicContact CD1-CG1 4.33Å; Y174-I177 HydrophobicContact CG-CD1 4.49Å; Y174-I177 HydrophobicContact CG-CG1 4.28Å; I177-K179 PolarHBondContact O-N 3.11Å; I177-L181 HydrophobicContact CG2-CD1 3.7Å; I177-L186 HydrophobicContact CD1-CD1 3.75Å; I177-S215 PolarHBondContact N-OG 2.89Å; I177-S215 PolarHBondContact O-OG 3.48Å
178	P	88.5	Confident	84.9	Confident	26 Å²	26	57.3 Å²	57.3	17%	0.169	26%	0.255	C	S	.	.			trans	-57.5	134.4	177.2	-23.5	28.3	0	0	0	112.6	V156 E157 K180 L181	V156-P178 HydrophobicContact CB-CG 4.26Å; V156-P178 HydrophobicContact CG2-CB 4.17Å; V156-P178 HydrophobicContact CG2-CG 3.86Å; E157-P178 WeakPolarHBondContact O-CD 3.41Å; E157-P178 WeakPolarHBondContact O-CG 3.29Å; P178-K180 PolarHBondContact O-N 3.3Å; P178-K180 VanDerWaalsContact O-N 3.13Å; P178-L181 HydrophobicContact CB-CD1 4.27Å; P178-L181 HydrophobicContact CB-CG 4.07Å; P178-L181 HydrophobicContact CG-CD1 4.21Å; P178-L181 HydrophobicContact CG-CG 4.41Å; P178-L181 WeakPolarHBondContact O-CB 3.12Å; P178-L181 VanDerWaalsContact O-CG 3.26Å; P178-L181 WeakPolarHBondContact O-CG 3.49Å; P178-L181 PolarHBondContact O-N 2.98Å
179	K	82.5	Confident	85.3	Confident	214 Å²	214	59.6 Å²	59.6	93%	0.93	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-24.5	-180	-66.2	-176.7	179.5	179.9	0	113.9	I177 L181	I177-K179 PolarHBondContact O-N 3.11Å; K179-L181 PolarHBondContact O-N 3.33Å
180	K	70	Confident	85.4	Confident	148 Å²	148	57.6 Å²	57.6	64%	0.643	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	17.8	-174.3	-66.4	-175.7	179.7	178.9	0	113.5	V151 P178 W182	V151-K180 HydrophobicContact CG1-CB 3.9Å; P178-K180 PolarHBondContact O-N 3.3Å; P178-K180 VanDerWaalsContact O-N 3.13Å; K180-W182 VanDerWaalsContact C-N 3.35Å; K180-W182 PolarHBondContact O-N 3.11Å
181	L	67.4	Low	85.4	Confident	17 Å²	17	58.3 Å²	58.3	9%	0.089	26%	0.26	C	S	.	.			trans	-82.6	5.4	-171.2	-81	179.7	0	0	0	117.1	L124 I149 V151 I177 P178 K179 K183 V184	L124-L181 HydrophobicContact CD1-CD1 4.49Å; I149-L181 HydrophobicContact CD1-CD1 4.33Å; I149-L181 HydrophobicContact CD1-CD2 3.05Å; I149-L181 HydrophobicContact CD1-CG 4.13Å; V151-L181 HydrophobicContact CG2-CD2 4.35Å; I177-L181 HydrophobicContact CG2-CD1 3.7Å; P178-L181 HydrophobicContact CB-CD1 4.27Å; P178-L181 HydrophobicContact CB-CG 4.07Å; P178-L181 HydrophobicContact CG-CD1 4.21Å; P178-L181 HydrophobicContact CG-CG 4.41Å; P178-L181 WeakPolarHBondContact O-CB 3.12Å; P178-L181 VanDerWaalsContact O-CG 3.26Å; P178-L181 WeakPolarHBondContact O-CG 3.49Å; P178-L181 PolarHBondContact O-N 2.98Å; K179-L181 PolarHBondContact O-N 3.33Å; L181-K183 PolarHBondContact O-N 3.16Å; L181-V184 HydrophobicContact CD2-CB 3.69Å; L181-V184 HydrophobicContact CD2-CG1 4.35Å; L181-V184 HydrophobicContact CD2-CG2 3.65Å; L181-V184 PolarHBondContact O-N 2.7Å
182	W	55.9	Low	85.1	Confident	200 Å²	200	58.1 Å²	58.1	76%	0.758	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-17.5	-175.6	66.7	-77.1	0	0	0	115.8	K180	K180-W182 VanDerWaalsContact C-N 3.35Å; K180-W182 PolarHBondContact O-N 3.11Å
183	K	58.2	Low	84.6	Confident	149 Å²	149	58.9 Å²	58.9	65%	0.648	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-15.6	173.6	-66.3	-170.2	177.9	-176.2	0	114.8	L181	L181-K183 PolarHBondContact O-N 3.16Å
184	V	65.5	Low	83.9	Confident	21 Å²	21	58.8 Å²	58.8	13%	0.127	26%	0.263	C	S	.	.	S	Bend	trans	-102.3	117.4	-175.2	-174	0	0	0	0	108.7	L124 N125 L181 L186	L124-V184 HydrophobicContact CD1-CG1 3.8Å; L124-V184 HydrophobicContact CD2-CG1 3.81Å; L124-V184 HydrophobicContact CG-CG1 3.67Å; N125-V184 WeakPolarHBondContact O-CG1 3.09Å; L181-V184 HydrophobicContact CD2-CB 3.69Å; L181-V184 HydrophobicContact CD2-CG1 4.35Å; L181-V184 HydrophobicContact CD2-CG2 3.65Å; L181-V184 PolarHBondContact O-N 2.7Å; V184-L186 PolarHBondContact O-N 3.08Å
185	K	76.6	Confident	83.3	Confident	146 Å²	146	63.7 Å²	63.7	64%	0.635	29%	0.285	S	S	*	.			trans	-76.4	95.4	-179.3	-166.4	173.6	-176.3	174.1	0	109.7	I187	K185-I187 HydrophobicContact CD-CD1 4.35Å; K185-I187 HydrophobicContact CG-CD1 4.31Å; K185-I187 HydrophobicContact CG-CG1 4.02Å
186	L	86.9	Confident	82.7	Confident	26 Å²	26	62.8 Å²	62.8	14%	0.136	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	131.1	166.4	-168.8	164.3	0	0	0	108.2	M160 Y174 I177 V184 S188 I213	M160-L186 HydrophobicContact CE-CD1 4.33Å; M160-L186 HydrophobicContact CE-CG 4.27Å; M160-L186 HydrophobicContact SD-CD1 3.52Å; M160-L186 VanDerWaalsContact SD-CD1 3.52Å; M160-L186 HydrophobicContact SD-CD2 3.87Å; M160-L186 HydrophobicContact SD-CG 3.79Å; Y174-L186 HydrophobicContact CE1-CD2 4.35Å; I177-L186 HydrophobicContact CD1-CD1 3.75Å; V184-L186 PolarHBondContact O-N 3.08Å; L186-S188 WeakPolarHBondContact CD2-OG 3.22Å; L186-I213 HydrophobicContact CB-CG2 4.47Å; L186-I213 HydrophobicContact CD1-CG2 3.4Å; L186-I213 VanDerWaalsContact CD1-CG2 3.4Å; L186-I213 HydrophobicContact CD2-CD1 3.7Å; L186-I213 HydrophobicContact CD2-CG2 3.44Å; L186-I213 VanDerWaalsContact CD2-CG2 3.44Å; L186-I213 HydrophobicContact CG-CG2 3.92Å
187	I	89.1	Confident	82.1	Confident	49 Å²	49	67 Å²	67	25%	0.251	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.4	-178.4	-57.6	176.7	0	0	0	108.3	Y123 K185 K189	Y123-I187 PolarHBondContact N-O 3.01Å; Y123-I187 PolarHBondContact O-N 2.98Å; K185-I187 HydrophobicContact CD-CD1 4.35Å; K185-I187 HydrophobicContact CG-CD1 4.31Å; K185-I187 HydrophobicContact CG-CG1 4.02Å; I187-K189 HydrophobicContact CG2-CD 4.3Å; I187-K189 HydrophobicContact CG2-CG 4.2Å
188	S	95.1	Very high	81.6	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.6	167.3	-56.7	0	0	0	0	109.9	H121 N122 Y174 L186 V208	H121-S188 CarbonylContact O-C 3.56Å; H121-S188 WeakPolarHBondContact O-CA 3.3Å; N122-S188 PolarHBondContact OD1-OG 2.75Å; Y174-S188 WeakPolarHBondContact CE1-OG 3.19Å; Y174-S188 WeakPolarHBondContact OH-CB 3.45Å; Y174-S188 PolarHBondContact OH-OG 2.79Å; L186-S188 WeakPolarHBondContact CD2-OG 3.22Å; S188-V208 PolarHBondContact O-N 3.35Å
189	K	95.5	Very high	81.2	Confident	49 Å²	49	73 Å²	73	21%	0.213	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	150.8	177.7	61.8	175.7	-174.2	174.7	0	112	H121 I187 T191 A205 I206	H121-K189 HydrophobicContact CB-CG 3.65Å; H121-K189 WeakPolarHBondContact CB-O 3.37Å; H121-K189 WeakPolarHBondContact CD2-CE 3.4Å; H121-K189 PolarHBondContact N-O 2.85Å; H121-K189 WeakPolarHBondContact NE2-CE 3.37Å; H121-K189 PolarHBondContact O-N 2.87Å; I187-K189 HydrophobicContact CG2-CD 4.3Å; I187-K189 HydrophobicContact CG2-CG 4.2Å; K189-T191 HydrophobicContact CD-CG2 3.85Å; K189-T191 HydrophobicContact CG-CG2 4.13Å; K189-A205 HydrophobicContact CD-CB 4.5Å; K189-I206 CarbonylContact C-O 3.53Å; K189-I206 WeakPolarHBondContact CA-O 3.3Å; K189-I206 VanDerWaalsContact CB-O 3.26Å; K189-I206 WeakPolarHBondContact CB-O 3.23Å
