A0A087X8V6_POEFO 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 A0A087X8V6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 279 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	47.6	Very low	79.6	Confident	241 Å²	241	99.7 Å²	99.7	100%	1.187	51%	0.509	S	S	*	.				0	116.4	0	-73.2	167.3	173.2	0	0	105.4	D3	M1-D3 PolarHBondContact O-N 3.28Å
2	A	55.8	Low	80.5	Confident	90 Å²	90	100.2 Å²	100.2	74%	0.744	51%	0.508	S	S	*	.			trans	-69.6	122.4	177.4	0	0	0	0	0	107.8	R4	A2-R4 PolarHBondContact O-N 2.75Å
3	D	65.1	Low	81.3	Confident	144 Å²	144	96.7 Å²	96.7	77%	0.77	50%	0.498	S	S	*	.			trans	-56	125.7	170.5	-92.4	-58.6	0	0	0	108.6	M1 F5	M1-D3 PolarHBondContact O-N 3.28Å; D3-F5 PolarHBondContact O-N 2.93Å; D3-F5 VanDerWaalsContact O-N 3.08Å
4	R	74.4	Confident	81.9	Confident	202 Å²	202	90.1 Å²	90.1	76%	0.762	46%	0.464	S	S	*	.			trans	-72.8	103.9	-179.3	-75.2	-177.4	62.6	175.9	-1	108.7	A2 D6	A2-R4 PolarHBondContact O-N 2.75Å; R4-D6 IonicContact CZ-OD2 3.89Å; R4-D6 IonicContact NE-OD2 3.33Å; R4-D6 PolarHBondContact NE-OD2 3.44Å; R4-D6 IonicContact NH2-OD2 2.75Å; R4-D6 PolarHBondContact NH2-OD2 3.1Å; R4-D6 PolarHBondContact O-N 2.85Å
5	F	87.1	Confident	82.3	Confident	68 Å²	68	94.1 Å²	94.1	30%	0.298	47%	0.472	S	S	.	.			trans	-96.2	78.4	175	-164.1	-108.6	0	0	0	109.6	D3 L14 Y15 Y19 P26	D3-F5 PolarHBondContact O-N 2.93Å; D3-F5 VanDerWaalsContact O-N 3.08Å; F5-L14 HydrophobicContact CD1-CB 3.7Å; F5-L14 HydrophobicContact CE1-CB 3.78Å; F5-L14 HydrophobicContact CE1-CD1 4.23Å; F5-L14 PolarHBondContact O-N 2.79Å; F5-Y15 HydrophobicContact CB-CD2 4.15Å; F5-Y15 HydrophobicContact CB-CE2 3.73Å; F5-Y19 AromaticContact CE1-CD1 3.89Å; F5-Y19 HydrophobicContact CE1-CD1 3.89Å; F5-Y19 HydrophobicContact CE1-CD2 4.43Å; F5-Y19 AromaticContact CE1-CE1 3.65Å; F5-Y19 HydrophobicContact CE1-CE1 3.65Å; F5-Y19 HydrophobicContact CE1-CE2 4.24Å; F5-Y19 HydrophobicContact CE1-CG 4.28Å; F5-Y19 AromaticContact CE1-CZ 3.84Å; F5-Y19 HydrophobicContact CZ-CD1 4.27Å; F5-Y19 HydrophobicContact CZ-CD2 4.07Å; F5-Y19 AromaticContact CZ-CE1 3.84Å; F5-Y19 HydrophobicContact CZ-CE1 3.84Å; F5-Y19 AromaticContact CZ-CE2 3.64Å; F5-Y19 HydrophobicContact CZ-CE2 3.64Å; F5-Y19 HydrophobicContact CZ-CG 4.38Å; F5-Y19 AromaticContact CZ-CZ 3.51Å; F5-P26 HydrophobicContact CD2-CG 4.43Å; F5-P26 HydrophobicContact CE2-CB 4Å; F5-P26 HydrophobicContact CE2-CG 3.91Å; F5-P26 HydrophobicContact CZ-CB 3.85Å; F5-P26 HydrophobicContact CZ-CG 4.24Å
6	D	92	Very high	82.4	Confident	32 Å²	32	94 Å²	94	17%	0.171	50%	0.503	C	S	.	.	B	Isolated β-bridge	trans	-113.8	153.9	-176.1	-58.4	-28.6	0	0	0	110	R4 D8 E12 S13	R4-D6 IonicContact CZ-OD2 3.89Å; R4-D6 IonicContact NE-OD2 3.33Å; R4-D6 PolarHBondContact NE-OD2 3.44Å; R4-D6 IonicContact NH2-OD2 2.75Å; R4-D6 PolarHBondContact NH2-OD2 3.1Å; R4-D6 PolarHBondContact O-N 2.85Å; D6-D8 PolarHBondContact O-N 2.96Å; D6-E12 CarbonylContact C-O 3.5Å; D6-E12 WeakPolarHBondContact CA-O 3.03Å; D6-S13 WeakPolarHBondContact OD1-CA 3.39Å
7	C	89.9	Confident	82.7	Confident	0 Å²	0	97.1 Å²	97.1	0%	0	51%	0.506	C	S	.	.			trans	-62.2	132.7	175.2	173.9	0	0	0	0	110.7	N9 C10 K11 E12 L14 P26 C28 C31	C7-N9 VanDerWaalsContact C-N 3.31Å; C7-N9 PolarHBondContact O-N 3.48Å; C7-N9 PolarHBondContact SG-N 2.91Å; C7-C10 VanDerWaalsContact CB-SG 3.52Å; C7-K11 WeakPolarHBondContact O-CA 3.46Å; C7-K11 WeakPolarHBondContact O-CD 3.37Å; C7-K11 PolarHBondContact O-N 3.47Å; C7-E12 PolarHBondContact N-O 3.31Å; C7-L14 HydrophobicContact CB-CD1 4.23Å; C7-L14 HydrophobicContact CB-CD2 3.99Å; C7-L14 HydrophobicContact CB-CG 4.11Å; C7-P26 CarbonylContact C-O 3.58Å; C7-P26 WeakPolarHBondContact CA-O 3.49Å; C7-C28 HydrophobicContact CB-CB 4.06Å; C7-C28 PolarHBondContact SG-N 3.29Å; C7-C31 PolarHBondContact SG-SG 3.18Å
8	D	90.8	Very high	83	Confident	59 Å²	59	101.4 Å²	101.4	32%	0.316	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-30.1	-177.2	-169.3	52.3	0	0	0	113.5	D6 K11 N25 P26 Y27	D6-D8 PolarHBondContact O-N 2.96Å; D8-K11 WeakPolarHBondContact O-CE 3.14Å; D8-K11 PolarHBondContact O-NZ 2.95Å; D8-K11 IonicContact OD1-NZ 3.65Å; D8-K11 PolarHBondContact OD1-NZ 3.44Å; D8-N25 HydrophobicContact CB-CB 4.01Å; D8-P26 PolarHBondContact N-O 3.4Å; D8-Y27 HydrophobicContact CB-CD1 4.37Å; D8-Y27 HydrophobicContact CB-CE1 3.94Å
9	N	90.5	Very high	83.4	Confident	83 Å²	83	101.7 Å²	101.7	44%	0.444	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-60.1	178.2	-170.4	34.3	0	0	0	113.1	C7 Y27 C31 L35	C7-N9 VanDerWaalsContact C-N 3.31Å; C7-N9 PolarHBondContact O-N 3.48Å; C7-N9 PolarHBondContact SG-N 2.91Å; N9-Y27 HydrophobicContact CB-CD1 4.11Å; N9-Y27 HydrophobicContact CB-CE1 4.28Å; N9-C31 HydrophobicContact CB-CB 3.97Å; N9-L35 HydrophobicContact CB-CD1 3.98Å
10	C	91.8	Very high	83.7	Confident	56 Å²	56	98.2 Å²	98.2	38%	0.378	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-7.3	-172.9	70.1	0	0	0	0	114.7	C7 E12 C31	C7-C10 VanDerWaalsContact CB-SG 3.52Å; C10-E12 PolarHBondContact O-N 3.36Å; C10-E12 VanDerWaalsContact O-N 3.1Å; C10-C31 PolarHBondContact SG-SG 3.38Å
11	K	90.8	Very high	84	Confident	122 Å²	122	99.6 Å²	99.6	53%	0.53	50%	0.502	S	S	.	.			trans	58.9	15.2	-177.9	-49.7	-54.8	-174.1	-169.2	0	115.2	C7 D8	C7-K11 WeakPolarHBondContact O-CA 3.46Å; C7-K11 WeakPolarHBondContact O-CD 3.37Å; C7-K11 PolarHBondContact O-N 3.47Å; D8-K11 WeakPolarHBondContact O-CE 3.14Å; D8-K11 PolarHBondContact O-NZ 2.95Å; D8-K11 IonicContact OD1-NZ 3.65Å; D8-K11 PolarHBondContact OD1-NZ 3.44Å
12	E	90.5	Very high	86	Confident	105 Å²	105	89.1 Å²	89.1	49%	0.491	45%	0.452	S	S	.	.			trans	-74.6	148.1	170	-69	-158.7	155.9	0	0	111.9	D6 C7 C10 L14 R17	D6-E12 CarbonylContact C-O 3.5Å; D6-E12 WeakPolarHBondContact CA-O 3.03Å; C7-E12 PolarHBondContact N-O 3.31Å; C10-E12 PolarHBondContact O-N 3.36Å; C10-E12 VanDerWaalsContact O-N 3.1Å; E12-L14 PolarHBondContact O-N 2.68Å; E12-R17 IonicContact OE2-CZ 3.63Å; E12-R17 IonicContact OE2-NH1 2.7Å; E12-R17 PolarHBondContact OE2-NH1 3.18Å
13	S	90.8	Very high	87.3	Confident	55 Å²	55	90.8 Å²	90.8	39%	0.385	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-64.7	133.1	177	-166.3	0	0	0	0	112.2	D6	D6-S13 WeakPolarHBondContact OD1-CA 3.39Å
