A0A2K5MFS1_CERAT Loading...

Four and a half LIM domains protein 3

Recruited by SOX15 to FOXK1 promoters where it acts as a transcriptional coactivator of FOXK1.

AlphaFold DB , UniProt , Accession A0A2K5MFS1, Species CERAT (Cercocebus atys, Sooty mangabey), Gene FHL3, Length 280 aa.

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(Predicted Aligned Error values between residue pairs)

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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	47.4	Very low	79.5	Confident	243 Å²	243	95 Å²	95	100%	1.197	54%	0.539	S	S	*	.				0	105	0	-69.5	178.6	-77.5	0	0	105.4	E3	M1-E3 PolarHBondContact O-N 3.24Å
2	S	57.2	Low	80.3	Confident	111 Å²	111	95.5 Å²	95.5	78%	0.776	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-69.6	120	179.2	48.3	0	0	0	0	108.5	S4	S2-S4 PolarHBondContact O-N 2.85Å
3	E	66.8	Low	81.1	Confident	176 Å²	176	92.4 Å²	92.4	82%	0.822	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-57.7	128.3	169.9	-67.9	-179.2	121.8	0	0	108.3	M1 F5	M1-E3 PolarHBondContact O-N 3.24Å; E3-F5 PolarHBondContact O-N 3.33Å
4	S	73.9	Confident	81.7	Confident	99 Å²	99	85.9 Å²	85.9	69%	0.692	49%	0.485	S	S	*	.	P	Polyproline II helix	trans	-69	116.7	178.8	47.3	0	0	0	0	108.7	S2 D6	S2-S4 PolarHBondContact O-N 2.85Å; S4-D6 WeakPolarHBondContact CB-OD2 3.2Å
5	F	87.4	Confident	82.2	Confident	60 Å²	60	90.2 Å²	90.2	26%	0.263	49%	0.492	S	S	.	.			trans	-104.6	77.8	178.8	-170.3	-109.8	0	0	0	108.8	E3 L14 Y15 Y19 P26	E3-F5 PolarHBondContact O-N 3.33Å; F5-L14 HydrophobicContact CD1-CB 3.64Å; F5-L14 HydrophobicContact CE1-CB 3.62Å; F5-L14 HydrophobicContact CE1-CD1 4.18Å; F5-L14 HydrophobicContact CZ-CD1 4.42Å; F5-L14 WeakPolarHBondContact O-CB 3.4Å; F5-L14 PolarHBondContact O-N 3.05Å; F5-Y15 HydrophobicContact CB-CD2 4.19Å; F5-Y15 HydrophobicContact CB-CE2 3.61Å; F5-Y19 AromaticContact CE1-CD1 3.99Å; F5-Y19 HydrophobicContact CE1-CD1 3.99Å; F5-Y19 AromaticContact CE1-CE1 3.8Å; F5-Y19 HydrophobicContact CE1-CE1 3.8Å; F5-Y19 HydrophobicContact CE1-CE2 4.37Å; F5-Y19 HydrophobicContact CE1-CG 4.36Å; F5-Y19 HydrophobicContact CZ-CD1 4.24Å; F5-Y19 HydrophobicContact CZ-CD2 4.04Å; F5-Y19 AromaticContact CZ-CE1 3.88Å; F5-Y19 HydrophobicContact CZ-CE1 3.88Å; F5-Y19 AromaticContact CZ-CE2 3.66Å; F5-Y19 HydrophobicContact CZ-CE2 3.66Å; F5-Y19 HydrophobicContact CZ-CG 4.32Å; F5-Y19 AromaticContact CZ-CZ 3.57Å; F5-P26 HydrophobicContact CD2-CG 4.44Å; F5-P26 HydrophobicContact CE2-CB 4.19Å; F5-P26 HydrophobicContact CE2-CG 3.9Å; F5-P26 HydrophobicContact CZ-CB 4.14Å; F5-P26 HydrophobicContact CZ-CG 4.3Å
6	D	91.7	Very high	82.4	Confident	56 Å²	56	90.3 Å²	90.3	30%	0.299	52%	0.521	S	S	.	.	B	Isolated β-bridge	trans	-120.1	157.1	-170	-56.5	-27	0	0	0	110.5	S4 A8 E12 S13	S4-D6 WeakPolarHBondContact CB-OD2 3.2Å; D6-A8 PolarHBondContact O-N 3.35Å; D6-E12 CarbonylContact C-O 3.54Å; D6-E12 VanDerWaalsContact CA-O 3.3Å; D6-E12 WeakPolarHBondContact CA-O 3.34Å; D6-S13 VanDerWaalsContact OD1-CA 3.25Å; D6-S13 WeakPolarHBondContact OD1-CA 3.43Å
7	C	89.8	Confident	82.6	Confident	3 Å²	3	93.3 Å²	93.3	2%	0.02	52%	0.521	C	S	.	.			trans	-64	129.1	178.7	175.7	0	0	0	0	111.1	K9 C10 S11 E12 L14 P26 C28	C7-K9 PolarHBondContact O-N 2.75Å; C7-K9 VanDerWaalsContact O-N 3.09Å; C7-K9 PolarHBondContact SG-N 3.2Å; C7-C10 VanDerWaalsContact CB-SG 3.51Å; C7-S11 VanDerWaalsContact O-CA 3.24Å; C7-S11 WeakPolarHBondContact O-CA 3.48Å; C7-S11 PolarHBondContact O-N 3.48Å; C7-E12 PolarHBondContact N-O 2.89Å; C7-L14 HydrophobicContact CB-CD1 4.45Å; C7-L14 HydrophobicContact CB-CD2 4Å; C7-L14 HydrophobicContact CB-CG 4.29Å; C7-P26 WeakPolarHBondContact CA-O 3.2Å; C7-C28 HydrophobicContact CB-CB 4.33Å; C7-C28 PolarHBondContact SG-N 3.15Å
8	A	89.7	Confident	83	Confident	50 Å²	50	98.2 Å²	98.2	41%	0.413	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-27.2	179.9	0	0	0	0	0	114.1	D6 P26 Y27	D6-A8 PolarHBondContact O-N 3.35Å; A8-P26 PolarHBondContact N-O 3.29Å; A8-Y27 HydrophobicContact CB-CD2 4.17Å; A8-Y27 HydrophobicContact CB-CE1 4.27Å; A8-Y27 HydrophobicContact CB-CE2 3.72Å
9	K	90.3	Very high	83.4	Confident	102 Å²	102	98.8 Å²	98.8	44%	0.443	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-54.2	178.9	-167.8	172.2	-173.4	175.6	0	115.3	C7 Y27 C31 T35	C7-K9 PolarHBondContact O-N 2.75Å; C7-K9 VanDerWaalsContact O-N 3.09Å; C7-K9 PolarHBondContact SG-N 3.2Å; K9-Y27 HydrophobicContact CB-CD1 3.93Å; K9-Y27 HydrophobicContact CB-CE1 3.79Å; K9-C31 HydrophobicContact CB-CB 3.96Å; K9-C31 HydrophobicContact CD-CB 4.02Å; K9-C31 HydrophobicContact CG-CB 4.46Å; K9-T35 WeakPolarHBondContact CD-OG1 3.25Å; K9-T35 PolarHBondContact NZ-OG1 3.47Å
10	C	91.6	Very high	83.6	Confident	55 Å²	55	95.4 Å²	95.4	37%	0.372	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-4.8	-174.1	66.6	0	0	0	0	114.4	C7 E12	C7-C10 VanDerWaalsContact CB-SG 3.51Å; C10-E12 PolarHBondContact O-N 3.05Å
11	S	88.5	Confident	84	Confident	90 Å²	90	96.5 Å²	96.5	63%	0.629	51%	0.514	S	S	*	.			trans	57.9	16.5	-177.9	-50	0	0	0	0	114.7	C7	C7-S11 VanDerWaalsContact O-CA 3.24Å; C7-S11 WeakPolarHBondContact O-CA 3.48Å; C7-S11 PolarHBondContact O-N 3.48Å
12	E	89.8	Confident	85.9	Confident	101 Å²	101	86.2 Å²	86.2	47%	0.472	47%	0.465	S	S	.	.			trans	-75.3	145.5	170.3	-71.9	-162.8	-177	0	0	111.4	D6 C7 C10 L14 R17	D6-E12 CarbonylContact C-O 3.54Å; D6-E12 VanDerWaalsContact CA-O 3.3Å; D6-E12 WeakPolarHBondContact CA-O 3.34Å; C7-E12 PolarHBondContact N-O 2.89Å; C10-E12 PolarHBondContact O-N 3.05Å; E12-L14 PolarHBondContact O-N 2.87Å; E12-R17 IonicContact OE2-CZ 3.75Å; E12-R17 IonicContact OE2-NH1 2.75Å; E12-R17 PolarHBondContact OE2-NH1 2.86Å; E12-R17 IonicContact OE2-NH2 3.95Å
13	S	90.8	Very high	87.3	Confident	55 Å²	55	89.7 Å²	89.7	39%	0.385	48%	0.475	S	S	.	.	B	Isolated β-bridge	trans	-62.8	133.3	176.6	-161.9	0	0	0	0	112.8	D6 Y15 R17	D6-S13 VanDerWaalsContact OD1-CA 3.25Å; D6-S13 WeakPolarHBondContact OD1-CA 3.43Å; S13-Y15 WeakPolarHBondContact OG-CD2 3.36Å; S13-R17 PolarHBondContact O-NH1 3.48Å
14	L	89.6	Confident	88.2	Confident	2 Å²	2	84.9 Å²	84.9	1%	0.01	46%	0.46	C	S	.	.			trans	-97.2	-2.1	179.9	-63.4	176.9	0	0	0	113.2	F5 C7 E12 G16 R17 Y19 P26 C28	F5-L14 HydrophobicContact CD1-CB 3.64Å; F5-L14 HydrophobicContact CE1-CB 3.62Å; F5-L14 HydrophobicContact CE1-CD1 4.18Å; F5-L14 HydrophobicContact CZ-CD1 4.42Å; F5-L14 WeakPolarHBondContact O-CB 3.4Å; F5-L14 PolarHBondContact O-N 3.05Å; C7-L14 HydrophobicContact CB-CD1 4.45Å; C7-L14 HydrophobicContact CB-CD2 4Å; C7-L14 HydrophobicContact CB-CG 4.29Å; E12-L14 PolarHBondContact O-N 2.87Å; L14-G16 PolarHBondContact O-N 3.03Å; L14-R17 PolarHBondContact O-N 3.14Å; L14-Y19 HydrophobicContact CD1-CG 4.32Å; L14-P26 HydrophobicContact CD1-CB 3.63Å; L14-P26 HydrophobicContact CD1-CG 3.91Å; L14-C28 HydrophobicContact CD2-CB 3.63Å
15	Y	88.8	Confident	88.9	Confident	150 Å²	150	81 Å²	81	59%	0.588	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	122.7	177.2	-80.6	-81.8	0	0	0	111.3	F5 S13 R17	F5-Y15 HydrophobicContact CB-CD2 4.19Å; F5-Y15 HydrophobicContact CB-CE2 3.61Å; S13-Y15 WeakPolarHBondContact OG-CD2 3.36Å; Y15-R17 PolarHBondContact O-N 3.43Å
16	G	84.5	Confident	89.1	Confident	92 Å²	92	79.1 Å²	79.1	95%	0.948	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	8.8	179.8	0	0	0	0	0	115.2	L14	L14-G16 PolarHBondContact O-N 3.03Å
17	R	87.1	Confident	89.1	Confident	141 Å²	141	77.8 Å²	77.8	53%	0.532	42%	0.421	S	S	.	.	S	Bend	trans	-113.2	153.7	178.7	-69.7	174.1	164.1	-176.7	-10.8	110.7	E12 S13 L14 Y15	E12-R17 IonicContact OE2-CZ 3.75Å; E12-R17 IonicContact OE2-NH1 2.75Å; E12-R17 PolarHBondContact OE2-NH1 2.86Å; E12-R17 IonicContact OE2-NH2 3.95Å; S13-R17 PolarHBondContact O-NH1 3.48Å; L14-R17 PolarHBondContact O-N 3.14Å; Y15-R17 PolarHBondContact O-N 3.43Å
18	K	88.6	Confident	89.2	Confident	182 Å²	182	78.4 Å²	78.4	79%	0.791	43%	0.425	S	S	*	.			trans	-68.4	135.5	170.7	-67.3	-174.4	179.5	-177.6	0	109.4	V29	K18-V29 HydrophobicContact CB-CG2 4.01Å
19	Y	90.8	Very high	89.2	Confident	109 Å²	109	77.4 Å²	77.4	43%	0.427	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	162.1	179.2	69.8	-88.1	0	0	0	110.1	F5 L14 P26 Y27	F5-Y19 AromaticContact CE1-CD1 3.99Å; F5-Y19 HydrophobicContact CE1-CD1 3.99Å; F5-Y19 AromaticContact CE1-CE1 3.8Å; F5-Y19 HydrophobicContact CE1-CE1 3.8Å; F5-Y19 HydrophobicContact CE1-CE2 4.37Å; F5-Y19 HydrophobicContact CE1-CG 4.36Å; F5-Y19 HydrophobicContact CZ-CD1 4.24Å; F5-Y19 HydrophobicContact CZ-CD2 4.04Å; F5-Y19 AromaticContact CZ-CE1 3.88Å; F5-Y19 HydrophobicContact CZ-CE1 3.88Å; F5-Y19 AromaticContact CZ-CE2 3.66Å; F5-Y19 HydrophobicContact CZ-CE2 3.66Å; F5-Y19 HydrophobicContact CZ-CG 4.32Å; F5-Y19 AromaticContact CZ-CZ 3.57Å; L14-Y19 HydrophobicContact CD1-CG 4.32Å; Y19-P26 HydrophobicContact CD2-CB 3.92Å; Y19-P26 HydrophobicContact CE2-CB 4.42Å; Y19-Y27 CarbonylContact C-O 3.52Å; Y19-Y27 VanDerWaalsContact CA-O 3.25Å; Y19-Y27 WeakPolarHBondContact CA-O 3.39Å; Y19-Y27 WeakPolarHBondContact CB-O 3.46Å
20	I	88.6	Confident	89.1	Confident	31 Å²	31	77 Å²	77	16%	0.159	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.4	178.9	-61	167.1	0	0	0	107.9	P26 Y27 V29 Y32 H49	I20-P26 WeakPolarHBondContact O-CA 3.3Å; I20-Y27 PolarHBondContact N-O 3.46Å; I20-Y27 PolarHBondContact O-N 3.25Å; I20-V29 HydrophobicContact CD1-CG2 4.33Å; I20-V29 HydrophobicContact CG1-CG2 4.45Å; I20-Y32 HydrophobicContact CB-CD2 3.93Å; I20-Y32 HydrophobicContact CB-CE2 4.38Å; I20-Y32 HydrophobicContact CB-CG 4.03Å; I20-Y32 HydrophobicContact CD1-CD1 3.29Å; I20-Y32 HydrophobicContact CD1-CD2 4.2Å; I20-Y32 HydrophobicContact CD1-CE1 3.86Å; I20-Y32 HydrophobicContact CD1-CG 3.49Å; I20-Y32 VanDerWaalsContact CD1-CG 3.49Å; I20-Y32 HydrophobicContact CG1-CD1 4.5Å; I20-Y32 HydrophobicContact CG1-CG 4.35Å; I20-Y32 HydrophobicContact CG2-CD1 4.43Å; I20-Y32 HydrophobicContact CG2-CD2 3.65Å; I20-Y32 HydrophobicContact CG2-CE1 4.36Å; I20-Y32 HydrophobicContact CG2-CE2 3.59Å; I20-Y32 HydrophobicContact CG2-CG 4.09Å; I20-H49 HydrophobicContact CD1-CB 3.76Å; I20-H49 VanDerWaalsContact CD1-CG 3.41Å
21	Q	90.4	Very high	89.1	Confident	119 Å²	119	75.3 Å²	75.3	56%	0.556	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	126.5	178.3	-171.9	67	41.6	0	0	109.7
22	T	87.7	Confident	89.2	Confident	27 Å²	27	74 Å²	74	17%	0.166	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	172.5	173.8	76	0	0	0	0	110.6	S24 G25 Y27 Y32 F36	T22-S24 PolarHBondContact O-N 3.03Å; T22-S24 PolarHBondContact OG1-N 2.85Å; T22-S24 PolarHBondContact OG1-OG 3.06Å; T22-G25 PolarHBondContact N-O 3.3Å; T22-G25 VanDerWaalsContact N-O 3.07Å; T22-G25 PolarHBondContact O-N 3.1Å; T22-G25 VanDerWaalsContact O-N 3.1Å; T22-G25 PolarHBondContact OG1-N 3.44Å; T22-G25 PolarHBondContact OG1-O 3.19Å; T22-Y27 HydrophobicContact CG2-CD2 3.95Å; T22-Y27 HydrophobicContact CG2-CE2 4.3Å; T22-Y27 VanDerWaalsContact OG1-CE2 3.29Å; T22-Y27 WeakPolarHBondContact OG1-CE2 3.46Å; T22-Y32 HydrophobicContact CG2-CD2 3.8Å; T22-Y32 HydrophobicContact CG2-CE2 3.6Å; T22-F36 HydrophobicContact CG2-CE2 4.48Å
23	D	86.7	Confident	89.2	Confident	184 Å²	184	70.3 Å²	70.3	98%	0.984	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-25.4	174.4	-60.3	-28	0	0	0	112.9
24	S	86.7	Confident	89	Confident	74 Å²	74	72.9 Å²	72.9	52%	0.517	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	4.6	177.9	65.5	0	0	0	0	114	T22 Y27	T22-S24 PolarHBondContact O-N 3.03Å; T22-S24 PolarHBondContact OG1-N 2.85Å; T22-S24 PolarHBondContact OG1-OG 3.06Å; S24-Y27 WeakPolarHBondContact OG-CE2 3.29Å; S24-Y27 PolarHBondContact OG-OH 3.4Å
25	G	88.8	Confident	88.9	Confident	17 Å²	17	75.7 Å²	75.7	18%	0.175	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	114.9	-179.4	-178.7	0	0	0	0	0	113.8	T22 Y27	T22-G25 PolarHBondContact N-O 3.3Å; T22-G25 VanDerWaalsContact N-O 3.07Å; T22-G25 PolarHBondContact O-N 3.1Å; T22-G25 VanDerWaalsContact O-N 3.1Å; T22-G25 PolarHBondContact OG1-N 3.44Å; T22-G25 PolarHBondContact OG1-O 3.19Å; G25-Y27 VanDerWaalsContact O-CD2 3.31Å; G25-Y27 WeakPolarHBondContact O-CD2 3.44Å
26	P	91.3	Very high	88.8	Confident	22 Å²	22	73 Å²	73	14%	0.143	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	135.3	179.3	33.2	-34.7	0	0	0	111.5	F5 C7 A8 L14 Y19 I20	F5-P26 HydrophobicContact CD2-CG 4.44Å; F5-P26 HydrophobicContact CE2-CB 4.19Å; F5-P26 HydrophobicContact CE2-CG 3.9Å; F5-P26 HydrophobicContact CZ-CB 4.14Å; F5-P26 HydrophobicContact CZ-CG 4.3Å; C7-P26 WeakPolarHBondContact CA-O 3.2Å; A8-P26 PolarHBondContact N-O 3.29Å; L14-P26 HydrophobicContact CD1-CB 3.63Å; L14-P26 HydrophobicContact CD1-CG 3.91Å; Y19-P26 HydrophobicContact CD2-CB 3.92Å; Y19-P26 HydrophobicContact CE2-CB 4.42Å; I20-P26 WeakPolarHBondContact O-CA 3.3Å
27	Y	91.4	Very high	89.1	Confident	28 Å²	28	69.7 Å²	69.7	11%	0.11	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142.4	175.8	-72.1	-110.2	0	0	0	109.8	A8 K9 Y19 I20 T22 S24 G25 C31 F36	A8-Y27 HydrophobicContact CB-CD2 4.17Å; A8-Y27 HydrophobicContact CB-CE1 4.27Å; A8-Y27 HydrophobicContact CB-CE2 3.72Å; K9-Y27 HydrophobicContact CB-CD1 3.93Å; K9-Y27 HydrophobicContact CB-CE1 3.79Å; Y19-Y27 CarbonylContact C-O 3.52Å; Y19-Y27 VanDerWaalsContact CA-O 3.25Å; Y19-Y27 WeakPolarHBondContact CA-O 3.39Å; Y19-Y27 WeakPolarHBondContact CB-O 3.46Å; I20-Y27 PolarHBondContact N-O 3.46Å; I20-Y27 PolarHBondContact O-N 3.25Å; T22-Y27 HydrophobicContact CG2-CD2 3.95Å; T22-Y27 HydrophobicContact CG2-CE2 4.3Å; T22-Y27 VanDerWaalsContact OG1-CE2 3.29Å; T22-Y27 WeakPolarHBondContact OG1-CE2 3.46Å; S24-Y27 WeakPolarHBondContact OG-CE2 3.29Å; S24-Y27 PolarHBondContact OG-OH 3.4Å; G25-Y27 VanDerWaalsContact O-CD2 3.31Å; G25-Y27 WeakPolarHBondContact O-CD2 3.44Å; Y27-C31 HydrophobicContact CD1-CB 4.18Å; Y27-F36 HydrophobicContact CD1-CE2 4.44Å; Y27-F36 HydrophobicContact CE1-CE2 4.23Å; Y27-F36 HydrophobicContact CE2-CE2 4.48Å
28	C	92	Very high	89.4	Confident	16 Å²	16	65.8 Å²	65.8	11%	0.108	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	150.5	163.3	70.6	0	0	0	0	109.1	C7 L14 C31 Y32	C7-C28 HydrophobicContact CB-CB 4.33Å; C7-C28 PolarHBondContact SG-N 3.15Å; L14-C28 HydrophobicContact CD2-CB 3.63Å; C28-C31 PolarHBondContact O-N 2.92Å; C28-C31 WeakPolarHBondContact SG-CB 3.24Å; C28-C31 PolarHBondContact SG-SG 2.92Å; C28-Y32 PolarHBondContact O-N 3.47Å
29	V	89.2	Confident	89.6	Confident	29 Å²	29	60.6 Å²	60.6	18%	0.176	33%	0.331	C	S	.	.	H	α-helix	trans	-49.2	-48.9	-177	168.9	0	0	0	0	112.9	K18 I20 C31 Y32 D33 H49	K18-V29 HydrophobicContact CB-CG2 4.01Å; I20-V29 HydrophobicContact CD1-CG2 4.33Å; I20-V29 HydrophobicContact CG1-CG2 4.45Å; V29-C31 VanDerWaalsContact C-N 3.34Å; V29-C31 PolarHBondContact O-N 3.32Å; V29-Y32 PolarHBondContact O-N 2.83Å; V29-D33 WeakPolarHBondContact CG1-OD2 3.3Å; V29-D33 PolarHBondContact O-N 2.85Å; V29-H49 WeakPolarHBondContact CG1-CE1 3.24Å
30	P	89.1	Confident	89.8	Confident	92 Å²	92	55.4 Å²	55.4	60%	0.597	31%	0.311	S	S	*	.	H	α-helix	trans	-62.5	-37.2	178.8	-23.2	33.9	0	0	0	114	N34	P30-N34 VanDerWaalsContact O-CB 3.24Å; P30-N34 WeakPolarHBondContact O-CB 3.43Å; P30-N34 PolarHBondContact O-N 3.03Å
31	C	89.9	Confident	89.9	Confident	20 Å²	20	55.2 Å²	55.2	14%	0.135	31%	0.313	C	S	.	.	H	α-helix	trans	-72.6	-34.3	177.9	-76.3	0	0	0	0	112	K9 Y27 C28 V29 T35	K9-C31 HydrophobicContact CB-CB 3.96Å; K9-C31 HydrophobicContact CD-CB 4.02Å; K9-C31 HydrophobicContact CG-CB 4.46Å; Y27-C31 HydrophobicContact CD1-CB 4.18Å; C28-C31 PolarHBondContact O-N 2.92Å; C28-C31 WeakPolarHBondContact SG-CB 3.24Å; C28-C31 PolarHBondContact SG-SG 2.92Å; V29-C31 VanDerWaalsContact C-N 3.34Å; V29-C31 PolarHBondContact O-N 3.32Å; C31-T35 WeakPolarHBondContact O-CB 3Å; C31-T35 PolarHBondContact O-N 3.19Å; C31-T35 PolarHBondContact O-OG1 3.33Å
32	Y	90.7	Very high	89.9	Confident	63 Å²	63	53.7 Å²	53.7	25%	0.247	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-54.3	173.7	-178.4	-91.7	0	0	0	110.4	I20 T22 C28 V29 N34 T35 F36 H49	I20-Y32 HydrophobicContact CB-CD2 3.93Å; I20-Y32 HydrophobicContact CB-CE2 4.38Å; I20-Y32 HydrophobicContact CB-CG 4.03Å; I20-Y32 HydrophobicContact CD1-CD1 3.29Å; I20-Y32 HydrophobicContact CD1-CD2 4.2Å; I20-Y32 HydrophobicContact CD1-CE1 3.86Å; I20-Y32 HydrophobicContact CD1-CG 3.49Å; I20-Y32 VanDerWaalsContact CD1-CG 3.49Å; I20-Y32 HydrophobicContact CG1-CD1 4.5Å; I20-Y32 HydrophobicContact CG1-CG 4.35Å; I20-Y32 HydrophobicContact CG2-CD1 4.43Å; I20-Y32 HydrophobicContact CG2-CD2 3.65Å; I20-Y32 HydrophobicContact CG2-CE1 4.36Å; I20-Y32 HydrophobicContact CG2-CE2 3.59Å; I20-Y32 HydrophobicContact CG2-CG 4.09Å; T22-Y32 HydrophobicContact CG2-CD2 3.8Å; T22-Y32 HydrophobicContact CG2-CE2 3.6Å; C28-Y32 PolarHBondContact O-N 3.47Å; V29-Y32 PolarHBondContact O-N 2.83Å; Y32-N34 VanDerWaalsContact C-N 3.33Å; Y32-N34 PolarHBondContact O-N 2.89Å; Y32-T35 PolarHBondContact O-N 3.37Å; Y32-F36 AromaticContact CD2-CD2 3.43Å; Y32-F36 HydrophobicContact CD2-CD2 3.43Å; Y32-F36 VanDerWaalsContact CD2-CD2 3.43Å; Y32-F36 AromaticContact CD2-CE2 3.89Å; Y32-F36 HydrophobicContact CD2-CE2 3.89Å; Y32-F36 HydrophobicContact CD2-CG 4.41Å; Y32-F36 HydrophobicContact CE1-CB 4.36Å; Y32-F36 HydrophobicContact CE2-CB 4.36Å; Y32-F36 AromaticContact CE2-CD2 3.55Å; Y32-F36 HydrophobicContact CE2-CD2 3.55Å; Y32-F36 HydrophobicContact CE2-CE2 4.14Å; Y32-F36 HydrophobicContact CE2-CG 4.16Å; Y32-F36 AromaticContact CG-CD2 3.97Å; Y32-F36 HydrophobicContact CG-CD2 3.97Å; Y32-F36 WeakPolarHBondContact O-CD2 3.47Å; Y32-F36 PolarHBondContact O-N 2.91Å; Y32-H49 HydrophobicContact CD1-CB 4.09Å; Y32-H49 HydrophobicContact CE1-CB 3.91Å
33	D	89.6	Confident	90.2	Very high	23 Å²	23	54.8 Å²	54.8	12%	0.123	32%	0.315	C	S	.	.	H	α-helix	trans	-57.6	-46.4	-179	-66.2	-24.4	0	0	0	110.5	V29 T35 F36 A37 H49	V29-D33 WeakPolarHBondContact CG1-OD2 3.3Å; V29-D33 PolarHBondContact O-N 2.85Å; D33-T35 PolarHBondContact O-N 2.9Å; D33-F36 PolarHBondContact O-N 2.81Å; D33-A37 HydrophobicContact CB-CB 4.26Å; D33-A37 WeakPolarHBondContact O-CA 3.38Å; D33-A37 WeakPolarHBondContact O-CB 3.5Å; D33-A37 PolarHBondContact O-N 3.39Å; D33-H49 IonicContact OD1-CG 3.66Å; D33-H49 PolarHBondContact OD1-N 3.48Å; D33-H49 IonicContact OD1-ND1 2.77Å; D33-H49 PolarHBondContact OD1-ND1 3.33Å; D33-H49 IonicContact OD2-ND1 2.68Å
34	N	88.4	Confident	90.4	Very high	109 Å²	109	52.1 Å²	52.1	58%	0.583	30%	0.296	S	S	*	.	H	α-helix	trans	-71.4	-3.2	179	-166.1	38.4	0	0	0	115	P30 Y32 L46	P30-N34 VanDerWaalsContact O-CB 3.24Å; P30-N34 WeakPolarHBondContact O-CB 3.43Å; P30-N34 PolarHBondContact O-N 3.03Å; Y32-N34 VanDerWaalsContact C-N 3.33Å; Y32-N34 PolarHBondContact O-N 2.89Å; N34-L46 HydrophobicContact CB-CD1 4.36Å
35	T	86.1	Confident	90.7	Very high	61 Å²	61	54.7 Å²	54.7	37%	0.374	30%	0.3	S	S	.	.	H	α-helix	trans	-110.9	-33.2	177.2	-49.1	0	0	0	0	111.7	K9 C31 Y32 D33	K9-T35 WeakPolarHBondContact CD-OG1 3.25Å; K9-T35 PolarHBondContact NZ-OG1 3.47Å; C31-T35 WeakPolarHBondContact O-CB 3Å; C31-T35 PolarHBondContact O-N 3.19Å; C31-T35 PolarHBondContact O-OG1 3.33Å; Y32-T35 PolarHBondContact O-N 3.37Å; D33-T35 PolarHBondContact O-N 2.9Å