190	L	94.9	Very high	81.2	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.9	166.5	-165.8	79.8	0	0	0	108.3	Y56 Y91 N120 V170 A205 I206 F221	Y56-L190 HydrophobicContact CD1-CD2 3.56Å; Y56-L190 HydrophobicContact CE1-CD2 3.51Å; Y56-L190 HydrophobicContact CG-CD2 4.04Å; Y91-L190 HydrophobicContact CE2-CD1 3.87Å; Y91-L190 WeakPolarHBondContact OH-CD1 3.34Å; Y91-L190 WeakPolarHBondContact OH-CG 3.47Å; N120-L190 WeakPolarHBondContact OD1-CD1 3.39Å; V170-L190 HydrophobicContact CB-CD1 4.16Å; V170-L190 HydrophobicContact CG1-CD1 4.12Å; V170-L190 HydrophobicContact CG2-CD1 4.11Å; L190-A205 CarbonylContact O-C 3.54Å; L190-A205 WeakPolarHBondContact O-CA 3.35Å; L190-I206 HydrophobicContact CB-CB 4.3Å; L190-I206 HydrophobicContact CD2-CD1 4.3Å; L190-I206 PolarHBondContact N-O 2.91Å; L190-I206 PolarHBondContact O-N 2.81Å; L190-F221 HydrophobicContact CB-CD1 4.23Å; L190-F221 HydrophobicContact CB-CE1 4.24Å; L190-F221 HydrophobicContact CB-CG 4.35Å; L190-F221 HydrophobicContact CB-CZ 4.38Å; L190-F221 HydrophobicContact CD2-CB 4.05Å; L190-F221 HydrophobicContact CD2-CD1 4.28Å; L190-F221 HydrophobicContact CD2-CG 4.17Å
191	T	93.9	Very high	82	Confident	15 Å²	15	65 Å²	65	9%	0.092	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	147.2	173.8	66.3	0	0	0	0	110.3	Y91 G118 T119 K189 F204 A205	Y91-T191 WeakPolarHBondContact CE1-O 3.04Å; Y91-T191 PolarHBondContact OH-O 3.02Å; Y91-T191 VanDerWaalsContact OH-O 3.06Å; G118-T191 CarbonylContact C-O 3.53Å; G118-T191 WeakPolarHBondContact CA-O 3.27Å; T119-T191 WeakPolarHBondContact CB-OG1 3.37Å; T119-T191 PolarHBondContact N-O 2.96Å; T119-T191 PolarHBondContact N-OG1 2.82Å; T119-T191 VanDerWaalsContact N-OG1 3.16Å; T119-T191 PolarHBondContact O-N 3.06Å; T119-T191 PolarHBondContact O-OG1 2.92Å; T119-T191 VanDerWaalsContact O-OG1 3.08Å; K189-T191 HydrophobicContact CD-CG2 3.85Å; K189-T191 HydrophobicContact CG-CG2 4.13Å; T191-F204 WeakPolarHBondContact CA-O 3.26Å; T191-A205 HydrophobicContact CG2-CB 3.89Å
192	G	91.2	Very high	82.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	163.8	172.8	0	0	0	0	0	113.1	I117 F203 F204	I117-G192 VanDerWaalsContact O-CA 3.29Å; I117-G192 WeakPolarHBondContact O-CA 3.34Å; G192-F203 WeakPolarHBondContact O-CA 3.4Å; G192-F204 PolarHBondContact N-O 2.82Å; G192-F204 WeakPolarHBondContact O-CE1 3.33Å; G192-F204 PolarHBondContact O-N 3.06Å
193	I	87.9	Confident	84.5	Confident	16 Å²	16	62.5 Å²	62.5	8%	0.082	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	135.9	177.2	-60.8	-166.1	0	0	0	109.7	Y116 I117 Q201 K202 F203	Y116-I193 HydrophobicContact CD1-CD1 3.33Å; Y116-I193 HydrophobicContact CD1-CG1 4.07Å; Y116-I193 HydrophobicContact CE1-CD1 3.39Å; Y116-I193 HydrophobicContact CE1-CG1 3.76Å; I117-I193 PolarHBondContact O-N 2.69Å; I193-Q201 HydrophobicContact CG2-CB 3.85Å; I193-Q201 HydrophobicContact CG2-CG 3.98Å; I193-K202 CarbonylContact C-O 3.52Å; I193-K202 WeakPolarHBondContact CA-O 3.34Å; I193-F203 HydrophobicContact CD1-CD1 4Å; I193-F203 HydrophobicContact CD1-CE1 3.29Å; I193-F203 HydrophobicContact CD1-CZ 3.75Å; I193-F203 HydrophobicContact CG1-CD1 3.64Å; I193-F203 HydrophobicContact CG1-CE1 3.5Å; I193-F203 VanDerWaalsContact CG1-CE1 3.5Å; I193-F203 HydrophobicContact CG1-CZ 4.25Å
194	I	83.7	Confident	86	Confident	14 Å²	14	55.6 Å²	55.6	7%	0.072	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128.3	165	-55.7	-56.7	0	0	0	108.5	I29 Y54 K55 H92 Q201 K202 F204	I29-I194 HydrophobicContact CG2-CB 3.69Å; I29-I194 HydrophobicContact CG2-CG1 3.73Å; I29-I194 HydrophobicContact CG2-CG2 3.98Å; Y54-I194 HydrophobicContact CE1-CG1 4.09Å; K55-I194 HydrophobicContact CD-CD1 4.19Å; H92-I194 HydrophobicContact CB-CD1 4.48Å; I194-Q201 WeakPolarHBondContact O-CA 3.47Å; I194-K202 PolarHBondContact N-O 2.82Å; I194-K202 PolarHBondContact O-N 2.86Å; I194-F204 HydrophobicContact CD1-CE1 4.15Å; I194-F204 HydrophobicContact CG1-CD1 4.3Å; I194-F204 HydrophobicContact CG1-CE1 4.06Å
195	K	83.2	Confident	87.3	Confident	104 Å²	104	56.2 Å²	56.2	45%	0.452	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	123.3	169.9	-67.1	171	179.7	167.8	0	108.1	E111 S115 Q201	E111-K195 IonicContact OE1-NZ 3.16Å; E111-K195 PolarHBondContact OE1-NZ 3.24Å; S115-K195 VanDerWaalsContact CB-NZ 3.33Å; S115-K195 PolarHBondContact OG-NZ 2.74Å; K195-Q201 HydrophobicContact CG-CG 4.39Å
196	C	83.1	Confident	88.1	Confident	11 Å²	11	49.4 Å²	49.4	7%	0.074	26%	0.259	C	S	.	.			trans	-89.8	160.1	178.7	-58.4	0	0	0	0	111.2	C30 D198 G199 L200 K202	C30-C196 WeakPolarHBondContact CA-SG 3.37Å; C30-C196 HydrophobicContact CB-CB 3.62Å; C30-C196 WeakPolarHBondContact CB-SG 3.44Å; C30-C196 WeakPolarHBondContact SG-CA 3.49Å; C30-C196 WeakPolarHBondContact SG-CB 3.42Å; C30-C196 CovalentContact SG-SG 2.02Å; C30-C196 PolarHBondContact SG-SG 2.98Å; C196-D198 WeakPolarHBondContact CB-OD1 3.2Å; C196-D198 PolarHBondContact O-N 3.3Å; C196-G199 WeakPolarHBondContact O-CA 3.43Å; C196-G199 PolarHBondContact O-N 3.13Å; C196-L200 VanDerWaalsContact CB-O 3.3Å; C196-L200 WeakPolarHBondContact CB-O 3.38Å; C196-L200 PolarHBondContact N-O 3.44Å; C196-K202 WeakPolarHBondContact SG-CG 3.14Å
197	E	81.5	Confident	88.5	Confident	181 Å²	181	53.1 Å²	53.1	85%	0.846	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-31	-179.8	-64.6	-174.5	163.7	0	0	113.1	G199	E197-G199 PolarHBondContact O-N 2.84Å
198	D	83	Confident	88.9	Confident	110 Å²	110	51.2 Å²	51.2	59%	0.588	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	0.9	175	65.3	0.3	0	0	0	113.7	C196 L200	C196-D198 WeakPolarHBondContact CB-OD1 3.2Å; C196-D198 PolarHBondContact O-N 3.3Å; D198-L200 VanDerWaalsContact C-N 3.26Å; D198-L200 PolarHBondContact O-N 3.41Å; D198-L200 WeakPolarHBondContact OD1-CB 3.31Å; D198-L200 WeakPolarHBondContact OD1-CG 3.44Å; D198-L200 PolarHBondContact OD1-N 2.87Å; D198-L200 WeakPolarHBondContact OD2-CD1 3.22Å; D198-L200 WeakPolarHBondContact OD2-CG 3.47Å
199	G	79.7	Confident	88.8	Confident	60 Å²	60	52.9 Å²	52.9	62%	0.619	28%	0.277	S	S	*	.	S	Bend	trans	81	-3.3	-176	0	0	0	0	0	114.3	C196 E197	C196-G199 WeakPolarHBondContact O-CA 3.43Å; C196-G199 PolarHBondContact O-N 3.13Å; E197-G199 PolarHBondContact O-N 2.84Å
200	L	83.6	Confident	88.6	Confident	91 Å²	91	57.5 Å²	57.5	48%	0.476	30%	0.299	S	S	.	.			trans	-70.6	148.5	174.9	-62.8	-178.1	0	0	0	110.7	C196 D198	C196-L200 VanDerWaalsContact CB-O 3.3Å; C196-L200 WeakPolarHBondContact CB-O 3.38Å; C196-L200 PolarHBondContact N-O 3.44Å; D198-L200 VanDerWaalsContact C-N 3.26Å; D198-L200 PolarHBondContact O-N 3.41Å; D198-L200 WeakPolarHBondContact OD1-CB 3.31Å; D198-L200 WeakPolarHBondContact OD1-CG 3.44Å; D198-L200 PolarHBondContact OD1-N 2.87Å; D198-L200 WeakPolarHBondContact OD2-CD1 3.22Å; D198-L200 WeakPolarHBondContact OD2-CG 3.47Å
201	Q	85.5	Confident	88.4	Confident	102 Å²	102	62.9 Å²	62.9	48%	0.477	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.6	172.4	-68.7	-179.2	18.6	0	0	109.5	I193 I194 K195 F203	I193-Q201 HydrophobicContact CG2-CB 3.85Å; I193-Q201 HydrophobicContact CG2-CG 3.98Å; I194-Q201 WeakPolarHBondContact O-CA 3.47Å; K195-Q201 HydrophobicContact CG-CG 4.39Å; Q201-F203 HydrophobicContact CB-CE2 4.36Å