14	L	89.4	Confident	88.3	Confident	5 Å²	5	90.8 Å²	90.8	3%	0.026	45%	0.449	C	S	.	.			trans	-95.4	-0.3	178.2	-66	176.4	0	0	0	113.2	F5 C7 E12 G16 R17 Y19 P26 C28	F5-L14 HydrophobicContact CD1-CB 3.7Å; F5-L14 HydrophobicContact CE1-CB 3.78Å; F5-L14 HydrophobicContact CE1-CD1 4.23Å; F5-L14 PolarHBondContact O-N 2.79Å; C7-L14 HydrophobicContact CB-CD1 4.23Å; C7-L14 HydrophobicContact CB-CD2 3.99Å; C7-L14 HydrophobicContact CB-CG 4.11Å; E12-L14 PolarHBondContact O-N 2.68Å; L14-G16 PolarHBondContact O-N 2.83Å; L14-R17 PolarHBondContact O-N 3.04Å; L14-Y19 HydrophobicContact CD1-CG 4.28Å; L14-P26 HydrophobicContact CD1-CB 3.64Å; L14-P26 HydrophobicContact CD1-CG 4.1Å; L14-C28 HydrophobicContact CD2-CB 3.94Å
15	Y	87.9	Confident	89.1	Confident	149 Å²	149	84.2 Å²	84.2	58%	0.584	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	121.3	177.5	-90.6	-81.3	0	0	0	111.8	F5 R17	F5-Y15 HydrophobicContact CB-CD2 4.15Å; F5-Y15 HydrophobicContact CB-CE2 3.73Å; Y15-R17 PolarHBondContact O-N 3.31Å
16	G	83.8	Confident	89.3	Confident	93 Å²	93	82 Å²	82	96%	0.959	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	8.8	179.7	0	0	0	0	0	115	L14	L14-G16 PolarHBondContact O-N 2.83Å
17	R	87	Confident	89.3	Confident	146 Å²	146	81.6 Å²	81.6	55%	0.551	42%	0.417	S	S	*	.	S	Bend	trans	-112.6	153.7	177.1	-64.1	179.4	175	-176.9	-5.2	110.3	E12 L14 Y15	E12-R17 IonicContact OE2-CZ 3.63Å; E12-R17 IonicContact OE2-NH1 2.7Å; E12-R17 PolarHBondContact OE2-NH1 3.18Å; L14-R17 PolarHBondContact O-N 3.04Å; Y15-R17 PolarHBondContact O-N 3.31Å
18	K	89	Confident	89.4	Confident	175 Å²	175	82.5 Å²	82.5	76%	0.761	42%	0.424	S	S	*	.			trans	-70.7	140.4	170.6	-64.5	-176.4	178.8	-178.4	0	109.6	I29	K18-I29 HydrophobicContact CB-CD1 3.55Å; K18-I29 HydrophobicContact CB-CG1 4.42Å; K18-I29 HydrophobicContact CD-CD1 4.21Å
19	Y	90.5	Very high	89.3	Confident	107 Å²	107	81.7 Å²	81.7	42%	0.42	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163	-179.8	69.1	-88.5	0	0	0	109.9	F5 L14 P26 Y27	F5-Y19 AromaticContact CE1-CD1 3.89Å; F5-Y19 HydrophobicContact CE1-CD1 3.89Å; F5-Y19 HydrophobicContact CE1-CD2 4.43Å; F5-Y19 AromaticContact CE1-CE1 3.65Å; F5-Y19 HydrophobicContact CE1-CE1 3.65Å; F5-Y19 HydrophobicContact CE1-CE2 4.24Å; F5-Y19 HydrophobicContact CE1-CG 4.28Å; F5-Y19 AromaticContact CE1-CZ 3.84Å; F5-Y19 HydrophobicContact CZ-CD1 4.27Å; F5-Y19 HydrophobicContact CZ-CD2 4.07Å; F5-Y19 AromaticContact CZ-CE1 3.84Å; F5-Y19 HydrophobicContact CZ-CE1 3.84Å; F5-Y19 AromaticContact CZ-CE2 3.64Å; F5-Y19 HydrophobicContact CZ-CE2 3.64Å; F5-Y19 HydrophobicContact CZ-CG 4.38Å; F5-Y19 AromaticContact CZ-CZ 3.51Å; L14-Y19 HydrophobicContact CD1-CG 4.28Å; Y19-P26 HydrophobicContact CD2-CB 4Å; Y19-P26 HydrophobicContact CE2-CB 4.41Å; Y19-Y27 CarbonylContact C-O 3.53Å; Y19-Y27 VanDerWaalsContact CA-O 3.28Å; Y19-Y27 WeakPolarHBondContact CA-O 3.13Å; Y19-Y27 VanDerWaalsContact CB-O 3.3Å; Y19-Y27 WeakPolarHBondContact CB-O 3.23Å
20	I	89.1	Confident	89.3	Confident	31 Å²	31	82.1 Å²	82.1	16%	0.159	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	136.6	177.5	-59.4	165.6	0	0	0	107.6	Y27 I29 Y32 H49	I20-Y27 PolarHBondContact N-O 2.07Å; I20-Y27 PolarHBondContact O-N 2.85Å; I20-I29 HydrophobicContact CD1-CG1 4.21Å; I20-I29 HydrophobicContact CG1-CG1 4.36Å; I20-Y32 HydrophobicContact CB-CD1 4.41Å; I20-Y32 HydrophobicContact CB-CD2 3.9Å; I20-Y32 HydrophobicContact CB-CE2 4.35Å; I20-Y32 HydrophobicContact CB-CG 3.94Å; I20-Y32 HydrophobicContact CD1-CD1 3.32Å; I20-Y32 HydrophobicContact CD1-CD2 4.35Å; I20-Y32 HydrophobicContact CD1-CE1 3.89Å; I20-Y32 HydrophobicContact CD1-CG 3.58Å; I20-Y32 HydrophobicContact CG1-CD1 4.46Å; I20-Y32 HydrophobicContact CG1-CG 4.36Å; I20-Y32 HydrophobicContact CG2-CD1 4.25Å; I20-Y32 HydrophobicContact CG2-CD2 3.61Å; I20-Y32 HydrophobicContact CG2-CE1 4.16Å; I20-Y32 HydrophobicContact CG2-CE2 3.54Å; I20-Y32 HydrophobicContact CG2-CG 3.97Å; I20-H49 HydrophobicContact CD1-CB 3.74Å; I20-H49 WeakPolarHBondContact CD1-CD2 3.4Å
21	Q	90.4	Very high	89.2	Confident	129 Å²	129	79.9 Å²	79.9	60%	0.603	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.5	178.1	-167.8	169.4	14.9	0	0	109.3
22	S	88.3	Confident	89.2	Confident	21 Å²	21	76.7 Å²	76.7	15%	0.147	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	131.9	175.9	-162.9	0	0	0	0	109.3	D24 N25	S22-D24 VanDerWaalsContact C-N 3.26Å; S22-D24 PolarHBondContact O-N 3.28Å; S22-N25 PolarHBondContact N-O 2.89Å; S22-N25 PolarHBondContact O-N 3.24Å; S22-N25 VanDerWaalsContact O-O 3.1Å
23	D	84.7	Confident	89.2	Confident	125 Å²	125	73 Å²	73	67%	0.668	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	49.5	178.6	-55.6	-74.7	0	0	0	112.7	N25	D23-N25 PolarHBondContact O-N 3.01Å; D23-N25 PolarHBondContact O-ND2 3.14Å; D23-N25 VanDerWaalsContact O-ND2 3.09Å
24	D	85.9	Confident	89	Confident	144 Å²	144	74.3 Å²	74.3	77%	0.77	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	-0.2	-177.7	-63.1	-54.8	0	0	0	116.6	S22	S22-D24 VanDerWaalsContact C-N 3.26Å; S22-D24 PolarHBondContact O-N 3.28Å
25	N	89.9	Confident	88.9	Confident	64 Å²	64	78 Å²	78	34%	0.342	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.3	179.6	-65.8	-60.9	0	0	0	112.1	D8 S22 D23 Y27	D8-N25 HydrophobicContact CB-CB 4.01Å; S22-N25 PolarHBondContact N-O 2.89Å; S22-N25 PolarHBondContact O-N 3.24Å; S22-N25 VanDerWaalsContact O-O 3.1Å; D23-N25 PolarHBondContact O-N 3.01Å; D23-N25 PolarHBondContact O-ND2 3.14Å; D23-N25 VanDerWaalsContact O-ND2 3.09Å; N25-Y27 HydrophobicContact CB-CE2 3.8Å; N25-Y27 WeakPolarHBondContact O-CD2 3.04Å; N25-Y27 WeakPolarHBondContact O-CE2 3.27Å
26	P	92.2	Very high	88.9	Confident	22 Å²	22	74.9 Å²	74.9	14%	0.143	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	131.1	176.9	34.7	-34.3	0	0	0	111.4	F5 C7 D8 L14 Y19	F5-P26 HydrophobicContact CD2-CG 4.43Å; F5-P26 HydrophobicContact CE2-CB 4Å; F5-P26 HydrophobicContact CE2-CG 3.91Å; F5-P26 HydrophobicContact CZ-CB 3.85Å; F5-P26 HydrophobicContact CZ-CG 4.24Å; C7-P26 CarbonylContact C-O 3.58Å; C7-P26 WeakPolarHBondContact CA-O 3.49Å; D8-P26 PolarHBondContact N-O 3.4Å; L14-P26 HydrophobicContact CD1-CB 3.64Å; L14-P26 HydrophobicContact CD1-CG 4.1Å; Y19-P26 HydrophobicContact CD2-CB 4Å; Y19-P26 HydrophobicContact CE2-CB 4.41Å