36	F	87.9	Confident	90.8	Very high	93 Å²	93	57.2 Å²	57.2	41%	0.408	31%	0.309	S	S	.	.	H	α-helix	trans	-125.7	-14.9	-168.1	-55.2	-70.7	0	0	0	114.1	T22 Y27 Y32 D33	T22-F36 HydrophobicContact CG2-CE2 4.48Å; Y27-F36 HydrophobicContact CD1-CE2 4.44Å; Y27-F36 HydrophobicContact CE1-CE2 4.23Å; Y27-F36 HydrophobicContact CE2-CE2 4.48Å; Y32-F36 AromaticContact CD2-CD2 3.43Å; Y32-F36 HydrophobicContact CD2-CD2 3.43Å; Y32-F36 VanDerWaalsContact CD2-CD2 3.43Å; Y32-F36 AromaticContact CD2-CE2 3.89Å; Y32-F36 HydrophobicContact CD2-CE2 3.89Å; Y32-F36 HydrophobicContact CD2-CG 4.41Å; Y32-F36 HydrophobicContact CE1-CB 4.36Å; Y32-F36 HydrophobicContact CE2-CB 4.36Å; Y32-F36 AromaticContact CE2-CD2 3.55Å; Y32-F36 HydrophobicContact CE2-CD2 3.55Å; Y32-F36 HydrophobicContact CE2-CE2 4.14Å; Y32-F36 HydrophobicContact CE2-CG 4.16Å; Y32-F36 AromaticContact CG-CD2 3.97Å; Y32-F36 HydrophobicContact CG-CD2 3.97Å; Y32-F36 WeakPolarHBondContact O-CD2 3.47Å; Y32-F36 PolarHBondContact O-N 2.91Å; D33-F36 PolarHBondContact O-N 2.81Å
37	A	90.5	Very high	90.9	Very high	23 Å²	23	56.6 Å²	56.6	19%	0.19	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-73.9	141.9	178	0	0	0	0	0	111.6	D33 L46 I47	D33-A37 HydrophobicContact CB-CB 4.26Å; D33-A37 WeakPolarHBondContact O-CA 3.38Å; D33-A37 WeakPolarHBondContact O-CB 3.5Å; D33-A37 PolarHBondContact O-N 3.39Å; A37-L46 HydrophobicContact CB-CB 4.13Å; A37-L46 HydrophobicContact CB-CD2 4.37Å; A37-I47 WeakPolarHBondContact CB-O 3.42Å
38	N	92.6	Very high	90.7	Very high	59 Å²	59	55.8 Å²	55.8	32%	0.316	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-77.6	157.5	169.7	-62.8	-53.7	0	0	0	110.9	I47 E53 H60	N38-I47 PolarHBondContact O-N 3.28Å; N38-E53 VanDerWaalsContact CB-OE1 3.26Å; N38-E53 WeakPolarHBondContact CB-OE1 3.4Å; N38-E53 PolarHBondContact ND2-OE1 2.88Å; N38-H60 HydrophobicContact CB-CB 3.79Å; N38-H60 VanDerWaalsContact CG-CE1 3.5Å; N38-H60 PolarHBondContact ND2-CE1 2.91Å; N38-H60 VanDerWaalsContact ND2-CE1 3.28Å; N38-H60 PolarHBondContact ND2-ND1 3.07Å
39	T	93.4	Very high	90.2	Very high	74 Å²	74	59.3 Å²	59.3	45%	0.454	32%	0.32	S	S	.	.	B	Isolated β-bridge	trans	-93.2	128.5	176.4	-57.3	0	0	0	0	109.8	A41	T39-A41 PolarHBondContact O-N 2.6Å
40	C	93.9	Very high	90	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-67.8	126.8	177.8	175.8	0	0	0	0	111.4	E42 C43 Q44 Q45 I47 H60 H62	C40-E42 PolarHBondContact O-N 3.02Å; C40-E42 PolarHBondContact SG-N 3.42Å; C40-C43 VanDerWaalsContact SG-SG 3.7Å; C40-Q44 WeakPolarHBondContact O-CA 3.24Å; C40-Q44 PolarHBondContact O-N 2.77Å; C40-Q45 WeakPolarHBondContact CB-O 3.4Å; C40-Q45 PolarHBondContact N-O 2.88Å; C40-I47 HydrophobicContact CB-CD1 4.18Å; C40-I47 HydrophobicContact CB-CG1 3.94Å; C40-H60 CarbonylContact C-O 3.58Å; C40-H60 VanDerWaalsContact CA-O 3.29Å; C40-H60 WeakPolarHBondContact CA-O 3.41Å; C40-H62 WeakPolarHBondContact CB-CE1 3.37Å; C40-H62 VanDerWaalsContact CB-ND1 3.3Å; C40-H62 WeakPolarHBondContact CB-ND1 3.31Å; C40-H62 PolarHBondContact SG-ND1 2.63Å; C40-H62 VanDerWaalsContact SG-ND1 3.4Å
41	A	92.1	Very high	89.8	Confident	26 Å²	26	62.1 Å²	62.1	22%	0.215	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-18	-177.9	0	0	0	0	0	114.3	T39 Q44 R59 H60 F61	T39-A41 PolarHBondContact O-N 2.6Å; A41-Q44 PolarHBondContact O-NE2 3.09Å; A41-R59 HydrophobicContact CB-CB 3.94Å; A41-R59 HydrophobicContact CB-CG 4.22Å; A41-H60 PolarHBondContact N-O 3.34Å; A41-F61 HydrophobicContact CB-CD1 4.37Å; A41-F61 HydrophobicContact CB-CE1 3.92Å; A41-F61 HydrophobicContact CB-CZ 4.11Å
42	E	90.5	Very high	89.7	Confident	87 Å²	87	67.1 Å²	67.1	41%	0.407	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-52.8	-179.8	178	72.2	-179.6	0	0	111.6	C40 F61 C65 R67	C40-E42 PolarHBondContact O-N 3.02Å; C40-E42 PolarHBondContact SG-N 3.42Å; E42-F61 HydrophobicContact CB-CD1 4.25Å; E42-C65 HydrophobicContact CB-CB 3.89Å; E42-C65 HydrophobicContact CG-CB 4.05Å; E42-R67 VanDerWaalsContact CG-NH2 3.31Å; E42-R67 IonicContact OE1-CZ 3.66Å; E42-R67 IonicContact OE1-NE 3.81Å; E42-R67 IonicContact OE1-NH2 2.85Å; E42-R67 PolarHBondContact OE1-NH2 3.3Å
43	C	92.5	Very high	89.8	Confident	51 Å²	51	68 Å²	68	35%	0.345	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-6.6	-173.7	73.1	0	0	0	0	114.3	C40 Q45 H62	C40-C43 VanDerWaalsContact SG-SG 3.7Å; C43-Q45 PolarHBondContact O-N 3.3Å; C43-H62 PolarHBondContact SG-CE1 2.82Å; C43-H62 PolarHBondContact SG-ND1 3.49Å; C43-H62 VanDerWaalsContact SG-ND1 3.35Å
44	Q	92.7	Very high	90	Very high	128 Å²	128	68.1 Å²	68.1	60%	0.598	36%	0.355	S	S	*	.			trans	61.5	19.7	-179.2	-53.4	-64.3	-45.7	0	0	114.4	C40 A41	C40-Q44 WeakPolarHBondContact O-CA 3.24Å; C40-Q44 PolarHBondContact O-N 2.77Å; A41-Q44 PolarHBondContact O-NE2 3.09Å
45	Q	92.3	Very high	90.2	Very high	128 Å²	128	68.7 Å²	68.7	60%	0.598	35%	0.353	S	S	*	.			trans	-100.2	154.6	173.7	-58.8	-60.1	-43.9	0	0	111.2	C40 C43	C40-Q45 WeakPolarHBondContact CB-O 3.4Å; C40-Q45 PolarHBondContact N-O 2.88Å; C43-Q45 PolarHBondContact O-N 3.3Å
46	L	91.4	Very high	90.4	Very high	69 Å²	69	69.3 Å²	69.3	36%	0.361	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-61.7	139.2	173.6	-63.8	175.9	0	0	0	110.7	N34 A37 G48 H62	N34-L46 HydrophobicContact CB-CD1 4.36Å; A37-L46 HydrophobicContact CB-CB 4.13Å; A37-L46 HydrophobicContact CB-CD2 4.37Å; L46-G48 PolarHBondContact O-N 2.93Å; L46-H62 PolarHBondContact O-NE2 2.81Å; L46-H62 VanDerWaalsContact O-NE2 3.15Å
47	I	92.6	Very high	90.4	Very high	9 Å²	9	70.3 Å²	70.3	5%	0.046	35%	0.354	C	S	.	.			trans	-87.9	93	172.6	-54.9	170.6	0	0	0	107	A37 N38 C40 E53 H60	A37-I47 WeakPolarHBondContact CB-O 3.42Å; N38-I47 PolarHBondContact O-N 3.28Å; C40-I47 HydrophobicContact CB-CD1 4.18Å; C40-I47 HydrophobicContact CB-CG1 3.94Å; I47-E53 HydrophobicContact CD1-CG 4.09Å; I47-E53 HydrophobicContact CG2-CB 4.05Å; I47-E53 HydrophobicContact CG2-CG 4.46Å; I47-H60 HydrophobicContact CD1-CB 3.72Å
48	G	87.2	Confident	90.4	Very high	12 Å²	12	76 Å²	76	12%	0.124	38%	0.382	C	S	.	.			trans	-58	156.4	-177.8	0	0	0	0	0	112.6	L46 D50 S51	L46-G48 PolarHBondContact O-N 2.93Å; G48-D50 PolarHBondContact O-N 3.16Å; G48-S51 PolarHBondContact O-N 3.37Å
49	H	82.3	Confident	90.4	Very high	90 Å²	90	76.3 Å²	76.3	42%	0.417	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-19.6	-178.9	74.3	-68.2	0	0	0	115.5	I20 V29 Y32 D33	I20-H49 HydrophobicContact CD1-CB 3.76Å; I20-H49 VanDerWaalsContact CD1-CG 3.41Å; V29-H49 WeakPolarHBondContact CG1-CE1 3.24Å; Y32-H49 HydrophobicContact CD1-CB 4.09Å; Y32-H49 HydrophobicContact CE1-CB 3.91Å; D33-H49 IonicContact OD1-CG 3.66Å; D33-H49 PolarHBondContact OD1-N 3.48Å; D33-H49 IonicContact OD1-ND1 2.77Å; D33-H49 PolarHBondContact OD1-ND1 3.33Å; D33-H49 IonicContact OD2-ND1 2.68Å
50	D	83.5	Confident	90.4	Very high	135 Å²	135	75 Å²	75	72%	0.722	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-4.6	-179.5	62.3	-19	0	0	0	113.7	G48	G48-D50 PolarHBondContact O-N 3.16Å
51	S	85.7	Confident	90.5	Very high	45 Å²	45	75 Å²	75	32%	0.315	37%	0.367	S	S	.	.	S	Bend	trans	-94.5	138.1	177	-177.5	0	0	0	0	111.3	G48 E53	G48-S51 PolarHBondContact O-N 3.37Å; S51-E53 PolarHBondContact O-N 3.44Å
52	R	88.6	Confident	90.5	Very high	124 Å²	124	75.3 Å²	75.3	47%	0.468	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-67.3	122.9	166.8	-175.2	173.1	173.2	-158.2	1.1	109.1	E63 D77	R52-E63 HydrophobicContact CB-CB 4.23Å; R52-E63 WeakPolarHBondContact CB-OE2 3.37Å; R52-E63 WeakPolarHBondContact CD-OE2 3.18Å; R52-E63 IonicContact CZ-OE1 3.99Å; R52-E63 IonicContact NE-OE1 3.87Å; R52-E63 IonicContact NH1-OE1 3.68Å; R52-E63 PolarHBondContact NH1-OE1 3.39Å; R52-E63 PolarHBondContact O-N 2.95Å; R52-D77 IonicContact NH2-OD1 3.09Å
53	E	92.3	Very high	90.5	Very high	81 Å²	81	74.5 Å²	74.5	38%	0.379	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	137.1	177.4	178.7	173.8	-136	0	0	110.4	N38 I47 S51 H60	N38-E53 VanDerWaalsContact CB-OE1 3.26Å; N38-E53 WeakPolarHBondContact CB-OE1 3.4Å; N38-E53 PolarHBondContact ND2-OE1 2.88Å; I47-E53 HydrophobicContact CD1-CG 4.09Å; I47-E53 HydrophobicContact CG2-CB 4.05Å; I47-E53 HydrophobicContact CG2-CG 4.46Å; S51-E53 PolarHBondContact O-N 3.44Å; E53-H60 IonicContact OE1-CE1 3.96Å; E53-H60 IonicContact OE1-CG 3.28Å; E53-H60 IonicContact OE1-ND1 2.66Å; E53-H60 PolarHBondContact OE1-ND1 3.36Å
54	L	93	Very high	90.4	Very high	27 Å²	27	74.7 Å²	74.7	14%	0.141	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.6	169.3	-62.9	174.2	0	0	0	109.5	H60 F61 E63 F66 A76	L54-H60 CarbonylContact O-C 3.53Å; L54-H60 WeakPolarHBondContact O-CA 3.26Å; L54-F61 PolarHBondContact N-O 3.29Å; L54-F61 PolarHBondContact O-N 3.23Å; L54-E63 HydrophobicContact CD1-CB 4.5Å; L54-F66 HydrophobicContact CB-CD2 4.46Å; L54-F66 HydrophobicContact CB-CG 4.47Å; L54-F66 HydrophobicContact CD1-CB 3.51Å; L54-F66 HydrophobicContact CD1-CD1 3.93Å; L54-F66 HydrophobicContact CD1-CG 3.74Å; L54-A76 HydrophobicContact CD1-CB 3.6Å
55	F	92.5	Very high	90.4	Very high	121 Å²	121	69.3 Å²	69.3	53%	0.531	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.2	-177	178.9	-103.5	0	0	0	110.8	R59 H60	F55-R59 WeakPolarHBondContact CA-O 3.42Å; F55-H60 AromaticContact CD2-CE1 3.47Å; F55-H60 VanDerWaalsContact CD2-CE1 3.47Å; F55-H60 WeakPolarHBondContact CD2-CE1 3.41Å; F55-H60 AromaticContact CD2-ND1 3.74Å; F55-H60 AromaticContact CD2-NE2 3.7Å; F55-H60 AromaticContact CE2-CE1 3.82Å; F55-H60 AromaticContact CE2-NE2 3.65Å
56	Y	90.6	Very high	90.5	Very high	73 Å²	73	63.7 Å²	63.7	29%	0.286	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	133.9	178.2	-178.6	-99.1	0	0	0	110.7	D58 R59 F80 C82 L87	Y56-D58 VanDerWaalsContact C-N 3.33Å; Y56-D58 PolarHBondContact O-N 2.96Å; Y56-R59 PolarHBondContact N-O 3.18Å; Y56-R59 WeakPolarHBondContact O-CA 3.38Å; Y56-R59 WeakPolarHBondContact O-CB 3.42Å; Y56-R59 PolarHBondContact O-N 3.39Å; Y56-F80 HydrophobicContact CD1-CE2 4.24Å; Y56-F80 HydrophobicContact CD1-CZ 4.41Å; Y56-F80 HydrophobicContact CD2-CE2 4.21Å; Y56-F80 AromaticContact CD2-CZ 3.69Å; Y56-F80 HydrophobicContact CD2-CZ 3.69Å; Y56-F80 AromaticContact CE1-CE2 3.9Å; Y56-F80 HydrophobicContact CE1-CE2 3.9Å; Y56-F80 HydrophobicContact CE1-CZ 4.35Å; Y56-F80 AromaticContact CE2-CE2 3.87Å; Y56-F80 HydrophobicContact CE2-CE2 3.87Å; Y56-F80 AromaticContact CE2-CZ 3.63Å; Y56-F80 HydrophobicContact CE2-CZ 3.63Å; Y56-F80 HydrophobicContact CG-CE2 4.38Å; Y56-F80 HydrophobicContact CG-CZ 4.09Å; Y56-F80 AromaticContact CZ-CE2 3.69Å; Y56-F80 AromaticContact CZ-CZ 3.97Å; Y56-C82 HydrophobicContact CE1-CB 3.59Å; Y56-C82 WeakPolarHBondContact OH-CB 3.31Å; Y56-L87 HydrophobicContact CD1-CD2 4.3Å; Y56-L87 HydrophobicContact CE1-CD2 4.35Å
57	E	89.2	Confident	90.7	Very high	114 Å²	114	63.6 Å²	63.6	53%	0.533	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.7	52.1	179.9	-71.3	-173.2	154.4	0	0	113.8	R59 C82	E57-R59 PolarHBondContact O-N 3.01Å; E57-R59 VanDerWaalsContact O-N 3.09Å; E57-C82 PolarHBondContact OE2-SG 2.75Å
58	D	89.7	Confident	90.7	Very high	144 Å²	144	63.2 Å²	63.2	77%	0.77	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	19	-179	-61.2	-36.7	0	0	0	115	Y56	Y56-D58 VanDerWaalsContact C-N 3.33Å; Y56-D58 PolarHBondContact O-N 2.96Å
59	R	92.8	Very high	90.9	Very high	65 Å²	65	64.9 Å²	64.9	25%	0.245	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	142.1	176.6	-64.1	168.7	62.9	-173.9	1.8	110.7	A41 F55 Y56 E57 F61 S85	A41-R59 HydrophobicContact CB-CB 3.94Å; A41-R59 HydrophobicContact CB-CG 4.22Å; F55-R59 WeakPolarHBondContact CA-O 3.42Å; Y56-R59 PolarHBondContact N-O 3.18Å; Y56-R59 WeakPolarHBondContact O-CA 3.38Å; Y56-R59 WeakPolarHBondContact O-CB 3.42Å; Y56-R59 PolarHBondContact O-N 3.39Å; E57-R59 PolarHBondContact O-N 3.01Å; E57-R59 VanDerWaalsContact O-N 3.09Å; R59-F61 HydrophobicContact CB-CD2 4.38Å; R59-F61 HydrophobicContact CB-CE2 3.49Å; R59-F61 VanDerWaalsContact CB-CE2 3.49Å; R59-F61 HydrophobicContact CB-CZ 3.75Å; R59-S85 PolarHBondContact NH1-O 3.28Å
60	H	94.2	Very high	91.2	Very high	45 Å²	45	68.9 Å²	68.9	21%	0.208	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	141	178.7	-61.6	-96.9	0	0	0	110.2	N38 C40 A41 I47 E53 L54 F55	N38-H60 HydrophobicContact CB-CB 3.79Å; N38-H60 VanDerWaalsContact CG-CE1 3.5Å; N38-H60 PolarHBondContact ND2-CE1 2.91Å; N38-H60 VanDerWaalsContact ND2-CE1 3.28Å; N38-H60 PolarHBondContact ND2-ND1 3.07Å; C40-H60 CarbonylContact C-O 3.58Å; C40-H60 VanDerWaalsContact CA-O 3.29Å; C40-H60 WeakPolarHBondContact CA-O 3.41Å; A41-H60 PolarHBondContact N-O 3.34Å; I47-H60 HydrophobicContact CD1-CB 3.72Å; E53-H60 IonicContact OE1-CE1 3.96Å; E53-H60 IonicContact OE1-CG 3.28Å; E53-H60 IonicContact OE1-ND1 2.66Å; E53-H60 PolarHBondContact OE1-ND1 3.36Å; L54-H60 CarbonylContact O-C 3.53Å; L54-H60 WeakPolarHBondContact O-CA 3.26Å; F55-H60 AromaticContact CD2-CE1 3.47Å; F55-H60 VanDerWaalsContact CD2-CE1 3.47Å; F55-H60 WeakPolarHBondContact CD2-CE1 3.41Å; F55-H60 AromaticContact CD2-ND1 3.74Å; F55-H60 AromaticContact CD2-NE2 3.7Å; F55-H60 AromaticContact CE2-CE1 3.82Å; F55-H60 AromaticContact CE2-NE2 3.65Å
61	F	94.4	Very high	91.7	Very high	1 Å²	1	65.2 Å²	65.2	0%	0.004	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	143.3	-178.4	-56.7	-97.8	0	0	0	111	A41 E42 L54 R59 F66 L87	A41-F61 HydrophobicContact CB-CD1 4.37Å; A41-F61 HydrophobicContact CB-CE1 3.92Å; A41-F61 HydrophobicContact CB-CZ 4.11Å; E42-F61 HydrophobicContact CB-CD1 4.25Å; L54-F61 PolarHBondContact N-O 3.29Å; L54-F61 PolarHBondContact O-N 3.23Å; R59-F61 HydrophobicContact CB-CD2 4.38Å; R59-F61 HydrophobicContact CB-CE2 3.49Å; R59-F61 VanDerWaalsContact CB-CE2 3.49Å; R59-F61 HydrophobicContact CB-CZ 3.75Å; F61-F66 HydrophobicContact CB-CB 4.14Å; F61-F66 HydrophobicContact CB-CD2 3.9Å; F61-F66 HydrophobicContact CD1-CD2 4.13Å; F61-F66 AromaticContact CD2-CD2 3.59Å; F61-F66 HydrophobicContact CD2-CD2 3.59Å; F61-F66 AromaticContact CD2-CE2 3.88Å; F61-F66 HydrophobicContact CD2-CE2 3.88Å; F61-F66 HydrophobicContact CE2-CD2 4.05Å; F61-F66 AromaticContact CE2-CE2 3.95Å; F61-F66 HydrophobicContact CE2-CE2 3.95Å; F61-F66 AromaticContact CG-CD2 3.63Å; F61-F66 HydrophobicContact CG-CD2 3.63Å; F61-F66 HydrophobicContact CG-CE2 4.36Å; F61-F66 HydrophobicContact CZ-CD2 4.49Å; F61-F66 HydrophobicContact CZ-CE2 4.48Å; F61-L87 HydrophobicContact CE1-CD1 4.13Å; F61-L87 HydrophobicContact CZ-CD1 4.14Å
62	H	93.4	Very high	92	Very high	33 Å²	33	68 Å²	68	15%	0.153	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	146.6	157.5	-54.4	101.4	0	0	0	108.9	C40 C43 L46 G64 C65 F66	C40-H62 WeakPolarHBondContact CB-CE1 3.37Å; C40-H62 VanDerWaalsContact CB-ND1 3.3Å; C40-H62 WeakPolarHBondContact CB-ND1 3.31Å; C40-H62 PolarHBondContact SG-ND1 2.63Å; C40-H62 VanDerWaalsContact SG-ND1 3.4Å; C43-H62 PolarHBondContact SG-CE1 2.82Å; C43-H62 PolarHBondContact SG-ND1 3.49Å; C43-H62 VanDerWaalsContact SG-ND1 3.35Å; L46-H62 PolarHBondContact O-NE2 2.81Å; L46-H62 VanDerWaalsContact O-NE2 3.15Å; H62-G64 PolarHBondContact O-N 3.28Å; H62-C65 HydrophobicContact CB-CB 3.91Å; H62-C65 CarbonylContact O-C 3.56Å; H62-C65 WeakPolarHBondContact O-CA 3.25Å; H62-C65 WeakPolarHBondContact O-CB 3.34Å; H62-C65 PolarHBondContact O-N 2.87Å; H62-F66 PolarHBondContact O-N 3.06Å
63	E	90.7	Very high	92.2	Very high	69 Å²	69	68.7 Å²	68.7	32%	0.322	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-50.6	-42	173.7	-178.3	174.2	-153.2	0	0	112.9	R52 L54 C65 F66 A76	R52-E63 HydrophobicContact CB-CB 4.23Å; R52-E63 WeakPolarHBondContact CB-OE2 3.37Å; R52-E63 WeakPolarHBondContact CD-OE2 3.18Å; R52-E63 IonicContact CZ-OE1 3.99Å; R52-E63 IonicContact NE-OE1 3.87Å; R52-E63 IonicContact NH1-OE1 3.68Å; R52-E63 PolarHBondContact NH1-OE1 3.39Å; R52-E63 PolarHBondContact O-N 2.95Å; L54-E63 HydrophobicContact CD1-CB 4.5Å; E63-C65 VanDerWaalsContact C-N 3.31Å; E63-C65 PolarHBondContact O-N 2.86Å; E63-F66 PolarHBondContact O-N 3.2Å; E63-A76 HydrophobicContact CG-CB 4.29Å
64	G	89.9	Confident	92.2	Very high	56 Å²	56	67.6 Å²	67.6	58%	0.577	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-75.9	-12.8	175.9	0	0	0	0	0	115.3	H62 R67	H62-G64 PolarHBondContact O-N 3.28Å; G64-R67 PolarHBondContact O-NH1 3.18Å
65	C	92.8	Very high	92.2	Very high	15 Å²	15	66.4 Å²	66.4	10%	0.101	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-94.1	-15	176.3	-70.5	0	0	0	0	112.7	E42 H62 E63 R67	E42-C65 HydrophobicContact CB-CB 3.89Å; E42-C65 HydrophobicContact CG-CB 4.05Å; H62-C65 HydrophobicContact CB-CB 3.91Å; H62-C65 CarbonylContact O-C 3.56Å; H62-C65 WeakPolarHBondContact O-CA 3.25Å; H62-C65 WeakPolarHBondContact O-CB 3.34Å; H62-C65 PolarHBondContact O-N 2.87Å; E63-C65 VanDerWaalsContact C-N 3.31Å; E63-C65 PolarHBondContact O-N 2.86Å; C65-R67 PolarHBondContact O-N 3.48Å; C65-R67 VanDerWaalsContact O-N 3.1Å
66	F	94.6	Very high	92.1	Very high	9 Å²	9	61.6 Å²	61.6	4%	0.039	31%	0.307	C	S	.	.			trans	-83.7	81.5	175.5	-159.2	-99.7	0	0	0	110.2	L54 F61 H62 E63 L75 F80 L87	L54-F66 HydrophobicContact CB-CD2 4.46Å; L54-F66 HydrophobicContact CB-CG 4.47Å; L54-F66 HydrophobicContact CD1-CB 3.51Å; L54-F66 HydrophobicContact CD1-CD1 3.93Å; L54-F66 HydrophobicContact CD1-CG 3.74Å; F61-F66 HydrophobicContact CB-CB 4.14Å; F61-F66 HydrophobicContact CB-CD2 3.9Å; F61-F66 HydrophobicContact CD1-CD2 4.13Å; F61-F66 AromaticContact CD2-CD2 3.59Å; F61-F66 HydrophobicContact CD2-CD2 3.59Å; F61-F66 AromaticContact CD2-CE2 3.88Å; F61-F66 HydrophobicContact CD2-CE2 3.88Å; F61-F66 HydrophobicContact CE2-CD2 4.05Å; F61-F66 AromaticContact CE2-CE2 3.95Å; F61-F66 HydrophobicContact CE2-CE2 3.95Å; F61-F66 AromaticContact CG-CD2 3.63Å; F61-F66 HydrophobicContact CG-CD2 3.63Å; F61-F66 HydrophobicContact CG-CE2 4.36Å; F61-F66 HydrophobicContact CZ-CD2 4.49Å; F61-F66 HydrophobicContact CZ-CE2 4.48Å; H62-F66 PolarHBondContact O-N 3.06Å; E63-F66 PolarHBondContact O-N 3.2Å; F66-L75 HydrophobicContact CD1-CB 3.63Å; F66-L75 HydrophobicContact CE1-CB 3.71Å; F66-L75 WeakPolarHBondContact CE1-O 3.26Å; F66-L75 PolarHBondContact O-N 3.31Å; F66-F80 HydrophobicContact CE1-CD1 4.1Å; F66-F80 AromaticContact CE1-CE1 3.78Å; F66-F80 HydrophobicContact CE1-CE1 3.78Å; F66-F80 HydrophobicContact CE1-CZ 4.1Å; F66-F80 HydrophobicContact CZ-CD1 4.4Å; F66-F80 AromaticContact CZ-CE1 3.77Å; F66-F80 HydrophobicContact CZ-CE1 3.77Å; F66-F80 HydrophobicContact CZ-CE2 4.07Å; F66-F80 AromaticContact CZ-CZ 3.6Å; F66-F80 HydrophobicContact CZ-CZ 3.6Å; F66-L87 HydrophobicContact CD2-CD1 3.71Å; F66-L87 HydrophobicContact CE2-CD1 3.54Å; F66-L87 HydrophobicContact CE2-CD2 4.41Å; F66-L87 HydrophobicContact CG-CD1 4.36Å; F66-L87 HydrophobicContact CZ-CD1 4.04Å; F66-L87 HydrophobicContact CZ-CD2 4.42Å
67	R	94.7	Very high	91.9	Very high	68 Å²	68	64 Å²	64	26%	0.257	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-139.2	159.6	-169.8	64.4	-170.1	175.5	-113.4	-14.2	112.2	E42 G64 C65 C69 R73	E42-R67 VanDerWaalsContact CG-NH2 3.31Å; E42-R67 IonicContact OE1-CZ 3.66Å; E42-R67 IonicContact OE1-NE 3.81Å; E42-R67 IonicContact OE1-NH2 2.85Å; E42-R67 PolarHBondContact OE1-NH2 3.3Å; G64-R67 PolarHBondContact O-NH1 3.18Å; C65-R67 PolarHBondContact O-N 3.48Å; C65-R67 VanDerWaalsContact O-N 3.1Å; R67-C69 PolarHBondContact O-N 2.96Å; R67-R73 CarbonylContact C-O 3.57Å; R67-R73 VanDerWaalsContact CA-O 3.24Å; R67-R73 WeakPolarHBondContact CA-O 3.35Å; R67-R73 WeakPolarHBondContact CB-O 3.49Å