202	K	87	Confident	88.5	Confident	58 Å²	58	62.6 Å²	62.6	25%	0.252	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	142.6	173.9	-59.7	-67.9	-176.7	-177.7	0	109.5	I29 I193 I194 C196	I29-K202 HydrophobicContact CB-CB 4.41Å; I29-K202 HydrophobicContact CD1-CB 4.11Å; I29-K202 HydrophobicContact CG1-CB 3.98Å; I29-K202 HydrophobicContact CG2-CB 3.66Å; I29-K202 HydrophobicContact CG2-CG 4.25Å; I193-K202 CarbonylContact C-O 3.52Å; I193-K202 WeakPolarHBondContact CA-O 3.34Å; I194-K202 PolarHBondContact N-O 2.82Å; I194-K202 PolarHBondContact O-N 2.86Å; C196-K202 WeakPolarHBondContact SG-CG 3.14Å
203	F	88.6	Confident	88.6	Confident	107 Å²	107	63.3 Å²	63.3	47%	0.469	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.8	-176.7	-59.5	-101.9	0	0	0	109.5	G192 I193 Q201	G192-F203 WeakPolarHBondContact O-CA 3.4Å; I193-F203 HydrophobicContact CD1-CD1 4Å; I193-F203 HydrophobicContact CD1-CE1 3.29Å; I193-F203 HydrophobicContact CD1-CZ 3.75Å; I193-F203 HydrophobicContact CG1-CD1 3.64Å; I193-F203 HydrophobicContact CG1-CE1 3.5Å; I193-F203 VanDerWaalsContact CG1-CE1 3.5Å; I193-F203 HydrophobicContact CG1-CZ 4.25Å; Q201-F203 HydrophobicContact CB-CE2 4.36Å
204	F	89.7	Confident	88.9	Confident	5 Å²	5	67.1 Å²	67.1	2%	0.022	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	158.9	164.7	63.7	-84.7	0	0	0	109.5	I29 R36 Y54 H92 T191 G192 I194 I206	I29-F204 HydrophobicContact CD1-CB 3.92Å; I29-F204 HydrophobicContact CD1-CD1 4.37Å; R36-F204 HydrophobicContact CB-CB 4Å; Y54-F204 HydrophobicContact CD1-CB 4.19Å; Y54-F204 AromaticContact CD1-CD1 3.66Å; Y54-F204 HydrophobicContact CD1-CD1 3.66Å; Y54-F204 HydrophobicContact CD1-CD2 4.3Å; Y54-F204 HydrophobicContact CD1-CE1 4.26Å; Y54-F204 AromaticContact CD1-CG 3.73Å; Y54-F204 HydrophobicContact CD1-CG 3.73Å; Y54-F204 AromaticContact CE1-CD1 3.83Å; Y54-F204 HydrophobicContact CE1-CD1 3.83Å; Y54-F204 HydrophobicContact CE1-CE1 4.29Å; Y54-F204 HydrophobicContact CE1-CG 4.36Å; H92-F204 HydrophobicContact CB-CZ 4.33Å; H92-F204 AromaticContact CD2-CZ 3.55Å; H92-F204 AromaticContact CE1-CE2 3.18Å; H92-F204 WeakPolarHBondContact CE1-CE2 3.27Å; H92-F204 AromaticContact CE1-CZ 3.11Å; H92-F204 WeakPolarHBondContact CE1-CZ 3.45Å; H92-F204 AromaticContact CG-CZ 3.4Å; H92-F204 AromaticContact ND1-CE2 3.49Å; H92-F204 WeakPolarHBondContact ND1-CE2 3.36Å; H92-F204 AromaticContact ND1-CZ 3.02Å; H92-F204 WeakPolarHBondContact ND1-CZ 3.47Å; H92-F204 AromaticContact NE2-CE2 3.69Å; H92-F204 AromaticContact NE2-CZ 3.4Å; H92-F204 WeakPolarHBondContact NE2-CZ 3.21Å; T191-F204 WeakPolarHBondContact CA-O 3.26Å; G192-F204 PolarHBondContact N-O 2.82Å; G192-F204 WeakPolarHBondContact O-CE1 3.33Å; G192-F204 PolarHBondContact O-N 3.06Å; I194-F204 HydrophobicContact CD1-CE1 4.15Å; I194-F204 HydrophobicContact CG1-CD1 4.3Å; I194-F204 HydrophobicContact CG1-CE1 4.06Å; F204-I206 HydrophobicContact CD2-CG1 4.38Å
205	A	92.8	Very high	89.4	Confident	33 Å²	33	69.3 Å²	69.3	27%	0.273	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	130.2	179.5	0	0	0	0	0	109.4	K189 L190 T191	K189-A205 HydrophobicContact CD-CB 4.5Å; L190-A205 CarbonylContact O-C 3.54Å; L190-A205 WeakPolarHBondContact O-CA 3.35Å; T191-A205 HydrophobicContact CG2-CB 3.89Å
206	I	94.7	Very high	90.1	Very high	4 Å²	4	65 Å²	65	2%	0.021	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	109.3	176	-55	171.9	0	0	0	107	H53 Y56 M58 K189 L190 F204 F221	H53-I206 HydrophobicContact CB-CD1 3.64Å; H53-I206 HydrophobicContact CB-CG1 3.83Å; H53-I206 HydrophobicContact CB-CG2 4.14Å; Y56-I206 VanDerWaalsContact CB-CD1 3.44Å; Y56-I206 HydrophobicContact CG-CD1 4.03Å; M58-I206 HydrophobicContact SD-CG2 4.36Å; K189-I206 CarbonylContact C-O 3.53Å; K189-I206 WeakPolarHBondContact CA-O 3.3Å; K189-I206 VanDerWaalsContact CB-O 3.26Å; K189-I206 WeakPolarHBondContact CB-O 3.23Å; L190-I206 HydrophobicContact CB-CB 4.3Å; L190-I206 HydrophobicContact CD2-CD1 4.3Å; L190-I206 PolarHBondContact N-O 2.91Å; L190-I206 PolarHBondContact O-N 2.81Å; F204-I206 HydrophobicContact CD2-CG1 4.38Å; I206-F221 HydrophobicContact CB-CE1 4.19Å; I206-F221 HydrophobicContact CG2-CD1 4.19Å; I206-F221 HydrophobicContact CG2-CE1 3.63Å
207	H	95.5	Very high	90.8	Very high	103 Å²	103	64.4 Å²	64.4	48%	0.477	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	135.4	-176.7	-74.6	-104.4	0	0	0	110.8	P209	H207-P209 WeakPolarHBondContact O-CD 3.04Å
208	V	96.2	Very high	91.6	Very high	9 Å²	9	56.9 Å²	56.9	6%	0.055	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-74.1	123.6	164.8	-176.2	0	0	0	0	107.6	I60 F172 S188 E210 W212 I213 V219 F221	I60-V208 HydrophobicContact CD1-CG1 4.13Å; F172-V208 HydrophobicContact CD2-CG2 4.26Å; S188-V208 PolarHBondContact O-N 3.35Å; V208-E210 PolarHBondContact O-N 2.82Å; V208-W212 HydrophobicContact CG1-CB 4.34Å; V208-I213 HydrophobicContact CB-CD1 4.33Å; V208-I213 HydrophobicContact CB-CG1 4.44Å; V208-I213 HydrophobicContact CG1-CD1 4.31Å; V208-I213 HydrophobicContact CG1-CG1 3.88Å; V208-V219 HydrophobicContact CG1-CG2 3.82Å; V208-V219 HydrophobicContact CG2-CB 4.49Å; V208-V219 HydrophobicContact CG2-CG1 3.93Å; V208-V219 HydrophobicContact CG2-CG2 4.18Å; V208-F221 HydrophobicContact CG2-CE2 4.37Å; V208-F221 HydrophobicContact CG2-CZ 3.75Å
209	P	93.6	Very high	92.3	Very high	39 Å²	39	51.6 Å²	51.6	25%	0.253	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-65.3	133.5	179.8	-14.5	26	0	0	0	110.3	L49 H207 K211 W212	L49-P209 HydrophobicContact CD2-CG 4.43Å; H207-P209 WeakPolarHBondContact O-CD 3.04Å; P209-K211 HydrophobicContact CB-CG 4.43Å; P209-K211 PolarHBondContact O-N 2.85Å; P209-W212 WeakPolarHBondContact O-CB 3.42Å; P209-W212 PolarHBondContact O-N 2.91Å
210	E	91	Very high	93.2	Very high	146 Å²	146	50 Å²	50	68%	0.682	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-53.3	-34.1	-171.7	-172.1	178.7	167	0	0	113.2	V208 W212 I213	V208-E210 PolarHBondContact O-N 2.82Å; E210-W212 PolarHBondContact O-N 2.99Å; E210-I213 PolarHBondContact O-N 3.21Å
211	K	91.7	Very high	93.8	Very high	113 Å²	113	45.7 Å²	45.7	49%	0.491	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-57.9	-23.6	178.4	73	-176.8	-176.4	-177.5	0	114.1	E44 P209 K214	E44-K211 VanDerWaalsContact CD-NZ 3.28Å; E44-K211 WeakPolarHBondContact OE1-CE 3.29Å; E44-K211 IonicContact OE1-NZ 2.93Å; E44-K211 PolarHBondContact OE1-NZ 3.37Å; E44-K211 IonicContact OE2-NZ 3.26Å; E44-K211 PolarHBondContact OE2-NZ 3.25Å; P209-K211 HydrophobicContact CB-CG 4.43Å; P209-K211 PolarHBondContact O-N 2.85Å; K211-K214 WeakPolarHBondContact O-CE 3.28Å; K211-K214 PolarHBondContact O-NZ 2.78Å