27	Y	91.5	Very high	89.3	Confident	23 Å²	23	71.5 Å²	71.5	9%	0.09	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.6	177.9	-64.2	-89.4	0	0	0	111.3	D8 N9 Y19 I20 N25 L35 F36	D8-Y27 HydrophobicContact CB-CD1 4.37Å; D8-Y27 HydrophobicContact CB-CE1 3.94Å; N9-Y27 HydrophobicContact CB-CD1 4.11Å; N9-Y27 HydrophobicContact CB-CE1 4.28Å; Y19-Y27 CarbonylContact C-O 3.53Å; Y19-Y27 VanDerWaalsContact CA-O 3.28Å; Y19-Y27 WeakPolarHBondContact CA-O 3.13Å; Y19-Y27 VanDerWaalsContact CB-O 3.3Å; Y19-Y27 WeakPolarHBondContact CB-O 3.23Å; I20-Y27 PolarHBondContact N-O 2.07Å; I20-Y27 PolarHBondContact O-N 2.85Å; N25-Y27 HydrophobicContact CB-CE2 3.8Å; N25-Y27 WeakPolarHBondContact O-CD2 3.04Å; N25-Y27 WeakPolarHBondContact O-CE2 3.27Å; Y27-L35 HydrophobicContact CD1-CD1 4.04Å; Y27-L35 HydrophobicContact CE1-CD1 3.87Å; Y27-F36 HydrophobicContact CD2-CE2 4.33Å; Y27-F36 HydrophobicContact CE1-CE2 4.41Å; Y27-F36 HydrophobicContact CE2-CE2 4.21Å; Y27-F36 HydrophobicContact CE2-CZ 4.39Å; Y27-F36 HydrophobicContact CG-CE2 4.49Å
28	C	92.1	Very high	89.5	Confident	19 Å²	19	67.5 Å²	67.5	13%	0.128	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	145.2	165.7	92.9	0	0	0	0	109.4	C7 L14 C31 Y32	C7-C28 HydrophobicContact CB-CB 4.06Å; C7-C28 PolarHBondContact SG-N 3.29Å; L14-C28 HydrophobicContact CD2-CB 3.94Å; C28-C31 HydrophobicContact CB-CB 4.11Å; C28-C31 WeakPolarHBondContact CB-SG 3.42Å; C28-C31 CarbonylContact O-C 3.51Å; C28-C31 WeakPolarHBondContact O-CA 3.32Å; C28-C31 VanDerWaalsContact O-CB 3.25Å; C28-C31 WeakPolarHBondContact O-CB 3.13Å; C28-C31 PolarHBondContact O-N 3.2Å; C28-C31 WeakPolarHBondContact SG-CB 3.25Å; C28-C31 PolarHBondContact SG-N 3.15Å; C28-C31 CovalentContact SG-SG 2.07Å; C28-C31 PolarHBondContact SG-SG 3.48Å; C28-Y32 PolarHBondContact O-N 3.47Å
29	I	89.6	Confident	89.7	Confident	41 Å²	41	62.9 Å²	62.9	21%	0.21	34%	0.336	C	S	.	.	H	α-helix	trans	-50.2	-51.3	179.7	-72.4	172.3	0	0	0	112.3	K18 I20 C31 Y32 D33 H49	K18-I29 HydrophobicContact CB-CD1 3.55Å; K18-I29 HydrophobicContact CB-CG1 4.42Å; K18-I29 HydrophobicContact CD-CD1 4.21Å; I20-I29 HydrophobicContact CD1-CG1 4.21Å; I20-I29 HydrophobicContact CG1-CG1 4.36Å; I29-C31 PolarHBondContact O-N 2.95Å; I29-Y32 PolarHBondContact O-N 2.94Å; I29-Y32 VanDerWaalsContact O-N 3.14Å; I29-D33 WeakPolarHBondContact CG2-OD2 3.38Å; I29-D33 PolarHBondContact O-N 3.08Å; I29-H49 VanDerWaalsContact CG2-CE1 3.4Å; I29-H49 WeakPolarHBondContact CG2-CE1 3.47Å
30	P	89.1	Confident	89.9	Confident	93 Å²	93	57.8 Å²	57.8	60%	0.604	32%	0.316	S	S	*	.	H	α-helix	trans	-58.5	-34.7	177.3	-25.1	32.3	0	0	0	114	S34	P30-S34 VanDerWaalsContact O-CB 3.23Å; P30-S34 WeakPolarHBondContact O-CB 3.38Å; P30-S34 PolarHBondContact O-N 2.87Å
31	C	90.5	Very high	90.1	Very high	9 Å²	9	59 Å²	59	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-71.4	-42.1	179.8	-52.7	0	0	0	0	110.9	C7 N9 C10 C28 I29 L35	C7-C31 PolarHBondContact SG-SG 3.18Å; N9-C31 HydrophobicContact CB-CB 3.97Å; C10-C31 PolarHBondContact SG-SG 3.38Å; C28-C31 HydrophobicContact CB-CB 4.11Å; C28-C31 WeakPolarHBondContact CB-SG 3.42Å; C28-C31 CarbonylContact O-C 3.51Å; C28-C31 WeakPolarHBondContact O-CA 3.32Å; C28-C31 VanDerWaalsContact O-CB 3.25Å; C28-C31 WeakPolarHBondContact O-CB 3.13Å; C28-C31 PolarHBondContact O-N 3.2Å; C28-C31 WeakPolarHBondContact SG-CB 3.25Å; C28-C31 PolarHBondContact SG-N 3.15Å; C28-C31 CovalentContact SG-SG 2.07Å; C28-C31 PolarHBondContact SG-SG 3.48Å; I29-C31 PolarHBondContact O-N 2.95Å; C31-L35 WeakPolarHBondContact O-CB 3.18Å; C31-L35 WeakPolarHBondContact O-CD1 3.34Å; C31-L35 WeakPolarHBondContact O-CG 3.13Å; C31-L35 PolarHBondContact O-N 3.27Å
32	Y	90.9	Very high	90.1	Very high	55 Å²	55	57.1 Å²	57.1	22%	0.216	31%	0.313	C	S	.	.	H	α-helix	trans	-65.2	-51.4	177.2	-178.2	-91	0	0	0	110.3	I20 C28 I29 S34 L35 F36 H49	I20-Y32 HydrophobicContact CB-CD1 4.41Å; I20-Y32 HydrophobicContact CB-CD2 3.9Å; I20-Y32 HydrophobicContact CB-CE2 4.35Å; I20-Y32 HydrophobicContact CB-CG 3.94Å; I20-Y32 HydrophobicContact CD1-CD1 3.32Å; I20-Y32 HydrophobicContact CD1-CD2 4.35Å; I20-Y32 HydrophobicContact CD1-CE1 3.89Å; I20-Y32 HydrophobicContact CD1-CG 3.58Å; I20-Y32 HydrophobicContact CG1-CD1 4.46Å; I20-Y32 HydrophobicContact CG1-CG 4.36Å; I20-Y32 HydrophobicContact CG2-CD1 4.25Å; I20-Y32 HydrophobicContact CG2-CD2 3.61Å; I20-Y32 HydrophobicContact CG2-CE1 4.16Å; I20-Y32 HydrophobicContact CG2-CE2 3.54Å; I20-Y32 HydrophobicContact CG2-CG 3.97Å; C28-Y32 PolarHBondContact O-N 3.47Å; I29-Y32 PolarHBondContact O-N 2.94Å; I29-Y32 VanDerWaalsContact O-N 3.14Å; Y32-S34 VanDerWaalsContact C-N 3.29Å; Y32-S34 PolarHBondContact O-N 3.49Å; Y32-L35 PolarHBondContact O-N 2.8Å; Y32-F36 AromaticContact CD2-CD2 3.38Å; Y32-F36 HydrophobicContact CD2-CD2 3.38Å; Y32-F36 AromaticContact CD2-CE2 3.86Å; Y32-F36 HydrophobicContact CD2-CE2 3.86Å; Y32-F36 HydrophobicContact CD2-CG 4.33Å; Y32-F36 HydrophobicContact CE1-CB 4.37Å; Y32-F36 HydrophobicContact CE2-CB 4.29Å; Y32-F36 AromaticContact CE2-CD2 3.56Å; Y32-F36 HydrophobicContact CE2-CD2 3.56Å; Y32-F36 HydrophobicContact CE2-CE2 4.17Å; Y32-F36 HydrophobicContact CE2-CG 4.11Å; Y32-F36 AromaticContact CG-CD2 3.93Å; Y32-F36 HydrophobicContact CG-CD2 3.93Å; Y32-F36 WeakPolarHBondContact O-CD2 3.42Å; Y32-F36 PolarHBondContact O-N 3.41Å; Y32-H49 HydrophobicContact CD1-CB 3.92Å; Y32-H49 HydrophobicContact CE1-CB 3.74Å
33	D	89.7	Confident	90.3	Very high	27 Å²	27	58.4 Å²	58.4	14%	0.144	32%	0.322	C	S	.	.	H	α-helix	trans	-58.8	-42.8	179.5	-65	-26.4	0	0	0	110.5	I29 L35 S37 H49	I29-D33 WeakPolarHBondContact CG2-OD2 3.38Å; I29-D33 PolarHBondContact O-N 3.08Å; D33-L35 VanDerWaalsContact C-N 3.29Å; D33-L35 PolarHBondContact O-N 3.2Å; D33-S37 VanDerWaalsContact CA-OG 3.27Å; D33-S37 WeakPolarHBondContact CA-OG 3.34Å; D33-S37 WeakPolarHBondContact O-CB 3.32Å; D33-S37 PolarHBondContact O-N 3.34Å; D33-S37 PolarHBondContact O-OG 2.69Å; D33-H49 WeakPolarHBondContact OD1-CB 3.45Å; D33-H49 IonicContact OD1-CG 2.96Å; D33-H49 PolarHBondContact OD1-N 2.99Å; D33-H49 IonicContact OD1-ND1 3.65Å; D33-H49 PolarHBondContact OD1-ND1 2.96Å; D33-H49 IonicContact OD2-ND1 3.89Å
34	S	87.8	Confident	90.7	Very high	82 Å²	82	58.8 Å²	58.8	57%	0.573	32%	0.318	S	S	*	.	H	α-helix	trans	-65.4	-25.9	177.8	-178.6	0	0	0	0	115	P30 Y32	P30-S34 VanDerWaalsContact O-CB 3.23Å; P30-S34 WeakPolarHBondContact O-CB 3.38Å; P30-S34 PolarHBondContact O-N 2.87Å; Y32-S34 VanDerWaalsContact C-N 3.29Å; Y32-S34 PolarHBondContact O-N 3.49Å