68	C	93	Very high	91.8	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.325	C	S	.	.			trans	-68.2	129.7	177.5	175.9	0	0	0	0	111.4	R70 C71 Q72 R73 L75 L87 C89	C68-R70 PolarHBondContact O-N 3.02Å; C68-R70 VanDerWaalsContact O-N 3.14Å; C68-R70 PolarHBondContact SG-N 2.92Å; C68-R70 VanDerWaalsContact SG-N 3.43Å; C68-C71 VanDerWaalsContact CB-SG 3.57Å; C68-C71 VanDerWaalsContact SG-SG 3.68Å; C68-Q72 WeakPolarHBondContact O-CA 3.43Å; C68-Q72 PolarHBondContact O-N 2.96Å; C68-R73 PolarHBondContact N-O 3.4Å; C68-L75 HydrophobicContact CB-CD1 4.28Å; C68-L75 HydrophobicContact CB-CD2 4.22Å; C68-L75 HydrophobicContact CB-CG 4.39Å; C68-L87 CarbonylContact C-O 3.58Å; C68-L87 VanDerWaalsContact CA-O 3.31Å; C68-L87 WeakPolarHBondContact CA-O 3.2Å; C68-C89 HydrophobicContact CB-CB 4.08Å; C68-C89 PolarHBondContact SG-N 3.27Å
69	C	90.9	Very high	91.5	Very high	47 Å²	47	61 Å²	61	32%	0.318	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-24.8	179.6	67	0	0	0	0	113.6	R67 Q72 E86 L87 L88	R67-C69 PolarHBondContact O-N 2.96Å; C69-Q72 PolarHBondContact O-NE2 2.86Å; C69-E86 PolarHBondContact SG-OE2 2.91Å; C69-L87 PolarHBondContact N-O 2.97Å; C69-L88 WeakPolarHBondContact SG-CD2 2.97Å
70	R	89.8	Confident	91.4	Very high	174 Å²	174	60.5 Å²	60.5	66%	0.657	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-53.1	-177.9	-64.1	-69.2	177.3	149.8	-0.8	113.6	C68 L88 C92	C68-R70 PolarHBondContact O-N 3.02Å; C68-R70 VanDerWaalsContact O-N 3.14Å; C68-R70 PolarHBondContact SG-N 2.92Å; C68-R70 VanDerWaalsContact SG-N 3.43Å; R70-L88 HydrophobicContact CB-CD2 4.33Å; R70-L88 HydrophobicContact CG-CD2 3.45Å; R70-L88 VanDerWaalsContact CG-CD2 3.45Å; R70-C92 HydrophobicContact CB-CB 3.9Å; R70-C92 HydrophobicContact CG-CB 4.16Å
71	C	92.6	Very high	91.1	Very high	58 Å²	58	59.8 Å²	59.8	39%	0.392	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-4.3	-172.8	70.8	0	0	0	0	114.1	C68 R73 C89	C68-C71 VanDerWaalsContact CB-SG 3.57Å; C68-C71 VanDerWaalsContact SG-SG 3.68Å; C71-R73 PolarHBondContact O-N 2.86Å; C71-C89 VanDerWaalsContact SG-SG 3.69Å
72	Q	92.2	Very high	90.7	Very high	104 Å²	104	61.2 Å²	61.2	49%	0.486	32%	0.322	S	S	.	.			trans	60.8	9.8	179.2	-54.8	-65.8	-40.5	0	0	115	C68 C69	C68-Q72 WeakPolarHBondContact O-CA 3.43Å; C68-Q72 PolarHBondContact O-N 2.96Å; C69-Q72 PolarHBondContact O-NE2 2.86Å
73	R	92.2	Very high	90.2	Very high	139 Å²	139	62.7 Å²	62.7	53%	0.525	33%	0.329	S	S	.	.			trans	-64.1	139.7	171.2	-172.6	-175.2	-73.6	164.1	0.8	109.6	R67 C68 C71 D91	R67-R73 CarbonylContact C-O 3.57Å; R67-R73 VanDerWaalsContact CA-O 3.24Å; R67-R73 WeakPolarHBondContact CA-O 3.35Å; R67-R73 WeakPolarHBondContact CB-O 3.49Å; C68-R73 PolarHBondContact N-O 3.4Å; C71-R73 PolarHBondContact O-N 2.86Å; R73-D91 IonicContact NH1-OD2 3.82Å; R73-D91 PolarHBondContact NH1-OD2 2.87Å
74	S	93.4	Very high	89.8	Confident	58 Å²	58	66.1 Å²	66.1	41%	0.406	35%	0.349	S	S	.	.	B	Isolated β-bridge	trans	-59.3	140.5	172.4	-179.7	0	0	0	0	110.9	A76	S74-A76 PolarHBondContact OG-N 3.18Å
75	L	93.1	Very high	89.5	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.01	35%	0.348	C	S	.	.			trans	-111.5	6.7	177.8	-60.5	176.5	0	0	0	112	F66 C68 D77 E78 F80 L87 C89	F66-L75 HydrophobicContact CD1-CB 3.63Å; F66-L75 HydrophobicContact CE1-CB 3.71Å; F66-L75 WeakPolarHBondContact CE1-O 3.26Å; F66-L75 PolarHBondContact O-N 3.31Å; C68-L75 HydrophobicContact CB-CD1 4.28Å; C68-L75 HydrophobicContact CB-CD2 4.22Å; C68-L75 HydrophobicContact CB-CG 4.39Å; L75-D77 VanDerWaalsContact C-N 3.27Å; L75-D77 PolarHBondContact O-N 3Å; L75-E78 PolarHBondContact O-N 2.92Å; L75-F80 HydrophobicContact CB-CB 4.33Å; L75-F80 HydrophobicContact CB-CD1 4.43Å; L75-F80 HydrophobicContact CD1-CB 3.87Å; L75-F80 HydrophobicContact CD1-CG 4.34Å; L75-F80 HydrophobicContact CD2-CB 4Å; L75-F80 HydrophobicContact CG-CB 4.28Å; L75-L87 HydrophobicContact CD1-CB 3.67Å; L75-C89 HydrophobicContact CD2-CB 3.7Å
76	A	89.8	Confident	89.3	Confident	20 Å²	20	71.2 Å²	71.2	17%	0.165	37%	0.365	C	S	.	.	S	Bend	trans	-58.5	-37.4	-170.7	0	0	0	0	0	113.3	L54 E63 S74	L54-A76 HydrophobicContact CD1-CB 3.6Å; E63-A76 HydrophobicContact CG-CB 4.29Å; S74-A76 PolarHBondContact OG-N 3.18Å
77	D	87.4	Confident	89.1	Confident	123 Å²	123	71.3 Å²	71.3	66%	0.658	37%	0.366	S	S	*	.	S	Bend	trans	-124.2	11.5	-177.8	-55.2	-61.5	0	0	0	112.4	R52 L75	R52-D77 IonicContact NH2-OD1 3.09Å; L75-D77 VanDerWaalsContact C-N 3.27Å; L75-D77 PolarHBondContact O-N 3Å
78	E	85.8	Confident	88.9	Confident	112 Å²	112	68.5 Å²	68.5	52%	0.523	36%	0.356	S	S	.	.	S	Bend	trans	-115.8	145.4	-175.3	-73.8	-70.1	150.5	0	0	111.1	L75 F80	L75-E78 PolarHBondContact O-N 2.92Å; E78-F80 WeakPolarHBondContact O-CD1 3.36Å; E78-F80 PolarHBondContact O-N 3.09Å
79	P	84.6	Confident	88.8	Confident	82 Å²	82	68.9 Å²	68.9	53%	0.532	36%	0.359	S	S	.	.			trans	-65.1	135.6	174.7	27	-32.6	0	0	0	111.1
80	F	89.4	Confident	88.4	Confident	55 Å²	55	68.5 Å²	68.5	24%	0.241	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	167	-175.4	68.1	-88.8	0	0	0	111.6	Y56 F66 L75 E78 L87 L88	Y56-F80 HydrophobicContact CD1-CE2 4.24Å; Y56-F80 HydrophobicContact CD1-CZ 4.41Å; Y56-F80 HydrophobicContact CD2-CE2 4.21Å; Y56-F80 AromaticContact CD2-CZ 3.69Å; Y56-F80 HydrophobicContact CD2-CZ 3.69Å; Y56-F80 AromaticContact CE1-CE2 3.9Å; Y56-F80 HydrophobicContact CE1-CE2 3.9Å; Y56-F80 HydrophobicContact CE1-CZ 4.35Å; Y56-F80 AromaticContact CE2-CE2 3.87Å; Y56-F80 HydrophobicContact CE2-CE2 3.87Å; Y56-F80 AromaticContact CE2-CZ 3.63Å; Y56-F80 HydrophobicContact CE2-CZ 3.63Å; Y56-F80 HydrophobicContact CG-CE2 4.38Å; Y56-F80 HydrophobicContact CG-CZ 4.09Å; Y56-F80 AromaticContact CZ-CE2 3.69Å; Y56-F80 AromaticContact CZ-CZ 3.97Å; F66-F80 HydrophobicContact CE1-CD1 4.1Å; F66-F80 AromaticContact CE1-CE1 3.78Å; F66-F80 HydrophobicContact CE1-CE1 3.78Å; F66-F80 HydrophobicContact CE1-CZ 4.1Å; F66-F80 HydrophobicContact CZ-CD1 4.4Å; F66-F80 AromaticContact CZ-CE1 3.77Å; F66-F80 HydrophobicContact CZ-CE1 3.77Å; F66-F80 HydrophobicContact CZ-CE2 4.07Å; F66-F80 AromaticContact CZ-CZ 3.6Å; F66-F80 HydrophobicContact CZ-CZ 3.6Å; L75-F80 HydrophobicContact CB-CB 4.33Å; L75-F80 HydrophobicContact CB-CD1 4.43Å; L75-F80 HydrophobicContact CD1-CB 3.87Å; L75-F80 HydrophobicContact CD1-CG 4.34Å; L75-F80 HydrophobicContact CD2-CB 4Å; L75-F80 HydrophobicContact CG-CB 4.28Å; E78-F80 WeakPolarHBondContact O-CD1 3.36Å; E78-F80 PolarHBondContact O-N 3.09Å; F80-L87 HydrophobicContact CD2-CD2 3.94Å; F80-L87 HydrophobicContact CE2-CD2 3.78Å; F80-L88 WeakPolarHBondContact CA-O 3.29Å; F80-L88 WeakPolarHBondContact CB-O 3.45Å
81	T	87.4	Confident	88.1	Confident	31 Å²	31	65 Å²	65	19%	0.19	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	130.5	172.1	-60.4	0	0	0	0	109.1	L88 Y93	T81-L88 PolarHBondContact N-O 3.41Å; T81-L88 PolarHBondContact O-N 2.86Å; T81-Y93 HydrophobicContact CG2-CD1 4.11Å; T81-Y93 HydrophobicContact CG2-CD2 4.11Å; T81-Y93 HydrophobicContact CG2-CE1 3.87Å; T81-Y93 HydrophobicContact CG2-CE2 3.99Å; T81-Y93 HydrophobicContact CG2-CG 4.21Å; T81-Y93 WeakPolarHBondContact OG1-CD1 3.39Å
82	C	87.6	Confident	87.8	Confident	30 Å²	30	63.5 Å²	63.5	20%	0.203	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	115.3	165.9	-171.7	0	0	0	0	108.1	Y56 E57 E86 L87	Y56-C82 HydrophobicContact CE1-CB 3.59Å; Y56-C82 WeakPolarHBondContact OH-CB 3.31Å; E57-C82 PolarHBondContact OE2-SG 2.75Å; C82-E86 WeakPolarHBondContact CA-O 3.49Å; C82-L87 HydrophobicContact CB-CD2 4.19Å
83	Q	82.3	Confident	87.4	Confident	65 Å²	65	60.1 Å²	60.1	30%	0.304	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	126.8	172.9	-175.9	-179.4	-17.6	0	0	108.7	S85 E86 Y93	Q83-S85 PolarHBondContact O-N 2.68Å; Q83-E86 PolarHBondContact N-O 2.96Å; Q83-E86 PolarHBondContact O-N 3.25Å; Q83-Y93 VanDerWaalsContact OE1-CE2 3.26Å
84	D	82.9	Confident	86.6	Confident	141 Å²	141	54.1 Å²	54.1	75%	0.754	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	36.5	179.5	-57.9	-49.1	0	0	0	113.4	E86	D84-E86 VanDerWaalsContact C-N 3.25Å; D84-E86 PolarHBondContact O-N 2.89Å
85	S	83.5	Confident	85.9	Confident	79 Å²	79	56.7 Å²	56.7	55%	0.552	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	3.9	-173.8	-50.5	0	0	0	0	116.6	R59 Q83	R59-S85 PolarHBondContact NH1-O 3.28Å; Q83-S85 PolarHBondContact O-N 2.68Å
86	E	88.3	Confident	85	Confident	99 Å²	99	59.4 Å²	59.4	46%	0.463	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133.4	171.1	-64.8	-162.4	165.6	0	0	111.8	C69 C82 Q83 D84	C69-E86 PolarHBondContact SG-OE2 2.91Å; C82-E86 WeakPolarHBondContact CA-O 3.49Å; Q83-E86 PolarHBondContact N-O 2.96Å; Q83-E86 PolarHBondContact O-N 3.25Å; D84-E86 VanDerWaalsContact C-N 3.25Å; D84-E86 PolarHBondContact O-N 2.89Å
87	L	90.7	Very high	84.1	Confident	11 Å²	11	63.8 Å²	63.8	6%	0.058	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	119.1	175.5	-58.4	174.2	0	0	0	110.1	Y56 F61 F66 C68 C69 L75 F80 C82	Y56-L87 HydrophobicContact CD1-CD2 4.3Å; Y56-L87 HydrophobicContact CE1-CD2 4.35Å; F61-L87 HydrophobicContact CE1-CD1 4.13Å; F61-L87 HydrophobicContact CZ-CD1 4.14Å; F66-L87 HydrophobicContact CD2-CD1 3.71Å; F66-L87 HydrophobicContact CE2-CD1 3.54Å; F66-L87 HydrophobicContact CE2-CD2 4.41Å; F66-L87 HydrophobicContact CG-CD1 4.36Å; F66-L87 HydrophobicContact CZ-CD1 4.04Å; F66-L87 HydrophobicContact CZ-CD2 4.42Å; C68-L87 CarbonylContact C-O 3.58Å; C68-L87 VanDerWaalsContact CA-O 3.31Å; C68-L87 WeakPolarHBondContact CA-O 3.2Å; C69-L87 PolarHBondContact N-O 2.97Å; L75-L87 HydrophobicContact CD1-CB 3.67Å; F80-L87 HydrophobicContact CD2-CD2 3.94Å; F80-L87 HydrophobicContact CE2-CD2 3.78Å; C82-L87 HydrophobicContact CB-CD2 4.19Å
88	L	90.3	Very high	83.2	Confident	9 Å²	9	59.5 Å²	59.5	5%	0.047	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.3	178.7	-72.5	161.9	0	0	0	110.3	C69 R70 F80 T81 C92 Y93 F97	C69-L88 WeakPolarHBondContact SG-CD2 2.97Å; R70-L88 HydrophobicContact CB-CD2 4.33Å; R70-L88 HydrophobicContact CG-CD2 3.45Å; R70-L88 VanDerWaalsContact CG-CD2 3.45Å; F80-L88 WeakPolarHBondContact CA-O 3.29Å; F80-L88 WeakPolarHBondContact CB-O 3.45Å; T81-L88 PolarHBondContact N-O 3.41Å; T81-L88 PolarHBondContact O-N 2.86Å; L88-C92 HydrophobicContact CD2-CB 4.15Å; L88-Y93 HydrophobicContact CD1-CD2 4.02Å; L88-F97 HydrophobicContact CD1-CE2 4.44Å
89	C	90	Very high	82.7	Confident	7 Å²	7	56 Å²	56	5%	0.047	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	154	164.6	73.4	0	0	0	0	109.4	C68 C71 L75 D91 C92 Y93	C68-C89 HydrophobicContact CB-CB 4.08Å; C68-C89 PolarHBondContact SG-N 3.27Å; C71-C89 VanDerWaalsContact SG-SG 3.69Å; L75-C89 HydrophobicContact CD2-CB 3.7Å; C89-D91 PolarHBondContact O-N 3.32Å; C89-C92 PolarHBondContact O-N 2.86Å; C89-C92 VanDerWaalsContact O-N 3.16Å; C89-C92 PolarHBondContact SG-N 3.43Å; C89-C92 VanDerWaalsContact SG-N 3.37Å; C89-Y93 WeakPolarHBondContact O-CB 3.5Å; C89-Y93 PolarHBondContact O-N 3.45Å
90	N	83.1	Confident	82.9	Confident	40 Å²	40	58.7 Å²	58.7	21%	0.214	33%	0.329	C	S	.	.	H	α-helix	trans	-53.4	-40.6	178.7	-81	-21.9	0	0	0	112.5	C92 Y93 C94 M109	N90-C92 PolarHBondContact O-N 3.21Å; N90-Y93 PolarHBondContact O-N 3.25Å; N90-C94 WeakPolarHBondContact O-CB 3.43Å; N90-C94 PolarHBondContact O-N 2.77Å; N90-C94 PolarHBondContact O-SG 3.03Å; N90-M109 HydrophobicContact CB-CE 3.84Å; N90-M109 WeakPolarHBondContact OD1-CE 3.15Å
91	D	82.9	Confident	82.9	Confident	99 Å²	99	56.1 Å²	56.1	53%	0.529	32%	0.319	S	S	.	.	H	α-helix	trans	-59.9	-48.1	178.8	-57.9	-27.7	0	0	0	112.5	R73 C89 C94 S95	R73-D91 IonicContact NH1-OD2 3.82Å; R73-D91 PolarHBondContact NH1-OD2 2.87Å; C89-D91 PolarHBondContact O-N 3.32Å; D91-C94 PolarHBondContact O-N 3.4Å; D91-S95 WeakPolarHBondContact O-CB 3.33Å; D91-S95 PolarHBondContact O-N 3.05Å
92	C	86.8	Confident	83	Confident	28 Å²	28	57.3 Å²	57.3	19%	0.189	33%	0.328	C	S	.	.	H	α-helix	trans	-70.6	-37.2	-178.9	-72.4	0	0	0	0	111.7	R70 L88 C89 N90 A96	R70-C92 HydrophobicContact CB-CB 3.9Å; R70-C92 HydrophobicContact CG-CB 4.16Å; L88-C92 HydrophobicContact CD2-CB 4.15Å; C89-C92 PolarHBondContact O-N 2.86Å; C89-C92 VanDerWaalsContact O-N 3.16Å; C89-C92 PolarHBondContact SG-N 3.43Å; C89-C92 VanDerWaalsContact SG-N 3.37Å; N90-C92 PolarHBondContact O-N 3.21Å; C92-A96 WeakPolarHBondContact O-CB 3.5Å; C92-A96 PolarHBondContact O-N 3.47Å
93	Y	83.5	Confident	83.1	Confident	32 Å²	32	58.5 Å²	58.5	13%	0.125	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-46.9	174.3	-177.4	-122.1	0	0	0	111.2	T81 Q83 L88 C89 N90 A96 F97 P110	T81-Y93 HydrophobicContact CG2-CD1 4.11Å; T81-Y93 HydrophobicContact CG2-CD2 4.11Å; T81-Y93 HydrophobicContact CG2-CE1 3.87Å; T81-Y93 HydrophobicContact CG2-CE2 3.99Å; T81-Y93 HydrophobicContact CG2-CG 4.21Å; T81-Y93 WeakPolarHBondContact OG1-CD1 3.39Å; Q83-Y93 VanDerWaalsContact OE1-CE2 3.26Å; L88-Y93 HydrophobicContact CD1-CD2 4.02Å; C89-Y93 WeakPolarHBondContact O-CB 3.5Å; C89-Y93 PolarHBondContact O-N 3.45Å; N90-Y93 PolarHBondContact O-N 3.25Å; Y93-A96 PolarHBondContact O-N 2.66Å; Y93-F97 AromaticContact CD2-CD2 3.55Å; Y93-F97 HydrophobicContact CD2-CD2 3.55Å; Y93-F97 HydrophobicContact CD2-CE2 4.15Å; Y93-F97 HydrophobicContact CD2-CG 4.48Å; Y93-F97 HydrophobicContact CE2-CB 4.28Å; Y93-F97 AromaticContact CE2-CD2 3.63Å; Y93-F97 HydrophobicContact CE2-CD2 3.63Å; Y93-F97 HydrophobicContact CE2-CE2 4.34Å; Y93-F97 HydrophobicContact CE2-CG 4.21Å; Y93-F97 WeakPolarHBondContact O-CD2 3.45Å; Y93-F97 PolarHBondContact O-N 3.07Å; Y93-P110 HydrophobicContact CD1-CG 3.89Å; Y93-P110 HydrophobicContact CE1-CB 3.4Å; Y93-P110 HydrophobicContact CE1-CG 3.17Å; Y93-P110 VanDerWaalsContact OH-CB 3.22Å; Y93-P110 WeakPolarHBondContact OH-CB 3.3Å
94	C	76.3	Confident	83.5	Confident	13 Å²	13	58.2 Å²	58.2	9%	0.088	35%	0.345	C	S	.	.	H	α-helix	trans	-60.9	-47.3	177.5	-74.9	0	0	0	0	112.4	N90 D91 A96 F97 S98 T107 M109	N90-C94 WeakPolarHBondContact O-CB 3.43Å; N90-C94 PolarHBondContact O-N 2.77Å; N90-C94 PolarHBondContact O-SG 3.03Å; D91-C94 PolarHBondContact O-N 3.4Å; C94-A96 PolarHBondContact O-N 3.28Å; C94-F97 PolarHBondContact O-N 2.8Å; C94-S98 VanDerWaalsContact C-OG 3.32Å; C94-S98 VanDerWaalsContact O-CB 3.26Å; C94-S98 WeakPolarHBondContact O-CB 3.47Å; C94-S98 PolarHBondContact O-N 3.26Å; C94-S98 PolarHBondContact O-OG 3.42Å; C94-T107 HydrophobicContact CB-CG2 3.73Å; C94-T107 WeakPolarHBondContact SG-CG2 3.5Å; C94-M109 PolarHBondContact SG-SD 3.34Å
95	S	77.6	Confident	83.7	Confident	112 Å²	112	53.6 Å²	53.6	78%	0.783	33%	0.33	S	S	*	.	H	α-helix	trans	-59.6	-29	178.7	-179	0	0	0	0	113.3	D91	D91-S95 WeakPolarHBondContact O-CB 3.33Å; D91-S95 PolarHBondContact O-N 3.05Å
96	A	74.3	Confident	83.8	Confident	60 Å²	60	56 Å²	56	50%	0.496	33%	0.333	S	S	.	.	H	α-helix	trans	-92.5	-29.9	-176.5	0	0	0	0	0	113.2	C92 Y93 C94	C92-A96 WeakPolarHBondContact O-CB 3.5Å; C92-A96 PolarHBondContact O-N 3.47Å; Y93-A96 PolarHBondContact O-N 2.66Å; C94-A96 PolarHBondContact O-N 3.28Å
97	F	70.6	Confident	83.6	Confident	112 Å²	112	53.5 Å²	53.5	49%	0.491	32%	0.324	S	S	.	.	H	α-helix	trans	-135.7	-4.6	-164.6	-56	-70.7	0	0	0	115.8	L88 Y93 C94	L88-F97 HydrophobicContact CD1-CE2 4.44Å; Y93-F97 AromaticContact CD2-CD2 3.55Å; Y93-F97 HydrophobicContact CD2-CD2 3.55Å; Y93-F97 HydrophobicContact CD2-CE2 4.15Å; Y93-F97 HydrophobicContact CD2-CG 4.48Å; Y93-F97 HydrophobicContact CE2-CB 4.28Å; Y93-F97 AromaticContact CE2-CD2 3.63Å; Y93-F97 HydrophobicContact CE2-CD2 3.63Å; Y93-F97 HydrophobicContact CE2-CE2 4.34Å; Y93-F97 HydrophobicContact CE2-CG 4.21Å; Y93-F97 WeakPolarHBondContact O-CD2 3.45Å; Y93-F97 PolarHBondContact O-N 3.07Å; C94-F97 PolarHBondContact O-N 2.8Å
98	S	68.7	Low	83.2	Confident	32 Å²	32	53.1 Å²	53.1	22%	0.224	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-96.8	147.5	-173.4	76.6	0	0	0	0	114.3	C94 T107	C94-S98 VanDerWaalsContact C-OG 3.32Å; C94-S98 VanDerWaalsContact O-CB 3.26Å; C94-S98 WeakPolarHBondContact O-CB 3.47Å; C94-S98 PolarHBondContact O-N 3.26Å; C94-S98 PolarHBondContact O-OG 3.42Å; S98-T107 WeakPolarHBondContact OG-CG2 3.27Å
99	S	77.1	Confident	82.6	Confident	40 Å²	40	55.8 Å²	55.8	28%	0.28	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	137.1	168.7	32.4	0	0	0	0	110	V108 T121	S99-V108 WeakPolarHBondContact O-CB 3.48Å; S99-V108 PolarHBondContact O-N 3.1Å; S99-T121 WeakPolarHBondContact CB-OG1 3.49Å; S99-T121 PolarHBondContact OG-OG1 3.13Å
100	Q	87.5	Confident	81.6	Confident	137 Å²	137	57.7 Å²	57.7	64%	0.64	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	142	177.3	-69.3	174.1	-9.3	0	0	111	S102	Q100-S102 PolarHBondContact O-N 3.03Å
101	C	89.6	Confident	81	Confident	2 Å²	2	60 Å²	60	1%	0.014	38%	0.381	C	S	.	.	B	Isolated β-bridge	trans	-69.5	125.2	174.1	-180	0	0	0	0	109.8	A103 C104 G105 E106 V108 T121 H123 C126	C101-A103 PolarHBondContact O-N 3.21Å; C101-C104 WeakPolarHBondContact CB-SG 3.48Å; C101-G105 VanDerWaalsContact O-CA 3.26Å; C101-G105 WeakPolarHBondContact O-CA 3.39Å; C101-G105 PolarHBondContact O-N 3.49Å; C101-E106 VanDerWaalsContact CB-O 3.27Å; C101-E106 WeakPolarHBondContact CB-O 3.46Å; C101-E106 PolarHBondContact N-O 3.22Å; C101-V108 HydrophobicContact CB-CG2 3.76Å; C101-T121 CarbonylContact C-O 3.45Å; C101-T121 VanDerWaalsContact CA-O 3.3Å; C101-T121 WeakPolarHBondContact CA-O 3.22Å; C101-H123 VanDerWaalsContact CB-CE1 3.5Å; C101-H123 WeakPolarHBondContact CB-CE1 3.26Å; C101-H123 WeakPolarHBondContact CB-ND1 3.47Å; C101-H123 PolarHBondContact SG-N 3.48Å; C101-H123 PolarHBondContact SG-ND1 2.85Å; C101-C126 VanDerWaalsContact SG-CB 3.59Å
102	S	89.8	Confident	80.8	Confident	55 Å²	55	57.7 Å²	57.7	39%	0.385	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.3	-178.7	-63.2	0	0	0	0	114	Q100 Q120 T121 W122	Q100-S102 PolarHBondContact O-N 3.03Å; S102-Q120 WeakPolarHBondContact OG-CB 3.4Å; S102-T121 PolarHBondContact N-O 3.16Å; S102-W122 VanDerWaalsContact CB-CZ2 3.43Å
103	A	89.8	Confident	80.5	Confident	55 Å²	55	65.7 Å²	65.7	46%	0.455	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-52.9	174.8	0	0	0	0	0	113	C101 W122 C126	C101-A103 PolarHBondContact O-N 3.21Å; A103-W122 HydrophobicContact CB-CE3 3.5Å; A103-W122 VanDerWaalsContact CB-CE3 3.5Å; A103-W122 HydrophobicContact CB-CH2 4.32Å; A103-W122 HydrophobicContact CB-CZ3 3.26Å; A103-C126 HydrophobicContact CB-CB 3.63Å
104	C	90.6	Very high	80.6	Confident	60 Å²	60	69 Å²	69	41%	0.405	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-10.2	-170	60	0	0	0	0	113.5	C101 E106 H123	C101-C104 WeakPolarHBondContact CB-SG 3.48Å; C104-E106 PolarHBondContact O-N 3.33Å; C104-E106 VanDerWaalsContact O-N 3.16Å; C104-H123 VanDerWaalsContact SG-CE1 3.59Å; C104-H123 PolarHBondContact SG-ND1 2.89Å
105	G	86.2	Confident	81.1	Confident	43 Å²	43	69.6 Å²	69.6	44%	0.443	42%	0.416	S	S	.	.			trans	76.2	-12.9	-175.8	0	0	0	0	0	114.3	C101	C101-G105 VanDerWaalsContact O-CA 3.26Å; C101-G105 WeakPolarHBondContact O-CA 3.39Å; C101-G105 PolarHBondContact O-N 3.49Å
106	E	85.8	Confident	81.6	Confident	130 Å²	130	70.3 Å²	70.3	61%	0.607	41%	0.407	S	S	*	.			trans	-72.1	156.1	179.7	-65.1	-60.6	152.8	0	0	112.3	C101 C104 V108	C101-E106 VanDerWaalsContact CB-O 3.27Å; C101-E106 WeakPolarHBondContact CB-O 3.46Å; C101-E106 PolarHBondContact N-O 3.22Å; C104-E106 PolarHBondContact O-N 3.33Å; C104-E106 VanDerWaalsContact O-N 3.16Å; E106-V108 PolarHBondContact O-N 2.8Å