212	W	94.6	Very high	94.1	Very high	8 Å²	8	43.4 Å²	43.4	3%	0.03	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-92.3	-13.9	180	-68	106.2	0	0	0	113.6	E44 N45 L49 I60 R62 V208 P209 E210 K214 T217	E44-W212 HydrophobicContact CG-CZ2 4.2Å; E44-W212 WeakPolarHBondContact OE1-CZ2 3.19Å; E44-W212 PolarHBondContact OE1-NE1 3.11Å; N45-W212 WeakPolarHBondContact O-CH2 3.21Å; L49-W212 HydrophobicContact CB-CH2 4.17Å; L49-W212 HydrophobicContact CB-CZ2 3.65Å; I60-W212 HydrophobicContact CB-CD2 4.3Å; I60-W212 HydrophobicContact CB-CE3 4.2Å; I60-W212 HydrophobicContact CD1-CB 3.89Å; I60-W212 HydrophobicContact CD1-CD2 4.18Å; I60-W212 HydrophobicContact CD1-CG 3.68Å; I60-W212 HydrophobicContact CG2-CB 4.01Å; I60-W212 HydrophobicContact CG2-CD2 3.76Å; I60-W212 HydrophobicContact CG2-CE3 3.43Å; I60-W212 VanDerWaalsContact CG2-CE3 3.43Å; I60-W212 HydrophobicContact CG2-CG 4.01Å; I60-W212 HydrophobicContact CG2-CZ3 4.13Å; R62-W212 HydrophobicContact CG-CE3 3.81Å; R62-W212 HydrophobicContact CG-CZ3 3.69Å; V208-W212 HydrophobicContact CG1-CB 4.34Å; P209-W212 WeakPolarHBondContact O-CB 3.42Å; P209-W212 PolarHBondContact O-N 2.91Å; E210-W212 PolarHBondContact O-N 2.99Å; W212-K214 VanDerWaalsContact C-N 3.29Å; W212-K214 PolarHBondContact O-N 3.2Å; W212-T217 WeakPolarHBondContact O-CB 3.47Å; W212-T217 VanDerWaalsContact O-CG2 3.27Å; W212-T217 WeakPolarHBondContact O-CG2 3.28Å; W212-T217 PolarHBondContact O-OG1 3.13Å
213	I	93.8	Very high	94.2	Very high	16 Å²	16	42 Å²	42	8%	0.082	22%	0.217	C	C	.	.			trans	-79.9	79.6	-177.2	-54.5	-171.7	0	0	0	109.4	Y174 L186 V208 E210	Y174-I213 HydrophobicContact CD1-CG2 3.98Å; Y174-I213 HydrophobicContact CE1-CG2 3.66Å; Y174-I213 HydrophobicContact CE2-CB 4.44Å; Y174-I213 HydrophobicContact CE2-CG1 4.32Å; Y174-I213 HydrophobicContact CE2-CG2 4.36Å; Y174-I213 HydrophobicContact CG-CG2 4.48Å; L186-I213 HydrophobicContact CB-CG2 4.47Å; L186-I213 HydrophobicContact CD1-CG2 3.4Å; L186-I213 VanDerWaalsContact CD1-CG2 3.4Å; L186-I213 HydrophobicContact CD2-CD1 3.7Å; L186-I213 HydrophobicContact CD2-CG2 3.44Å; L186-I213 VanDerWaalsContact CD2-CG2 3.44Å; L186-I213 HydrophobicContact CG-CG2 3.92Å; V208-I213 HydrophobicContact CB-CD1 4.33Å; V208-I213 HydrophobicContact CB-CG1 4.44Å; V208-I213 HydrophobicContact CG1-CD1 4.31Å; V208-I213 HydrophobicContact CG1-CG1 3.88Å; E210-I213 PolarHBondContact O-N 3.21Å
214	K	93.9	Very high	93.7	Very high	95 Å²	95	37.9 Å²	37.9	41%	0.413	20%	0.199	S	C	.	.	S	Bend	trans	-140.5	151.7	-175.3	-69.1	172.8	178.5	150.3	0	110.3	Y174 K211 W212 G216 T217	Y174-K214 WeakPolarHBondContact CB-O 3.47Å; K211-K214 WeakPolarHBondContact O-CE 3.28Å; K211-K214 PolarHBondContact O-NZ 2.78Å; W212-K214 VanDerWaalsContact C-N 3.29Å; W212-K214 PolarHBondContact O-N 3.2Å; K214-G216 PolarHBondContact O-N 3.35Å; K214-T217 VanDerWaalsContact O-CB 3.23Å; K214-T217 WeakPolarHBondContact O-CB 3.44Å; K214-T217 PolarHBondContact O-N 3.04Å; K214-T217 VanDerWaalsContact O-N 3.13Å; K214-T217 PolarHBondContact O-OG1 2.85Å
215	S	95.5	Very high	92.6	Very high	60 Å²	60	39.9 Å²	39.9	42%	0.42	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	136	176.4	-51.1	0	0	0	0	112.3	Y174 I177 T217	Y174-S215 CarbonylContact O-C 3.59Å; Y174-S215 VanDerWaalsContact O-CA 3.29Å; Y174-S215 WeakPolarHBondContact O-CA 3.37Å; I177-S215 PolarHBondContact N-OG 2.89Å; I177-S215 PolarHBondContact O-OG 3.48Å; S215-T217 VanDerWaalsContact C-N 3.32Å
216	G	96.8	Very high	91.2	Very high	13 Å²	13	46.1 Å²	46.1	13%	0.134	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	19.7	180	0	0	0	0	0	114	R62 H63 Q64 Y174 K214	R62-G216 CarbonylContact C-O 3.59Å; H63-G216 PolarHBondContact N-O 3.33Å; Q64-G216 PolarHBondContact N-O 3.31Å; Y174-G216 PolarHBondContact O-N 2.71Å; K214-G216 PolarHBondContact O-N 3.35Å
217	T	97.8	Very high	89.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.8	174.4	-49.1	0	0	0	0	110.1	I60 Q61 R62 Y173 Y174 W212 K214 S215	I60-T217 HydrophobicContact CG2-CG2 3.39Å; Q61-T217 WeakPolarHBondContact O-CA 3.46Å; Q61-T217 WeakPolarHBondContact O-CG2 3.02Å; R62-T217 HydrophobicContact CG-CG2 4.11Å; Y173-T217 WeakPolarHBondContact CD2-O 3.42Å; Y174-T217 HydrophobicContact CD2-CG2 4.45Å; Y174-T217 WeakPolarHBondContact CD2-O 3.48Å; Y174-T217 PolarHBondContact N-O 3.45Å; W212-T217 WeakPolarHBondContact O-CB 3.47Å; W212-T217 VanDerWaalsContact O-CG2 3.27Å; W212-T217 WeakPolarHBondContact O-CG2 3.28Å; W212-T217 PolarHBondContact O-OG1 3.13Å; K214-T217 VanDerWaalsContact O-CB 3.23Å; K214-T217 WeakPolarHBondContact O-CB 3.44Å; K214-T217 PolarHBondContact O-N 3.04Å; K214-T217 VanDerWaalsContact O-N 3.13Å; K214-T217 PolarHBondContact O-OG1 2.85Å; S215-T217 VanDerWaalsContact C-N 3.32Å
218	L	98.5	Very high	87.9	Confident	22 Å²	22	42.3 Å²	42.3	12%	0.115	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.3	173.4	-179.3	66.6	0	0	0	108.8	I60 Q61 Q64 F172 Y173 E220	I60-L218 CarbonylContact C-O 3.57Å; I60-L218 WeakPolarHBondContact CA-O 3.26Å; Q61-L218 PolarHBondContact N-O 3Å; Q61-L218 PolarHBondContact O-N 3.47Å; Q64-L218 HydrophobicContact CB-CB 4.12Å; Q64-L218 HydrophobicContact CG-CB 3.83Å; F172-L218 WeakPolarHBondContact O-CA 3.15Å; Y173-L218 HydrophobicContact CD2-CB 4.21Å; Y173-L218 HydrophobicContact CD2-CD1 4.28Å; L218-E220 HydrophobicContact CD2-CG 4.1Å; L218-E220 HydrophobicContact CG-CG 4.02Å
219	V	98.5	Very high	85.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.7	171.7	-178.1	0	0	0	0	107.6	M58 K59 I60 S171 F172 Y174 V208 F221	M58-V219 HydrophobicContact CG-CG1 3.95Å; M58-V219 HydrophobicContact SD-CG1 4.11Å; K59-V219 CarbonylContact O-C 3.49Å; K59-V219 WeakPolarHBondContact O-CA 3.49Å; I60-V219 HydrophobicContact CD1-CG2 4.26Å; I60-V219 HydrophobicContact CG1-CG1 4.22Å; I60-V219 HydrophobicContact CG1-CG2 4.12Å; I60-V219 HydrophobicContact CG2-CG2 4.12Å; S171-V219 CarbonylContact C-O 3.59Å; S171-V219 WeakPolarHBondContact CA-O 3.2Å; F172-V219 HydrophobicContact CB-CB 4.28Å; F172-V219 PolarHBondContact N-O 2.89Å; F172-V219 PolarHBondContact O-N 3Å; Y174-V219 HydrophobicContact CE2-CG2 3.89Å; V208-V219 HydrophobicContact CG1-CG2 3.82Å; V208-V219 HydrophobicContact CG2-CB 4.49Å; V208-V219 HydrophobicContact CG2-CG1 3.93Å; V208-V219 HydrophobicContact CG2-CG2 4.18Å; V219-F221 HydrophobicContact CG1-CD2 4.23Å; V219-F221 HydrophobicContact CG1-CE1 4.31Å; V219-F221 HydrophobicContact CG1-CE2 3.58Å; V219-F221 HydrophobicContact CG1-CZ 3.64Å
220	E	97.8	Very high	84.1	Confident	27 Å²	27	49.5 Å²	49.5	13%	0.126	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	124	178	-58.4	-177.4	107.4	0	0	109.3	M58 K59 K169 L218	M58-E220 WeakPolarHBondContact CA-O 3.33Å; K59-E220 HydrophobicContact CB-CB 4.38Å; K59-E220 PolarHBondContact N-O 2.75Å; K59-E220 IonicContact NZ-OE2 3.15Å; K59-E220 PolarHBondContact NZ-OE2 2.82Å; K59-E220 PolarHBondContact O-N 3.4Å; K169-E220 HydrophobicContact CD-CB 4.22Å; K169-E220 HydrophobicContact CD-CG 4.46Å; K169-E220 WeakPolarHBondContact CE-OE1 3.28Å; K169-E220 IonicContact NZ-OE1 2.68Å; K169-E220 PolarHBondContact NZ-OE1 2.62Å; L218-E220 HydrophobicContact CD2-CG 4.1Å; L218-E220 HydrophobicContact CG-CG 4.02Å