35	L	87.1	Confident	91	Very high	84 Å²	84	58.3 Å²	58.3	44%	0.44	31%	0.311	S	S	.	.	H	α-helix	trans	-97	-30.7	-175.3	-72.9	171.5	0	0	0	112.5	N9 Y27 C31 Y32 D33	N9-L35 HydrophobicContact CB-CD1 3.98Å; Y27-L35 HydrophobicContact CD1-CD1 4.04Å; Y27-L35 HydrophobicContact CE1-CD1 3.87Å; C31-L35 WeakPolarHBondContact O-CB 3.18Å; C31-L35 WeakPolarHBondContact O-CD1 3.34Å; C31-L35 WeakPolarHBondContact O-CG 3.13Å; C31-L35 PolarHBondContact O-N 3.27Å; Y32-L35 PolarHBondContact O-N 2.8Å; D33-L35 VanDerWaalsContact C-N 3.29Å; D33-L35 PolarHBondContact O-N 3.2Å
36	F	88.2	Confident	91.1	Very high	83 Å²	83	59 Å²	59	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-127.9	-12.9	-165.9	-54	-70.9	0	0	0	114.3	Y27 Y32	Y27-F36 HydrophobicContact CD2-CE2 4.33Å; Y27-F36 HydrophobicContact CE1-CE2 4.41Å; Y27-F36 HydrophobicContact CE2-CE2 4.21Å; Y27-F36 HydrophobicContact CE2-CZ 4.39Å; Y27-F36 HydrophobicContact CG-CE2 4.49Å; Y32-F36 AromaticContact CD2-CD2 3.38Å; Y32-F36 HydrophobicContact CD2-CD2 3.38Å; Y32-F36 AromaticContact CD2-CE2 3.86Å; Y32-F36 HydrophobicContact CD2-CE2 3.86Å; Y32-F36 HydrophobicContact CD2-CG 4.33Å; Y32-F36 HydrophobicContact CE1-CB 4.37Å; Y32-F36 HydrophobicContact CE2-CB 4.29Å; Y32-F36 AromaticContact CE2-CD2 3.56Å; Y32-F36 HydrophobicContact CE2-CD2 3.56Å; Y32-F36 HydrophobicContact CE2-CE2 4.17Å; Y32-F36 HydrophobicContact CE2-CG 4.11Å; Y32-F36 AromaticContact CG-CD2 3.93Å; Y32-F36 HydrophobicContact CG-CD2 3.93Å; Y32-F36 WeakPolarHBondContact O-CD2 3.42Å; Y32-F36 PolarHBondContact O-N 3.41Å
37	S	90.9	Very high	91.2	Very high	22 Å²	22	58.4 Å²	58.4	15%	0.154	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-75.3	141.7	176.9	-69.4	0	0	0	0	112.3	D33 I47	D33-S37 VanDerWaalsContact CA-OG 3.27Å; D33-S37 WeakPolarHBondContact CA-OG 3.34Å; D33-S37 WeakPolarHBondContact O-CB 3.32Å; D33-S37 PolarHBondContact O-N 3.34Å; D33-S37 PolarHBondContact O-OG 2.69Å; S37-I47 WeakPolarHBondContact CB-O 3.49Å; S37-I47 PolarHBondContact OG-O 3.47Å
38	N	92.7	Very high	91	Very high	62 Å²	62	58 Å²	58	33%	0.332	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-75.2	156.3	168.4	-61.9	-52.7	0	0	0	110.9	I47 E53 H60	N38-I47 PolarHBondContact O-N 2.88Å; N38-E53 VanDerWaalsContact CB-OE1 3.25Å; N38-E53 WeakPolarHBondContact CB-OE1 3.45Å; N38-E53 PolarHBondContact ND2-OE1 2.94Å; N38-E53 PolarHBondContact ND2-OE2 3.35Å; N38-H60 HydrophobicContact CB-CB 3.88Å; N38-H60 PolarHBondContact ND2-CE1 3.38Å; N38-H60 VanDerWaalsContact ND2-CE1 3.31Å; N38-H60 PolarHBondContact ND2-ND1 2.93Å
39	T	93.5	Very high	90.6	Very high	78 Å²	78	61 Å²	61	48%	0.479	32%	0.324	S	S	.	.	B	Isolated β-bridge	trans	-93.2	129.6	175.5	-56.3	0	0	0	0	109.6
40	C	94.3	Very high	90.4	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-68.3	132.6	176.6	175	0	0	0	0	111.2	E42 C43 K44 E45 I47 H60 H62	C40-E42 PolarHBondContact O-N 3.39Å; C40-E42 PolarHBondContact SG-N 3.45Å; C40-E42 VanDerWaalsContact SG-N 3.44Å; C40-C43 VanDerWaalsContact CB-SG 3.56Å; C40-C43 VanDerWaalsContact SG-SG 3.67Å; C40-K44 WeakPolarHBondContact O-CA 3.4Å; C40-K44 PolarHBondContact O-N 3.35Å; C40-E45 WeakPolarHBondContact CB-O 3.32Å; C40-E45 PolarHBondContact N-O 3.06Å; C40-I47 HydrophobicContact CB-CD1 4.17Å; C40-I47 HydrophobicContact CB-CG1 3.95Å; C40-H60 CarbonylContact C-O 3.57Å; C40-H60 VanDerWaalsContact CA-O 3.28Å; C40-H60 WeakPolarHBondContact CA-O 3.33Å; C40-H62 VanDerWaalsContact CB-CE1 3.46Å; C40-H62 WeakPolarHBondContact CB-CE1 3.45Å; C40-H62 VanDerWaalsContact CB-ND1 3.28Å; C40-H62 WeakPolarHBondContact CB-ND1 3.42Å; C40-H62 PolarHBondContact SG-ND1 2.88Å
41	D	92.3	Very high	90.3	Very high	57 Å²	57	63 Å²	63	31%	0.305	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-28.3	-178.4	-146.7	111.6	0	0	0	112.9	K44 R59 H60 Y61	D41-K44 WeakPolarHBondContact O-CD 3.43Å; D41-K44 WeakPolarHBondContact O-CE 3.28Å; D41-K44 PolarHBondContact O-NZ 3.03Å; D41-K44 IonicContact OD2-NZ 2.68Å; D41-K44 PolarHBondContact OD2-NZ 2.93Å; D41-R59 HydrophobicContact CB-CB 4.16Å; D41-R59 HydrophobicContact CB-CG 4.43Å; D41-R59 WeakPolarHBondContact OD1-CD 3.25Å; D41-R59 WeakPolarHBondContact OD1-CG 3.38Å; D41-R59 IonicContact OD1-NE 2.79Å; D41-H60 PolarHBondContact N-O 3.06Å; D41-Y61 HydrophobicContact CB-CD1 4.34Å; D41-Y61 HydrophobicContact CB-CE1 3.82Å
42	E	90.8	Very high	90.3	Very high	88 Å²	88	68.1 Å²	68.1	41%	0.411	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-56.1	-180	-179.2	76.3	173.5	0	0	112.1	C40 Y61 C65 R67	C40-E42 PolarHBondContact O-N 3.39Å; C40-E42 PolarHBondContact SG-N 3.45Å; C40-E42 VanDerWaalsContact SG-N 3.44Å; E42-Y61 HydrophobicContact CB-CD1 4.3Å; E42-C65 HydrophobicContact CB-CB 3.76Å; E42-C65 HydrophobicContact CG-CB 4.01Å; E42-R67 IonicContact OE1-CZ 2.85Å; E42-R67 IonicContact OE1-NE 3.42Å; E42-R67 PolarHBondContact OE1-NE 2.98Å; E42-R67 IonicContact OE1-NH2 2.91Å; E42-R67 PolarHBondContact OE1-NH2 3.45Å
43	C	93	Very high	90.4	Very high	49 Å²	49	69.2 Å²	69.2	33%	0.331	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-11.8	-173.6	68.4	0	0	0	0	114.1	C40 E45 H62	C40-C43 VanDerWaalsContact CB-SG 3.56Å; C40-C43 VanDerWaalsContact SG-SG 3.67Å; C43-E45 PolarHBondContact O-N 3.45Å; C43-E45 PolarHBondContact SG-N 2.89Å; C43-H62 PolarHBondContact SG-CE1 3.09Å; C43-H62 PolarHBondContact SG-ND1 2.86Å; C43-H62 VanDerWaalsContact SG-ND1 3.36Å
44	K	93.1	Very high	90.6	Very high	133 Å²	133	69.1 Å²	69.1	58%	0.578	36%	0.361	S	S	*	.			trans	63.1	17.1	-176.5	-48.1	-54.7	-173.7	-171.4	0	114.7	C40 D41	C40-K44 WeakPolarHBondContact O-CA 3.4Å; C40-K44 PolarHBondContact O-N 3.35Å; D41-K44 WeakPolarHBondContact O-CD 3.43Å; D41-K44 WeakPolarHBondContact O-CE 3.28Å; D41-K44 PolarHBondContact O-NZ 3.03Å; D41-K44 IonicContact OD2-NZ 2.68Å; D41-K44 PolarHBondContact OD2-NZ 2.93Å
45	E	92.8	Very high	90.8	Very high	134 Å²	134	71.1 Å²	71.1	63%	0.626	36%	0.359	S	S	*	.			trans	-95.7	159.6	173.1	-59.7	-172.7	165.2	0	0	111.9	C40 C43	C40-E45 WeakPolarHBondContact CB-O 3.32Å; C40-E45 PolarHBondContact N-O 3.06Å; C43-E45 PolarHBondContact O-N 3.45Å; C43-E45 PolarHBondContact SG-N 2.89Å
46	L	91.9	Very high	91	Very high	78 Å²	78	70 Å²	70	41%	0.408	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-68.8	138.8	176.4	-64.6	175.4	0	0	0	111	G48 H62	L46-G48 PolarHBondContact O-N 3.33Å; L46-H62 PolarHBondContact O-NE2 3.18Å