107	T	83.8	Confident	82.2	Confident	46 Å²	46	71.6 Å²	71.6	28%	0.282	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	134.7	179.6	-66.1	0	0	0	0	112.1	C94 S98 H123	C94-T107 HydrophobicContact CB-CG2 3.73Å; C94-T107 WeakPolarHBondContact SG-CG2 3.5Å; S98-T107 WeakPolarHBondContact OG-CG2 3.27Å; T107-H123 PolarHBondContact O-NE2 3.09Å
108	V	84.2	Confident	82.9	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.018	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	105.8	166.9	-173.2	0	0	0	0	108.9	S99 C101 E106 K114 T121	S99-V108 WeakPolarHBondContact O-CB 3.48Å; S99-V108 PolarHBondContact O-N 3.1Å; C101-V108 HydrophobicContact CB-CG2 3.76Å; E106-V108 PolarHBondContact O-N 2.8Å; V108-K114 HydrophobicContact CG1-CB 3.58Å; V108-K114 HydrophobicContact CG1-CD 4.47Å; V108-T121 HydrophobicContact CB-CG2 4.32Å; V108-T121 HydrophobicContact CG1-CG2 4.36Å; V108-T121 HydrophobicContact CG2-CG2 4.12Å
109	M	77	Confident	83.7	Confident	66 Å²	66	72.3 Å²	72.3	33%	0.325	44%	0.444	S	S	.	.			trans	-55.1	130.6	-177.6	-67.2	-60.7	-59.4	0	0	111.3	N90 C94 S112	N90-M109 HydrophobicContact CB-CE 3.84Å; N90-M109 WeakPolarHBondContact OD1-CE 3.15Å; C94-M109 PolarHBondContact SG-SD 3.34Å; M109-S112 VanDerWaalsContact O-CB 3.29Å; M109-S112 WeakPolarHBondContact O-CB 3.48Å; M109-S112 PolarHBondContact O-N 3.05Å; M109-S112 VanDerWaalsContact O-N 3.13Å; M109-S112 PolarHBondContact O-OG 3.47Å
110	P	69.2	Low	84.2	Confident	46 Å²	46	74.9 Å²	74.9	30%	0.299	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	145.5	174.5	-19.6	33.3	0	0	0	110.8	Y93 S112	Y93-P110 HydrophobicContact CD1-CG 3.89Å; Y93-P110 HydrophobicContact CE1-CB 3.4Å; Y93-P110 HydrophobicContact CE1-CG 3.17Å; Y93-P110 VanDerWaalsContact OH-CB 3.22Å; Y93-P110 WeakPolarHBondContact OH-CB 3.3Å; P110-S112 PolarHBondContact O-N 3.5Å
111	G	70.4	Confident	84.3	Confident	89 Å²	89	69 Å²	69	92%	0.918	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.8	-15	-171	0	0	0	0	0	114.9
112	S	77.8	Confident	84.3	Confident	51 Å²	51	70.4 Å²	70.4	36%	0.357	43%	0.43	S	S	.	.	S	Bend	trans	-75.8	155.2	169.2	76.7	0	0	0	0	111.3	M109 P110 K114	M109-S112 VanDerWaalsContact O-CB 3.29Å; M109-S112 WeakPolarHBondContact O-CB 3.48Å; M109-S112 PolarHBondContact O-N 3.05Å; M109-S112 VanDerWaalsContact O-N 3.13Å; M109-S112 PolarHBondContact O-OG 3.47Å; P110-S112 PolarHBondContact O-N 3.5Å; S112-K114 PolarHBondContact O-N 3.4Å
113	R	80.3	Confident	84.3	Confident	195 Å²	195	69.3 Å²	69.3	74%	0.736	42%	0.419	S	S	*	.			trans	-66.9	119.9	173.4	-68.3	-172.8	176.7	-153.6	-0.3	109.4	E124	R113-E124 VanDerWaalsContact CB-CD 3.41Å; R113-E124 HydrophobicContact CB-CG 3.98Å; R113-E124 WeakPolarHBondContact CB-OE2 3.37Å; R113-E124 WeakPolarHBondContact CD-OE1 3.32Å; R113-E124 WeakPolarHBondContact CD-OE2 3.36Å
114	K	85.6	Confident	84.2	Confident	103 Å²	103	70.1 Å²	70.1	45%	0.448	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	154.7	178.7	63.6	172.3	171.7	164.1	0	110.8	V108 S112 E116 T121	V108-K114 HydrophobicContact CG1-CB 3.58Å; V108-K114 HydrophobicContact CG1-CD 4.47Å; S112-K114 PolarHBondContact O-N 3.4Å; K114-E116 WeakPolarHBondContact CE-OE1 3.43Å; K114-E116 IonicContact NZ-OE1 3.4Å; K114-E116 PolarHBondContact NZ-OE1 3.05Å; K114-T121 HydrophobicContact CB-CG2 4.13Å; K114-T121 HydrophobicContact CD-CG2 3.81Å; K114-T121 HydrophobicContact CG-CG2 4.47Å
115	L	88.1	Confident	84.1	Confident	25 Å²	25	73.1 Å²	73.1	13%	0.131	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	132.4	172.2	-169.8	142.7	0	0	0	109.3	T121 W122 F127 G137	L115-T121 CarbonylContact O-C 3.55Å; L115-T121 WeakPolarHBondContact O-CA 3.48Å; L115-W122 HydrophobicContact CB-CB 4.46Å; L115-W122 PolarHBondContact N-O 2.85Å; L115-W122 PolarHBondContact O-N 3.25Å; L115-F127 HydrophobicContact CD1-CB 4.46Å; L115-F127 HydrophobicContact CD1-CD1 3.76Å; L115-F127 HydrophobicContact CD1-CE1 4.34Å; L115-F127 HydrophobicContact CD1-CG 4.28Å; L115-F127 HydrophobicContact CD2-CB 4.39Å; L115-F127 HydrophobicContact CD2-CD1 3.72Å; L115-F127 HydrophobicContact CD2-CD2 4.01Å; L115-F127 HydrophobicContact CD2-CE1 3.92Å; L115-F127 HydrophobicContact CD2-CE2 4.18Å; L115-F127 HydrophobicContact CD2-CG 3.78Å; L115-F127 HydrophobicContact CD2-CZ 4.13Å; L115-F127 HydrophobicContact CG-CD1 4.39Å; L115-G137 WeakPolarHBondContact CD1-O 3.5Å
116	E	88.2	Confident	84.4	Confident	126 Å²	126	72 Å²	72	59%	0.589	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	122.7	176.5	-69.5	180	-175.5	0	0	109.4	K114 Q120 T121	K114-E116 WeakPolarHBondContact CE-OE1 3.43Å; K114-E116 IonicContact NZ-OE1 3.4Å; K114-E116 PolarHBondContact NZ-OE1 3.05Å; E116-Q120 WeakPolarHBondContact CA-O 3.13Å; E116-T121 HydrophobicContact CG-CG2 4.26Å
117	Y	87	Confident	84.7	Confident	88 Å²	88	65.8 Å²	65.8	35%	0.345	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	133.6	178.3	-179.8	-106.1	0	0	0	109.9	G119 Q120 F127 F141 P143 H148	Y117-G119 PolarHBondContact O-N 3Å; Y117-Q120 PolarHBondContact N-O 2.6Å; Y117-Q120 WeakPolarHBondContact O-CB 3.29Å; Y117-Q120 PolarHBondContact O-N 2.88Å; Y117-F127 HydrophobicContact CD1-CZ 4.28Å; Y117-F141 HydrophobicContact CD1-CE2 4.34Å; Y117-F141 HydrophobicContact CD1-CZ 4.25Å; Y117-F141 HydrophobicContact CD2-CE2 4.33Å; Y117-F141 AromaticContact CD2-CZ 3.65Å; Y117-F141 HydrophobicContact CD2-CZ 3.65Å; Y117-F141 HydrophobicContact CE1-CE2 4.07Å; Y117-F141 HydrophobicContact CE1-CZ 4.31Å; Y117-F141 HydrophobicContact CE2-CE2 4.06Å; Y117-F141 AromaticContact CE2-CZ 3.72Å; Y117-F141 HydrophobicContact CE2-CZ 3.72Å; Y117-F141 HydrophobicContact CG-CE2 4.47Å; Y117-F141 AromaticContact CG-CZ 3.93Å; Y117-F141 HydrophobicContact CG-CZ 3.93Å; Y117-F141 AromaticContact CZ-CE2 3.94Å; Y117-P143 HydrophobicContact CE1-CB 4.4Å; Y117-P143 WeakPolarHBondContact OH-CB 3.42Å; Y117-P143 VanDerWaalsContact OH-CG 3.27Å; Y117-P143 WeakPolarHBondContact OH-CG 3.45Å; Y117-H148 AromaticContact CD1-NE2 3.91Å; Y117-H148 AromaticContact CE1-NE2 3.91Å
118	G	85.1	Confident	85.2	Confident	73 Å²	73	66.9 Å²	66.9	75%	0.753	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	27.3	178.5	0	0	0	0	0	114.7	Q120	G118-Q120 PolarHBondContact O-N 3.19Å
119	G	84.4	Confident	85.7	Confident	86 Å²	86	66.8 Å²	66.8	89%	0.887	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.3	6.3	-175.8	0	0	0	0	0	114.6	Y117	Y117-G119 PolarHBondContact O-N 3Å
120	Q	87.9	Confident	86.5	Confident	93 Å²	93	66.9 Å²	66.9	44%	0.435	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	150.2	176.4	-71	-179.7	-24.3	0	0	111	S102 E116 Y117 G118	S102-Q120 WeakPolarHBondContact OG-CB 3.4Å; E116-Q120 WeakPolarHBondContact CA-O 3.13Å; Y117-Q120 PolarHBondContact N-O 2.6Å; Y117-Q120 WeakPolarHBondContact O-CB 3.29Å; Y117-Q120 PolarHBondContact O-N 2.88Å; G118-Q120 PolarHBondContact O-N 3.19Å
121	T	89.1	Confident	87.6	Confident	15 Å²	15	67 Å²	67	9%	0.092	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.8	177.5	-42.3	0	0	0	0	110.3	S99 C101 S102 V108 K114 L115 E116	S99-T121 WeakPolarHBondContact CB-OG1 3.49Å; S99-T121 PolarHBondContact OG-OG1 3.13Å; C101-T121 CarbonylContact C-O 3.45Å; C101-T121 VanDerWaalsContact CA-O 3.3Å; C101-T121 WeakPolarHBondContact CA-O 3.22Å; S102-T121 PolarHBondContact N-O 3.16Å; V108-T121 HydrophobicContact CB-CG2 4.32Å; V108-T121 HydrophobicContact CG1-CG2 4.36Å; V108-T121 HydrophobicContact CG2-CG2 4.12Å; K114-T121 HydrophobicContact CB-CG2 4.13Å; K114-T121 HydrophobicContact CD-CG2 3.81Å; K114-T121 HydrophobicContact CG-CG2 4.47Å; L115-T121 CarbonylContact O-C 3.55Å; L115-T121 WeakPolarHBondContact O-CA 3.48Å; E116-T121 HydrophobicContact CG-CG2 4.26Å
122	W	90.7	Very high	88.7	Confident	31 Å²	31	65.2 Å²	65.2	12%	0.117	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	145.5	-177.1	-58.3	75	0	0	0	109.8	S102 A103 L115 C126 F127	S102-W122 VanDerWaalsContact CB-CZ2 3.43Å; A103-W122 HydrophobicContact CB-CE3 3.5Å; A103-W122 VanDerWaalsContact CB-CE3 3.5Å; A103-W122 HydrophobicContact CB-CH2 4.32Å; A103-W122 HydrophobicContact CB-CZ3 3.26Å; L115-W122 HydrophobicContact CB-CB 4.46Å; L115-W122 PolarHBondContact N-O 2.85Å; L115-W122 PolarHBondContact O-N 3.25Å; W122-C126 HydrophobicContact CE3-CB 4.47Å; W122-F127 HydrophobicContact CB-CB 4.1Å; W122-F127 HydrophobicContact CB-CD2 4.34Å; W122-F127 AromaticContact CD2-CD2 3.68Å; W122-F127 HydrophobicContact CD2-CD2 3.68Å; W122-F127 HydrophobicContact CD2-CE2 4.41Å; W122-F127 AromaticContact CE3-CD2 3.97Å; W122-F127 HydrophobicContact CE3-CD2 3.97Å; W122-F127 HydrophobicContact CG-CB 4.43Å; W122-F127 AromaticContact CG-CD2 3.8Å; W122-F127 HydrophobicContact CG-CD2 3.8Å
123	H	89.2	Confident	89.5	Confident	32 Å²	32	70 Å²	70	15%	0.148	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	147.7	159.9	-55.9	107.6	0	0	0	109.4	C101 C104 T107 H125 C126 F127	C101-H123 VanDerWaalsContact CB-CE1 3.5Å; C101-H123 WeakPolarHBondContact CB-CE1 3.26Å; C101-H123 WeakPolarHBondContact CB-ND1 3.47Å; C101-H123 PolarHBondContact SG-N 3.48Å; C101-H123 PolarHBondContact SG-ND1 2.85Å; C104-H123 VanDerWaalsContact SG-CE1 3.59Å; C104-H123 PolarHBondContact SG-ND1 2.89Å; T107-H123 PolarHBondContact O-NE2 3.09Å; H123-H125 VanDerWaalsContact CB-CE1 3.49Å; H123-H125 WeakPolarHBondContact CB-CE1 3.27Å; H123-H125 AromaticContact CG-CE1 3.82Å; H123-H125 AromaticContact ND1-CE1 3.94Å; H123-H125 PolarHBondContact O-N 3.08Å; H123-H125 VanDerWaalsContact O-N 3.15Å; H123-C126 HydrophobicContact CB-CB 3.95Å; H123-C126 WeakPolarHBondContact O-CB 3.02Å; H123-C126 PolarHBondContact O-N 3.15Å; H123-F127 PolarHBondContact O-N 3.22Å
124	E	87.4	Confident	90.1	Very high	72 Å²	72	66 Å²	66	34%	0.336	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-36.7	178.5	-76	-171.1	141.7	0	0	112.6	R113	R113-E124 VanDerWaalsContact CB-CD 3.41Å; R113-E124 HydrophobicContact CB-CG 3.98Å; R113-E124 WeakPolarHBondContact CB-OE2 3.37Å; R113-E124 WeakPolarHBondContact CD-OE1 3.32Å; R113-E124 WeakPolarHBondContact CD-OE2 3.36Å
125	H	88.9	Confident	90.4	Very high	122 Å²	122	63.5 Å²	63.5	57%	0.565	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-13.6	177.7	66.6	29	0	0	0	114.2	H123 L128	H123-H125 VanDerWaalsContact CB-CE1 3.49Å; H123-H125 WeakPolarHBondContact CB-CE1 3.27Å; H123-H125 AromaticContact CG-CE1 3.82Å; H123-H125 AromaticContact ND1-CE1 3.94Å; H123-H125 PolarHBondContact O-N 3.08Å; H123-H125 VanDerWaalsContact O-N 3.15Å; H125-L128 WeakPolarHBondContact O-CD2 3.45Å
126	C	91.7	Very high	90.6	Very high	20 Å²	20	62.4 Å²	62.4	14%	0.135	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-19.9	-177.3	-83.6	0	0	0	0	112	C101 A103 W122 H123 L128	C101-C126 VanDerWaalsContact SG-CB 3.59Å; A103-C126 HydrophobicContact CB-CB 3.63Å; W122-C126 HydrophobicContact CE3-CB 4.47Å; H123-C126 HydrophobicContact CB-CB 3.95Å; H123-C126 WeakPolarHBondContact O-CB 3.02Å; H123-C126 PolarHBondContact O-N 3.15Å; C126-L128 PolarHBondContact O-N 2.93Å; C126-L128 VanDerWaalsContact O-N 3.09Å
127	F	92.9	Very high	90.3	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	-83.4	82.8	176.2	-162.1	-114.7	0	0	0	110.1	L115 Y117 W122 H123 L136 F141 H148	L115-F127 HydrophobicContact CD1-CB 4.46Å; L115-F127 HydrophobicContact CD1-CD1 3.76Å; L115-F127 HydrophobicContact CD1-CE1 4.34Å; L115-F127 HydrophobicContact CD1-CG 4.28Å; L115-F127 HydrophobicContact CD2-CB 4.39Å; L115-F127 HydrophobicContact CD2-CD1 3.72Å; L115-F127 HydrophobicContact CD2-CD2 4.01Å; L115-F127 HydrophobicContact CD2-CE1 3.92Å; L115-F127 HydrophobicContact CD2-CE2 4.18Å; L115-F127 HydrophobicContact CD2-CG 3.78Å; L115-F127 HydrophobicContact CD2-CZ 4.13Å; L115-F127 HydrophobicContact CG-CD1 4.39Å; Y117-F127 HydrophobicContact CD1-CZ 4.28Å; W122-F127 HydrophobicContact CB-CB 4.1Å; W122-F127 HydrophobicContact CB-CD2 4.34Å; W122-F127 AromaticContact CD2-CD2 3.68Å; W122-F127 HydrophobicContact CD2-CD2 3.68Å; W122-F127 HydrophobicContact CD2-CE2 4.41Å; W122-F127 AromaticContact CE3-CD2 3.97Å; W122-F127 HydrophobicContact CE3-CD2 3.97Å; W122-F127 HydrophobicContact CG-CB 4.43Å; W122-F127 AromaticContact CG-CD2 3.8Å; W122-F127 HydrophobicContact CG-CD2 3.8Å; H123-F127 PolarHBondContact O-N 3.22Å; F127-L136 HydrophobicContact CD1-CB 3.76Å; F127-L136 HydrophobicContact CD1-CD1 3.97Å; F127-L136 HydrophobicContact CD1-CG 4.46Å; F127-L136 HydrophobicContact CE1-CB 4.18Å; F127-L136 HydrophobicContact CE1-CD1 3.81Å; F127-L136 WeakPolarHBondContact O-CB 3.49Å; F127-L136 PolarHBondContact O-N 3.38Å; F127-F141 HydrophobicContact CE1-CD1 4Å; F127-F141 HydrophobicContact CE1-CD2 4.27Å; F127-F141 AromaticContact CE1-CE1 3.87Å; F127-F141 HydrophobicContact CE1-CE1 3.87Å; F127-F141 HydrophobicContact CE1-CE2 4.14Å; F127-F141 HydrophobicContact CE1-CG 4.2Å; F127-F141 AromaticContact CE1-CZ 3.94Å; F127-F141 HydrophobicContact CE1-CZ 3.94Å; F127-F141 HydrophobicContact CZ-CD2 4.34Å; F127-F141 HydrophobicContact CZ-CE1 4.33Å; F127-F141 AromaticContact CZ-CE2 3.93Å; F127-F141 HydrophobicContact CZ-CE2 3.93Å; F127-F141 AromaticContact CZ-CZ 3.92Å; F127-F141 HydrophobicContact CZ-CZ 3.92Å; F127-H148 AromaticContact CE2-CD2 3.61Å; F127-H148 AromaticContact CE2-CE1 3.8Å; F127-H148 AromaticContact CE2-CG 3.77Å; F127-H148 AromaticContact CE2-ND1 3.89Å; F127-H148 AromaticContact CE2-NE2 3.64Å; F127-H148 HydrophobicContact CZ-CB 4.16Å; F127-H148 AromaticContact CZ-CD2 3.36Å; F127-H148 WeakPolarHBondContact CZ-CD2 3.13Å; F127-H148 AromaticContact CZ-CG 3.67Å; F127-H148 AromaticContact CZ-NE2 3.84Å
128	L	93.6	Very high	89.8	Confident	68 Å²	68	58.9 Å²	58.9	36%	0.356	37%	0.369	S	S	.	.	B	Isolated β-bridge	trans	-99.3	149	-170.7	-59.1	-178.3	0	0	0	113	H125 C126 S130 E133 P135	H125-L128 WeakPolarHBondContact O-CD2 3.45Å; C126-L128 PolarHBondContact O-N 2.93Å; C126-L128 VanDerWaalsContact O-N 3.09Å; L128-S130 PolarHBondContact O-N 2.79Å; L128-E133 WeakPolarHBondContact CD2-O 3.4Å; L128-P135 HydrophobicContact CD2-CB 4.14Å; L128-P135 HydrophobicContact CD2-CG 3.75Å
129	C	94.9	Very high	89.7	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.014	36%	0.362	C	S	.	.			trans	-68.1	124.6	168.6	176.8	0	0	0	0	110.6	G131 C132 E133 Q134 L136 H148 C150	C129-G131 PolarHBondContact O-N 2.89Å; C129-G131 PolarHBondContact SG-N 3.45Å; C129-C132 VanDerWaalsContact CB-SG 3.56Å; C129-C132 PolarHBondContact O-N 3.27Å; C129-E133 WeakPolarHBondContact O-CA 3.45Å; C129-E133 PolarHBondContact O-N 2.95Å; C129-Q134 PolarHBondContact N-O 2.79Å; C129-L136 HydrophobicContact CB-CD2 3.92Å; C129-L136 HydrophobicContact CB-CG 4.23Å; C129-H148 CarbonylContact C-O 3.54Å; C129-H148 WeakPolarHBondContact CA-O 3.29Å; C129-C150 HydrophobicContact CB-CB 4.37Å; C129-C150 PolarHBondContact SG-N 3.48Å; C129-C150 VanDerWaalsContact SG-SG 3.66Å
130	S	94	Very high	89.9	Confident	67 Å²	67	63.9 Å²	63.9	47%	0.469	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-3.6	175.9	-51	0	0	0	0	114.4	L128 H148	L128-S130 PolarHBondContact O-N 2.79Å; S130-H148 PolarHBondContact N-O 3.45Å; S130-H148 PolarHBondContact OG-N 3.31Å; S130-H148 PolarHBondContact OG-O 3.06Å
131	G	92.3	Very high	90.2	Very high	48 Å²	48	62 Å²	62	50%	0.495	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-34.6	177	0	0	0	0	0	114.7	C129	C129-G131 PolarHBondContact O-N 2.89Å; C129-G131 PolarHBondContact SG-N 3.45Å
132	C	94.4	Very high	90.3	Very high	52 Å²	52	63 Å²	63	35%	0.351	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129	0.6	-176.5	65.6	0	0	0	0	114.3	C129 Q134	C129-C132 VanDerWaalsContact CB-SG 3.56Å; C129-C132 PolarHBondContact O-N 3.27Å; C132-Q134 HydrophobicContact CB-CG 4.43Å; C132-Q134 PolarHBondContact O-N 2.89Å
133	E	93.6	Very high	90.3	Very high	151 Å²	151	64.7 Å²	64.7	71%	0.706	37%	0.365	S	S	*	.			trans	58.5	14.8	178.8	-57.2	178.7	171.5	0	0	114.3	L128 C129	L128-E133 WeakPolarHBondContact CD2-O 3.4Å; C129-E133 WeakPolarHBondContact O-CA 3.45Å; C129-E133 PolarHBondContact O-N 2.95Å
134	Q	93.4	Very high	90.4	Very high	111 Å²	111	65 Å²	65	52%	0.519	37%	0.367	S	S	.	.			trans	-84.3	144.3	176	-65.7	-59.2	-55.9	0	0	111.1	C129 C132 L136	C129-Q134 PolarHBondContact N-O 2.79Å; C132-Q134 HydrophobicContact CB-CG 4.43Å; C132-Q134 PolarHBondContact O-N 2.89Å; Q134-L136 PolarHBondContact O-N 2.83Å
135	P	91.8	Very high	90.4	Very high	51 Å²	51	71.1 Å²	71.1	33%	0.331	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-56.3	127.8	172.8	-24.9	33.7	0	0	0	111.8	L128	L128-P135 HydrophobicContact CD2-CB 4.14Å; L128-P135 HydrophobicContact CD2-CG 3.75Å
136	L	91.9	Very high	90.2	Very high	3 Å²	3	68.9 Å²	68.9	2%	0.016	40%	0.403	C	S	.	.			trans	-78.7	-43.6	173.4	-66.7	170.7	0	0	0	109.8	F127 C129 Q134 S138 R139 F141 H148 C150	F127-L136 HydrophobicContact CD1-CB 3.76Å; F127-L136 HydrophobicContact CD1-CD1 3.97Å; F127-L136 HydrophobicContact CD1-CG 4.46Å; F127-L136 HydrophobicContact CE1-CB 4.18Å; F127-L136 HydrophobicContact CE1-CD1 3.81Å; F127-L136 WeakPolarHBondContact O-CB 3.49Å; F127-L136 PolarHBondContact O-N 3.38Å; C129-L136 HydrophobicContact CB-CD2 3.92Å; C129-L136 HydrophobicContact CB-CG 4.23Å; Q134-L136 PolarHBondContact O-N 2.83Å; L136-S138 PolarHBondContact O-N 3.47Å; L136-R139 WeakPolarHBondContact O-CA 3.33Å; L136-R139 WeakPolarHBondContact O-CB 3.47Å; L136-R139 VanDerWaalsContact O-CG 3.27Å; L136-R139 WeakPolarHBondContact O-CG 3.05Å; L136-R139 PolarHBondContact O-N 2.91Å; L136-F141 HydrophobicContact CD1-CB 3.81Å; L136-F141 HydrophobicContact CD1-CG 4.25Å; L136-F141 HydrophobicContact CD2-CB 4.01Å; L136-F141 HydrophobicContact CG-CB 4.36Å; L136-H148 HydrophobicContact CD1-CB 3.69Å; L136-C150 HydrophobicContact CD2-CB 3.63Å
137	G	81.6	Confident	90.1	Very high	14 Å²	14	68.9 Å²	68.9	14%	0.144	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	-125	178.2	0	0	0	0	0	111.9	L115 R139	L115-G137 WeakPolarHBondContact CD1-O 3.5Å; G137-R139 VanDerWaalsContact C-N 3.32Å; G137-R139 PolarHBondContact O-N 3.24Å
138	S	76.9	Confident	90.1	Very high	125 Å²	125	70.1 Å²	70.1	87%	0.874	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	2.5	176.6	58.7	0	0	0	0	115.3	L136	L136-S138 PolarHBondContact O-N 3.47Å
139	R	84	Confident	90.1	Very high	164 Å²	164	67.8 Å²	67.8	62%	0.619	40%	0.397	S	S	*	.	S	Bend	trans	-76.4	150.1	-179.3	-57.4	172.3	176.9	172.8	-1.5	110.5	L136 G137 F141	L136-R139 WeakPolarHBondContact O-CA 3.33Å; L136-R139 WeakPolarHBondContact O-CB 3.47Å; L136-R139 VanDerWaalsContact O-CG 3.27Å; L136-R139 WeakPolarHBondContact O-CG 3.05Å; L136-R139 PolarHBondContact O-N 2.91Å; G137-R139 VanDerWaalsContact C-N 3.32Å; G137-R139 PolarHBondContact O-N 3.24Å; R139-F141 PolarHBondContact O-N 2.79Å
140	S	88.4	Confident	90.1	Very high	100 Å²	100	68.8 Å²	68.8	70%	0.699	40%	0.404	S	S	*	.			trans	-58.9	135	171	-52.9	0	0	0	0	111.1