221	F	96	Very high	82.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.9	170.7	-59.2	-82	0	0	0	108.8	Y56 S57 M58 K169 V170 F172 L190 I206 V208 V219	Y56-F221 HydrophobicContact CD1-CB 3.94Å; Y56-F221 HydrophobicContact CE1-CB 4.38Å; S57-F221 WeakPolarHBondContact O-CA 3.5Å; M58-F221 HydrophobicContact CB-CD1 4.14Å; M58-F221 HydrophobicContact CB-CE1 4.14Å; M58-F221 HydrophobicContact CG-CD1 4.14Å; M58-F221 HydrophobicContact CG-CE1 3.79Å; M58-F221 HydrophobicContact CG-CZ 4.43Å; M58-F221 HydrophobicContact SD-CE1 3.61Å; M58-F221 HydrophobicContact SD-CZ 4.02Å; K169-F221 WeakPolarHBondContact CA-O 3.45Å; K169-F221 WeakPolarHBondContact CG-O 3.25Å; V170-F221 HydrophobicContact CB-CB 4.32Å; V170-F221 HydrophobicContact CB-CD2 4.46Å; V170-F221 PolarHBondContact N-O 2.98Å; V170-F221 PolarHBondContact O-N 3.47Å; F172-F221 AromaticContact CD2-CE2 3.64Å; F172-F221 HydrophobicContact CD2-CE2 3.64Å; F172-F221 HydrophobicContact CD2-CZ 4.4Å; F172-F221 HydrophobicContact CE2-CD2 4.44Å; F172-F221 AromaticContact CE2-CE2 3.55Å; F172-F221 HydrophobicContact CE2-CE2 3.55Å; F172-F221 HydrophobicContact CE2-CZ 4.23Å; F172-F221 HydrophobicContact CG-CE2 4.36Å; F172-F221 HydrophobicContact CZ-CE2 4.19Å; L190-F221 HydrophobicContact CB-CD1 4.23Å; L190-F221 HydrophobicContact CB-CE1 4.24Å; L190-F221 HydrophobicContact CB-CG 4.35Å; L190-F221 HydrophobicContact CB-CZ 4.38Å; L190-F221 HydrophobicContact CD2-CB 4.05Å; L190-F221 HydrophobicContact CD2-CD1 4.28Å; L190-F221 HydrophobicContact CD2-CG 4.17Å; I206-F221 HydrophobicContact CB-CE1 4.19Å; I206-F221 HydrophobicContact CG2-CD1 4.19Å; I206-F221 HydrophobicContact CG2-CE1 3.63Å; V208-F221 HydrophobicContact CG2-CE2 4.37Å; V208-F221 HydrophobicContact CG2-CZ 3.75Å; V219-F221 HydrophobicContact CG1-CD2 4.23Å; V219-F221 HydrophobicContact CG1-CE1 4.31Å; V219-F221 HydrophobicContact CG1-CE2 3.58Å; V219-F221 HydrophobicContact CG1-CZ 3.64Å
222	Q	92.5	Very high	80.9	Confident	54 Å²	54	46.7 Å²	46.7	25%	0.252	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	126.9	177.5	-176.7	66.2	59.6	0	0	108.9	Y56 S57 N167 K169 I224	Y56-Q222 WeakPolarHBondContact CA-O 3.34Å; S57-Q222 PolarHBondContact N-O 3.21Å; S57-Q222 PolarHBondContact O-N 2.84Å; S57-Q222 PolarHBondContact OG-O 3.29Å; N167-Q222 PolarHBondContact ND2-OE1 3.43Å; N167-Q222 PolarHBondContact O-NE2 3.49Å; K169-Q222 VanDerWaalsContact CB-OE1 3.28Å; Q222-I224 PolarHBondContact O-N 2.83Å
223	A	88	Confident	79.4	Confident	28 Å²	28	48.9 Å²	48.9	23%	0.231	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	124.7	171.3	0	0	0	0	0	109	Y56	Y56-A223 HydrophobicContact CE1-CB 4.24Å; Y56-A223 HydrophobicContact CE2-CB 4Å
224	I	79.9	Confident	78	Confident	21 Å²	21	49.2 Å²	49.2	11%	0.108	27%	0.268	C	S	.	.			trans	-74.2	141.9	167.7	-71.6	160.1	0	0	0	106.5	K55 Y56 Q222 F248	K55-I224 PolarHBondContact O-N 3.23Å; Y56-I224 VanDerWaalsContact O-CD1 3.23Å; Y56-I224 WeakPolarHBondContact O-CD1 3.41Å; Q222-I224 PolarHBondContact O-N 2.83Å; I224-F248 HydrophobicContact CB-CD2 4.37Å; I224-F248 HydrophobicContact CB-CE2 4Å; I224-F248 HydrophobicContact CD1-CD2 4.25Å; I224-F248 HydrophobicContact CD1-CE1 3.97Å; I224-F248 HydrophobicContact CD1-CE2 3.38Å; I224-F248 HydrophobicContact CD1-CZ 3.18Å; I224-F248 HydrophobicContact CG1-CE2 3.69Å; I224-F248 HydrophobicContact CG1-CZ 3.99Å; I224-F248 HydrophobicContact CG2-CD2 3.14Å; I224-F248 HydrophobicContact CG2-CE2 3.11Å; I224-F248 HydrophobicContact CG2-CG 4.14Å; I224-F248 HydrophobicContact CG2-CZ 4.09Å
225	G	66.4	Low	76.8	Confident	46 Å²	46	51.4 Å²	51.4	47%	0.474	28%	0.279	S	S	.	.			trans	-62	-164.8	176.1	0	0	0	0	0	113.6	F227	G225-F227 PolarHBondContact O-N 2.96Å
226	E	61.9	Low	75.7	Confident	164 Å²	164	51.2 Å²	51.2	77%	0.766	28%	0.276	S	S	*	.			trans	-59.1	135.8	-178.8	-64.9	-177	165.3	0	0	111.8	C228	E226-C228 PolarHBondContact O-N 2.82Å
227	F	61.3	Low	74.3	Confident	14 Å²	14	50.6 Å²	50.6	6%	0.061	27%	0.27	C	S	.	.			trans	-64.6	129.9	165.5	-72	-109.6	0	0	0	107	N27 Y54 K55 G225 L229 F248 I253	N27-F227 HydrophobicContact CB-CB 4.48Å; N27-F227 WeakPolarHBondContact OD1-CD2 3.47Å; N27-F227 VanDerWaalsContact OD1-CE2 3.31Å; N27-F227 WeakPolarHBondContact OD1-CE2 3.18Å; N27-F227 WeakPolarHBondContact OD1-CG 3.32Å; Y54-F227 HydrophobicContact CD2-CZ 4.45Å; K55-F227 HydrophobicContact CG-CE2 3.94Å; G225-F227 PolarHBondContact O-N 2.96Å; F227-L229 HydrophobicContact CB-CG 4.48Å; F227-L229 PolarHBondContact O-N 3.27Å; F227-F248 HydrophobicContact CD1-CB 3.5Å; F227-F248 HydrophobicContact CD1-CG 4.45Å; F227-F248 HydrophobicContact CE1-CB 3.76Å; F227-F248 HydrophobicContact CE1-CD1 4.49Å; F227-F248 HydrophobicContact CE1-CG 4.28Å; F227-F248 HydrophobicContact CG-CB 4.13Å; F227-I253 HydrophobicContact CD1-CD1 4.08Å; F227-I253 HydrophobicContact CE1-CD1 3.76Å
228	C	60	Low	72.9	Confident	14 Å²	14	54.3 Å²	54.3	10%	0.095	29%	0.287	C	S	.	.			trans	-84.3	74.5	-173.3	-62	0	0	0	0	109.1	E226 Q230 Y231 C247 F248	E226-C228 PolarHBondContact O-N 2.82Å; C228-Q230 PolarHBondContact O-N 3.23Å; C228-Q230 VanDerWaalsContact O-N 3.13Å; C228-Y231 HydrophobicContact CB-CD2 3.63Å; C228-Y231 HydrophobicContact CB-CE2 3.94Å; C228-Y231 PolarHBondContact O-N 2.8Å; C228-C247 HydrophobicContact CB-CB 3.57Å; C228-C247 WeakPolarHBondContact CB-SG 3.42Å; C228-C247 WeakPolarHBondContact SG-CA 3.37Å; C228-C247 WeakPolarHBondContact SG-CB 3.45Å; C228-C247 CovalentContact SG-SG 2.02Å; C228-C247 PolarHBondContact SG-SG 2.64Å; C228-F248 PolarHBondContact N-O 2.85Å
229	L	53.7	Low	71.7	Confident	67 Å²	67	59.2 Å²	59.2	35%	0.351	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.2	-177.4	-65.6	170.4	0	0	0	113.9	N27 F227 Y231	N27-L229 HydrophobicContact CB-CD1 4.16Å; N27-L229 HydrophobicContact CB-CD2 3.83Å; N27-L229 HydrophobicContact CB-CG 4.42Å; F227-L229 HydrophobicContact CB-CG 4.48Å; F227-L229 PolarHBondContact O-N 3.27Å; L229-Y231 VanDerWaalsContact C-N 3.27Å; L229-Y231 PolarHBondContact O-N 2.72Å
230	Q	55.8	Low	70.1	Confident	131 Å²	131	60.1 Å²	60.1	61%	0.612	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-5.2	-177.9	68.3	-171.4	2.3	0	0	113.7	C228	C228-Q230 PolarHBondContact O-N 3.23Å; C228-Q230 VanDerWaalsContact O-N 3.13Å
231	Y	60.2	Low	68.5	Low	70 Å²	70	63.5 Å²	63.5	28%	0.275	34%	0.335	S	S	.	.			trans	-115.3	111.6	-176	-60.4	-62.3	0	0	0	110.3	C228 L229 T233 T236 C237 A240	C228-Y231 HydrophobicContact CB-CD2 3.63Å; C228-Y231 HydrophobicContact CB-CE2 3.94Å; C228-Y231 PolarHBondContact O-N 2.8Å; L229-Y231 VanDerWaalsContact C-N 3.27Å; L229-Y231 PolarHBondContact O-N 2.72Å; Y231-T233 PolarHBondContact O-N 2.83Å; Y231-T236 WeakPolarHBondContact CB-OG1 3.19Å; Y231-C237 HydrophobicContact CD2-CB 4.3Å; Y231-C237 HydrophobicContact CG-CB 4.32Å; Y231-A240 HydrophobicContact CD2-CB 3.72Å; Y231-A240 HydrophobicContact CE1-CB 4.07Å; Y231-A240 HydrophobicContact CE2-CB 3.01Å; Y231-A240 HydrophobicContact CG-CB 4.48Å; Y231-A240 WeakPolarHBondContact OH-CB 3.45Å
232	D	56.8	Low	66.8	Low	131 Å²	131	66.6 Å²	66.6	70%	0.701	35%	0.354	S	S	*	.	S	Bend	trans	-73.4	-12.4	-175.9	-58.9	-26	0	0	0	112.6