47	I	92.9	Very high	91.1	Very high	9 Å²	9	71.2 Å²	71.2	5%	0.046	36%	0.356	C	S	.	.			trans	-85.4	98.7	172.3	-54.1	173.3	0	0	0	107.4	S37 N38 C40 A51 E53 H60	S37-I47 WeakPolarHBondContact CB-O 3.49Å; S37-I47 PolarHBondContact OG-O 3.47Å; N38-I47 PolarHBondContact O-N 2.88Å; C40-I47 HydrophobicContact CB-CD1 4.17Å; C40-I47 HydrophobicContact CB-CG1 3.95Å; I47-A51 HydrophobicContact CG2-CB 3.94Å; I47-E53 HydrophobicContact CD1-CG 4.04Å; I47-E53 HydrophobicContact CG2-CB 4.08Å; I47-H60 HydrophobicContact CD1-CB 3.82Å
48	G	88.6	Confident	91.1	Very high	14 Å²	14	76.9 Å²	76.9	14%	0.144	39%	0.385	C	S	.	.			trans	-57.2	153.5	-179	0	0	0	0	0	112.4	L46 D50 A51	L46-G48 PolarHBondContact O-N 3.33Å; G48-D50 PolarHBondContact O-N 2.98Å; G48-A51 WeakPolarHBondContact O-CB 3.3Å; G48-A51 PolarHBondContact O-N 3.02Å
49	H	83.8	Confident	91.1	Very high	83 Å²	83	76.9 Å²	76.9	38%	0.384	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-20.7	-179.1	71	-74.7	0	0	0	115.3	I20 I29 Y32 D33	I20-H49 HydrophobicContact CD1-CB 3.74Å; I20-H49 WeakPolarHBondContact CD1-CD2 3.4Å; I29-H49 VanDerWaalsContact CG2-CE1 3.4Å; I29-H49 WeakPolarHBondContact CG2-CE1 3.47Å; Y32-H49 HydrophobicContact CD1-CB 3.92Å; Y32-H49 HydrophobicContact CE1-CB 3.74Å; D33-H49 WeakPolarHBondContact OD1-CB 3.45Å; D33-H49 IonicContact OD1-CG 2.96Å; D33-H49 PolarHBondContact OD1-N 2.99Å; D33-H49 IonicContact OD1-ND1 3.65Å; D33-H49 PolarHBondContact OD1-ND1 2.96Å; D33-H49 IonicContact OD2-ND1 3.89Å
50	D	85.6	Confident	91.1	Very high	134 Å²	134	75.3 Å²	75.3	72%	0.717	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-3.9	180	64.7	-23.5	0	0	0	113.5	G48	G48-D50 PolarHBondContact O-N 2.98Å
51	A	86.5	Confident	91.1	Very high	42 Å²	42	75.8 Å²	75.8	35%	0.347	37%	0.37	S	S	.	.	S	Bend	trans	-90.1	143.3	178.7	0	0	0	0	0	112.1	I47 G48 E53	I47-A51 HydrophobicContact CG2-CB 3.94Å; G48-A51 WeakPolarHBondContact O-CB 3.3Å; G48-A51 PolarHBondContact O-N 3.02Å; A51-E53 PolarHBondContact O-N 3.08Å
52	R	90.1	Very high	91.2	Very high	116 Å²	116	73.8 Å²	73.8	44%	0.438	36%	0.358	S	S	.	.			trans	-71.9	113.3	168.8	-176.5	175.9	173.2	-160.3	1.8	108.9	E63 D77	R52-E63 HydrophobicContact CB-CB 4.23Å; R52-E63 IonicContact CZ-OE1 3.39Å; R52-E63 IonicContact NE-OE1 3.56Å; R52-E63 IonicContact NH1-OE1 3.96Å; R52-E63 PolarHBondContact NH1-OE1 2.94Å; R52-E63 PolarHBondContact O-N 3.49Å; R52-E63 VanDerWaalsContact O-N 3.17Å; R52-D77 IonicContact CZ-OD1 3.92Å; R52-D77 IonicContact NH1-OD1 3.94Å; R52-D77 IonicContact NH1-OD2 2.78Å; R52-D77 PolarHBondContact NH1-OD2 3.36Å; R52-D77 IonicContact NH2-OD1 3.95Å; R52-D77 PolarHBondContact NH2-OD1 3.3Å; R52-D77 IonicContact NH2-OD2 3.8Å
53	E	92.4	Very high	91.3	Very high	79 Å²	79	73 Å²	73	37%	0.369	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	138.3	174.6	179.4	174.1	-133.4	0	0	111	N38 I47 A51 H60	N38-E53 VanDerWaalsContact CB-OE1 3.25Å; N38-E53 WeakPolarHBondContact CB-OE1 3.45Å; N38-E53 PolarHBondContact ND2-OE1 2.94Å; N38-E53 PolarHBondContact ND2-OE2 3.35Å; I47-E53 HydrophobicContact CD1-CG 4.04Å; I47-E53 HydrophobicContact CG2-CB 4.08Å; A51-E53 PolarHBondContact O-N 3.08Å; E53-H60 IonicContact OE1-CE1 3.96Å; E53-H60 IonicContact OE1-CG 3.66Å; E53-H60 IonicContact OE1-ND1 2.88Å; E53-H60 PolarHBondContact OE1-ND1 2.82Å
54	L	93.6	Very high	91.2	Very high	24 Å²	24	77 Å²	77	13%	0.126	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	138.4	169.1	-62.4	173.4	0	0	0	109.6	H60 Y61 E63 F66 A76	L54-H60 WeakPolarHBondContact O-CA 3.06Å; L54-Y61 PolarHBondContact N-O 3Å; L54-Y61 PolarHBondContact O-N 2.7Å; L54-E63 HydrophobicContact CD1-CB 4.47Å; L54-F66 HydrophobicContact CB-CD2 4.42Å; L54-F66 HydrophobicContact CB-CG 4.41Å; L54-F66 HydrophobicContact CD1-CB 3.45Å; L54-F66 VanDerWaalsContact CD1-CB 3.45Å; L54-F66 HydrophobicContact CD1-CD1 3.86Å; L54-F66 HydrophobicContact CD1-CD2 4.47Å; L54-F66 HydrophobicContact CD1-CG 3.68Å; L54-A76 HydrophobicContact CD1-CB 3.57Å
55	F	93	Very high	91.2	Very high	124 Å²	124	71 Å²	71	54%	0.544	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.6	-177.8	179.8	-103.5	0	0	0	110.7	R59 H60	F55-R59 WeakPolarHBondContact CA-O 3.28Å; F55-R59 WeakPolarHBondContact CD2-O 3.49Å; F55-H60 AromaticContact CD2-CE1 3.47Å; F55-H60 VanDerWaalsContact CD2-CE1 3.47Å; F55-H60 WeakPolarHBondContact CD2-CE1 3.28Å; F55-H60 AromaticContact CD2-ND1 3.77Å; F55-H60 AromaticContact CD2-NE2 3.68Å; F55-H60 AromaticContact CE2-CE1 3.83Å; F55-H60 AromaticContact CE2-NE2 3.63Å
56	Y	91.6	Very high	91.3	Very high	61 Å²	61	65 Å²	65	24%	0.239	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	131.8	179.3	179.8	-103.3	0	0	0	110.9	D58 R59 F66 F80 S82 L87	Y56-D58 VanDerWaalsContact C-N 3.33Å; Y56-D58 PolarHBondContact O-N 2.87Å; Y56-R59 PolarHBondContact N-O 2.74Å; Y56-R59 WeakPolarHBondContact O-CB 3.17Å; Y56-R59 PolarHBondContact O-N 2.81Å; Y56-F66 HydrophobicContact CG-CE2 4.48Å; Y56-F66 HydrophobicContact CG-CZ 4.44Å; Y56-F80 HydrophobicContact CD1-CE2 4.19Å; Y56-F80 HydrophobicContact CD1-CZ 4.33Å; Y56-F80 HydrophobicContact CD2-CE2 4.18Å; Y56-F80 AromaticContact CD2-CZ 3.65Å; Y56-F80 HydrophobicContact CD2-CZ 3.65Å; Y56-F80 AromaticContact CE1-CE2 3.82Å; Y56-F80 HydrophobicContact CE1-CE2 3.82Å; Y56-F80 HydrophobicContact CE1-CZ 4.28Å; Y56-F80 AromaticContact CE2-CE2 3.81Å; Y56-F80 HydrophobicContact CE2-CE2 3.81Å; Y56-F80 AromaticContact CE2-CZ 3.59Å; Y56-F80 HydrophobicContact CE2-CZ 3.59Å; Y56-F80 HydrophobicContact CG-CE2 4.35Å; Y56-F80 HydrophobicContact CG-CZ 4.02Å; Y56-F80 AromaticContact CZ-CE2 3.61Å; Y56-F80 AromaticContact CZ-CZ 3.91Å; Y56-S82 WeakPolarHBondContact OH-CB 3.39Å; Y56-S82 PolarHBondContact OH-OG 2.87Å; Y56-L87 HydrophobicContact CD1-CD2 4Å; Y56-L87 HydrophobicContact CE1-CD2 3.95Å
57	E	90.3	Very high	91.4	Very high	108 Å²	108	65.6 Å²	65.6	51%	0.505	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.9	50.9	179.8	-70.5	-173.5	153.4	0	0	113.8	R59	E57-R59 PolarHBondContact O-N 2.84Å; E57-R59 VanDerWaalsContact O-N 3.16Å
58	D	90.2	Very high	91.4	Very high	142 Å²	142	65.1 Å²	65.1	76%	0.759	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	19.6	-179	-62	-53.3	0	0	0	114.8	Y56	Y56-D58 VanDerWaalsContact C-N 3.33Å; Y56-D58 PolarHBondContact O-N 2.87Å