141	F	93.1	Very high	89.9	Confident	54 Å²	54	68 Å²	68	24%	0.237	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	163.3	178.9	70.3	-88.3	0	0	0	111	Y117 F127 L136 R139 P143 H148 Y149	Y117-F141 HydrophobicContact CD1-CE2 4.34Å; Y117-F141 HydrophobicContact CD1-CZ 4.25Å; Y117-F141 HydrophobicContact CD2-CE2 4.33Å; Y117-F141 AromaticContact CD2-CZ 3.65Å; Y117-F141 HydrophobicContact CD2-CZ 3.65Å; Y117-F141 HydrophobicContact CE1-CE2 4.07Å; Y117-F141 HydrophobicContact CE1-CZ 4.31Å; Y117-F141 HydrophobicContact CE2-CE2 4.06Å; Y117-F141 AromaticContact CE2-CZ 3.72Å; Y117-F141 HydrophobicContact CE2-CZ 3.72Å; Y117-F141 HydrophobicContact CG-CE2 4.47Å; Y117-F141 AromaticContact CG-CZ 3.93Å; Y117-F141 HydrophobicContact CG-CZ 3.93Å; Y117-F141 AromaticContact CZ-CE2 3.94Å; F127-F141 HydrophobicContact CE1-CD1 4Å; F127-F141 HydrophobicContact CE1-CD2 4.27Å; F127-F141 AromaticContact CE1-CE1 3.87Å; F127-F141 HydrophobicContact CE1-CE1 3.87Å; F127-F141 HydrophobicContact CE1-CE2 4.14Å; F127-F141 HydrophobicContact CE1-CG 4.2Å; F127-F141 AromaticContact CE1-CZ 3.94Å; F127-F141 HydrophobicContact CE1-CZ 3.94Å; F127-F141 HydrophobicContact CZ-CD2 4.34Å; F127-F141 HydrophobicContact CZ-CE1 4.33Å; F127-F141 AromaticContact CZ-CE2 3.93Å; F127-F141 HydrophobicContact CZ-CE2 3.93Å; F127-F141 AromaticContact CZ-CZ 3.92Å; F127-F141 HydrophobicContact CZ-CZ 3.92Å; L136-F141 HydrophobicContact CD1-CB 3.81Å; L136-F141 HydrophobicContact CD1-CG 4.25Å; L136-F141 HydrophobicContact CD2-CB 4.01Å; L136-F141 HydrophobicContact CG-CB 4.36Å; R139-F141 PolarHBondContact O-N 2.79Å; F141-P143 HydrophobicContact CE2-CB 4.48Å; F141-H148 HydrophobicContact CD2-CB 4.46Å; F141-Y149 CarbonylContact C-O 3.54Å; F141-Y149 VanDerWaalsContact CA-O 3.29Å; F141-Y149 WeakPolarHBondContact CA-O 3.5Å; F141-Y149 WeakPolarHBondContact CB-O 3.44Å
142	V	92.1	Very high	89.8	Confident	37 Å²	37	69.9 Å²	69.9	22%	0.224	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	115.2	178.5	-172.6	0	0	0	0	108.8	Y149 V151 Y154	V142-Y149 PolarHBondContact N-O 3.31Å; V142-Y149 PolarHBondContact O-N 2.93Å; V142-V151 HydrophobicContact CG2-CG2 4.36Å; V142-Y154 HydrophobicContact CB-CD1 4.21Å; V142-Y154 HydrophobicContact CB-CD2 3.81Å; V142-Y154 HydrophobicContact CB-CE2 4.32Å; V142-Y154 HydrophobicContact CB-CG 3.76Å; V142-Y154 HydrophobicContact CG1-CD1 3.94Å; V142-Y154 HydrophobicContact CG1-CD2 3.6Å; V142-Y154 HydrophobicContact CG1-CE1 3.91Å; V142-Y154 HydrophobicContact CG1-CE2 3.58Å; V142-Y154 HydrophobicContact CG1-CG 3.79Å; V142-Y154 HydrophobicContact CG2-CD1 4.1Å; V142-Y154 HydrophobicContact CG2-CG 3.98Å
143	P	91.4	Very high	89.8	Confident	65 Å²	65	68.7 Å²	68.7	42%	0.422	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	131.3	171.7	31.9	-34.5	0	0	0	110.3	Y117 F141 A147	Y117-P143 HydrophobicContact CE1-CB 4.4Å; Y117-P143 WeakPolarHBondContact OH-CB 3.42Å; Y117-P143 VanDerWaalsContact OH-CG 3.27Å; Y117-P143 WeakPolarHBondContact OH-CG 3.45Å; F141-P143 HydrophobicContact CE2-CB 4.48Å; P143-A147 WeakPolarHBondContact CA-O 3.3Å
144	D	89.8	Confident	89.7	Confident	38 Å²	38	64.9 Å²	64.9	20%	0.203	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	119.1	174.9	179.1	55.4	0	0	0	110.7	G146 A147 Y149 Y154 F158	D144-G146 PolarHBondContact O-N 3.06Å; D144-G146 VanDerWaalsContact O-N 3.08Å; D144-A147 PolarHBondContact N-O 2.92Å; D144-A147 WeakPolarHBondContact O-CA 3.43Å; D144-A147 WeakPolarHBondContact O-CB 3.49Å; D144-A147 PolarHBondContact O-N 3.21Å; D144-Y149 HydrophobicContact CB-CD2 4.25Å; D144-Y149 HydrophobicContact CB-CE2 4.15Å; D144-Y154 HydrophobicContact CB-CE2 3.94Å; D144-F158 WeakPolarHBondContact OD2-CZ 3.21Å
145	K	87.3	Confident	89.4	Confident	201 Å²	201	62.7 Å²	62.7	87%	0.874	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	37.9	175.7	-60.2	176.9	-175.3	177.7	0	114.9	A147	K145-A147 VanDerWaalsContact C-N 3.33Å
146	G	84.8	Confident	89.2	Confident	75 Å²	75	65 Å²	65	77%	0.773	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	85	-0.1	-179.5	0	0	0	0	0	115	D144	D144-G146 PolarHBondContact O-N 3.06Å; D144-G146 VanDerWaalsContact O-N 3.08Å
147	A	90.3	Very high	88.9	Confident	21 Å²	21	70.4 Å²	70.4	17%	0.174	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	159.4	169.3	0	0	0	0	0	111.1	P143 D144 K145 Y149	P143-A147 WeakPolarHBondContact CA-O 3.3Å; D144-A147 PolarHBondContact N-O 2.92Å; D144-A147 WeakPolarHBondContact O-CA 3.43Å; D144-A147 WeakPolarHBondContact O-CB 3.49Å; D144-A147 PolarHBondContact O-N 3.21Å; K145-A147 VanDerWaalsContact C-N 3.33Å; A147-Y149 HydrophobicContact CB-CD2 4.49Å; A147-Y149 HydrophobicContact CB-CE2 3.71Å
148	H	92.9	Very high	89	Confident	25 Å²	25	73.8 Å²	73.8	12%	0.116	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.7	-178.6	-47.1	89.7	0	0	0	108.6	Y117 F127 C129 S130 L136 F141	Y117-H148 AromaticContact CD1-NE2 3.91Å; Y117-H148 AromaticContact CE1-NE2 3.91Å; F127-H148 AromaticContact CE2-CD2 3.61Å; F127-H148 AromaticContact CE2-CE1 3.8Å; F127-H148 AromaticContact CE2-CG 3.77Å; F127-H148 AromaticContact CE2-ND1 3.89Å; F127-H148 AromaticContact CE2-NE2 3.64Å; F127-H148 HydrophobicContact CZ-CB 4.16Å; F127-H148 AromaticContact CZ-CD2 3.36Å; F127-H148 WeakPolarHBondContact CZ-CD2 3.13Å; F127-H148 AromaticContact CZ-CG 3.67Å; F127-H148 AromaticContact CZ-NE2 3.84Å; C129-H148 CarbonylContact C-O 3.54Å; C129-H148 WeakPolarHBondContact CA-O 3.29Å; S130-H148 PolarHBondContact N-O 3.45Å; S130-H148 PolarHBondContact OG-N 3.31Å; S130-H148 PolarHBondContact OG-O 3.06Å; L136-H148 HydrophobicContact CD1-CB 3.69Å; F141-H148 HydrophobicContact CD2-CB 4.46Å
149	Y	94	Very high	89.5	Confident	19 Å²	19	68.7 Å²	68.7	8%	0.075	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	140.4	-178.9	-64.5	-79.4	0	0	0	110.6	F141 V142 D144 A147 C153 Y154 K157 F158	F141-Y149 CarbonylContact C-O 3.54Å; F141-Y149 VanDerWaalsContact CA-O 3.29Å; F141-Y149 WeakPolarHBondContact CA-O 3.5Å; F141-Y149 WeakPolarHBondContact CB-O 3.44Å; V142-Y149 PolarHBondContact N-O 3.31Å; V142-Y149 PolarHBondContact O-N 2.93Å; D144-Y149 HydrophobicContact CB-CD2 4.25Å; D144-Y149 HydrophobicContact CB-CE2 4.15Å; A147-Y149 HydrophobicContact CB-CD2 4.49Å; A147-Y149 HydrophobicContact CB-CE2 3.71Å; Y149-C153 HydrophobicContact CD1-CB 4.45Å; Y149-Y154 HydrophobicContact CD2-CD2 4.02Å; Y149-Y154 HydrophobicContact CG-CD2 4.32Å; Y149-K157 HydrophobicContact CE1-CD 4.38Å; Y149-K157 PolarHBondContact OH-NZ 2.92Å; Y149-F158 HydrophobicContact CD2-CE2 4.43Å; Y149-F158 HydrophobicContact CE2-CE2 4.22Å
150	C	94.1	Very high	89.8	Confident	23 Å²	23	64.3 Å²	64.3	16%	0.155	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	152.1	162.4	70.5	0	0	0	0	108.8	C129 L136 P152 C153 Y154	C129-C150 HydrophobicContact CB-CB 4.37Å; C129-C150 PolarHBondContact SG-N 3.48Å; C129-C150 VanDerWaalsContact SG-SG 3.66Å; L136-C150 HydrophobicContact CD2-CB 3.63Å; C150-P152 VanDerWaalsContact C-N 3.33Å; C150-C153 PolarHBondContact O-N 3.44Å; C150-C153 VanDerWaalsContact SG-CB 3.55Å; C150-C153 PolarHBondContact SG-SG 3.5Å; C150-Y154 PolarHBondContact O-N 2.85Å
151	V	90.9	Very high	90	Very high	51 Å²	51	66 Å²	66	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-50	-47.6	-177.7	177.5	0	0	0	0	112.3	V142 C153 Y154 E155	V142-V151 HydrophobicContact CG2-CG2 4.36Å; V151-C153 PolarHBondContact O-N 2.97Å; V151-Y154 PolarHBondContact O-N 2.9Å; V151-E155 HydrophobicContact CG1-CG 4.19Å; V151-E155 WeakPolarHBondContact O-CB 3.27Å; V151-E155 WeakPolarHBondContact O-CG 3.35Å; V151-E155 PolarHBondContact O-N 3.11Å
152	P	90.2	Very high	90.1	Very high	87 Å²	87	63.5 Å²	63.5	57%	0.565	34%	0.343	S	S	*	.	H	α-helix	trans	-61.7	-40.5	178.5	-24	34.4	0	0	0	114.3	C150 N156	C150-P152 VanDerWaalsContact C-N 3.33Å; P152-N156 VanDerWaalsContact O-CB 3.26Å; P152-N156 WeakPolarHBondContact O-CB 2.93Å; P152-N156 PolarHBondContact O-N 3.16Å
153	C	92.4	Very high	90.2	Very high	28 Å²	28	63.8 Å²	63.8	19%	0.189	35%	0.349	C	S	.	.	H	α-helix	trans	-69.4	-39.5	178.6	-75.7	0	0	0	0	111.6	Y149 C150 V151 K157	Y149-C153 HydrophobicContact CD1-CB 4.45Å; C150-C153 PolarHBondContact O-N 3.44Å; C150-C153 VanDerWaalsContact SG-CB 3.55Å; C150-C153 PolarHBondContact SG-SG 3.5Å; V151-C153 PolarHBondContact O-N 2.97Å; C153-K157 WeakPolarHBondContact O-CB 3.41Å; C153-K157 PolarHBondContact O-N 3.4Å; C153-K157 VanDerWaalsContact O-N 3.11Å
154	Y	91.6	Very high	90.3	Very high	70 Å²	70	66.2 Å²	66.2	28%	0.275	35%	0.35	S	S	.	.	H	α-helix	trans	-63	-51.3	176	-172.4	-95.5	0	0	0	110.6	V142 D144 Y149 C150 V151 N156 K157 F158	V142-Y154 HydrophobicContact CB-CD1 4.21Å; V142-Y154 HydrophobicContact CB-CD2 3.81Å; V142-Y154 HydrophobicContact CB-CE2 4.32Å; V142-Y154 HydrophobicContact CB-CG 3.76Å; V142-Y154 HydrophobicContact CG1-CD1 3.94Å; V142-Y154 HydrophobicContact CG1-CD2 3.6Å; V142-Y154 HydrophobicContact CG1-CE1 3.91Å; V142-Y154 HydrophobicContact CG1-CE2 3.58Å; V142-Y154 HydrophobicContact CG1-CG 3.79Å; V142-Y154 HydrophobicContact CG2-CD1 4.1Å; V142-Y154 HydrophobicContact CG2-CG 3.98Å; D144-Y154 HydrophobicContact CB-CE2 3.94Å; Y149-Y154 HydrophobicContact CD2-CD2 4.02Å; Y149-Y154 HydrophobicContact CG-CD2 4.32Å; C150-Y154 PolarHBondContact O-N 2.85Å; V151-Y154 PolarHBondContact O-N 2.9Å; Y154-N156 VanDerWaalsContact C-N 3.35Å; Y154-N156 PolarHBondContact O-N 3.29Å; Y154-K157 PolarHBondContact O-N 2.83Å; Y154-K157 VanDerWaalsContact O-N 3.16Å; Y154-F158 HydrophobicContact CD1-CD2 4.3Å; Y154-F158 AromaticContact CD2-CD2 3.39Å; Y154-F158 HydrophobicContact CD2-CD2 3.39Å; Y154-F158 AromaticContact CD2-CE2 3.56Å; Y154-F158 HydrophobicContact CD2-CE2 3.56Å; Y154-F158 HydrophobicContact CE1-CB 4.38Å; Y154-F158 HydrophobicContact CE1-CD2 4.25Å; Y154-F158 AromaticContact CE2-CD2 3.31Å; Y154-F158 HydrophobicContact CE2-CD2 3.31Å; Y154-F158 AromaticContact CE2-CE2 3.5Å; Y154-F158 HydrophobicContact CE2-CE2 3.5Å; Y154-F158 VanDerWaalsContact CE2-CE2 3.5Å; Y154-F158 HydrophobicContact CE2-CG 4.18Å; Y154-F158 HydrophobicContact CE2-CZ 4.48Å; Y154-F158 AromaticContact CG-CD2 3.9Å; Y154-F158 HydrophobicContact CG-CD2 3.9Å; Y154-F158 HydrophobicContact CG-CE2 4.44Å; Y154-F158 AromaticContact CZ-CD2 3.78Å; Y154-F158 VanDerWaalsContact O-CD2 3.3Å; Y154-F158 WeakPolarHBondContact O-CD2 3.33Å; Y154-F158 PolarHBondContact O-N 2.89Å
155	E	88.4	Confident	90.5	Very high	65 Å²	65	66.7 Å²	66.7	30%	0.304	36%	0.356	S	S	.	.	H	α-helix	trans	-59	-44.4	177.3	-72.7	179.1	164.4	0	0	111.7	V151 K157 F158 A159 T170	V151-E155 HydrophobicContact CG1-CG 4.19Å; V151-E155 WeakPolarHBondContact O-CB 3.27Å; V151-E155 WeakPolarHBondContact O-CG 3.35Å; V151-E155 PolarHBondContact O-N 3.11Å; E155-K157 VanDerWaalsContact C-N 3.25Å; E155-K157 PolarHBondContact O-N 3.4Å; E155-F158 PolarHBondContact O-N 3.28Å; E155-A159 HydrophobicContact CB-CB 4.49Å; E155-A159 WeakPolarHBondContact O-CA 3.43Å; E155-A159 WeakPolarHBondContact O-CB 3.41Å; E155-A159 PolarHBondContact O-N 3.38Å; E155-T170 HydrophobicContact CB-CG2 4.26Å; E155-T170 VanDerWaalsContact OE2-CG2 3.32Å; E155-T170 WeakPolarHBondContact OE2-CG2 3.21Å
156	N	86.6	Confident	90.7	Very high	99 Å²	99	61.1 Å²	61.1	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-32.7	179.1	-172.1	44.5	0	0	0	113.2	P152 Y154 R161	P152-N156 VanDerWaalsContact O-CB 3.26Å; P152-N156 WeakPolarHBondContact O-CB 2.93Å; P152-N156 PolarHBondContact O-N 3.16Å; Y154-N156 VanDerWaalsContact C-N 3.35Å; Y154-N156 PolarHBondContact O-N 3.29Å; N156-R161 PolarHBondContact O-NH2 3.15Å; N156-R161 VanDerWaalsContact O-NH2 3.15Å
157	K	85.4	Confident	91.1	Very high	118 Å²	118	64.6 Å²	64.6	51%	0.513	34%	0.336	S	S	.	.	H	α-helix	trans	-81.7	-39.1	-178.5	-174	171.7	173.7	-178.1	0	112.5	Y149 C153 Y154 E155	Y149-K157 HydrophobicContact CE1-CD 4.38Å; Y149-K157 PolarHBondContact OH-NZ 2.92Å; C153-K157 WeakPolarHBondContact O-CB 3.41Å; C153-K157 PolarHBondContact O-N 3.4Å; C153-K157 VanDerWaalsContact O-N 3.11Å; Y154-K157 PolarHBondContact O-N 2.83Å; Y154-K157 VanDerWaalsContact O-N 3.16Å; E155-K157 VanDerWaalsContact C-N 3.25Å; E155-K157 PolarHBondContact O-N 3.4Å
158	F	84.8	Confident	91.1	Very high	84 Å²	84	65 Å²	65	37%	0.368	34%	0.336	S	S	.	.	H	α-helix	trans	-118.9	-14.9	-167.3	-58	-72.1	0	0	0	114.8	D144 Y149 Y154 E155	D144-F158 WeakPolarHBondContact OD2-CZ 3.21Å; Y149-F158 HydrophobicContact CD2-CE2 4.43Å; Y149-F158 HydrophobicContact CE2-CE2 4.22Å; Y154-F158 HydrophobicContact CD1-CD2 4.3Å; Y154-F158 AromaticContact CD2-CD2 3.39Å; Y154-F158 HydrophobicContact CD2-CD2 3.39Å; Y154-F158 AromaticContact CD2-CE2 3.56Å; Y154-F158 HydrophobicContact CD2-CE2 3.56Å; Y154-F158 HydrophobicContact CE1-CB 4.38Å; Y154-F158 HydrophobicContact CE1-CD2 4.25Å; Y154-F158 AromaticContact CE2-CD2 3.31Å; Y154-F158 HydrophobicContact CE2-CD2 3.31Å; Y154-F158 AromaticContact CE2-CE2 3.5Å; Y154-F158 HydrophobicContact CE2-CE2 3.5Å; Y154-F158 VanDerWaalsContact CE2-CE2 3.5Å; Y154-F158 HydrophobicContact CE2-CG 4.18Å; Y154-F158 HydrophobicContact CE2-CZ 4.48Å; Y154-F158 AromaticContact CG-CD2 3.9Å; Y154-F158 HydrophobicContact CG-CD2 3.9Å; Y154-F158 HydrophobicContact CG-CE2 4.44Å; Y154-F158 AromaticContact CZ-CD2 3.78Å; Y154-F158 VanDerWaalsContact O-CD2 3.3Å; Y154-F158 WeakPolarHBondContact O-CD2 3.33Å; Y154-F158 PolarHBondContact O-N 2.89Å; E155-F158 PolarHBondContact O-N 3.28Å
159	A	87.5	Confident	90.9	Very high	18 Å²	18	64.6 Å²	64.6	15%	0.149	34%	0.335	C	S	.	.	S	Bend	trans	-68.5	140.8	177.3	0	0	0	0	0	110.5	E155 T168	E155-A159 HydrophobicContact CB-CB 4.49Å; E155-A159 WeakPolarHBondContact O-CA 3.43Å; E155-A159 WeakPolarHBondContact O-CB 3.41Å; E155-A159 PolarHBondContact O-N 3.38Å; A159-T168 HydrophobicContact CB-CG2 4.23Å
160	P	89.9	Confident	90.4	Very high	72 Å²	72	67.1 Å²	67.1	47%	0.468	35%	0.352	S	S	.	.			trans	-57.6	151.6	173.4	21.4	-29.3	0	0	0	110.9	T168 L169 P180	P160-T168 CarbonylContact O-C 3.59Å; P160-T168 WeakPolarHBondContact O-CA 3.47Å; P160-L169 HydrophobicContact CB-CD1 4.25Å; P160-L169 HydrophobicContact CG-CB 4.37Å; P160-L169 HydrophobicContact CG-CD1 4.38Å; P160-L169 WeakPolarHBondContact O-CD1 3.4Å; P160-L169 PolarHBondContact O-N 3.36Å; P160-P180 HydrophobicContact CB-CB 3.98Å; P160-P180 HydrophobicContact CB-CG 3.73Å
161	R	92.3	Very high	89.7	Confident	136 Å²	136	75 Å²	75	51%	0.513	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-107.4	133.9	179.2	-72	-172.8	173	89.5	11.6	111.3	N156 A163 S166 K167 T168 P180	N156-R161 PolarHBondContact O-NH2 3.15Å; N156-R161 VanDerWaalsContact O-NH2 3.15Å; R161-A163 PolarHBondContact O-N 2.92Å; R161-S166 WeakPolarHBondContact CD-O 3.4Å; R161-K167 WeakPolarHBondContact CA-O 3.41Å; R161-T168 HydrophobicContact CG-CG2 4.16Å; R161-P180 WeakPolarHBondContact O-CG 3.26Å
162	C	94.7	Very high	89.1	Confident	2 Å²	2	74.9 Å²	74.9	1%	0.014	40%	0.395	C	S	.	.			trans	-62.7	127	-179.3	174.4	0	0	0	0	110.8	R164 C165 S166 K167 L169 P180 H182 C185	C162-R164 PolarHBondContact O-N 3.39Å; C162-C165 VanDerWaalsContact CB-SG 3.58Å; C162-C165 PolarHBondContact O-N 2.93Å; C162-S166 WeakPolarHBondContact O-CA 3.32Å; C162-S166 PolarHBondContact O-N 3.47Å; C162-K167 PolarHBondContact N-O 3.07Å; C162-L169 HydrophobicContact CB-CD1 4.05Å; C162-L169 VanDerWaalsContact N-CD1 3.26Å; C162-P180 CarbonylContact C-O 3.53Å; C162-P180 VanDerWaalsContact CA-O 3.29Å; C162-P180 WeakPolarHBondContact CA-O 3.14Å; C162-H182 WeakPolarHBondContact CB-CE1 3.39Å; C162-H182 WeakPolarHBondContact CB-ND1 3.08Å; C162-H182 PolarHBondContact SG-N 2.89Å; C162-H182 VanDerWaalsContact SG-N 3.43Å; C162-H182 PolarHBondContact SG-ND1 2.81Å; C162-H182 VanDerWaalsContact SG-ND1 3.37Å; C162-C185 VanDerWaalsContact SG-CB 3.53Å
163	A	94.1	Very high	89.1	Confident	42 Å²	42	72.3 Å²	72.3	35%	0.347	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.7	-179.3	0	0	0	0	0	113.8	R161 Q179 P180 W181	R161-A163 PolarHBondContact O-N 2.92Å; A163-Q179 HydrophobicContact CB-CB 4Å; A163-P180 PolarHBondContact N-O 2.96Å; A163-W181 HydrophobicContact CB-CD2 4.2Å; A163-W181 HydrophobicContact CB-CH2 4.37Å; A163-W181 HydrophobicContact CB-CZ2 3.64Å
164	R	93.8	Very high	89.2	Confident	117 Å²	117	72.4 Å²	72.4	44%	0.442	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-53.6	176	-163.1	173.3	177.4	-166.4	0.8	113.8	C162 W181 C185	C162-R164 PolarHBondContact O-N 3.39Å; R164-W181 HydrophobicContact CB-CE3 3.75Å; R164-W181 HydrophobicContact CB-CH2 4.3Å; R164-W181 HydrophobicContact CB-CZ3 3.49Å; R164-W181 VanDerWaalsContact CB-CZ3 3.49Å; R164-W181 HydrophobicContact CG-CZ3 4.07Å; R164-C185 HydrophobicContact CB-CB 3.91Å; R164-C185 WeakPolarHBondContact CD-O 3.02Å; R164-C185 PolarHBondContact NH1-O 3.06Å
165	C	94.5	Very high	89.4	Confident	47 Å²	47	74.3 Å²	74.3	32%	0.318	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-4.4	-166.7	75.2	0	0	0	0	113.4	C162 K167 H182	C162-C165 VanDerWaalsContact CB-SG 3.58Å; C162-C165 PolarHBondContact O-N 2.93Å; C165-K167 PolarHBondContact O-N 3.18Å; C165-H182 PolarHBondContact SG-CE1 3.46Å; C165-H182 PolarHBondContact SG-ND1 3.45Å
166	S	92.6	Very high	89.6	Confident	84 Å²	84	72.5 Å²	72.5	59%	0.587	39%	0.394	S	S	*	.			trans	60	5.7	-177.4	-57.8	0	0	0	0	115.8	R161 C162	R161-S166 WeakPolarHBondContact CD-O 3.4Å; C162-S166 WeakPolarHBondContact O-CA 3.32Å; C162-S166 PolarHBondContact O-N 3.47Å
167	K	91.2	Very high	89.8	Confident	149 Å²	149	73 Å²	73	65%	0.648	39%	0.388	S	S	*	.			trans	-81.8	152.5	175	-60.5	178.8	-179	178.9	0	110.9	R161 C162 C165 H182	R161-K167 WeakPolarHBondContact CA-O 3.41Å; C162-K167 PolarHBondContact N-O 3.07Å; C165-K167 PolarHBondContact O-N 3.18Å; K167-H182 PolarHBondContact O-CE1 3.28Å
168	T	90.9	Very high	90.1	Very high	30 Å²	30	75 Å²	75	18%	0.184	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-66.2	148	178.1	46.3	0	0	0	0	112.4	A159 P160 R161 H182	A159-T168 HydrophobicContact CB-CG2 4.23Å; P160-T168 CarbonylContact O-C 3.59Å; P160-T168 WeakPolarHBondContact O-CA 3.47Å; R161-T168 HydrophobicContact CG-CG2 4.16Å; T168-H182 PolarHBondContact O-NE2 2.94Å
169	L	89.9	Confident	90.6	Very high	16 Å²	16	75.8 Å²	75.8	8%	0.084	41%	0.41	C	S	.	.			trans	-94	91.1	174.1	-68.1	91.6	0	0	0	110.3	P160 C162 P180 W181	P160-L169 HydrophobicContact CB-CD1 4.25Å; P160-L169 HydrophobicContact CG-CB 4.37Å; P160-L169 HydrophobicContact CG-CD1 4.38Å; P160-L169 WeakPolarHBondContact O-CD1 3.4Å; P160-L169 PolarHBondContact O-N 3.36Å; C162-L169 HydrophobicContact CB-CD1 4.05Å; C162-L169 VanDerWaalsContact N-CD1 3.26Å; L169-P180 HydrophobicContact CD1-CB 3.96Å; L169-P180 HydrophobicContact CD1-CG 4.39Å; L169-P180 HydrophobicContact CD2-CB 4.26Å; L169-W181 WeakPolarHBondContact CD2-O 3.37Å
170	T	82.5	Confident	90.9	Very high	71 Å²	71	76.8 Å²	76.8	44%	0.436	42%	0.415	S	S	.	.	S	Bend	trans	-84.8	-28.9	179	54.9	0	0	0	0	113.2	E155	E155-T170 HydrophobicContact CB-CG2 4.26Å; E155-T170 VanDerWaalsContact OE2-CG2 3.32Å; E155-T170 WeakPolarHBondContact OE2-CG2 3.21Å
171	Q	79.7	Confident	91.2	Very high	190 Å²	190	75.2 Å²	75.2	89%	0.888	40%	0.399	S	S	*	.	S	Bend	trans	-106.6	28.4	-176.5	-61	-176.9	12.1	0	0	113.1
172	G	78.8	Confident	91.4	Very high	47 Å²	47	69.8 Å²	69.8	49%	0.485	38%	0.38	S	S	.	.			trans	72.2	-175.9	-171.8	0	0	0	0	0	112.8
173	G	90.4	Very high	91.3	Very high	33 Å²	33	77 Å²	77	34%	0.34	41%	0.407	S	S	.	.			trans	-167.9	-164.3	-172.5	0	0	0	0	0	113.5	W181	G173-W181 WeakPolarHBondContact CA-O 3.29Å
174	V	94.2	Very high	91.3	Very high	31 Å²	31	80.9 Å²	80.9	19%	0.188	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	149.6	169.3	-68.7	0	0	0	0	109.4	W181 R183 L186 A196	V174-W181 HydrophobicContact CG2-CB 4.13Å; V174-W181 PolarHBondContact N-O 3.01Å; V174-W181 PolarHBondContact O-N 2.97Å; V174-R183 HydrophobicContact CG1-CG 4.05Å; V174-L186 HydrophobicContact CG2-CB 4.14Å; V174-L186 HydrophobicContact CG2-CD2 3.7Å; V174-A196 HydrophobicContact CG1-CB 3.9Å; V174-A196 HydrophobicContact CG2-CB 4.4Å