233	T	61.7	Low	64.8	Low	53 Å²	53	71 Å²	71	33%	0.325	39%	0.388	S	S	.	.	S	Bend	trans	-129.3	149.8	-178.7	69.5	0	0	0	0	112.9	Y231 E235 T236 C237 E251	Y231-T233 PolarHBondContact O-N 2.83Å; T233-E235 PolarHBondContact O-N 2.85Å; T233-T236 PolarHBondContact N-OG1 3.29Å; T233-T236 PolarHBondContact O-N 2.84Å; T233-T236 PolarHBondContact O-OG1 2.77Å; T233-T236 WeakPolarHBondContact OG1-CG2 3.45Å; T233-T236 PolarHBondContact OG1-N 3.32Å; T233-T236 PolarHBondContact OG1-OG1 2.97Å; T233-C237 WeakPolarHBondContact O-CB 3.3Å; T233-C237 PolarHBondContact O-N 2.89Å; T233-E251 WeakPolarHBondContact CA-OE1 3.41Å
234	S	65.8	Low	62.8	Low	23 Å²	23	76 Å²	76	16%	0.161	42%	0.415	C	S	.	.	H	α-helix	trans	-53.4	-39.4	173.3	171.5	0	0	0	0	111.5	Q238 E251	S234-Q238 VanDerWaalsContact O-CB 3.24Å; S234-Q238 WeakPolarHBondContact O-CB 3.45Å; S234-Q238 WeakPolarHBondContact O-CG 3.46Å; S234-Q238 PolarHBondContact O-N 3.38Å; S234-Q238 PolarHBondContact OG-NE2 3.19Å; S234-E251 WeakPolarHBondContact CA-OE2 3.48Å; S234-E251 WeakPolarHBondContact CB-OE2 2.92Å; S234-E251 PolarHBondContact N-OE2 2.82Å
235	E	68.9	Low	61.5	Low	141 Å²	141	77.6 Å²	77.6	66%	0.659	43%	0.426	S	S	*	.	H	α-helix	trans	-65.5	-50.6	179.4	-172.4	178.3	-173.8	0	0	111.7	T233 C237 Q238 N239	T233-E235 PolarHBondContact O-N 2.85Å; E235-C237 VanDerWaalsContact C-N 3.33Å; E235-C237 PolarHBondContact O-N 2.54Å; E235-Q238 PolarHBondContact O-N 2.98Å; E235-N239 WeakPolarHBondContact O-CB 3.32Å; E235-N239 PolarHBondContact O-N 2.97Å; E235-N239 PolarHBondContact O-ND2 3.3Å
236	T	71.8	Confident	61.1	Low	57 Å²	57	78.6 Å²	78.6	35%	0.35	42%	0.423	S	S	.	.	H	α-helix	trans	-65.2	-39	179.9	52.1	0	0	0	0	111.7	Y231 T233 N239 A240	Y231-T236 WeakPolarHBondContact CB-OG1 3.19Å; T233-T236 PolarHBondContact N-OG1 3.29Å; T233-T236 PolarHBondContact O-N 2.84Å; T233-T236 PolarHBondContact O-OG1 2.77Å; T233-T236 WeakPolarHBondContact OG1-CG2 3.45Å; T233-T236 PolarHBondContact OG1-N 3.32Å; T233-T236 PolarHBondContact OG1-OG1 2.97Å; T236-N239 PolarHBondContact O-N 2.83Å; T236-A240 PolarHBondContact O-N 3.36Å; T236-A240 VanDerWaalsContact O-N 3.12Å
237	C	68	Low	61	Low	0 Å²	0	71.1 Å²	71.1	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-66.8	-40.6	175.1	167.6	0	0	0	0	113	Y231 T233 E235 N239 A240 C249	Y231-C237 HydrophobicContact CD2-CB 4.3Å; Y231-C237 HydrophobicContact CG-CB 4.32Å; T233-C237 WeakPolarHBondContact O-CB 3.3Å; T233-C237 PolarHBondContact O-N 2.89Å; E235-C237 VanDerWaalsContact C-N 3.33Å; E235-C237 PolarHBondContact O-N 2.54Å; C237-N239 VanDerWaalsContact C-N 3.34Å; C237-A240 PolarHBondContact O-N 2.68Å; C237-C249 HydrophobicContact CB-CB 3.56Å; C237-C249 WeakPolarHBondContact CB-SG 3.49Å; C237-C249 WeakPolarHBondContact SG-CA 3.38Å; C237-C249 WeakPolarHBondContact SG-CB 3.34Å; C237-C249 PolarHBondContact SG-N 2.81Å; C237-C249 VanDerWaalsContact SG-N 3.4Å; C237-C249 CovalentContact SG-SG 2.02Å; C237-C249 PolarHBondContact SG-SG 2.83Å
238	Q	68.2	Low	61.1	Low	77 Å²	77	70.9 Å²	70.9	36%	0.36	39%	0.388	S	S	.	.	H	α-helix	trans	-65.5	-39.3	176	-77.6	-178.7	47.2	0	0	111.7	S234 E235 A240 K241 K252	S234-Q238 VanDerWaalsContact O-CB 3.24Å; S234-Q238 WeakPolarHBondContact O-CB 3.45Å; S234-Q238 WeakPolarHBondContact O-CG 3.46Å; S234-Q238 PolarHBondContact O-N 3.38Å; S234-Q238 PolarHBondContact OG-NE2 3.19Å; E235-Q238 PolarHBondContact O-N 2.98Å; Q238-A240 PolarHBondContact O-N 3.4Å; Q238-K241 WeakPolarHBondContact O-CB 3.32Å; Q238-K241 WeakPolarHBondContact O-CG 3.39Å; Q238-K241 PolarHBondContact O-N 3.01Å; Q238-K252 VanDerWaalsContact NE2-CE 3.29Å; Q238-K252 VanDerWaalsContact NE2-NZ 3.12Å
239	N	72	Confident	61.4	Low	125 Å²	125	70.6 Å²	70.6	67%	0.668	39%	0.385	S	S	*	.	H	α-helix	trans	-68.2	-22.2	177.3	-69.7	-22.3	0	0	0	113.1	E235 T236 C237 K241	E235-N239 WeakPolarHBondContact O-CB 3.32Å; E235-N239 PolarHBondContact O-N 2.97Å; E235-N239 PolarHBondContact O-ND2 3.3Å; T236-N239 PolarHBondContact O-N 2.83Å; C237-N239 VanDerWaalsContact C-N 3.34Å; N239-K241 VanDerWaalsContact C-N 3.3Å
240	A	65.7	Low	61.9	Low	19 Å²	19	68.5 Å²	68.5	16%	0.157	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-6.6	176.7	0	0	0	0	0	114.6	Y231 T236 C237 Q238 T242	Y231-A240 HydrophobicContact CD2-CB 3.72Å; Y231-A240 HydrophobicContact CE1-CB 4.07Å; Y231-A240 HydrophobicContact CE2-CB 3.01Å; Y231-A240 HydrophobicContact CG-CB 4.48Å; Y231-A240 WeakPolarHBondContact OH-CB 3.45Å; T236-A240 PolarHBondContact O-N 3.36Å; T236-A240 VanDerWaalsContact O-N 3.12Å; C237-A240 PolarHBondContact O-N 2.68Å; Q238-A240 PolarHBondContact O-N 3.4Å; A240-T242 PolarHBondContact O-N 3.33Å; A240-T242 VanDerWaalsContact O-N 3.16Å
241	K	64.3	Low	62.2	Low	98 Å²	98	65.6 Å²	65.6	43%	0.426	36%	0.363	S	S	.	.			trans	-62.4	118.9	176.5	-68.9	178.1	179.4	-178.8	0	109.4	Q238 N239 C247	Q238-K241 WeakPolarHBondContact O-CB 3.32Å; Q238-K241 WeakPolarHBondContact O-CG 3.39Å; Q238-K241 PolarHBondContact O-N 3.01Å; N239-K241 VanDerWaalsContact C-N 3.3Å; K241-C247 WeakPolarHBondContact CE-O 3.49Å; K241-C247 HydrophobicContact CG-CB 4.08Å
242	T	59.1	Low	62.4	Low	66 Å²	66	65.9 Å²	65.9	41%	0.405	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-98.5	163.9	170.1	69.5	0	0	0	0	109.3	A240 T244 T245	A240-T242 PolarHBondContact O-N 3.33Å; A240-T242 VanDerWaalsContact O-N 3.16Å; T242-T244 PolarHBondContact O-N 2.8Å; T242-T244 PolarHBondContact OG1-OG1 2.92Å; T242-T245 PolarHBondContact N-O 2.98Å; T242-T245 PolarHBondContact O-N 3.05Å; T242-T245 VanDerWaalsContact O-N 3.13Å; T242-T245 WeakPolarHBondContact OG1-CB 3.46Å; T242-T245 PolarHBondContact OG1-N 3.13Å; T242-T245 PolarHBondContact OG1-OG1 2.78Å
243	P	52	Low	62.8	Low	147 Å²	147	60.1 Å²	60.1	96%	0.955	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-22.2	175.2	-26.7	35.1	0	0	0	114.2
244	T	45	Very low	62.9	Low	132 Å²	132	61.9 Å²	61.9	81%	0.81	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-16.2	-179	51.6	0	0	0	0	113.8	T242	T242-T244 PolarHBondContact O-N 2.8Å; T242-T244 PolarHBondContact OG1-OG1 2.92Å
245	T	53.5	Low	63	Low	55 Å²	55	67.3 Å²	67.3	34%	0.337	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-122.7	107.7	-174.4	-51.6	0	0	0	0	110	T242 C247	T242-T245 PolarHBondContact N-O 2.98Å; T242-T245 PolarHBondContact O-N 3.05Å; T242-T245 VanDerWaalsContact O-N 3.13Å; T242-T245 WeakPolarHBondContact OG1-CB 3.46Å; T242-T245 PolarHBondContact OG1-N 3.13Å; T242-T245 PolarHBondContact OG1-OG1 2.78Å; T245-C247 PolarHBondContact O-N 2.83Å
246	T	58.4	Low	63	Low	67 Å²	67	63 Å²	63	41%	0.411	34%	0.341	S	S	.	.			trans	-85.8	100.4	169.9	-54.3	0	0	0	0	108.8	F248	T246-F248 HydrophobicContact CG2-CD2 4.43Å; T246-F248 HydrophobicContact CG2-CE2 3.89Å
247	C	59.2	Low	62.7	Low	6 Å²	6	63.1 Å²	63.1	4%	0.041	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-72.3	131.1	173.1	-78.1	0	0	0	0	111.8	C228 K241 T245	C228-C247 HydrophobicContact CB-CB 3.57Å; C228-C247 WeakPolarHBondContact CB-SG 3.42Å; C228-C247 WeakPolarHBondContact SG-CA 3.37Å; C228-C247 WeakPolarHBondContact SG-CB 3.45Å; C228-C247 CovalentContact SG-SG 2.02Å; C228-C247 PolarHBondContact SG-SG 2.64Å; K241-C247 WeakPolarHBondContact CE-O 3.49Å; K241-C247 HydrophobicContact CG-CB 4.08Å; T245-C247 PolarHBondContact O-N 2.83Å