59	R	92.6	Very high	91.6	Very high	62 Å²	62	71 Å²	71	23%	0.234	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	147.4	175.8	-62.4	178.5	-174.6	160.7	12.2	111.7	D41 F55 Y56 E57 Y61 D85	D41-R59 HydrophobicContact CB-CB 4.16Å; D41-R59 HydrophobicContact CB-CG 4.43Å; D41-R59 WeakPolarHBondContact OD1-CD 3.25Å; D41-R59 WeakPolarHBondContact OD1-CG 3.38Å; D41-R59 IonicContact OD1-NE 2.79Å; F55-R59 WeakPolarHBondContact CA-O 3.28Å; F55-R59 WeakPolarHBondContact CD2-O 3.49Å; Y56-R59 PolarHBondContact N-O 2.74Å; Y56-R59 WeakPolarHBondContact O-CB 3.17Å; Y56-R59 PolarHBondContact O-N 2.81Å; E57-R59 PolarHBondContact O-N 2.84Å; E57-R59 VanDerWaalsContact O-N 3.16Å; R59-Y61 HydrophobicContact CB-CD2 4.41Å; R59-Y61 HydrophobicContact CB-CE2 3.49Å; R59-Y61 VanDerWaalsContact CB-CE2 3.49Å; R59-Y61 WeakPolarHBondContact CD-OH 3.45Å; R59-D85 IonicContact CZ-OD1 2.78Å; R59-D85 IonicContact NH1-OD1 3.4Å; R59-D85 PolarHBondContact NH1-OD1 2.9Å; R59-D85 IonicContact NH2-OD1 3.67Å; R59-D85 PolarHBondContact NH2-OD1 2.89Å; R59-D85 IonicContact NH2-OD2 3.47Å
60	H	94.3	Very high	91.8	Very high	45 Å²	45	74.1 Å²	74.1	21%	0.208	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	138.9	-179.2	-62.7	-96.1	0	0	0	109.9	N38 C40 D41 I47 E53 L54 F55	N38-H60 HydrophobicContact CB-CB 3.88Å; N38-H60 PolarHBondContact ND2-CE1 3.38Å; N38-H60 VanDerWaalsContact ND2-CE1 3.31Å; N38-H60 PolarHBondContact ND2-ND1 2.93Å; C40-H60 CarbonylContact C-O 3.57Å; C40-H60 VanDerWaalsContact CA-O 3.28Å; C40-H60 WeakPolarHBondContact CA-O 3.33Å; D41-H60 PolarHBondContact N-O 3.06Å; I47-H60 HydrophobicContact CD1-CB 3.82Å; E53-H60 IonicContact OE1-CE1 3.96Å; E53-H60 IonicContact OE1-CG 3.66Å; E53-H60 IonicContact OE1-ND1 2.88Å; E53-H60 PolarHBondContact OE1-ND1 2.82Å; L54-H60 WeakPolarHBondContact O-CA 3.06Å; F55-H60 AromaticContact CD2-CE1 3.47Å; F55-H60 VanDerWaalsContact CD2-CE1 3.47Å; F55-H60 WeakPolarHBondContact CD2-CE1 3.28Å; F55-H60 AromaticContact CD2-ND1 3.77Å; F55-H60 AromaticContact CD2-NE2 3.68Å; F55-H60 AromaticContact CE2-CE1 3.83Å; F55-H60 AromaticContact CE2-NE2 3.63Å
61	Y	94.4	Very high	92.2	Very high	10 Å²	10	70.6 Å²	70.6	4%	0.039	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	143.5	-179	-56.5	-94.9	0	0	0	110.8	D41 E42 L54 R59 F66 L87	D41-Y61 HydrophobicContact CB-CD1 4.34Å; D41-Y61 HydrophobicContact CB-CE1 3.82Å; E42-Y61 HydrophobicContact CB-CD1 4.3Å; L54-Y61 PolarHBondContact N-O 3Å; L54-Y61 PolarHBondContact O-N 2.7Å; R59-Y61 HydrophobicContact CB-CD2 4.41Å; R59-Y61 HydrophobicContact CB-CE2 3.49Å; R59-Y61 VanDerWaalsContact CB-CE2 3.49Å; R59-Y61 WeakPolarHBondContact CD-OH 3.45Å; Y61-F66 HydrophobicContact CD1-CD2 4.25Å; Y61-F66 AromaticContact CD2-CD2 3.56Å; Y61-F66 HydrophobicContact CD2-CD2 3.56Å; Y61-F66 AromaticContact CD2-CE2 3.86Å; Y61-F66 HydrophobicContact CD2-CE2 3.86Å; Y61-F66 HydrophobicContact CE2-CD2 4.08Å; Y61-F66 HydrophobicContact CE2-CE2 4.01Å; Y61-F66 AromaticContact CG-CD2 3.64Å; Y61-F66 HydrophobicContact CG-CD2 3.64Å; Y61-F66 HydrophobicContact CG-CE2 4.38Å; Y61-L87 HydrophobicContact CE1-CD1 4.39Å
62	H	93.9	Very high	92.4	Very high	14 Å²	14	73.6 Å²	73.6	7%	0.065	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	146.7	158.2	-57	101.9	0	0	0	109.2	C40 C43 L46 H64 C65 F66	C40-H62 VanDerWaalsContact CB-CE1 3.46Å; C40-H62 WeakPolarHBondContact CB-CE1 3.45Å; C40-H62 VanDerWaalsContact CB-ND1 3.28Å; C40-H62 WeakPolarHBondContact CB-ND1 3.42Å; C40-H62 PolarHBondContact SG-ND1 2.88Å; C43-H62 PolarHBondContact SG-CE1 3.09Å; C43-H62 PolarHBondContact SG-ND1 2.86Å; C43-H62 VanDerWaalsContact SG-ND1 3.36Å; L46-H62 PolarHBondContact O-NE2 3.18Å; H62-H64 WeakPolarHBondContact CB-CE1 3.32Å; H62-H64 AromaticContact CG-CE1 3.6Å; H62-H64 PolarHBondContact O-N 3.48Å; H62-H64 VanDerWaalsContact O-N 3.13Å; H62-C65 HydrophobicContact CB-CB 4Å; H62-C65 WeakPolarHBondContact O-CA 3.38Å; H62-C65 WeakPolarHBondContact O-CB 3.28Å; H62-C65 PolarHBondContact O-N 3.05Å; H62-F66 PolarHBondContact O-N 3.44Å
63	E	92	Very high	92.5	Very high	73 Å²	73	74.1 Å²	74.1	34%	0.341	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.5	-39.6	174.5	178.9	176	-152.3	0	0	113.4	R52 L54 A76	R52-E63 HydrophobicContact CB-CB 4.23Å; R52-E63 IonicContact CZ-OE1 3.39Å; R52-E63 IonicContact NE-OE1 3.56Å; R52-E63 IonicContact NH1-OE1 3.96Å; R52-E63 PolarHBondContact NH1-OE1 2.94Å; R52-E63 PolarHBondContact O-N 3.49Å; R52-E63 VanDerWaalsContact O-N 3.17Å; L54-E63 HydrophobicContact CD1-CB 4.47Å; E63-A76 HydrophobicContact CG-CB 4.11Å
64	H	91	Very high	92.6	Very high	133 Å²	133	73.1 Å²	73.1	62%	0.616	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-18.3	178.8	63.4	-93.6	0	0	0	114	H62	H62-H64 WeakPolarHBondContact CB-CE1 3.32Å; H62-H64 AromaticContact CG-CE1 3.6Å; H62-H64 PolarHBondContact O-N 3.48Å; H62-H64 VanDerWaalsContact O-N 3.13Å
65	C	93.5	Very high	92.6	Very high	7 Å²	7	72.1 Å²	72.1	5%	0.047	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-19.5	175	-77.7	0	0	0	0	112.3	E42 H62 R67	E42-C65 HydrophobicContact CB-CB 3.76Å; E42-C65 HydrophobicContact CG-CB 4.01Å; H62-C65 HydrophobicContact CB-CB 4Å; H62-C65 WeakPolarHBondContact O-CA 3.38Å; H62-C65 WeakPolarHBondContact O-CB 3.28Å; H62-C65 PolarHBondContact O-N 3.05Å; C65-R67 VanDerWaalsContact C-N 3.29Å; C65-R67 PolarHBondContact O-N 3.28Å
66	F	94.7	Very high	92.4	Very high	8 Å²	8	67 Å²	67	4%	0.035	31%	0.314	C	S	.	.	S	Bend	trans	-80.3	77.3	176.3	-159.2	-99.4	0	0	0	110.7	L54 Y56 Y61 H62 L75 F80 L87	L54-F66 HydrophobicContact CB-CD2 4.42Å; L54-F66 HydrophobicContact CB-CG 4.41Å; L54-F66 HydrophobicContact CD1-CB 3.45Å; L54-F66 VanDerWaalsContact CD1-CB 3.45Å; L54-F66 HydrophobicContact CD1-CD1 3.86Å; L54-F66 HydrophobicContact CD1-CD2 4.47Å; L54-F66 HydrophobicContact CD1-CG 3.68Å; Y56-F66 HydrophobicContact CG-CE2 4.48Å; Y56-F66 HydrophobicContact CG-CZ 4.44Å; Y61-F66 HydrophobicContact CD1-CD2 4.25Å; Y61-F66 AromaticContact CD2-CD2 3.56Å; Y61-F66 HydrophobicContact CD2-CD2 3.56Å; Y61-F66 AromaticContact CD2-CE2 3.86Å; Y61-F66 HydrophobicContact CD2-CE2 3.86Å; Y61-F66 HydrophobicContact CE2-CD2 4.08Å; Y61-F66 HydrophobicContact CE2-CE2 4.01Å; Y61-F66 AromaticContact CG-CD2 3.64Å; Y61-F66 HydrophobicContact CG-CD2 3.64Å; Y61-F66 HydrophobicContact CG-CE2 4.38Å; H62-F66 PolarHBondContact O-N 3.44Å; F66-L75 HydrophobicContact CD1-CB 3.65Å; F66-L75 HydrophobicContact CE1-CB 3.72Å; F66-L75 PolarHBondContact O-N 2.84Å; F66-F80 HydrophobicContact CE1-CD1 4.11Å; F66-F80 AromaticContact CE1-CE1 3.78Å; F66-F80 HydrophobicContact CE1-CE1 3.78Å; F66-F80 HydrophobicContact CE1-CZ 4.13Å; F66-F80 HydrophobicContact CZ-CD1 4.4Å; F66-F80 AromaticContact CZ-CE1 3.75Å; F66-F80 HydrophobicContact CZ-CE1 3.75Å; F66-F80 HydrophobicContact CZ-CE2 4.14Å; F66-F80 AromaticContact CZ-CZ 3.61Å; F66-F80 HydrophobicContact CZ-CZ 3.61Å; F66-L87 HydrophobicContact CD2-CD1 3.66Å; F66-L87 HydrophobicContact CE2-CD1 3.45Å; F66-L87 VanDerWaalsContact CE2-CD1 3.45Å; F66-L87 HydrophobicContact CE2-CD2 4.46Å; F66-L87 HydrophobicContact CG-CD1 4.34Å; F66-L87 HydrophobicContact CZ-CD1 3.94Å; F66-L87 HydrophobicContact CZ-CD2 4.46Å