175	T	94.4	Very high	91.4	Very high	109 Å²	109	76.1 Å²	76.1	67%	0.669	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	127	172.2	-55.4	0	0	0	0	108.1	Q179	T175-Q179 WeakPolarHBondContact CA-O 3.4Å
176	Y	93.4	Very high	91.5	Very high	28 Å²	28	74 Å²	74	11%	0.11	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	124.1	174.2	171.6	-115.7	0	0	0	108.1	D178 Q179 W181 L186 F200 S202 P207	Y176-D178 VanDerWaalsContact C-N 3.3Å; Y176-D178 PolarHBondContact O-N 2.85Å; Y176-Q179 PolarHBondContact N-O 2.86Å; Y176-Q179 PolarHBondContact O-N 3.43Å; Y176-W181 HydrophobicContact CD1-CZ2 4.29Å; Y176-W181 PolarHBondContact O-NE1 3.46Å; Y176-L186 HydrophobicContact CD1-CD1 3.62Å; Y176-L186 HydrophobicContact CE1-CD1 4.24Å; Y176-L186 HydrophobicContact CG-CD1 3.84Å; Y176-F200 AromaticContact CD2-CE2 3.92Å; Y176-F200 HydrophobicContact CD2-CE2 3.92Å; Y176-F200 AromaticContact CD2-CZ 3.73Å; Y176-F200 HydrophobicContact CD2-CZ 3.73Å; Y176-F200 AromaticContact CE2-CE2 3.55Å; Y176-F200 HydrophobicContact CE2-CE2 3.55Å; Y176-F200 AromaticContact CE2-CZ 3.85Å; Y176-F200 HydrophobicContact CE2-CZ 3.85Å; Y176-S202 WeakPolarHBondContact OH-CB 3.43Å; Y176-P207 HydrophobicContact CE1-CB 4.5Å
177	R	91.1	Very high	91.7	Very high	108 Å²	108	70.6 Å²	70.6	41%	0.408	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	48.7	-174.2	-60.9	176.7	170.9	-149.1	-4.4	112.5	Q179 S202 E205	R177-Q179 PolarHBondContact O-N 3.37Å; R177-S202 PolarHBondContact NH2-OG 2.92Å; R177-E205 IonicContact NH1-OE1 2.92Å; R177-E205 PolarHBondContact NH1-OE1 2.97Å; R177-E205 VanDerWaalsContact NH1-OE1 3.09Å
178	D	91.8	Very high	92	Very high	160 Å²	160	63.5 Å²	63.5	86%	0.856	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	10.3	-178.6	-53.9	-51.4	0	0	0	115.5	Y176	Y176-D178 VanDerWaalsContact C-N 3.3Å; Y176-D178 PolarHBondContact O-N 2.85Å
179	Q	94.3	Very high	92.2	Very high	101 Å²	101	64.7 Å²	64.7	47%	0.472	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	144.9	174.8	-67.7	-175.7	-6.4	0	0	110.5	A163 T175 Y176 R177	A163-Q179 HydrophobicContact CB-CB 4Å; T175-Q179 WeakPolarHBondContact CA-O 3.4Å; Y176-Q179 PolarHBondContact N-O 2.86Å; Y176-Q179 PolarHBondContact O-N 3.43Å; R177-Q179 PolarHBondContact O-N 3.37Å
180	P	95.1	Very high	92.4	Very high	39 Å²	39	66 Å²	66	25%	0.253	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	139	176.3	31.4	-31.8	0	0	0	110.9	P160 R161 C162 A163 L169	P160-P180 HydrophobicContact CB-CB 3.98Å; P160-P180 HydrophobicContact CB-CG 3.73Å; R161-P180 WeakPolarHBondContact O-CG 3.26Å; C162-P180 CarbonylContact C-O 3.53Å; C162-P180 VanDerWaalsContact CA-O 3.29Å; C162-P180 WeakPolarHBondContact CA-O 3.14Å; A163-P180 PolarHBondContact N-O 2.96Å; L169-P180 HydrophobicContact CD1-CB 3.96Å; L169-P180 HydrophobicContact CD1-CG 4.39Å; L169-P180 HydrophobicContact CD2-CB 4.26Å
181	W	95.8	Very high	93.1	Very high	39 Å²	39	65.3 Å²	65.3	15%	0.148	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	143.9	178.5	-63.5	69.3	0	0	0	110.3	A163 R164 L169 G173 V174 Y176 C185 L186	A163-W181 HydrophobicContact CB-CD2 4.2Å; A163-W181 HydrophobicContact CB-CH2 4.37Å; A163-W181 HydrophobicContact CB-CZ2 3.64Å; R164-W181 HydrophobicContact CB-CE3 3.75Å; R164-W181 HydrophobicContact CB-CH2 4.3Å; R164-W181 HydrophobicContact CB-CZ3 3.49Å; R164-W181 VanDerWaalsContact CB-CZ3 3.49Å; R164-W181 HydrophobicContact CG-CZ3 4.07Å; L169-W181 WeakPolarHBondContact CD2-O 3.37Å; G173-W181 WeakPolarHBondContact CA-O 3.29Å; V174-W181 HydrophobicContact CG2-CB 4.13Å; V174-W181 PolarHBondContact N-O 3.01Å; V174-W181 PolarHBondContact O-N 2.97Å; Y176-W181 HydrophobicContact CD1-CZ2 4.29Å; Y176-W181 PolarHBondContact O-NE1 3.46Å; W181-C185 HydrophobicContact CE3-CB 4.43Å; W181-L186 HydrophobicContact CB-CB 4.21Å; W181-L186 HydrophobicContact CD2-CD1 4.25Å; W181-L186 HydrophobicContact CE3-CB 4.42Å; W181-L186 HydrophobicContact CE3-CD1 4.2Å
182	H	95.4	Very high	93.8	Very high	23 Å²	23	61.1 Å²	61.1	11%	0.106	34%	0.335	C	S	.	.			trans	-62.8	148	161.1	-58.9	103.7	0	0	0	109.4	C162 C165 K167 T168 E184 C185 L186	C162-H182 WeakPolarHBondContact CB-CE1 3.39Å; C162-H182 WeakPolarHBondContact CB-ND1 3.08Å; C162-H182 PolarHBondContact SG-N 2.89Å; C162-H182 VanDerWaalsContact SG-N 3.43Å; C162-H182 PolarHBondContact SG-ND1 2.81Å; C162-H182 VanDerWaalsContact SG-ND1 3.37Å; C165-H182 PolarHBondContact SG-CE1 3.46Å; C165-H182 PolarHBondContact SG-ND1 3.45Å; K167-H182 PolarHBondContact O-CE1 3.28Å; T168-H182 PolarHBondContact O-NE2 2.94Å; H182-E184 HydrophobicContact CB-CG 4.11Å; H182-E184 IonicContact CD2-OE1 3.86Å; H182-E184 IonicContact CG-OE1 3.39Å; H182-E184 PolarHBondContact O-N 3.09Å; H182-C185 HydrophobicContact CB-CB 3.87Å; H182-C185 WeakPolarHBondContact O-CB 3.12Å; H182-C185 PolarHBondContact O-N 2.89Å; H182-L186 PolarHBondContact O-N 2.82Å
183	R	94	Very high	94.7	Very high	153 Å²	153	61.8 Å²	61.8	58%	0.577	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-37.5	-179.4	-68.4	177.5	173.9	-130.5	-0.1	111.5	V174 C185 A196	V174-R183 HydrophobicContact CG1-CG 4.05Å; R183-C185 VanDerWaalsContact C-N 3.35Å; R183-A196 HydrophobicContact CB-CB 3.9Å; R183-A196 HydrophobicContact CG-CB 4.03Å
184	E	94.3	Very high	94.9	Very high	123 Å²	123	63.2 Å²	63.2	58%	0.575	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-16.1	175.4	65.1	-87	-160.2	0	0	113.7	H182 V187	H182-E184 HydrophobicContact CB-CG 4.11Å; H182-E184 IonicContact CD2-OE1 3.86Å; H182-E184 IonicContact CG-OE1 3.39Å; H182-E184 PolarHBondContact O-N 3.09Å; E184-V187 WeakPolarHBondContact O-CG1 3.43Å
185	C	96	Very high	95	Very high	17 Å²	17	61.7 Å²	61.7	12%	0.115	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-31.9	174.5	-77.9	0	0	0	0	111.9	C162 R164 W181 H182 R183 V187	C162-C185 VanDerWaalsContact SG-CB 3.53Å; R164-C185 HydrophobicContact CB-CB 3.91Å; R164-C185 WeakPolarHBondContact CD-O 3.02Å; R164-C185 PolarHBondContact NH1-O 3.06Å; W181-C185 HydrophobicContact CE3-CB 4.43Å; H182-C185 HydrophobicContact CB-CB 3.87Å; H182-C185 WeakPolarHBondContact O-CB 3.12Å; H182-C185 PolarHBondContact O-N 2.89Å; R183-C185 VanDerWaalsContact C-N 3.35Å; C185-V187 PolarHBondContact O-N 2.81Å
186	L	96.5	Very high	95	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.021	30%	0.302	C	S	.	.	S	Bend	trans	-79	87	174.1	-172.6	68.5	0	0	0	109.8	V174 Y176 W181 H182 L195 F200 P207	V174-L186 HydrophobicContact CG2-CB 4.14Å; V174-L186 HydrophobicContact CG2-CD2 3.7Å; Y176-L186 HydrophobicContact CD1-CD1 3.62Å; Y176-L186 HydrophobicContact CE1-CD1 4.24Å; Y176-L186 HydrophobicContact CG-CD1 3.84Å; W181-L186 HydrophobicContact CB-CB 4.21Å; W181-L186 HydrophobicContact CD2-CD1 4.25Å; W181-L186 HydrophobicContact CE3-CB 4.42Å; W181-L186 HydrophobicContact CE3-CD1 4.2Å; H182-L186 PolarHBondContact O-N 2.82Å; L186-L195 HydrophobicContact CG-CB 4.3Å; L186-L195 PolarHBondContact O-N 3.05Å; L186-F200 HydrophobicContact CD2-CE1 4.4Å; L186-F200 HydrophobicContact CD2-CZ 4.15Å; L186-P207 HydrophobicContact CD1-CG 4.4Å
187	V	97	Very high	94.8	Very high	12 Å²	12	60.7 Å²	60.7	7%	0.073	34%	0.341	C	S	.	.	B	Isolated β-bridge	trans	-122.5	159.1	-176.4	-51.3	0	0	0	0	111.7	E184 C185 T189 Q192 T193	E184-V187 WeakPolarHBondContact O-CG1 3.43Å; C185-V187 PolarHBondContact O-N 2.81Å; V187-T189 PolarHBondContact O-N 2.96Å; V187-Q192 WeakPolarHBondContact CB-O 3.48Å; V187-Q192 HydrophobicContact CG2-CB 4.48Å; V187-Q192 VanDerWaalsContact CG2-OE1 3.3Å; V187-T193 CarbonylContact C-O 3.5Å; V187-T193 VanDerWaalsContact CA-O 3.29Å; V187-T193 WeakPolarHBondContact CA-O 3.18Å; V187-T193 WeakPolarHBondContact CB-O 3.46Å
188	C	96.6	Very high	94.9	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	34%	0.344	C	S	.	.			trans	-62	127.3	171.8	-179.4	0	0	0	0	110.8	G190 C191 Q192 T193 L195 P207 C209 C212	C188-G190 PolarHBondContact O-N 3.14Å; C188-G190 PolarHBondContact SG-N 3.46Å; C188-G190 VanDerWaalsContact SG-N 3.37Å; C188-C191 WeakPolarHBondContact CB-SG 3.2Å; C188-Q192 WeakPolarHBondContact O-CA 3.35Å; C188-Q192 PolarHBondContact O-N 3.13Å; C188-Q192 PolarHBondContact O-NE2 3.24Å; C188-T193 PolarHBondContact N-O 2.93Å; C188-L195 HydrophobicContact CB-CD1 4.47Å; C188-L195 HydrophobicContact CB-CD2 3.99Å; C188-L195 HydrophobicContact CB-CG 4.39Å; C188-P207 CarbonylContact C-O 3.6Å; C188-P207 WeakPolarHBondContact CA-O 3.06Å; C188-C209 HydrophobicContact CB-CB 4.15Å; C188-C209 PolarHBondContact SG-N 2.84Å; C188-C209 VanDerWaalsContact SG-SG 3.69Å; C188-C212 VanDerWaalsContact SG-SG 3.65Å
189	T	95.6	Very high	94.8	Very high	54 Å²	54	59.5 Å²	59.5	33%	0.331	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-35.9	174.4	-60.8	0	0	0	0	111.8	V187 Q192 D206 P207 Y208	V187-T189 PolarHBondContact O-N 2.96Å; T189-Q192 PolarHBondContact O-NE2 2.9Å; T189-D206 HydrophobicContact CG2-CB 4.38Å; T189-P207 PolarHBondContact N-O 3.3Å; T189-P207 PolarHBondContact OG1-O 2.94Å; T189-Y208 HydrophobicContact CG2-CE1 4.11Å
190	G	94.1	Very high	94.7	Very high	45 Å²	45	57.4 Å²	57.4	46%	0.464	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-39.2	-178.7	0	0	0	0	0	115.7	C188	C188-G190 PolarHBondContact O-N 3.14Å; C188-G190 PolarHBondContact SG-N 3.46Å; C188-G190 VanDerWaalsContact SG-N 3.37Å
191	C	96.1	Very high	94.5	Very high	55 Å²	55	57.9 Å²	57.9	37%	0.372	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-0.4	-172.8	70.2	0	0	0	0	115.2	C188 T193	C188-C191 WeakPolarHBondContact CB-SG 3.2Å; C191-T193 PolarHBondContact O-N 3.08Å; C191-T193 PolarHBondContact SG-OG1 2.98Å
192	Q	96	Very high	94.3	Very high	102 Å²	102	58.1 Å²	58.1	48%	0.477	33%	0.334	S	S	.	.			trans	58.7	12.4	-179	-56.6	-63	-57.3	0	0	115.4	V187 C188 T189	V187-Q192 WeakPolarHBondContact CB-O 3.48Å; V187-Q192 HydrophobicContact CG2-CB 4.48Å; V187-Q192 VanDerWaalsContact CG2-OE1 3.3Å; C188-Q192 WeakPolarHBondContact O-CA 3.35Å; C188-Q192 PolarHBondContact O-N 3.13Å; C188-Q192 PolarHBondContact O-NE2 3.24Å; T189-Q192 PolarHBondContact O-NE2 2.9Å
193	T	95.7	Very high	93.9	Very high	62 Å²	62	62.3 Å²	62.3	38%	0.38	35%	0.349	S	S	.	.			trans	-70.9	136.4	173.5	-51.6	0	0	0	0	110.7	V187 C188 C191 L195	V187-T193 CarbonylContact C-O 3.5Å; V187-T193 VanDerWaalsContact CA-O 3.29Å; V187-T193 WeakPolarHBondContact CA-O 3.18Å; V187-T193 WeakPolarHBondContact CB-O 3.46Å; C188-T193 PolarHBondContact N-O 2.93Å; C191-T193 PolarHBondContact O-N 3.08Å; C191-T193 PolarHBondContact SG-OG1 2.98Å; T193-L195 PolarHBondContact O-N 3.31Å
194	P	95.9	Very high	93.7	Very high	62 Å²	62	61.4 Å²	61.4	40%	0.403	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-56.2	134.7	174.4	-25.2	34.5	0	0	0	112.4	Q198	P194-Q198 VanDerWaalsContact O-CD 3.32Å; P194-Q198 PolarHBondContact O-NE2 2.78Å
195	L	96.3	Very high	93.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	36%	0.361	C	S	.	.			trans	-102.3	-10.5	-178.6	-61.3	176.7	0	0	0	113	L186 C188 T193 G197 Q198 F200 P207 C209	L186-L195 HydrophobicContact CG-CB 4.3Å; L186-L195 PolarHBondContact O-N 3.05Å; C188-L195 HydrophobicContact CB-CD1 4.47Å; C188-L195 HydrophobicContact CB-CD2 3.99Å; C188-L195 HydrophobicContact CB-CG 4.39Å; T193-L195 PolarHBondContact O-N 3.31Å; L195-G197 PolarHBondContact O-N 3.25Å; L195-G197 VanDerWaalsContact O-N 3.14Å; L195-Q198 PolarHBondContact O-N 2.89Å; L195-F200 HydrophobicContact CB-CB 4.35Å; L195-F200 HydrophobicContact CB-CD1 3.86Å; L195-F200 HydrophobicContact CB-CE1 4.29Å; L195-F200 HydrophobicContact CB-CG 4.06Å; L195-F200 HydrophobicContact CD1-CB 3.96Å; L195-F200 HydrophobicContact CD1-CD1 4.47Å; L195-F200 HydrophobicContact CD1-CD2 3.84Å; L195-F200 HydrophobicContact CD1-CE2 4.44Å; L195-F200 HydrophobicContact CD1-CG 3.86Å; L195-F200 HydrophobicContact CD2-CB 3.85Å; L195-F200 HydrophobicContact CD2-CG 4.44Å; L195-F200 HydrophobicContact CG-CB 4.27Å; L195-F200 HydrophobicContact CG-CG 4.35Å; L195-P207 HydrophobicContact CD1-CB 3.66Å; L195-P207 HydrophobicContact CD1-CG 4.25Å; L195-C209 HydrophobicContact CD2-CB 3.72Å
196	A	93.8	Very high	93.1	Very high	25 Å²	25	65.1 Å²	65.1	21%	0.207	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	119.2	177	0	0	0	0	0	110.8	V174 R183 Q198	V174-A196 HydrophobicContact CG1-CB 3.9Å; V174-A196 HydrophobicContact CG2-CB 4.4Å; R183-A196 HydrophobicContact CB-CB 3.9Å; R183-A196 HydrophobicContact CG-CB 4.03Å; A196-Q198 VanDerWaalsContact C-N 3.29Å; A196-Q198 PolarHBondContact O-N 3.47Å
197	G	90.6	Very high	93	Very high	90 Å²	90	65.5 Å²	65.5	93%	0.928	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	3.8	-178	0	0	0	0	0	115.3	L195	L195-G197 PolarHBondContact O-N 3.25Å; L195-G197 VanDerWaalsContact O-N 3.14Å
198	Q	91.4	Very high	92.8	Very high	101 Å²	101	66.2 Å²	66.2	47%	0.472	38%	0.378	S	S	.	.	S	Bend	trans	-106.2	160.7	175.6	-58.6	-172.2	24.3	0	0	110.9	P194 L195 A196 F200	P194-Q198 VanDerWaalsContact O-CD 3.32Å; P194-Q198 PolarHBondContact O-NE2 2.78Å; L195-Q198 PolarHBondContact O-N 2.89Å; A196-Q198 VanDerWaalsContact C-N 3.29Å; A196-Q198 PolarHBondContact O-N 3.47Å; Q198-F200 WeakPolarHBondContact O-CD1 3.32Å
199	Q	90.5	Very high	92.7	Very high	142 Å²	142	67 Å²	67	66%	0.664	38%	0.383	S	S	*	.			trans	-74	131.9	166.6	-66.9	-178.5	-67	0	0	109.4	V210	Q199-V210 HydrophobicContact CB-CG2 4.05Å; Q199-V210 WeakPolarHBondContact O-CG2 3.33Å
200	F	92.9	Very high	92.5	Very high	58 Å²	58	66.3 Å²	66.3	25%	0.254	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	167.9	176.9	72.8	-88	0	0	0	109.5	Y176 L186 L195 Q198 P207 Y208	Y176-F200 AromaticContact CD2-CE2 3.92Å; Y176-F200 HydrophobicContact CD2-CE2 3.92Å; Y176-F200 AromaticContact CD2-CZ 3.73Å; Y176-F200 HydrophobicContact CD2-CZ 3.73Å; Y176-F200 AromaticContact CE2-CE2 3.55Å; Y176-F200 HydrophobicContact CE2-CE2 3.55Å; Y176-F200 AromaticContact CE2-CZ 3.85Å; Y176-F200 HydrophobicContact CE2-CZ 3.85Å; L186-F200 HydrophobicContact CD2-CE1 4.4Å; L186-F200 HydrophobicContact CD2-CZ 4.15Å; L195-F200 HydrophobicContact CB-CB 4.35Å; L195-F200 HydrophobicContact CB-CD1 3.86Å; L195-F200 HydrophobicContact CB-CE1 4.29Å; L195-F200 HydrophobicContact CB-CG 4.06Å; L195-F200 HydrophobicContact CD1-CB 3.96Å; L195-F200 HydrophobicContact CD1-CD1 4.47Å; L195-F200 HydrophobicContact CD1-CD2 3.84Å; L195-F200 HydrophobicContact CD1-CE2 4.44Å; L195-F200 HydrophobicContact CD1-CG 3.86Å; L195-F200 HydrophobicContact CD2-CB 3.85Å; L195-F200 HydrophobicContact CD2-CG 4.44Å; L195-F200 HydrophobicContact CG-CB 4.27Å; L195-F200 HydrophobicContact CG-CG 4.35Å; Q198-F200 WeakPolarHBondContact O-CD1 3.32Å; F200-P207 HydrophobicContact CD2-CB 4.07Å; F200-P207 HydrophobicContact CE2-CB 4.08Å; F200-Y208 WeakPolarHBondContact CA-O 3.46Å; F200-Y208 VanDerWaalsContact CB-O 3.32Å; F200-Y208 WeakPolarHBondContact CB-O 3.42Å
201	T	90.3	Very high	92.3	Very high	49 Å²	49	67.4 Å²	67.4	30%	0.301	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	172.2	174.3	-173.4	0	0	0	0	109.1	Y208 F213	T201-Y208 PolarHBondContact N-O 3.29Å; T201-Y208 PolarHBondContact O-N 3.45Å; T201-Y208 VanDerWaalsContact O-O 3.1Å; T201-F213 HydrophobicContact CG2-CB 3.75Å; T201-F213 HydrophobicContact CG2-CD1 3.75Å; T201-F213 HydrophobicContact CG2-CD2 3.23Å; T201-F213 HydrophobicContact CG2-CE1 4.14Å; T201-F213 HydrophobicContact CG2-CE2 3.65Å; T201-F213 HydrophobicContact CG2-CG 3.27Å; T201-F213 HydrophobicContact CG2-CZ 4.09Å
202	S	91	Very high	92.2	Very high	43 Å²	43	66 Å²	66	30%	0.301	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145.2	180	66	0	0	0	0	111.8	Y176 R177 D206	Y176-S202 WeakPolarHBondContact OH-CB 3.43Å; R177-S202 PolarHBondContact NH2-OG 2.92Å; S202-D206 CarbonylContact C-O 3.56Å; S202-D206 WeakPolarHBondContact CA-O 3.49Å
203	R	88.4	Confident	92	Very high	111 Å²	111	63.4 Å²	63.4	42%	0.419	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.4	172	176.5	159.2	-177.4	158.2	0.4	108.9	E205 D206 Y208 F213	R203-E205 PolarHBondContact O-N 3.39Å; R203-E205 VanDerWaalsContact O-N 3.08Å; R203-D206 PolarHBondContact N-O 3.37Å; R203-D206 PolarHBondContact O-N 2.97Å; R203-Y208 HydrophobicContact CB-CD2 4.37Å; R203-Y208 HydrophobicContact CB-CE2 4.16Å; R203-F213 HydrophobicContact CB-CE2 4.13Å
204	D	87.8	Confident	91.7	Very high	134 Å²	134	60.5 Å²	60.5	72%	0.717	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	39.5	-180	-52.6	-43	0	0	0	112.1	D206	D204-D206 PolarHBondContact O-N 3.2Å
205	E	86.4	Confident	91.4	Very high	145 Å²	145	63 Å²	63	68%	0.678	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	-19.7	-176.1	-42.7	-154.6	100.1	0	0	117.4	R177 R203	R177-E205 IonicContact NH1-OE1 2.92Å; R177-E205 PolarHBondContact NH1-OE1 2.97Å; R177-E205 VanDerWaalsContact NH1-OE1 3.09Å; R203-E205 PolarHBondContact O-N 3.39Å; R203-E205 VanDerWaalsContact O-N 3.08Å
206	D	91.4	Very high	91	Very high	74 Å²	74	68 Å²	68	40%	0.396	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.5	179.4	-77.1	-38	0	0	0	112.2	T189 S202 R203 D204 Y208	T189-D206 HydrophobicContact CG2-CB 4.38Å; S202-D206 CarbonylContact C-O 3.56Å; S202-D206 WeakPolarHBondContact CA-O 3.49Å; R203-D206 PolarHBondContact N-O 3.37Å; R203-D206 PolarHBondContact O-N 2.97Å; D204-D206 PolarHBondContact O-N 3.2Å; D206-Y208 HydrophobicContact CB-CD2 4.45Å; D206-Y208 HydrophobicContact CB-CE2 3.6Å; D206-Y208 WeakPolarHBondContact O-CD2 3.29Å; D206-Y208 WeakPolarHBondContact O-CE2 3.5Å
207	P	94.6	Very high	90.7	Very high	12 Å²	12	69.8 Å²	69.8	8%	0.078	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	134.5	178.9	33.9	-35.1	0	0	0	111.9	Y176 L186 C188 T189 L195 F200	Y176-P207 HydrophobicContact CE1-CB 4.5Å; L186-P207 HydrophobicContact CD1-CG 4.4Å; C188-P207 CarbonylContact C-O 3.6Å; C188-P207 WeakPolarHBondContact CA-O 3.06Å; T189-P207 PolarHBondContact N-O 3.3Å; T189-P207 PolarHBondContact OG1-O 2.94Å; L195-P207 HydrophobicContact CD1-CB 3.66Å; L195-P207 HydrophobicContact CD1-CG 4.25Å; F200-P207 HydrophobicContact CD2-CB 4.07Å; F200-P207 HydrophobicContact CE2-CB 4.08Å
208	Y	94.3	Very high	90.6	Very high	26 Å²	26	66.1 Å²	66.1	10%	0.102	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.1	179.5	-65.5	-90.2	0	0	0	111.1	T189 F200 T201 R203 D206 C212 L216 F217	T189-Y208 HydrophobicContact CG2-CE1 4.11Å; F200-Y208 WeakPolarHBondContact CA-O 3.46Å; F200-Y208 VanDerWaalsContact CB-O 3.32Å; F200-Y208 WeakPolarHBondContact CB-O 3.42Å; T201-Y208 PolarHBondContact N-O 3.29Å; T201-Y208 PolarHBondContact O-N 3.45Å; T201-Y208 VanDerWaalsContact O-O 3.1Å; R203-Y208 HydrophobicContact CB-CD2 4.37Å; R203-Y208 HydrophobicContact CB-CE2 4.16Å; D206-Y208 HydrophobicContact CB-CD2 4.45Å; D206-Y208 HydrophobicContact CB-CE2 3.6Å; D206-Y208 WeakPolarHBondContact O-CD2 3.29Å; D206-Y208 WeakPolarHBondContact O-CE2 3.5Å; Y208-C212 HydrophobicContact CD1-CB 4.36Å; Y208-L216 HydrophobicContact CD1-CD1 4.17Å; Y208-L216 HydrophobicContact CE1-CD1 3.94Å; Y208-F217 AromaticContact CD1-CE2 3.97Å; Y208-F217 HydrophobicContact CD1-CE2 3.97Å; Y208-F217 AromaticContact CD2-CE2 3.89Å; Y208-F217 HydrophobicContact CD2-CE2 3.89Å; Y208-F217 AromaticContact CE1-CE2 3.8Å; Y208-F217 HydrophobicContact CE1-CE2 3.8Å; Y208-F217 HydrophobicContact CE1-CZ 4.05Å; Y208-F217 AromaticContact CE2-CE2 3.72Å; Y208-F217 HydrophobicContact CE2-CE2 3.72Å; Y208-F217 HydrophobicContact CE2-CZ 4.03Å; Y208-F217 HydrophobicContact CG-CE2 4.02Å; Y208-F217 AromaticContact CZ-CE2 3.67Å; Y208-F217 AromaticContact CZ-CZ 3.7Å