248	F	63.7	Low	62.6	Low	10 Å²	10	70 Å²	70	4%	0.044	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-96.7	128.2	167.3	-86.4	-103.1	0	0	0	110.5	H52 I224 F227 C228 T246	H52-F248 HydrophobicContact CB-CE1 3.52Å; H52-F248 HydrophobicContact CB-CZ 3.64Å; H52-F248 AromaticContact CD2-CZ 3.67Å; H52-F248 AromaticContact CE1-CZ 3.5Å; H52-F248 VanDerWaalsContact CE1-CZ 3.5Å; H52-F248 WeakPolarHBondContact CE1-CZ 3Å; H52-F248 AromaticContact CG-CE1 3.59Å; H52-F248 AromaticContact CG-CZ 3.27Å; H52-F248 AromaticContact ND1-CE1 3.42Å; H52-F248 WeakPolarHBondContact ND1-CE1 3.45Å; H52-F248 AromaticContact ND1-CZ 3.16Å; H52-F248 WeakPolarHBondContact ND1-CZ 3.47Å; H52-F248 AromaticContact NE2-CZ 3.79Å; I224-F248 HydrophobicContact CB-CD2 4.37Å; I224-F248 HydrophobicContact CB-CE2 4Å; I224-F248 HydrophobicContact CD1-CD2 4.25Å; I224-F248 HydrophobicContact CD1-CE1 3.97Å; I224-F248 HydrophobicContact CD1-CE2 3.38Å; I224-F248 HydrophobicContact CD1-CZ 3.18Å; I224-F248 HydrophobicContact CG1-CE2 3.69Å; I224-F248 HydrophobicContact CG1-CZ 3.99Å; I224-F248 HydrophobicContact CG2-CD2 3.14Å; I224-F248 HydrophobicContact CG2-CE2 3.11Å; I224-F248 HydrophobicContact CG2-CG 4.14Å; I224-F248 HydrophobicContact CG2-CZ 4.09Å; F227-F248 HydrophobicContact CD1-CB 3.5Å; F227-F248 HydrophobicContact CD1-CG 4.45Å; F227-F248 HydrophobicContact CE1-CB 3.76Å; F227-F248 HydrophobicContact CE1-CD1 4.49Å; F227-F248 HydrophobicContact CE1-CG 4.28Å; F227-F248 HydrophobicContact CG-CB 4.13Å; C228-F248 PolarHBondContact N-O 2.85Å; T246-F248 HydrophobicContact CG2-CD2 4.43Å; T246-F248 HydrophobicContact CG2-CE2 3.89Å
249	C	65.6	Low	62.8	Low	7 Å²	7	70.8 Å²	70.8	5%	0.047	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-100.6	126.4	-172.1	-46.4	0	0	0	0	110.1	C237 E251 K252	C237-C249 HydrophobicContact CB-CB 3.56Å; C237-C249 WeakPolarHBondContact CB-SG 3.49Å; C237-C249 WeakPolarHBondContact SG-CA 3.38Å; C237-C249 WeakPolarHBondContact SG-CB 3.34Å; C237-C249 PolarHBondContact SG-N 2.81Å; C237-C249 VanDerWaalsContact SG-N 3.4Å; C237-C249 CovalentContact SG-SG 2.02Å; C237-C249 PolarHBondContact SG-SG 2.83Å; C249-E251 PolarHBondContact O-N 3.33Å; C249-K252 PolarHBondContact O-N 2.84Å
250	C	64	Low	62.5	Low	24 Å²	24	65.5 Å²	65.5	16%	0.162	34%	0.344	C	S	.	.	H	α-helix	trans	-55.1	-43.6	-176.7	-73.4	0	0	0	0	114	C26 K252 I253 E254	C26-C250 HydrophobicContact CB-CB 3.86Å; C26-C250 WeakPolarHBondContact CB-SG 3.48Å; C26-C250 WeakPolarHBondContact SG-CB 3.5Å; C26-C250 CovalentContact SG-SG 2.03Å; C26-C250 PolarHBondContact SG-SG 2.87Å; C250-K252 VanDerWaalsContact C-N 3.26Å; C250-K252 PolarHBondContact O-N 2.91Å; C250-I253 WeakPolarHBondContact O-CA 3.17Å; C250-I253 VanDerWaalsContact O-CB 3.26Å; C250-I253 WeakPolarHBondContact O-CB 3.07Å; C250-I253 PolarHBondContact O-N 3.34Å; C250-E254 PolarHBondContact O-N 2.67Å
251	E	62.7	Low	62.4	Low	70 Å²	70	67.3 Å²	67.3	33%	0.327	35%	0.349	S	S	.	.	H	α-helix	trans	-57	-39.7	-177	-69.1	-178.5	164.7	0	0	112.5	T233 S234 C249 I253 E254 E255	T233-E251 WeakPolarHBondContact CA-OE1 3.41Å; S234-E251 WeakPolarHBondContact CA-OE2 3.48Å; S234-E251 WeakPolarHBondContact CB-OE2 2.92Å; S234-E251 PolarHBondContact N-OE2 2.82Å; C249-E251 PolarHBondContact O-N 3.33Å; E251-I253 PolarHBondContact O-N 2.81Å; E251-E254 PolarHBondContact O-N 3.3Å; E251-E254 VanDerWaalsContact O-N 3.15Å; E251-E255 PolarHBondContact O-N 3.07Å
252	K	65	Low	62.4	Low	76 Å²	76	70.3 Å²	70.3	33%	0.33	36%	0.359	S	S	.	.	H	α-helix	trans	-66.6	-24.6	178	-67.9	-167.3	177.4	-172.6	0	113.1	Q238 C249 C250 K256	Q238-K252 VanDerWaalsContact NE2-CE 3.29Å; Q238-K252 VanDerWaalsContact NE2-NZ 3.12Å; C249-K252 PolarHBondContact O-N 2.84Å; C250-K252 VanDerWaalsContact C-N 3.26Å; C250-K252 PolarHBondContact O-N 2.91Å; K252-K256 PolarHBondContact O-N 2.99Å
253	I	64.3	Low	62.7	Low	9 Å²	9	72.7 Å²	72.7	5%	0.046	37%	0.365	C	S	.	.	H	α-helix	trans	-75.2	-41	175.6	-60.9	175.4	0	0	0	109.4	L35 Y38 F227 C250 E251 K256 K257	L35-I253 HydrophobicContact CD2-CG2 3.33Å; Y38-I253 HydrophobicContact CD2-CG2 4.37Å; Y38-I253 HydrophobicContact CE2-CB 4.44Å; Y38-I253 HydrophobicContact CE2-CG1 4.08Å; F227-I253 HydrophobicContact CD1-CD1 4.08Å; F227-I253 HydrophobicContact CE1-CD1 3.76Å; C250-I253 WeakPolarHBondContact O-CA 3.17Å; C250-I253 VanDerWaalsContact O-CB 3.26Å; C250-I253 WeakPolarHBondContact O-CB 3.07Å; C250-I253 PolarHBondContact O-N 3.34Å; E251-I253 PolarHBondContact O-N 2.81Å; I253-K256 PolarHBondContact O-N 3.25Å; I253-K257 WeakPolarHBondContact O-CB 3.47Å; I253-K257 PolarHBondContact O-N 3.15Å
254	E	64.1	Low	63.1	Low	91 Å²	91	71 Å²	71	43%	0.425	34%	0.341	S	S	.	.	H	α-helix	trans	-64.7	-45.1	177.5	-66.9	-170.1	159.7	0	0	112.1	C250 E251 K256 K257 E258	C250-E254 PolarHBondContact O-N 2.67Å; E251-E254 PolarHBondContact O-N 3.3Å; E251-E254 VanDerWaalsContact O-N 3.15Å; E254-K256 VanDerWaalsContact C-N 3.29Å; E254-K256 PolarHBondContact O-N 3.34Å; E254-K257 WeakPolarHBondContact O-CB 3.4Å; E254-K257 PolarHBondContact O-N 3.33Å; E254-E258 PolarHBondContact O-N 2.98Å
255	E	66.7	Low	63.8	Low	137 Å²	137	70.4 Å²	70.4	64%	0.64	33%	0.329	S	S	*	.	H	α-helix	trans	-56.4	-44.6	174.3	-70.3	176	169.6	0	0	111.4	E251 K257 E258 E259	E251-E255 PolarHBondContact O-N 3.07Å; E255-K257 VanDerWaalsContact C-N 3.32Å; E255-K257 PolarHBondContact O-N 2.86Å; E255-E258 PolarHBondContact O-N 2.65Å; E255-E259 PolarHBondContact O-N 3.48Å
256	K	70	Confident	63.9	Low	51 Å²	51	71 Å²	71	22%	0.222	33%	0.33	C	S	.	.	H	α-helix	trans	-70	-30.5	178.4	-162.8	71.2	-163.5	167	0	112.2	Y38 E39 K252 I253 E254 E259 I260	Y38-K256 HydrophobicContact CD2-CB 4.2Å; Y38-K256 HydrophobicContact CD2-CG 4.15Å; Y38-K256 HydrophobicContact CE2-CB 3.98Å; Y38-K256 HydrophobicContact CE2-CG 4.14Å; E39-K256 VanDerWaalsContact O-CE 3.23Å; E39-K256 WeakPolarHBondContact O-CE 3.1Å; K252-K256 PolarHBondContact O-N 2.99Å; I253-K256 PolarHBondContact O-N 3.25Å; E254-K256 VanDerWaalsContact C-N 3.29Å; E254-K256 PolarHBondContact O-N 3.34Å; K256-E259 WeakPolarHBondContact CD-OE2 3.48Å; K256-E259 WeakPolarHBondContact CE-OE2 3.47Å; K256-E259 IonicContact NZ-OE1 3.61Å; K256-E259 PolarHBondContact NZ-OE1 2.91Å; K256-E259 IonicContact NZ-OE2 3.96Å; K256-E259 PolarHBondContact NZ-OE2 2.82Å; K256-E259 WeakPolarHBondContact O-CB 3.23Å; K256-E259 PolarHBondContact O-N 2.92Å; K256-I260 HydrophobicContact CG-CD1 4.21Å; K256-I260 VanDerWaalsContact O-CG1 3.26Å; K256-I260 WeakPolarHBondContact O-CG1 3.38Å; K256-I260 PolarHBondContact O-N 2.88Å
257	K	66.2	Low	63.8	Low	58 Å²	58	71.2 Å²	71.2	25%	0.252	33%	0.334	S	S	.	.	H	α-helix	trans	-65.1	-44.8	176.3	178	-176.2	178.6	170	0	111.4	D32 Y34 I253 E254 E255 E259 I260 E261	D32-K257 VanDerWaalsContact CG-NZ 3.32Å; D32-K257 IonicContact OD1-NZ 3.4Å; D32-K257 PolarHBondContact OD1-NZ 2.85Å; D32-K257 WeakPolarHBondContact OD2-CD 3.49Å; D32-K257 WeakPolarHBondContact OD2-CE 3.43Å; D32-K257 IonicContact OD2-NZ 2.75Å; D32-K257 PolarHBondContact OD2-NZ 2.83Å; Y34-K257 HydrophobicContact CD2-CG 4.49Å; Y34-K257 HydrophobicContact CG-CG 4.48Å; I253-K257 WeakPolarHBondContact O-CB 3.47Å; I253-K257 PolarHBondContact O-N 3.15Å; E254-K257 WeakPolarHBondContact O-CB 3.4Å; E254-K257 PolarHBondContact O-N 3.33Å; E255-K257 VanDerWaalsContact C-N 3.32Å; E255-K257 PolarHBondContact O-N 2.86Å; K257-E259 PolarHBondContact O-N 2.84Å; K257-I260 PolarHBondContact O-N 2.88Å; K257-E261 WeakPolarHBondContact CE-OE1 3.42Å; K257-E261 HydrophobicContact CG-CG 4.32Å; K257-E261 WeakPolarHBondContact O-CB 3.01Å; K257-E261 WeakPolarHBondContact O-CG 3.49Å; K257-E261 PolarHBondContact O-N 3.46Å