67	R	94.7	Very high	92.3	Very high	89 Å²	89	69.9 Å²	69.9	34%	0.336	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-131.9	160.1	-170.5	65.5	-171.4	169.6	-178.3	-2.4	112	E42 C65 F69 D72 R73	E42-R67 IonicContact OE1-CZ 2.85Å; E42-R67 IonicContact OE1-NE 3.42Å; E42-R67 PolarHBondContact OE1-NE 2.98Å; E42-R67 IonicContact OE1-NH2 2.91Å; E42-R67 PolarHBondContact OE1-NH2 3.45Å; C65-R67 VanDerWaalsContact C-N 3.29Å; C65-R67 PolarHBondContact O-N 3.28Å; R67-F69 PolarHBondContact O-N 3.41Å; R67-D72 IonicContact CZ-OD1 3.82Å; R67-D72 IonicContact NE-OD1 3.9Å; R67-D72 IonicContact NH1-OD1 2.9Å; R67-R73 CarbonylContact C-O 3.59Å; R67-R73 VanDerWaalsContact CA-O 3.29Å; R67-R73 WeakPolarHBondContact CA-O 3.29Å
68	C	93.5	Very high	92.1	Very high	0 Å²	0	70 Å²	70	0%	0	33%	0.334	C	S	.	.			trans	-67.9	124.6	174.8	177.8	0	0	0	0	110.6	R70 C71 D72 R73 L75 L87 C89	C68-R70 PolarHBondContact O-N 3.5Å; C68-R70 PolarHBondContact SG-N 3.36Å; C68-R70 VanDerWaalsContact SG-N 3.45Å; C68-C71 PolarHBondContact O-N 3.11Å; C68-C71 VanDerWaalsContact SG-SG 3.68Å; C68-D72 WeakPolarHBondContact O-CA 3.36Å; C68-D72 PolarHBondContact O-N 3.18Å; C68-R73 PolarHBondContact N-O 3.47Å; C68-L75 HydrophobicContact CB-CD1 4.26Å; C68-L75 HydrophobicContact CB-CD2 4.19Å; C68-L75 HydrophobicContact CB-CG 4.38Å; C68-L87 CarbonylContact C-O 3.55Å; C68-L87 WeakPolarHBondContact CA-O 3.48Å; C68-C89 HydrophobicContact CB-CB 4.07Å; C68-C89 PolarHBondContact SG-N 2.68Å
69	F	91.3	Very high	92	Very high	138 Å²	138	67.2 Å²	67.2	61%	0.605	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-21.2	177.8	179.8	-103.4	0	0	0	114.5	R67 A86 L87 L88	R67-F69 PolarHBondContact O-N 3.41Å; F69-A86 HydrophobicContact CB-CB 4.38Å; F69-A86 HydrophobicContact CG-CB 4.41Å; F69-L87 PolarHBondContact N-O 2.98Å; F69-L88 HydrophobicContact CB-CD2 4.34Å
70	R	89.5	Confident	91.9	Very high	148 Å²	148	66.9 Å²	66.9	56%	0.558	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-35.2	-175.7	-66.7	-65	-167.4	152.2	9.6	114.5	C68 L88 C92 E96	C68-R70 PolarHBondContact O-N 3.5Å; C68-R70 PolarHBondContact SG-N 3.36Å; C68-R70 VanDerWaalsContact SG-N 3.45Å; R70-L88 HydrophobicContact CB-CD2 4.33Å; R70-L88 HydrophobicContact CG-CD2 3.48Å; R70-L88 VanDerWaalsContact CG-CD2 3.48Å; R70-C92 HydrophobicContact CB-CB 4.04Å; R70-C92 HydrophobicContact CG-CB 4.37Å; R70-E96 IonicContact NH2-OE2 3.91Å
71	C	92.4	Very high	91.6	Very high	59 Å²	59	66.4 Å²	66.4	40%	0.399	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	3.2	-172.1	70.8	0	0	0	0	113.9	C68 R73	C68-C71 PolarHBondContact O-N 3.11Å; C68-C71 VanDerWaalsContact SG-SG 3.68Å; C71-R73 PolarHBondContact O-N 3.48Å
72	D	91.6	Very high	91.3	Very high	106 Å²	106	67.7 Å²	67.7	57%	0.567	33%	0.334	S	S	*	.			trans	57.4	8.5	179.9	-66.9	-55.9	0	0	0	115.5	R67 C68 S74	R67-D72 IonicContact CZ-OD1 3.82Å; R67-D72 IonicContact NE-OD1 3.9Å; R67-D72 IonicContact NH1-OD1 2.9Å; C68-D72 WeakPolarHBondContact O-CA 3.36Å; C68-D72 PolarHBondContact O-N 3.18Å; D72-S74 PolarHBondContact O-N 3.27Å
73	R	92.2	Very high	90.9	Very high	127 Å²	127	69.6 Å²	69.6	48%	0.479	34%	0.344	S	S	.	.			trans	-63.9	133.5	174	-173.1	-173.8	-71.8	164.7	2.3	109.3	R67 C68 C71 D91	R67-R73 CarbonylContact C-O 3.59Å; R67-R73 VanDerWaalsContact CA-O 3.29Å; R67-R73 WeakPolarHBondContact CA-O 3.29Å; C68-R73 PolarHBondContact N-O 3.47Å; C71-R73 PolarHBondContact O-N 3.48Å; R73-D91 IonicContact CZ-OD2 3.84Å; R73-D91 IonicContact NH1-OD2 2.92Å; R73-D91 PolarHBondContact NH1-OD2 3.16Å; R73-D91 IonicContact NH2-OD2 3.7Å
74	S	93.6	Very high	90.6	Very high	58 Å²	58	73.3 Å²	73.3	41%	0.406	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-57.5	137.9	172.1	176.4	0	0	0	0	111.2	D72 A76	D72-S74 PolarHBondContact O-N 3.27Å; S74-A76 PolarHBondContact OG-N 2.83Å
75	L	93.8	Very high	90.4	Very high	2 Å²	2	71.9 Å²	71.9	1%	0.01	36%	0.363	C	S	.	.			trans	-109.4	4.6	177.7	-58.2	173.2	0	0	0	112.3	F66 C68 D77 E78 F80 L87 C89	F66-L75 HydrophobicContact CD1-CB 3.65Å; F66-L75 HydrophobicContact CE1-CB 3.72Å; F66-L75 PolarHBondContact O-N 2.84Å; C68-L75 HydrophobicContact CB-CD1 4.26Å; C68-L75 HydrophobicContact CB-CD2 4.19Å; C68-L75 HydrophobicContact CB-CG 4.38Å; L75-D77 PolarHBondContact O-N 2.98Å; L75-D77 VanDerWaalsContact O-N 3.15Å; L75-E78 PolarHBondContact O-N 3.13Å; L75-F80 HydrophobicContact CB-CB 4.33Å; L75-F80 HydrophobicContact CB-CD1 4.41Å; L75-F80 HydrophobicContact CD1-CB 3.87Å; L75-F80 HydrophobicContact CD1-CG 4.34Å; L75-F80 HydrophobicContact CD2-CB 3.97Å; L75-F80 HydrophobicContact CG-CB 4.27Å; L75-L87 HydrophobicContact CD1-CB 3.7Å; L75-C89 HydrophobicContact CD2-CB 3.66Å
76	A	90.2	Very high	90.1	Very high	18 Å²	18	72.9 Å²	72.9	15%	0.149	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-36.7	-171.6	0	0	0	0	0	113.7	L54 E63 S74	L54-A76 HydrophobicContact CD1-CB 3.57Å; E63-A76 HydrophobicContact CG-CB 4.11Å; S74-A76 PolarHBondContact OG-N 2.83Å
77	D	88	Confident	90	Very high	121 Å²	121	73.2 Å²	73.2	65%	0.647	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.5	14.2	-178	-55.2	-63.8	0	0	0	112	R52 L75	R52-D77 IonicContact CZ-OD1 3.92Å; R52-D77 IonicContact NH1-OD1 3.94Å; R52-D77 IonicContact NH1-OD2 2.78Å; R52-D77 PolarHBondContact NH1-OD2 3.36Å; R52-D77 IonicContact NH2-OD1 3.95Å; R52-D77 PolarHBondContact NH2-OD1 3.3Å; R52-D77 IonicContact NH2-OD2 3.8Å; L75-D77 PolarHBondContact O-N 2.98Å; L75-D77 VanDerWaalsContact O-N 3.15Å