209	C	94.5	Very high	90.4	Very high	16 Å²	16	63.5 Å²	63.5	11%	0.108	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	156.8	166.7	75.6	0	0	0	0	110	C188 L195 A211 C212 F213	C188-C209 HydrophobicContact CB-CB 4.15Å; C188-C209 PolarHBondContact SG-N 2.84Å; C188-C209 VanDerWaalsContact SG-SG 3.69Å; L195-C209 HydrophobicContact CD2-CB 3.72Å; C209-A211 PolarHBondContact O-N 3.4Å; C209-C212 PolarHBondContact O-N 3.18Å; C209-C212 PolarHBondContact SG-N 3.27Å; C209-C212 VanDerWaalsContact SG-N 3.38Å; C209-F213 WeakPolarHBondContact O-CB 2.97Å; C209-F213 PolarHBondContact O-N 3.35Å
210	V	90.8	Very high	90.4	Very high	40 Å²	40	62 Å²	62	24%	0.242	32%	0.324	C	S	.	.	H	α-helix	trans	-50.7	-43.6	-179.2	173.9	0	0	0	0	112.8	Q199 G214 V229 L231	Q199-V210 HydrophobicContact CB-CG2 4.05Å; Q199-V210 WeakPolarHBondContact O-CG2 3.33Å; V210-G214 PolarHBondContact O-N 2.91Å; V210-V229 HydrophobicContact CG1-CG2 4.4Å; V210-L231 HydrophobicContact CB-CD1 3.7Å; V210-L231 HydrophobicContact CG1-CD1 3.2Å; V210-L231 HydrophobicContact CG2-CD1 3.31Å; V210-L231 HydrophobicContact CG2-CD2 4.3Å; V210-L231 HydrophobicContact CG2-CG 4.42Å
211	A	90.5	Very high	90.3	Very high	69 Å²	69	59.2 Å²	59.2	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-66.3	-51.6	-177.8	0	0	0	0	0	111.8	C209 F213 G214 E215	C209-A211 PolarHBondContact O-N 3.4Å; A211-F213 VanDerWaalsContact C-N 3.33Å; A211-F213 PolarHBondContact O-N 2.92Å; A211-G214 PolarHBondContact O-N 3.45Å; A211-E215 PolarHBondContact O-N 3.03Å
212	C	93.6	Very high	90.4	Very high	24 Å²	24	58.2 Å²	58.2	16%	0.162	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-41.5	177.9	-70.5	0	0	0	0	111.6	C188 Y208 C209 G214 E215 L216	C188-C212 VanDerWaalsContact SG-SG 3.65Å; Y208-C212 HydrophobicContact CD1-CB 4.36Å; C209-C212 PolarHBondContact O-N 3.18Å; C209-C212 PolarHBondContact SG-N 3.27Å; C209-C212 VanDerWaalsContact SG-N 3.38Å; C212-G214 VanDerWaalsContact C-N 3.33Å; C212-G214 PolarHBondContact O-N 2.89Å; C212-E215 PolarHBondContact O-N 2.78Å; C212-L216 HydrophobicContact CB-CD1 4.45Å; C212-L216 VanDerWaalsContact O-CB 3.26Å; C212-L216 WeakPolarHBondContact O-CB 3.42Å; C212-L216 WeakPolarHBondContact O-CG 3.49Å; C212-L216 PolarHBondContact O-N 2.93Å
213	F	91.7	Very high	90.4	Very high	48 Å²	48	59.6 Å²	59.6	21%	0.211	32%	0.316	C	S	.	.	H	α-helix	trans	-62.1	-43.7	176.8	-174.2	-89.4	0	0	0	111.5	T201 R203 C209 A211 F217 A218	T201-F213 HydrophobicContact CG2-CB 3.75Å; T201-F213 HydrophobicContact CG2-CD1 3.75Å; T201-F213 HydrophobicContact CG2-CD2 3.23Å; T201-F213 HydrophobicContact CG2-CE1 4.14Å; T201-F213 HydrophobicContact CG2-CE2 3.65Å; T201-F213 HydrophobicContact CG2-CG 3.27Å; T201-F213 HydrophobicContact CG2-CZ 4.09Å; R203-F213 HydrophobicContact CB-CE2 4.13Å; C209-F213 WeakPolarHBondContact O-CB 2.97Å; C209-F213 PolarHBondContact O-N 3.35Å; A211-F213 VanDerWaalsContact C-N 3.33Å; A211-F213 PolarHBondContact O-N 2.92Å; F213-F217 HydrophobicContact CB-CD2 4.48Å; F213-F217 HydrophobicContact CD2-CB 4.46Å; F213-F217 AromaticContact CD2-CD2 3.49Å; F213-F217 HydrophobicContact CD2-CD2 3.49Å; F213-F217 VanDerWaalsContact CD2-CD2 3.49Å; F213-F217 HydrophobicContact CD2-CE2 4.19Å; F213-F217 HydrophobicContact CD2-CG 4.39Å; F213-F217 HydrophobicContact CE1-CB 4.46Å; F213-F217 HydrophobicContact CE2-CB 4.28Å; F213-F217 AromaticContact CE2-CD2 3.86Å; F213-F217 HydrophobicContact CE2-CD2 3.86Å; F213-F217 HydrophobicContact CE2-CG 4.41Å; F213-F217 HydrophobicContact CG-CD2 4.04Å; F213-F217 HydrophobicContact CZ-CB 4.27Å; F213-F217 WeakPolarHBondContact O-CB 3.17Å; F213-F217 PolarHBondContact O-N 3.48Å; F213-A218 PolarHBondContact O-N 3.25Å
214	G	89.2	Confident	90.5	Very high	2 Å²	2	56.6 Å²	56.6	2%	0.021	31%	0.312	C	S	.	.	H	α-helix	trans	-58.6	-49.9	176.5	0	0	0	0	0	112.6	V210 A211 C212 A218 P227 V229	V210-G214 PolarHBondContact O-N 2.91Å; A211-G214 PolarHBondContact O-N 3.45Å; C212-G214 VanDerWaalsContact C-N 3.33Å; C212-G214 PolarHBondContact O-N 2.89Å; G214-A218 WeakPolarHBondContact O-CB 3.37Å; G214-A218 PolarHBondContact O-N 3.49Å; G214-P227 WeakPolarHBondContact O-CB 3.36Å; G214-V229 VanDerWaalsContact CA-CG1 3.4Å
215	E	89.3	Confident	90.6	Very high	114 Å²	114	56.6 Å²	56.6	53%	0.533	31%	0.306	S	S	.	.	H	α-helix	trans	-69.6	-36.8	-178.3	-72.9	-56.6	144.1	0	0	113.7	A211 C212 K220 P227	A211-E215 PolarHBondContact O-N 3.03Å; C212-E215 PolarHBondContact O-N 2.78Å; E215-K220 IonicContact OE2-NZ 3.67Å; E215-P227 VanDerWaalsContact OE1-CG 3.27Å; E215-P227 WeakPolarHBondContact OE1-CG 3.22Å
216	L	88.4	Confident	90.7	Very high	105 Å²	105	58.3 Å²	58.3	55%	0.55	31%	0.306	S	S	.	.	H	α-helix	trans	-84.7	-33.5	-175.4	-66.2	170.8	0	0	0	113.3	Y208 C212	Y208-L216 HydrophobicContact CD1-CD1 4.17Å; Y208-L216 HydrophobicContact CE1-CD1 3.94Å; C212-L216 HydrophobicContact CB-CD1 4.45Å; C212-L216 VanDerWaalsContact O-CB 3.26Å; C212-L216 WeakPolarHBondContact O-CB 3.42Å; C212-L216 WeakPolarHBondContact O-CG 3.49Å; C212-L216 PolarHBondContact O-N 2.93Å
217	F	87.3	Confident	90.6	Very high	62 Å²	62	55.9 Å²	55.9	27%	0.272	29%	0.294	S	S	.	.	H	α-helix	trans	-131.8	-21.5	-164	-52.2	-59.4	0	0	0	115.4	Y208 F213	Y208-F217 AromaticContact CD1-CE2 3.97Å; Y208-F217 HydrophobicContact CD1-CE2 3.97Å; Y208-F217 AromaticContact CD2-CE2 3.89Å; Y208-F217 HydrophobicContact CD2-CE2 3.89Å; Y208-F217 AromaticContact CE1-CE2 3.8Å; Y208-F217 HydrophobicContact CE1-CE2 3.8Å; Y208-F217 HydrophobicContact CE1-CZ 4.05Å; Y208-F217 AromaticContact CE2-CE2 3.72Å; Y208-F217 HydrophobicContact CE2-CE2 3.72Å; Y208-F217 HydrophobicContact CE2-CZ 4.03Å; Y208-F217 HydrophobicContact CG-CE2 4.02Å; Y208-F217 AromaticContact CZ-CE2 3.67Å; Y208-F217 AromaticContact CZ-CZ 3.7Å; F213-F217 HydrophobicContact CB-CD2 4.48Å; F213-F217 HydrophobicContact CD2-CB 4.46Å; F213-F217 AromaticContact CD2-CD2 3.49Å; F213-F217 HydrophobicContact CD2-CD2 3.49Å; F213-F217 VanDerWaalsContact CD2-CD2 3.49Å; F213-F217 HydrophobicContact CD2-CE2 4.19Å; F213-F217 HydrophobicContact CD2-CG 4.39Å; F213-F217 HydrophobicContact CE1-CB 4.46Å; F213-F217 HydrophobicContact CE2-CB 4.28Å; F213-F217 AromaticContact CE2-CD2 3.86Å; F213-F217 HydrophobicContact CE2-CD2 3.86Å; F213-F217 HydrophobicContact CE2-CG 4.41Å; F213-F217 HydrophobicContact CG-CD2 4.04Å; F213-F217 HydrophobicContact CZ-CB 4.27Å; F213-F217 WeakPolarHBondContact O-CB 3.17Å; F213-F217 PolarHBondContact O-N 3.48Å
218	A	87.2	Confident	90.3	Very high	14 Å²	14	56.1 Å²	56.1	12%	0.116	29%	0.294	C	S	.	.	S	Bend	trans	-81.2	143.5	-176	0	0	0	0	0	111.5	F213 G214 P227 V229	F213-A218 PolarHBondContact O-N 3.25Å; G214-A218 WeakPolarHBondContact O-CB 3.37Å; G214-A218 PolarHBondContact O-N 3.49Å; A218-P227 HydrophobicContact CB-CB 4.13Å; A218-V229 HydrophobicContact CB-CG1 4.24Å
219	P	88.5	Confident	89.6	Confident	46 Å²	46	57.8 Å²	57.8	30%	0.299	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-60.5	141.8	172.5	24.4	-31	0	0	0	110	I228 H243	P219-I228 HydrophobicContact CG-CB 4.34Å; P219-I228 WeakPolarHBondContact O-CB 3.26Å; P219-I228 WeakPolarHBondContact O-CG1 3.42Å; P219-I228 PolarHBondContact O-N 3.25Å; P219-H243 HydrophobicContact CB-CB 4.13Å
220	K	90.6	Very high	88.4	Confident	110 Å²	110	59.8 Å²	59.8	48%	0.478	33%	0.331	S	S	.	.	B	Isolated β-bridge	trans	-91.5	134.4	178.9	-63.8	-170.4	179.1	-165.6	0	109.9	E215 S222	E215-K220 IonicContact OE2-NZ 3.67Å; K220-S222 PolarHBondContact O-N 3.18Å
221	C	91.2	Very high	87	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-61.7	126.2	177.4	176.5	0	0	0	0	110.8	S223 C224 K225 R226 I228 H243 H245 C248	C221-S223 PolarHBondContact O-N 3.25Å; C221-C224 VanDerWaalsContact CB-SG 3.53Å; C221-C224 VanDerWaalsContact SG-SG 3.62Å; C221-K225 WeakPolarHBondContact O-CA 3.44Å; C221-K225 PolarHBondContact O-N 3.38Å; C221-R226 WeakPolarHBondContact CB-O 3.39Å; C221-R226 PolarHBondContact N-O 3.01Å; C221-I228 HydrophobicContact CB-CD1 4.24Å; C221-I228 HydrophobicContact CB-CG1 4.13Å; C221-H243 CarbonylContact C-O 3.58Å; C221-H243 VanDerWaalsContact CA-O 3.25Å; C221-H243 WeakPolarHBondContact CA-O 3.44Å; C221-H245 VanDerWaalsContact CB-CE1 3.42Å; C221-H245 WeakPolarHBondContact CB-CE1 3.46Å; C221-H245 VanDerWaalsContact CB-ND1 3.31Å; C221-H245 WeakPolarHBondContact CB-ND1 3.31Å; C221-H245 PolarHBondContact SG-ND1 3.45Å; C221-H245 VanDerWaalsContact SG-ND1 3.43Å; C221-C248 WeakPolarHBondContact SG-CB 3.42Å
222	S	91.8	Very high	85.3	Confident	27 Å²	27	61.5 Å²	61.5	19%	0.189	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-25.8	-177.5	-59.7	0	0	0	0	112.5	K220 K225 R242 H243	K220-S222 PolarHBondContact O-N 3.18Å; S222-K225 WeakPolarHBondContact O-CE 3.34Å; S222-K225 PolarHBondContact O-NZ 3.2Å; S222-R242 WeakPolarHBondContact OG-CB 3.27Å; S222-H243 PolarHBondContact N-O 3.21Å; S222-H243 PolarHBondContact OG-N 3.48Å; S222-H243 PolarHBondContact OG-O 2.84Å
223	S	89.9	Confident	83.4	Confident	72 Å²	72	63.9 Å²	63.9	50%	0.503	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-61.1	176.6	174.3	0	0	0	0	112.9	C221	C221-S223 PolarHBondContact O-N 3.25Å
224	C	90.6	Very high	81.9	Confident	48 Å²	48	64.1 Å²	64.1	32%	0.324	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-4.2	-172.8	76.1	0	0	0	0	114.8	C221 R226 H245	C221-C224 VanDerWaalsContact CB-SG 3.53Å; C221-C224 VanDerWaalsContact SG-SG 3.62Å; C224-R226 PolarHBondContact O-N 3.23Å; C224-H245 PolarHBondContact SG-CE1 3.43Å; C224-H245 PolarHBondContact SG-ND1 3.49Å; C224-H245 VanDerWaalsContact SG-ND1 3.35Å
225	K	90.3	Very high	81.2	Confident	135 Å²	135	72.6 Å²	72.6	59%	0.587	43%	0.426	S	S	*	.			trans	60.8	3.2	-177.7	-48.9	-54.6	-172.5	-169.9	0	116	C221 S222	C221-K225 WeakPolarHBondContact O-CA 3.44Å; C221-K225 PolarHBondContact O-N 3.38Å; S222-K225 WeakPolarHBondContact O-CE 3.34Å; S222-K225 PolarHBondContact O-NZ 3.2Å
226	R	88.9	Confident	81.2	Confident	181 Å²	181	72.7 Å²	72.7	68%	0.683	42%	0.422	S	S	*	.			trans	-81.1	149.2	176.3	-60.1	-179.2	-171.7	174.1	2.1	111.7	C221 C224	C221-R226 WeakPolarHBondContact CB-O 3.39Å; C221-R226 PolarHBondContact N-O 3.01Å; C224-R226 PolarHBondContact O-N 3.23Å
227	P	88.8	Confident	81.3	Confident	23 Å²	23	69 Å²	69	15%	0.149	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-56.2	143.8	173.6	-26.7	35.2	0	0	0	114	G214 E215 A218 V229 H245	G214-P227 WeakPolarHBondContact O-CB 3.36Å; E215-P227 VanDerWaalsContact OE1-CG 3.27Å; E215-P227 WeakPolarHBondContact OE1-CG 3.22Å; A218-P227 HydrophobicContact CB-CB 4.13Å; P227-V229 HydrophobicContact CB-CG1 4.33Å; P227-V229 PolarHBondContact O-N 2.95Å; P227-H245 PolarHBondContact O-NE2 3.49Å
228	I	87.9	Confident	81.5	Confident	16 Å²	16	69.2 Å²	69.2	8%	0.082	41%	0.413	C	S	.	.			trans	-97	85.3	173.3	-56.6	170.2	0	0	0	108.2	P219 C221 Y236 H243	P219-I228 HydrophobicContact CG-CB 4.34Å; P219-I228 WeakPolarHBondContact O-CB 3.26Å; P219-I228 WeakPolarHBondContact O-CG1 3.42Å; P219-I228 PolarHBondContact O-N 3.25Å; C221-I228 HydrophobicContact CB-CD1 4.24Å; C221-I228 HydrophobicContact CB-CG1 4.13Å; I228-Y236 HydrophobicContact CG2-CD1 4.11Å; I228-Y236 HydrophobicContact CG2-CG 3.92Å; I228-H243 HydrophobicContact CD1-CB 3.62Å
229	V	81.6	Confident	81.6	Confident	61 Å²	61	71.8 Å²	71.8	37%	0.37	42%	0.422	S	S	.	.			trans	-87	115.9	178.8	-71.4	0	0	0	0	111	V210 G214 A218 P227 L231	V210-V229 HydrophobicContact CG1-CG2 4.4Å; G214-V229 VanDerWaalsContact CA-CG1 3.4Å; A218-V229 HydrophobicContact CB-CG1 4.24Å; P227-V229 HydrophobicContact CB-CG1 4.33Å; P227-V229 PolarHBondContact O-N 2.95Å; V229-L231 HydrophobicContact CB-CD1 4.31Å; V229-L231 PolarHBondContact O-N 3.44Å
230	G	69.1	Low	81.7	Confident	59 Å²	59	75.9 Å²	75.9	61%	0.608	44%	0.437	S	S	*	.			trans	-73.7	22.3	-173.4	0	0	0	0	0	116.6	G232 G233	G230-G232 PolarHBondContact O-N 3.24Å; G230-G233 PolarHBondContact O-N 2.97Å
231	L	60.3	Low	81.6	Confident	73 Å²	73	77.9 Å²	77.9	38%	0.382	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	22.1	-169.7	-81.8	146.4	0	0	0	115.7	V210 V229	V210-L231 HydrophobicContact CB-CD1 3.7Å; V210-L231 HydrophobicContact CG1-CD1 3.2Å; V210-L231 HydrophobicContact CG2-CD1 3.31Å; V210-L231 HydrophobicContact CG2-CD2 4.3Å; V210-L231 HydrophobicContact CG2-CG 4.42Å; V229-L231 HydrophobicContact CB-CD1 4.31Å; V229-L231 PolarHBondContact O-N 3.44Å
232	G	54.4	Low	81.6	Confident	72 Å²	72	79.9 Å²	79.9	74%	0.742	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.1	21	175.5	0	0	0	0	0	114	G230 G234	G230-G232 PolarHBondContact O-N 3.24Å; G232-G234 PolarHBondContact O-N 2.97Å; G232-G234 VanDerWaalsContact O-N 3.13Å
233	G	53.8	Low	81.7	Confident	73 Å²	73	80.9 Å²	80.9	75%	0.753	46%	0.462	S	S	*	.			trans	64.4	16.6	-175.3	0	0	0	0	0	113.7	G230 K235	G230-G233 PolarHBondContact O-N 2.97Å; G233-K235 PolarHBondContact O-N 3.34Å
234	G	61.8	Low	81.8	Confident	53 Å²	53	77.7 Å²	77.7	55%	0.546	44%	0.439	S	S	.	.			trans	-67.7	113.1	-178.2	0	0	0	0	0	111.1	G232 Y236	G232-G234 PolarHBondContact O-N 2.97Å; G232-G234 VanDerWaalsContact O-N 3.13Å; G234-Y236 PolarHBondContact O-N 2.86Å
235	K	74.1	Confident	81.8	Confident	181 Å²	181	77.8 Å²	77.8	79%	0.787	44%	0.435	S	S	*	.			trans	-62.2	130.5	169.3	-61.9	179.8	-179	180	0	108.6	G233	G233-K235 PolarHBondContact O-N 3.34Å
236	Y	88.4	Confident	81.8	Confident	115 Å²	115	75.4 Å²	75.4	45%	0.451	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	155.1	171.4	63.9	-85.9	0	0	0	109.5	I228 G234 S238 H243 W244	I228-Y236 HydrophobicContact CG2-CD1 4.11Å; I228-Y236 HydrophobicContact CG2-CG 3.92Å; G234-Y236 PolarHBondContact O-N 2.86Å; Y236-S238 WeakPolarHBondContact CD2-OG 3.48Å; Y236-S238 WeakPolarHBondContact CE2-OG 3.45Å; Y236-H243 AromaticContact CE2-CD2 3.61Å; Y236-W244 WeakPolarHBondContact CB-O 3.25Å
237	V	90.3	Very high	81.8	Confident	28 Å²	28	73.8 Å²	73.8	17%	0.17	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.6	177.8	-177.8	0	0	0	0	108.1	H243 W244 F249 V259	V237-H243 CarbonylContact O-C 3.52Å; V237-H243 WeakPolarHBondContact O-CA 3.47Å; V237-W244 HydrophobicContact CB-CB 4.5Å; V237-W244 PolarHBondContact N-O 2.76Å; V237-W244 PolarHBondContact O-N 3.39Å; V237-F249 HydrophobicContact CB-CB 4.22Å; V237-F249 HydrophobicContact CB-CD1 4.3Å; V237-F249 HydrophobicContact CB-CD2 4.27Å; V237-F249 HydrophobicContact CB-CG 4.01Å; V237-F249 HydrophobicContact CG1-CD1 3.86Å; V237-F249 HydrophobicContact CG1-CD2 3.9Å; V237-F249 HydrophobicContact CG1-CE1 3.92Å; V237-F249 HydrophobicContact CG1-CE2 3.97Å; V237-F249 HydrophobicContact CG1-CG 3.85Å; V237-F249 HydrophobicContact CG1-CZ 3.99Å; V237-F249 HydrophobicContact CG2-CB 3.93Å; V237-F249 HydrophobicContact CG2-CD1 3.99Å; V237-F249 HydrophobicContact CG2-CG 3.97Å; V237-V259 HydrophobicContact CG2-CG2 4.08Å
238	S	91.3	Very high	81.9	Confident	66 Å²	66	74 Å²	74	46%	0.462	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.8	174.6	-49.1	0	0	0	0	109.3	Y236 R242	Y236-S238 WeakPolarHBondContact CD2-OG 3.48Å; Y236-S238 WeakPolarHBondContact CE2-OG 3.45Å; S238-R242 WeakPolarHBondContact CA-O 3.48Å
239	F	90.8	Very high	82.2	Confident	69 Å²	69	73.5 Å²	73.5	30%	0.303	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	123.4	171.7	177.5	-101	0	0	0	108.2	D241 R242 W244 F263 P265	F239-D241 PolarHBondContact O-N 3.07Å; F239-R242 PolarHBondContact N-O 3.05Å; F239-R242 WeakPolarHBondContact O-CB 3.42Å; F239-R242 PolarHBondContact O-N 3.35Å; F239-W244 HydrophobicContact CB-CH2 4.41Å; F239-W244 HydrophobicContact CB-CZ3 3.94Å; F239-F263 HydrophobicContact CB-CZ 4.07Å; F239-F263 AromaticContact CD1-CE2 3.95Å; F239-F263 HydrophobicContact CD1-CE2 3.95Å; F239-F263 HydrophobicContact CD1-CZ 4.06Å; F239-F263 HydrophobicContact CD2-CE2 4.29Å; F239-F263 AromaticContact CD2-CZ 3.61Å; F239-F263 HydrophobicContact CD2-CZ 3.61Å; F239-F263 HydrophobicContact CE1-CE2 4.16Å; F239-F263 HydrophobicContact CE1-CZ 4.43Å; F239-F263 HydrophobicContact CE2-CE2 4.47Å; F239-F263 HydrophobicContact CE2-CZ 4.02Å; F239-F263 HydrophobicContact CG-CE2 4.01Å; F239-F263 AromaticContact CG-CZ 3.62Å; F239-F263 HydrophobicContact CG-CZ 3.62Å; F239-F263 HydrophobicContact CZ-CE2 4.42Å; F239-F263 HydrophobicContact CZ-CZ 4.41Å; F239-P265 HydrophobicContact CD1-CG 4.5Å; F239-P265 HydrophobicContact CE1-CG 3.61Å; F239-P265 HydrophobicContact CZ-CG 4.09Å
240	E	89.4	Confident	82.8	Confident	131 Å²	131	72.1 Å²	72.1	61%	0.612	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	-134.6	-167.4	-56.3	167.9	149	0	0	109.9	R242	E240-R242 VanDerWaalsContact C-N 3.27Å; E240-R242 PolarHBondContact O-N 2.84Å; E240-R242 IonicContact OE2-CZ 3.84Å; E240-R242 IonicContact OE2-NE 3.5Å; E240-R242 IonicContact OE2-NH2 3.8Å; E240-R242 PolarHBondContact OE2-NH2 2.92Å
241	D	88.8	Confident	84.1	Confident	153 Å²	153	69.4 Å²	69.4	82%	0.818	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	5.9	175.8	-60.8	-45.3	0	0	0	113.2	F239 H243	F239-D241 PolarHBondContact O-N 3.07Å; D241-H243 PolarHBondContact O-CE1 3.44Å; D241-H243 VanDerWaalsContact O-CE1 3.25Å; D241-H243 PolarHBondContact O-ND1 3.15Å
242	R	91.8	Very high	85.6	Confident	42 Å²	42	68.3 Å²	68.3	16%	0.158	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	145.8	-177.3	-68.6	-179.1	-71.7	-172.4	-11.6	111.9	S222 S238 F239 E240 W244 G267	S222-R242 WeakPolarHBondContact OG-CB 3.27Å; S238-R242 WeakPolarHBondContact CA-O 3.48Å; F239-R242 PolarHBondContact N-O 3.05Å; F239-R242 WeakPolarHBondContact O-CB 3.42Å; F239-R242 PolarHBondContact O-N 3.35Å; E240-R242 VanDerWaalsContact C-N 3.27Å; E240-R242 PolarHBondContact O-N 2.84Å; E240-R242 IonicContact OE2-CZ 3.84Å; E240-R242 IonicContact OE2-NE 3.5Å; E240-R242 IonicContact OE2-NH2 3.8Å; E240-R242 PolarHBondContact OE2-NH2 2.92Å; R242-W244 VanDerWaalsContact C-CZ3 3.47Å; R242-W244 HydrophobicContact CB-CE3 4.31Å; R242-W244 HydrophobicContact CB-CH2 3.16Å; R242-W244 HydrophobicContact CB-CZ2 3.79Å; R242-W244 HydrophobicContact CB-CZ3 3.46Å; R242-W244 VanDerWaalsContact CB-CZ3 3.46Å; R242-W244 HydrophobicContact CG-CH2 4.16Å; R242-W244 WeakPolarHBondContact O-CZ3 3.5Å; R242-G267 PolarHBondContact NH1-O 3.48Å
243	H	92.8	Very high	87.4	Confident	47 Å²	47	70.5 Å²	70.5	22%	0.218	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	138.6	-169.3	-58.8	71.3	0	0	0	108.8	P219 C221 S222 I228 Y236 V237 D241	P219-H243 HydrophobicContact CB-CB 4.13Å; C221-H243 CarbonylContact C-O 3.58Å; C221-H243 VanDerWaalsContact CA-O 3.25Å; C221-H243 WeakPolarHBondContact CA-O 3.44Å; S222-H243 PolarHBondContact N-O 3.21Å; S222-H243 PolarHBondContact OG-N 3.48Å; S222-H243 PolarHBondContact OG-O 2.84Å; I228-H243 HydrophobicContact CD1-CB 3.62Å; Y236-H243 AromaticContact CE2-CD2 3.61Å; V237-H243 CarbonylContact O-C 3.52Å; V237-H243 WeakPolarHBondContact O-CA 3.47Å; D241-H243 PolarHBondContact O-CE1 3.44Å; D241-H243 VanDerWaalsContact O-CE1 3.25Å; D241-H243 PolarHBondContact O-ND1 3.15Å