258	E	66	Low	63.3	Low	146 Å²	146	74.1 Å²	74.1	68%	0.682	37%	0.365	S	S	*	.	H	α-helix	trans	-58.9	-39.4	176.6	-68.5	-174.7	169.3	0	0	111.5	E254 E255 Y262	E254-E258 PolarHBondContact O-N 2.98Å; E255-E258 PolarHBondContact O-N 2.65Å; E258-Y262 WeakPolarHBondContact O-CB 3.42Å; E258-Y262 PolarHBondContact O-N 2.88Å; E258-Y262 VanDerWaalsContact O-N 3.09Å
259	E	70.9	Confident	62.3	Low	92 Å²	92	82.4 Å²	82.4	43%	0.43	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-45.5	174.9	-166.8	-176.3	161	0	0	112	E255 K256 K257 Y262 E263	E255-E259 PolarHBondContact O-N 3.48Å; K256-E259 WeakPolarHBondContact CD-OE2 3.48Å; K256-E259 WeakPolarHBondContact CE-OE2 3.47Å; K256-E259 IonicContact NZ-OE1 3.61Å; K256-E259 PolarHBondContact NZ-OE1 2.91Å; K256-E259 IonicContact NZ-OE2 3.96Å; K256-E259 PolarHBondContact NZ-OE2 2.82Å; K256-E259 WeakPolarHBondContact O-CB 3.23Å; K256-E259 PolarHBondContact O-N 2.92Å; K257-E259 PolarHBondContact O-N 2.84Å; E259-Y262 PolarHBondContact O-N 2.94Å; E259-E263 PolarHBondContact O-N 3.21Å; E259-E263 VanDerWaalsContact O-N 3.11Å
260	I	65.3	Low	60.8	Low	14 Å²	14	92.9 Å²	92.9	7%	0.072	44%	0.441	C	S	.	.	H	α-helix	trans	-64	-47.2	177.8	-69.6	166.7	0	0	0	110.9	Y34 K256 K257 Y262 E263 Y264	Y34-I260 HydrophobicContact CD1-CG2 4.17Å; K256-I260 HydrophobicContact CG-CD1 4.21Å; K256-I260 VanDerWaalsContact O-CG1 3.26Å; K256-I260 WeakPolarHBondContact O-CG1 3.38Å; K256-I260 PolarHBondContact O-N 2.88Å; K257-I260 PolarHBondContact O-N 2.88Å; I260-Y262 VanDerWaalsContact C-N 3.26Å; I260-Y262 PolarHBondContact O-N 2.76Å; I260-E263 PolarHBondContact O-N 3.27Å; I260-Y264 HydrophobicContact CG2-CD2 3.61Å; I260-Y264 HydrophobicContact CG2-CE2 3.65Å; I260-Y264 VanDerWaalsContact O-CD2 3.28Å; I260-Y264 WeakPolarHBondContact O-CD2 3.35Å; I260-Y264 PolarHBondContact O-N 3.24Å
261	E	65.2	Low	60.7	Low	58 Å²	58	96.3 Å²	96.3	27%	0.271	46%	0.455	S	S	.	.	H	α-helix	trans	-59	-39.6	178.8	-75.6	-174.2	-178.6	0	0	111.6	Y34 K257 Y264 Q265	Y34-E261 HydrophobicContact CD1-CG 4.17Å; Y34-E261 HydrophobicContact CD2-CG 4.4Å; Y34-E261 HydrophobicContact CE1-CG 3.73Å; Y34-E261 HydrophobicContact CE2-CG 3.95Å; Y34-E261 WeakPolarHBondContact CE2-OE1 3.42Å; Y34-E261 HydrophobicContact CG-CG 4.48Å; K257-E261 WeakPolarHBondContact CE-OE1 3.42Å; K257-E261 HydrophobicContact CG-CG 4.32Å; K257-E261 WeakPolarHBondContact O-CB 3.01Å; K257-E261 WeakPolarHBondContact O-CG 3.49Å; K257-E261 PolarHBondContact O-N 3.46Å; E261-Y264 PolarHBondContact O-N 3.29Å; E261-Q265 WeakPolarHBondContact O-CB 3.25Å; E261-Q265 WeakPolarHBondContact O-CG 3.02Å; E261-Q265 PolarHBondContact O-N 3.43Å
262	Y	64.2	Low	60.6	Low	160 Å²	160	97.7 Å²	97.7	63%	0.627	46%	0.462	S	S	*	.	H	α-helix	trans	-63.1	-45.3	175.4	-173.1	-94.8	0	0	0	112.3	E258 E259 I260 Y264 Q265 D266	E258-Y262 WeakPolarHBondContact O-CB 3.42Å; E258-Y262 PolarHBondContact O-N 2.88Å; E258-Y262 VanDerWaalsContact O-N 3.09Å; E259-Y262 PolarHBondContact O-N 2.94Å; I260-Y262 VanDerWaalsContact C-N 3.26Å; I260-Y262 PolarHBondContact O-N 2.76Å; Y262-Y264 PolarHBondContact O-N 3.12Å; Y262-Q265 PolarHBondContact O-N 2.88Å; Y262-D266 PolarHBondContact O-N 2.74Å; Y262-D266 VanDerWaalsContact O-N 3.09Å
263	E	65.3	Low	60.3	Low	116 Å²	116	98.9 Å²	98.9	54%	0.542	47%	0.469	S	S	.	.	H	α-helix	trans	-63	-39.3	177.2	-73.3	-176	169.9	0	0	113	E259 I260 D266 S267	E259-E263 PolarHBondContact O-N 3.21Å; E259-E263 VanDerWaalsContact O-N 3.11Å; I260-E263 PolarHBondContact O-N 3.27Å; E263-D266 PolarHBondContact O-N 3.3Å; E263-S267 WeakPolarHBondContact O-CB 3.23Å; E263-S267 PolarHBondContact O-N 3.47Å; E263-S267 PolarHBondContact O-OG 3.34Å
264	Y	58.9	Low	60.1	Low	112 Å²	112	104.2 Å²	104.2	44%	0.439	49%	0.494	S	S	.	.	H	α-helix	trans	-73.4	-31.1	177.7	-80.9	-78.6	0	0	0	112.9	Y37 I260 E261 Y262 S267 G268	Y37-Y264 HydrophobicContact CD2-CE2 4.38Å; Y37-Y264 HydrophobicContact CG-CE2 4.45Å; I260-Y264 HydrophobicContact CG2-CD2 3.61Å; I260-Y264 HydrophobicContact CG2-CE2 3.65Å; I260-Y264 VanDerWaalsContact O-CD2 3.28Å; I260-Y264 WeakPolarHBondContact O-CD2 3.35Å; I260-Y264 PolarHBondContact O-N 3.24Å; E261-Y264 PolarHBondContact O-N 3.29Å; Y262-Y264 PolarHBondContact O-N 3.12Å; Y264-S267 WeakPolarHBondContact CA-OG 3.47Å; Y264-S267 PolarHBondContact O-OG 2.88Å; Y264-G268 PolarHBondContact O-N 2.81Å
265	Q	60.7	Low	59.8	Low	119 Å²	119	105 Å²	105	56%	0.556	50%	0.498	S	S	*	.	H	α-helix	trans	-72.7	-26.1	173	-75.4	-175.6	-0.4	0	0	113.7	E261 Y262 R269	E261-Q265 WeakPolarHBondContact O-CB 3.25Å; E261-Q265 WeakPolarHBondContact O-CG 3.02Å; E261-Q265 PolarHBondContact O-N 3.43Å; Y262-Q265 PolarHBondContact O-N 2.88Å; Q265-R269 PolarHBondContact O-NE 3.03Å; Q265-R269 VanDerWaalsContact O-NE 3.15Å
266	D	56.2	Low	59.4	Low	67 Å²	67	102.9 Å²	102.9	36%	0.358	49%	0.488	S	S	.	.	H	α-helix	trans	-85.5	-35.6	176.4	-161.2	34.8	0	0	0	112	Y262 E263 G268 R269	Y262-D266 PolarHBondContact O-N 2.74Å; Y262-D266 VanDerWaalsContact O-N 3.09Å; E263-D266 PolarHBondContact O-N 3.3Å; D266-G268 VanDerWaalsContact C-N 3.3Å; D266-G268 PolarHBondContact O-N 2.77Å; D266-R269 PolarHBondContact O-N 3.39Å; D266-R269 VanDerWaalsContact O-N 3.11Å
267	S	56.9	Low	58.6	Low	72 Å²	72	106.6 Å²	106.6	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-70	-23	173.7	57.8	0	0	0	0	113.9	E263 Y264 R269	E263-S267 WeakPolarHBondContact O-CB 3.23Å; E263-S267 PolarHBondContact O-N 3.47Å; E263-S267 PolarHBondContact O-OG 3.34Å; Y264-S267 WeakPolarHBondContact CA-OG 3.47Å; Y264-S267 PolarHBondContact O-OG 2.88Å; S267-R269 VanDerWaalsContact C-N 3.29Å
268	G	48.1	Very low	58	Low	67 Å²	67	110.3 Å²	110.3	69%	0.691	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-1.8	169.3	0	0	0	0	0	115	Y264 D266	Y264-G268 PolarHBondContact O-N 2.81Å; D266-G268 VanDerWaalsContact C-N 3.3Å; D266-G268 PolarHBondContact O-N 2.77Å
269	R	42.6	Very low	57.4	Low	185 Å²	185	107.3 Å²	107.3	70%	0.698	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	2.8	179.7	-93	-175.5	-86.3	174.9	-9.6	114.2	Q265 D266 S267	Q265-R269 PolarHBondContact O-NE 3.03Å; Q265-R269 VanDerWaalsContact O-NE 3.15Å; D266-R269 PolarHBondContact O-N 3.39Å; D266-R269 VanDerWaalsContact O-N 3.11Å; S267-R269 VanDerWaalsContact C-N 3.29Å
270	K	34.3	Very low	56.1	Low	226 Å²	226	108.7 Å²	108.7	98%	0.983	52%	0.522	S	S	*	.			trans	-112.6	0	173.4	-71.3	-179.7	-177.6	164.4	0	111.1

Retrieved 270 of 270 residues in 83.5 ms (Link to these results)

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