244	W	92.6	Very high	89.3	Confident	5 Å²	5	69.7 Å²	69.7	2%	0.019	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	142	177.1	-62.4	-103.6	0	0	0	110.4	Y236 V237 F239 R242 F249 V270	Y236-W244 WeakPolarHBondContact CB-O 3.25Å; V237-W244 HydrophobicContact CB-CB 4.5Å; V237-W244 PolarHBondContact N-O 2.76Å; V237-W244 PolarHBondContact O-N 3.39Å; F239-W244 HydrophobicContact CB-CH2 4.41Å; F239-W244 HydrophobicContact CB-CZ3 3.94Å; R242-W244 VanDerWaalsContact C-CZ3 3.47Å; R242-W244 HydrophobicContact CB-CE3 4.31Å; R242-W244 HydrophobicContact CB-CH2 3.16Å; R242-W244 HydrophobicContact CB-CZ2 3.79Å; R242-W244 HydrophobicContact CB-CZ3 3.46Å; R242-W244 VanDerWaalsContact CB-CZ3 3.46Å; R242-W244 HydrophobicContact CG-CH2 4.16Å; R242-W244 WeakPolarHBondContact O-CZ3 3.5Å; W244-F249 HydrophobicContact CB-CB 4.02Å; W244-F249 HydrophobicContact CB-CD2 4.17Å; W244-F249 AromaticContact CD2-CD2 3.78Å; W244-F249 HydrophobicContact CD2-CD2 3.78Å; W244-F249 HydrophobicContact CD2-CE2 4.24Å; W244-F249 AromaticContact CE3-CD2 3.98Å; W244-F249 HydrophobicContact CE3-CD2 3.98Å; W244-F249 HydrophobicContact CE3-CE2 4.14Å; W244-F249 HydrophobicContact CG-CB 4.48Å; W244-F249 AromaticContact CG-CD2 3.88Å; W244-F249 HydrophobicContact CG-CD2 3.88Å; W244-F249 HydrophobicContact CZ3-CE2 4.31Å; W244-V270 HydrophobicContact CH2-CG1 4.29Å; W244-V270 HydrophobicContact CZ2-CG1 3.92Å
245	H	90.5	Very high	90.8	Very high	51 Å²	51	71.6 Å²	71.6	24%	0.236	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	147.3	158.4	-54.6	104.5	0	0	0	108.6	C221 C224 P227 N247 C248 F249	C221-H245 VanDerWaalsContact CB-CE1 3.42Å; C221-H245 WeakPolarHBondContact CB-CE1 3.46Å; C221-H245 VanDerWaalsContact CB-ND1 3.31Å; C221-H245 WeakPolarHBondContact CB-ND1 3.31Å; C221-H245 PolarHBondContact SG-ND1 3.45Å; C221-H245 VanDerWaalsContact SG-ND1 3.43Å; C224-H245 PolarHBondContact SG-CE1 3.43Å; C224-H245 PolarHBondContact SG-ND1 3.49Å; C224-H245 VanDerWaalsContact SG-ND1 3.35Å; P227-H245 PolarHBondContact O-NE2 3.49Å; H245-N247 PolarHBondContact O-N 3.35Å; H245-N247 VanDerWaalsContact O-N 3.15Å; H245-C248 HydrophobicContact CB-CB 3.99Å; H245-C248 WeakPolarHBondContact O-CA 3.42Å; H245-C248 WeakPolarHBondContact O-CB 3.11Å; H245-C248 PolarHBondContact O-N 3.43Å; H245-F249 PolarHBondContact O-N 3.43Å
246	H	89.9	Confident	91.8	Very high	85 Å²	85	66.2 Å²	66.2	39%	0.394	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-49.7	-43.9	178.3	-173.5	-80.5	0	0	0	112.7	C248 F249	H246-C248 VanDerWaalsContact C-N 3.29Å; H246-C248 PolarHBondContact O-N 3.4Å; H246-F249 PolarHBondContact O-N 2.92Å
247	N	89.6	Confident	92	Very high	146 Å²	146	63.3 Å²	63.3	78%	0.781	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-78.8	-10.3	179.6	-62	-10.5	0	0	0	114	H245	H245-N247 PolarHBondContact O-N 3.35Å; H245-N247 VanDerWaalsContact O-N 3.15Å
248	C	91.8	Very high	92.2	Very high	28 Å²	28	62 Å²	62	19%	0.189	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-97.2	-4.2	177.1	-67.2	0	0	0	0	112.7	C221 H245 H246 S250	C221-C248 WeakPolarHBondContact SG-CB 3.42Å; H245-C248 HydrophobicContact CB-CB 3.99Å; H245-C248 WeakPolarHBondContact O-CA 3.42Å; H245-C248 WeakPolarHBondContact O-CB 3.11Å; H245-C248 PolarHBondContact O-N 3.43Å; H246-C248 VanDerWaalsContact C-N 3.29Å; H246-C248 PolarHBondContact O-N 3.4Å; C248-S250 PolarHBondContact O-N 2.89Å
249	F	94	Very high	92.2	Very high	5 Å²	5	61.1 Å²	61.1	2%	0.022	33%	0.332	C	S	.	.			trans	-89	78.4	177	-166.8	-116.3	0	0	0	110.2	V237 W244 H245 H246 L258 V259 F263 V270	V237-F249 HydrophobicContact CB-CB 4.22Å; V237-F249 HydrophobicContact CB-CD1 4.3Å; V237-F249 HydrophobicContact CB-CD2 4.27Å; V237-F249 HydrophobicContact CB-CG 4.01Å; V237-F249 HydrophobicContact CG1-CD1 3.86Å; V237-F249 HydrophobicContact CG1-CD2 3.9Å; V237-F249 HydrophobicContact CG1-CE1 3.92Å; V237-F249 HydrophobicContact CG1-CE2 3.97Å; V237-F249 HydrophobicContact CG1-CG 3.85Å; V237-F249 HydrophobicContact CG1-CZ 3.99Å; V237-F249 HydrophobicContact CG2-CB 3.93Å; V237-F249 HydrophobicContact CG2-CD1 3.99Å; V237-F249 HydrophobicContact CG2-CG 3.97Å; W244-F249 HydrophobicContact CB-CB 4.02Å; W244-F249 HydrophobicContact CB-CD2 4.17Å; W244-F249 AromaticContact CD2-CD2 3.78Å; W244-F249 HydrophobicContact CD2-CD2 3.78Å; W244-F249 HydrophobicContact CD2-CE2 4.24Å; W244-F249 AromaticContact CE3-CD2 3.98Å; W244-F249 HydrophobicContact CE3-CD2 3.98Å; W244-F249 HydrophobicContact CE3-CE2 4.14Å; W244-F249 HydrophobicContact CG-CB 4.48Å; W244-F249 AromaticContact CG-CD2 3.88Å; W244-F249 HydrophobicContact CG-CD2 3.88Å; W244-F249 HydrophobicContact CZ3-CE2 4.31Å; H245-F249 PolarHBondContact O-N 3.43Å; H246-F249 PolarHBondContact O-N 2.92Å; F249-L258 HydrophobicContact CD1-CB 3.56Å; F249-L258 HydrophobicContact CE1-CB 3.38Å; F249-L258 WeakPolarHBondContact CE1-O 3.22Å; F249-L258 HydrophobicContact CG-CB 4.35Å; F249-L258 HydrophobicContact CZ-CB 4.05Å; F249-L258 PolarHBondContact O-N 3.23Å; F249-V259 HydrophobicContact CB-CG2 4.2Å; F249-V259 HydrophobicContact CD1-CG2 4.03Å; F249-F263 HydrophobicContact CE1-CD1 4.16Å; F249-F263 HydrophobicContact CE1-CE1 4.36Å; F249-F263 AromaticContact CZ-CD1 3.7Å; F249-F263 HydrophobicContact CZ-CD1 3.7Å; F249-F263 HydrophobicContact CZ-CD2 4.17Å; F249-F263 AromaticContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE2 4.19Å; F249-F263 AromaticContact CZ-CG 3.93Å; F249-F263 HydrophobicContact CZ-CG 3.93Å; F249-F263 AromaticContact CZ-CZ 3.97Å; F249-F263 HydrophobicContact CZ-CZ 3.97Å; F249-V270 HydrophobicContact CD2-CG2 4.37Å; F249-V270 HydrophobicContact CE2-CG1 4.28Å; F249-V270 HydrophobicContact CE2-CG2 4.15Å
250	S	94.6	Very high	92.1	Very high	33 Å²	33	62 Å²	62	23%	0.231	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-133.8	154.8	-176.2	55.8	0	0	0	0	112.2	C248 A252 T256	C248-S250 PolarHBondContact O-N 2.89Å; S250-A252 PolarHBondContact O-N 3.03Å; S250-T256 CarbonylContact C-O 3.54Å; S250-T256 WeakPolarHBondContact CA-O 3.43Å; S250-T256 WeakPolarHBondContact CB-O 3.4Å
251	C	94.9	Very high	92.2	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.007	36%	0.355	C	S	.	.			trans	-61.5	126.7	177.5	178.2	0	0	0	0	110.3	R253 C254 S255 T256 L258 V270 C272 C275	C251-R253 PolarHBondContact O-N 3.32Å; C251-R253 VanDerWaalsContact O-N 3.14Å; C251-C254 WeakPolarHBondContact CB-SG 3.41Å; C251-S255 WeakPolarHBondContact O-CA 3.29Å; C251-S255 PolarHBondContact O-N 3.48Å; C251-T256 PolarHBondContact N-O 3.21Å; C251-L258 HydrophobicContact CB-CD1 4.43Å; C251-L258 HydrophobicContact CB-CD2 4.16Å; C251-L258 HydrophobicContact CB-CG 4.39Å; C251-V270 WeakPolarHBondContact CA-O 3.3Å; C251-C272 HydrophobicContact CB-CB 4.17Å; C251-C272 PolarHBondContact SG-N 2.94Å; C251-C275 VanDerWaalsContact SG-SG 3.67Å
252	A	92.6	Very high	92.3	Very high	51 Å²	51	55.4 Å²	55.4	42%	0.421	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.4	-177.8	0	0	0	0	0	114.5	S250 Q269 V270 L271	S250-A252 PolarHBondContact O-N 3.03Å; A252-Q269 HydrophobicContact CB-CB 3.85Å; A252-Q269 HydrophobicContact CB-CG 4.1Å; A252-V270 PolarHBondContact N-O 3.47Å; A252-L271 HydrophobicContact CB-CD2 4.07Å
253	R	92.4	Very high	92.4	Very high	118 Å²	118	55.9 Å²	55.9	45%	0.445	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-44.2	179.1	-69.2	-176.4	-172.1	-173.5	-4.8	113.8	C251 L271 C275 A278	C251-R253 PolarHBondContact O-N 3.32Å; C251-R253 VanDerWaalsContact O-N 3.14Å; R253-L271 HydrophobicContact CB-CD2 4.36Å; R253-L271 HydrophobicContact CG-CD2 3.75Å; R253-C275 HydrophobicContact CB-CB 4.2Å; R253-C275 PolarHBondContact NH1-O 2.98Å; R253-A278 PolarHBondContact NH1-O 2.89Å
254	C	93.9	Very high	92.5	Very high	56 Å²	56	56.3 Å²	56.3	38%	0.378	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	0.3	-173.6	71.4	0	0	0	0	114.4	C251 T256	C251-C254 WeakPolarHBondContact CB-SG 3.41Å; C254-T256 PolarHBondContact O-N 2.84Å; C254-T256 PolarHBondContact SG-OG1 2.85Å
255	S	93.1	Very high	92.4	Very high	93 Å²	93	58.8 Å²	58.8	65%	0.65	36%	0.361	S	S	*	.			trans	59.2	9.1	178.9	-56.2	0	0	0	0	115.6	C251	C251-S255 WeakPolarHBondContact O-CA 3.29Å; C251-S255 PolarHBondContact O-N 3.48Å
256	T	93.9	Very high	92.3	Very high	68 Å²	68	60.3 Å²	60.3	42%	0.417	37%	0.371	S	S	.	.			trans	-68.2	137.6	176.7	-62	0	0	0	0	110	S250 C251 C254 L258	S250-T256 CarbonylContact C-O 3.54Å; S250-T256 WeakPolarHBondContact CA-O 3.43Å; S250-T256 WeakPolarHBondContact CB-O 3.4Å; C251-T256 PolarHBondContact N-O 3.21Å; C254-T256 PolarHBondContact O-N 2.84Å; C254-T256 PolarHBondContact SG-OG1 2.85Å; T256-L258 PolarHBondContact O-N 3.01Å
257	S	93.9	Very high	92.1	Very high	54 Å²	54	59.1 Å²	59.1	38%	0.378	38%	0.382	S	S	.	.	B	Isolated β-bridge	trans	-59.3	129.4	175	-179.8	0	0	0	0	110.7	V259 Q261	S257-V259 PolarHBondContact OG-N 3.39Å; S257-Q261 PolarHBondContact O-NE2 3.43Å; S257-Q261 PolarHBondContact O-OE1 2.94Å
258	L	94.2	Very high	91.9	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	38%	0.38	C	S	.	.			trans	-95.6	0.3	178.2	-63.8	175.1	0	0	0	112.2	F249 C251 T256 G260 Q261 F263 V270 C272	F249-L258 HydrophobicContact CD1-CB 3.56Å; F249-L258 HydrophobicContact CE1-CB 3.38Å; F249-L258 WeakPolarHBondContact CE1-O 3.22Å; F249-L258 HydrophobicContact CG-CB 4.35Å; F249-L258 HydrophobicContact CZ-CB 4.05Å; F249-L258 PolarHBondContact O-N 3.23Å; C251-L258 HydrophobicContact CB-CD1 4.43Å; C251-L258 HydrophobicContact CB-CD2 4.16Å; C251-L258 HydrophobicContact CB-CG 4.39Å; T256-L258 PolarHBondContact O-N 3.01Å; L258-G260 PolarHBondContact O-N 3.31Å; L258-Q261 PolarHBondContact O-N 2.87Å; L258-F263 HydrophobicContact CB-CB 4.48Å; L258-F263 HydrophobicContact CD1-CB 3.94Å; L258-F263 HydrophobicContact CD2-CB 4.26Å; L258-F263 HydrophobicContact CG-CB 4.46Å; L258-V270 HydrophobicContact CD1-CB 3.88Å; L258-V270 HydrophobicContact CD1-CG2 3.62Å; L258-C272 HydrophobicContact CD2-CB 3.56Å
259	V	91.4	Very high	91.7	Very high	47 Å²	47	62.5 Å²	62.5	29%	0.285	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	123.7	-179	-176.8	0	0	0	0	110	V237 F249 S257 Q261	V237-V259 HydrophobicContact CG2-CG2 4.08Å; F249-V259 HydrophobicContact CB-CG2 4.2Å; F249-V259 HydrophobicContact CD1-CG2 4.03Å; S257-V259 PolarHBondContact OG-N 3.39Å; V259-Q261 PolarHBondContact O-N 3.36Å
260	G	89.3	Confident	91.7	Very high	88 Å²	88	62.6 Å²	62.6	91%	0.907	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	7.9	-178	0	0	0	0	0	114.4	L258	L258-G260 PolarHBondContact O-N 3.31Å
261	Q	90.7	Very high	91.7	Very high	105 Å²	105	61.2 Å²	61.2	49%	0.491	39%	0.385	S	S	.	.	S	Bend	trans	-113	159.6	178.1	-58.3	-172.5	7.5	0	0	111.2	S257 L258 V259	S257-Q261 PolarHBondContact O-NE2 3.43Å; S257-Q261 PolarHBondContact O-OE1 2.94Å; L258-Q261 PolarHBondContact O-N 2.87Å; V259-Q261 PolarHBondContact O-N 3.36Å
262	G	90.8	Very high	91.7	Very high	39 Å²	39	62 Å²	62	40%	0.402	39%	0.391	S	S	.	.			trans	-69.8	135.5	169.7	0	0	0	0	0	111.2
263	F	94.4	Very high	91.6	Very high	53 Å²	53	64.8 Å²	64.8	23%	0.232	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	162.1	178.7	69	-84.7	0	0	0	111.3	F239 F249 L258 P265 V270 L271	F239-F263 HydrophobicContact CB-CZ 4.07Å; F239-F263 AromaticContact CD1-CE2 3.95Å; F239-F263 HydrophobicContact CD1-CE2 3.95Å; F239-F263 HydrophobicContact CD1-CZ 4.06Å; F239-F263 HydrophobicContact CD2-CE2 4.29Å; F239-F263 AromaticContact CD2-CZ 3.61Å; F239-F263 HydrophobicContact CD2-CZ 3.61Å; F239-F263 HydrophobicContact CE1-CE2 4.16Å; F239-F263 HydrophobicContact CE1-CZ 4.43Å; F239-F263 HydrophobicContact CE2-CE2 4.47Å; F239-F263 HydrophobicContact CE2-CZ 4.02Å; F239-F263 HydrophobicContact CG-CE2 4.01Å; F239-F263 AromaticContact CG-CZ 3.62Å; F239-F263 HydrophobicContact CG-CZ 3.62Å; F239-F263 HydrophobicContact CZ-CE2 4.42Å; F239-F263 HydrophobicContact CZ-CZ 4.41Å; F249-F263 HydrophobicContact CE1-CD1 4.16Å; F249-F263 HydrophobicContact CE1-CE1 4.36Å; F249-F263 AromaticContact CZ-CD1 3.7Å; F249-F263 HydrophobicContact CZ-CD1 3.7Å; F249-F263 HydrophobicContact CZ-CD2 4.17Å; F249-F263 AromaticContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE2 4.19Å; F249-F263 AromaticContact CZ-CG 3.93Å; F249-F263 HydrophobicContact CZ-CG 3.93Å; F249-F263 AromaticContact CZ-CZ 3.97Å; F249-F263 HydrophobicContact CZ-CZ 3.97Å; L258-F263 HydrophobicContact CB-CB 4.48Å; L258-F263 HydrophobicContact CD1-CB 3.94Å; L258-F263 HydrophobicContact CD2-CB 4.26Å; L258-F263 HydrophobicContact CG-CB 4.46Å; F263-P265 HydrophobicContact CE2-CG 4.25Å; F263-V270 HydrophobicContact CD2-CB 4.35Å; F263-V270 HydrophobicContact CD2-CG1 4.13Å; F263-V270 HydrophobicContact CE2-CG1 4.35Å; F263-L271 CarbonylContact C-O 3.59Å; F263-L271 VanDerWaalsContact CA-O 3.29Å; F263-L271 WeakPolarHBondContact CA-O 3.46Å; F263-L271 WeakPolarHBondContact CB-O 3.39Å
264	V	93.2	Very high	91.6	Very high	56 Å²	56	61.5 Å²	61.5	34%	0.339	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.2	176.6	-176.5	0	0	0	0	108.5	L271 S276	V264-L271 PolarHBondContact N-O 2.92Å; V264-L271 PolarHBondContact O-N 2.89Å; V264-S276 WeakPolarHBondContact CG2-OG 3.49Å
265	P	91.6	Very high	91.6	Very high	56 Å²	56	59.9 Å²	59.9	36%	0.364	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	133.9	170.7	-16.3	29.8	0	0	0	111.2	F239 F263	F239-P265 HydrophobicContact CD1-CG 4.5Å; F239-P265 HydrophobicContact CE1-CG 3.61Å; F239-P265 HydrophobicContact CZ-CG 4.09Å; F263-P265 HydrophobicContact CE2-CG 4.25Å
266	D	88.9	Confident	91.4	Very high	83 Å²	83	57.6 Å²	57.6	44%	0.444	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	93.3	175.3	-176.8	26.5	0	0	0	109	D268 Q269 L271	D266-D268 PolarHBondContact O-N 2.92Å; D266-Q269 PolarHBondContact N-O 2.83Å; D266-Q269 WeakPolarHBondContact O-CA 3.5Å; D266-Q269 WeakPolarHBondContact O-CB 3.46Å; D266-Q269 PolarHBondContact O-N 2.92Å; D266-L271 HydrophobicContact CB-CD1 3.85Å; D266-L271 HydrophobicContact CB-CG 4.15Å
267	G	85.8	Confident	91	Very high	61 Å²	61	62 Å²	62	63%	0.629	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	-123.8	-168.8	0	0	0	0	0	112.1	R242 Q269	R242-G267 PolarHBondContact NH1-O 3.48Å; G267-Q269 VanDerWaalsContact C-N 3.27Å; G267-Q269 PolarHBondContact O-N 2.86Å
268	D	84	Confident	90.2	Very high	138 Å²	138	62.2 Å²	62.2	74%	0.738	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-7.9	177.1	-76.6	-21	0	0	0	113.9	D266	D266-D268 PolarHBondContact O-N 2.92Å
269	Q	88.8	Confident	88.8	Confident	107 Å²	107	64.7 Å²	64.7	50%	0.5	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	163.6	-176.3	-60	-176.6	17.8	0	0	111.5	A252 D266 G267	A252-Q269 HydrophobicContact CB-CB 3.85Å; A252-Q269 HydrophobicContact CB-CG 4.1Å; D266-Q269 PolarHBondContact N-O 2.83Å; D266-Q269 WeakPolarHBondContact O-CA 3.5Å; D266-Q269 WeakPolarHBondContact O-CB 3.46Å; D266-Q269 PolarHBondContact O-N 2.92Å; G267-Q269 VanDerWaalsContact C-N 3.27Å; G267-Q269 PolarHBondContact O-N 2.86Å
270	V	93.3	Very high	87.3	Confident	6 Å²	6	71.5 Å²	71.5	4%	0.036	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.2	172.7	-69.9	0	0	0	0	108.9	W244 F249 C251 A252 L258 F263	W244-V270 HydrophobicContact CH2-CG1 4.29Å; W244-V270 HydrophobicContact CZ2-CG1 3.92Å; F249-V270 HydrophobicContact CD2-CG2 4.37Å; F249-V270 HydrophobicContact CE2-CG1 4.28Å; F249-V270 HydrophobicContact CE2-CG2 4.15Å; C251-V270 WeakPolarHBondContact CA-O 3.3Å; A252-V270 PolarHBondContact N-O 3.47Å; L258-V270 HydrophobicContact CD1-CB 3.88Å; L258-V270 HydrophobicContact CD1-CG2 3.62Å; F263-V270 HydrophobicContact CD2-CB 4.35Å; F263-V270 HydrophobicContact CD2-CG1 4.13Å; F263-V270 HydrophobicContact CE2-CG1 4.35Å
271	L	94.1	Very high	87.2	Confident	4 Å²	4	70.7 Å²	70.7	2%	0.021	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147.1	-178.3	-60.6	179.6	0	0	0	110.4	A252 R253 F263 V264 D266 C275	A252-L271 HydrophobicContact CB-CD2 4.07Å; R253-L271 HydrophobicContact CB-CD2 4.36Å; R253-L271 HydrophobicContact CG-CD2 3.75Å; F263-L271 CarbonylContact C-O 3.59Å; F263-L271 VanDerWaalsContact CA-O 3.29Å; F263-L271 WeakPolarHBondContact CA-O 3.46Å; F263-L271 WeakPolarHBondContact CB-O 3.39Å; V264-L271 PolarHBondContact N-O 2.92Å; V264-L271 PolarHBondContact O-N 2.89Å; D266-L271 HydrophobicContact CB-CD1 3.85Å; D266-L271 HydrophobicContact CB-CG 4.15Å; L271-C275 HydrophobicContact CB-CB 4.44Å
272	C	94.8	Very high	87	Confident	18 Å²	18	68.8 Å²	68.8	12%	0.122	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	157.5	165.1	72	0	0	0	0	109.8	C251 L258 G274 C275 S276	C251-C272 HydrophobicContact CB-CB 4.17Å; C251-C272 PolarHBondContact SG-N 2.94Å; L258-C272 HydrophobicContact CD2-CB 3.56Å; C272-G274 PolarHBondContact O-N 3.28Å; C272-C275 PolarHBondContact O-N 3.17Å; C272-C275 VanDerWaalsContact SG-CB 3.58Å; C272-C275 PolarHBondContact SG-N 3.39Å; C272-C275 VanDerWaalsContact SG-N 3.39Å; C272-S276 PolarHBondContact O-N 3.05Å; C272-S276 PolarHBondContact O-OG 3.14Å
273	Q	92	Very high	86.8	Confident	110 Å²	110	70.5 Å²	70.5	51%	0.514	44%	0.439	S	S	.	.	H	α-helix	trans	-55.5	-35.8	-179.2	-68.5	179.9	-20.1	0	0	113.6	S276 Q277	Q273-S276 WeakPolarHBondContact CA-OG 3.21Å; Q273-S276 PolarHBondContact O-OG 2.82Å; Q273-Q277 VanDerWaalsContact O-CG 3.3Å; Q273-Q277 WeakPolarHBondContact O-CG 3.49Å; Q273-Q277 PolarHBondContact O-N 3.25Å
274	G	91.9	Very high	86.4	Confident	48 Å²	48	71.5 Å²	71.5	50%	0.495	45%	0.451	S	S	.	.	H	α-helix	trans	-66.3	-44.3	176.4	0	0	0	0	0	112.5	C272 S276 Q277 A278	C272-G274 PolarHBondContact O-N 3.28Å; G274-S276 VanDerWaalsContact C-N 3.33Å; G274-S276 PolarHBondContact O-N 3.07Å; G274-Q277 PolarHBondContact O-N 3.22Å; G274-A278 PolarHBondContact O-N 3.47Å
275	C	92.9	Very high	85.9	Confident	23 Å²	23	72.5 Å²	72.5	16%	0.155	46%	0.458	C	S	.	.	H	α-helix	trans	-71.5	-24.8	178.6	-76.1	0	0	0	0	113.6	C251 R253 L271 C272 A278	C251-C275 VanDerWaalsContact SG-SG 3.67Å; R253-C275 HydrophobicContact CB-CB 4.2Å; R253-C275 PolarHBondContact NH1-O 2.98Å; L271-C275 HydrophobicContact CB-CB 4.44Å; C272-C275 PolarHBondContact O-N 3.17Å; C272-C275 VanDerWaalsContact SG-CB 3.58Å; C272-C275 PolarHBondContact SG-N 3.39Å; C272-C275 VanDerWaalsContact SG-N 3.39Å; C275-A278 VanDerWaalsContact O-O 3.13Å
276	S	89.3	Confident	85.6	Confident	44 Å²	44	73.6 Å²	73.6	31%	0.308	47%	0.465	S	S	.	.	H	α-helix	trans	-78.7	-25.6	175.4	61.2	0	0	0	0	113.1	V264 C272 Q273 G274	V264-S276 WeakPolarHBondContact CG2-OG 3.49Å; C272-S276 PolarHBondContact O-N 3.05Å; C272-S276 PolarHBondContact O-OG 3.14Å; Q273-S276 WeakPolarHBondContact CA-OG 3.21Å; Q273-S276 PolarHBondContact O-OG 2.82Å; G274-S276 VanDerWaalsContact C-N 3.33Å; G274-S276 PolarHBondContact O-N 3.07Å
277	Q	86.7	Confident	85.3	Confident	161 Å²	161	72.9 Å²	72.9	75%	0.752	47%	0.466	S	S	*	.	H	α-helix	trans	-91.7	-27	-179.8	-68.5	174.9	11.5	0	0	112.7	Q273 G274 G279	Q273-Q277 VanDerWaalsContact O-CG 3.3Å; Q273-Q277 WeakPolarHBondContact O-CG 3.49Å; Q273-Q277 PolarHBondContact O-N 3.25Å; G274-Q277 PolarHBondContact O-N 3.22Å; Q277-G279 PolarHBondContact O-N 2.88Å
278	A	76.4	Confident	85.3	Confident	59 Å²	59	73.8 Å²	73.8	49%	0.488	45%	0.454	S	S	.	.	S	Bend	trans	-70.2	107.7	162.8	0	0	0	0	0	107.8	R253 G274 C275	R253-A278 PolarHBondContact NH1-O 2.89Å; G274-A278 PolarHBondContact O-N 3.47Å; C275-A278 VanDerWaalsContact O-O 3.13Å
279	G	64.4	Low	85.4	Confident	52 Å²	52	68.5 Å²	68.5	54%	0.536	43%	0.43	S	S	.	.			trans	-52.4	168.8	172.9	0	0	0	0	0	112.7	Q277	Q277-G279 PolarHBondContact O-N 2.88Å
280	P	60.3	Low	85.1	Confident	190 Å²	190	65 Å²	65	100%	1.234	42%	0.424	S	S	*	.			trans	-54.3	0	179.6	26.1	-34.9	0	0	0	113.2

Retrieved 280 of 280 residues in 48.2 ms (Link to these results)

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