78	E	87.8	Confident	89.8	Confident	111 Å²	111	69.5 Å²	69.5	52%	0.519	36%	0.36	S	S	.	.	S	Bend	trans	-116.5	146.5	-175.7	-75.4	-73.7	149.9	0	0	111.1	L75 F80	L75-E78 PolarHBondContact O-N 3.13Å; E78-F80 PolarHBondContact O-N 3.17Å
79	P	86.4	Confident	89.7	Confident	82 Å²	82	69.8 Å²	69.8	53%	0.532	36%	0.362	S	S	.	.			trans	-67.8	134.3	175.5	29.2	-34.3	0	0	0	111.2	N90	P79-N90 WeakPolarHBondContact CB-ND2 3.4Å; P79-N90 PolarHBondContact O-ND2 2.85Å
80	F	90.6	Very high	89.4	Confident	56 Å²	56	65.3 Å²	65.3	25%	0.246	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	169.3	-176	69.2	-88.8	0	0	0	111.7	Y56 F66 L75 E78 L87 L88	Y56-F80 HydrophobicContact CD1-CE2 4.19Å; Y56-F80 HydrophobicContact CD1-CZ 4.33Å; Y56-F80 HydrophobicContact CD2-CE2 4.18Å; Y56-F80 AromaticContact CD2-CZ 3.65Å; Y56-F80 HydrophobicContact CD2-CZ 3.65Å; Y56-F80 AromaticContact CE1-CE2 3.82Å; Y56-F80 HydrophobicContact CE1-CE2 3.82Å; Y56-F80 HydrophobicContact CE1-CZ 4.28Å; Y56-F80 AromaticContact CE2-CE2 3.81Å; Y56-F80 HydrophobicContact CE2-CE2 3.81Å; Y56-F80 AromaticContact CE2-CZ 3.59Å; Y56-F80 HydrophobicContact CE2-CZ 3.59Å; Y56-F80 HydrophobicContact CG-CE2 4.35Å; Y56-F80 HydrophobicContact CG-CZ 4.02Å; Y56-F80 AromaticContact CZ-CE2 3.61Å; Y56-F80 AromaticContact CZ-CZ 3.91Å; F66-F80 HydrophobicContact CE1-CD1 4.11Å; F66-F80 AromaticContact CE1-CE1 3.78Å; F66-F80 HydrophobicContact CE1-CE1 3.78Å; F66-F80 HydrophobicContact CE1-CZ 4.13Å; F66-F80 HydrophobicContact CZ-CD1 4.4Å; F66-F80 AromaticContact CZ-CE1 3.75Å; F66-F80 HydrophobicContact CZ-CE1 3.75Å; F66-F80 HydrophobicContact CZ-CE2 4.14Å; F66-F80 AromaticContact CZ-CZ 3.61Å; F66-F80 HydrophobicContact CZ-CZ 3.61Å; L75-F80 HydrophobicContact CB-CB 4.33Å; L75-F80 HydrophobicContact CB-CD1 4.41Å; L75-F80 HydrophobicContact CD1-CB 3.87Å; L75-F80 HydrophobicContact CD1-CG 4.34Å; L75-F80 HydrophobicContact CD2-CB 3.97Å; L75-F80 HydrophobicContact CG-CB 4.27Å; E78-F80 PolarHBondContact O-N 3.17Å; F80-L87 HydrophobicContact CD2-CD2 3.92Å; F80-L87 HydrophobicContact CE2-CD2 3.71Å; F80-L88 CarbonylContact C-O 3.52Å; F80-L88 WeakPolarHBondContact CA-O 3.38Å; F80-L88 WeakPolarHBondContact CB-O 3.4Å
81	T	88.7	Confident	89.1	Confident	34 Å²	34	62.8 Å²	62.8	21%	0.209	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	131.7	173.2	-60.5	0	0	0	0	108.9	L88 Y93	T81-L88 PolarHBondContact N-O 2.99Å; T81-L88 PolarHBondContact O-N 2.93Å; T81-Y93 HydrophobicContact CG2-CD1 4.31Å; T81-Y93 HydrophobicContact CG2-CD2 3.88Å; T81-Y93 HydrophobicContact CG2-CE1 4.23Å; T81-Y93 HydrophobicContact CG2-CE2 3.84Å; T81-Y93 HydrophobicContact CG2-CG 4.13Å
82	S	88.9	Confident	88.9	Confident	37 Å²	37	61.2 Å²	61.2	26%	0.259	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	127.6	165.7	63.6	0	0	0	0	109.2	Y56 A86	Y56-S82 WeakPolarHBondContact OH-CB 3.39Å; Y56-S82 PolarHBondContact OH-OG 2.87Å; S82-A86 WeakPolarHBondContact CA-O 3.45Å
83	Q	85.6	Confident	88.6	Confident	55 Å²	55	58.5 Å²	58.5	26%	0.257	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	120.8	175.4	-175	177.7	11	0	0	108.9	D85 A86 L88 Y93	Q83-D85 VanDerWaalsContact C-N 3.27Å; Q83-D85 PolarHBondContact O-N 3.23Å; Q83-A86 PolarHBondContact N-O 3.3Å; Q83-A86 WeakPolarHBondContact O-CB 3.37Å; Q83-A86 PolarHBondContact O-N 2.98Å; Q83-L88 HydrophobicContact CB-CD1 4.43Å; Q83-Y93 VanDerWaalsContact OE1-CE2 3.31Å
84	D	85.4	Confident	87.9	Confident	150 Å²	150	52.6 Å²	52.6	80%	0.802	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	48.9	-177.6	-56.9	-49.3	0	0	0	112.1	A86	D84-A86 PolarHBondContact O-N 2.93Å; D84-A86 VanDerWaalsContact O-N 3.08Å
85	D	85.1	Confident	87.2	Confident	104 Å²	104	54.7 Å²	54.7	56%	0.556	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	-2.8	-176.4	-64.1	-48.8	0	0	0	116.6	R59 Q83	R59-D85 IonicContact CZ-OD1 2.78Å; R59-D85 IonicContact NH1-OD1 3.4Å; R59-D85 PolarHBondContact NH1-OD1 2.9Å; R59-D85 IonicContact NH2-OD1 3.67Å; R59-D85 PolarHBondContact NH2-OD1 2.89Å; R59-D85 IonicContact NH2-OD2 3.47Å; Q83-D85 VanDerWaalsContact C-N 3.27Å; Q83-D85 PolarHBondContact O-N 3.23Å
86	A	88.9	Confident	86.3	Confident	27 Å²	27	59.8 Å²	59.8	22%	0.223	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	131.7	175.8	0	0	0	0	0	111.8	F69 S82 Q83 D84	F69-A86 HydrophobicContact CB-CB 4.38Å; F69-A86 HydrophobicContact CG-CB 4.41Å; S82-A86 WeakPolarHBondContact CA-O 3.45Å; Q83-A86 PolarHBondContact N-O 3.3Å; Q83-A86 WeakPolarHBondContact O-CB 3.37Å; Q83-A86 PolarHBondContact O-N 2.98Å; D84-A86 PolarHBondContact O-N 2.93Å; D84-A86 VanDerWaalsContact O-N 3.08Å
87	L	91.6	Very high	85.4	Confident	16 Å²	16	63.7 Å²	63.7	8%	0.084	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	118.8	173.8	-58.5	174.7	0	0	0	110	Y56 Y61 F66 C68 F69 L75 F80	Y56-L87 HydrophobicContact CD1-CD2 4Å; Y56-L87 HydrophobicContact CE1-CD2 3.95Å; Y61-L87 HydrophobicContact CE1-CD1 4.39Å; F66-L87 HydrophobicContact CD2-CD1 3.66Å; F66-L87 HydrophobicContact CE2-CD1 3.45Å; F66-L87 VanDerWaalsContact CE2-CD1 3.45Å; F66-L87 HydrophobicContact CE2-CD2 4.46Å; F66-L87 HydrophobicContact CG-CD1 4.34Å; F66-L87 HydrophobicContact CZ-CD1 3.94Å; F66-L87 HydrophobicContact CZ-CD2 4.46Å; C68-L87 CarbonylContact C-O 3.55Å; C68-L87 WeakPolarHBondContact CA-O 3.48Å; F69-L87 PolarHBondContact N-O 2.98Å; L75-L87 HydrophobicContact CD1-CB 3.7Å; F80-L87 HydrophobicContact CD2-CD2 3.92Å; F80-L87 HydrophobicContact CE2-CD2 3.71Å
88	L	91.4	Very high	84.7	Confident	10 Å²	10	59 Å²	59	5%	0.052	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.7	179.6	-64.8	173.1	0	0	0	110.5	F69 R70 F80 T81 Q83 Y93 F97	F69-L88 HydrophobicContact CB-CD2 4.34Å; R70-L88 HydrophobicContact CB-CD2 4.33Å; R70-L88 HydrophobicContact CG-CD2 3.48Å; R70-L88 VanDerWaalsContact CG-CD2 3.48Å; F80-L88 CarbonylContact C-O 3.52Å; F80-L88 WeakPolarHBondContact CA-O 3.38Å; F80-L88 WeakPolarHBondContact CB-O 3.4Å; T81-L88 PolarHBondContact N-O 2.99Å; T81-L88 PolarHBondContact O-N 2.93Å; Q83-L88 HydrophobicContact CB-CD1 4.43Å; L88-Y93 HydrophobicContact CD1-CD2 4.21Å; L88-F97 HydrophobicContact CD1-CE2 4.2Å
89	C	90.8	Very high	84.4	Confident	6 Å²	6	55.9 Å²	55.9	4%	0.041	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	153.6	165.9	73.1	0	0	0	0	109.5	C68 L75 D91 C92 Y93	C68-C89 HydrophobicContact CB-CB 4.07Å; C68-C89 PolarHBondContact SG-N 2.68Å; L75-C89 HydrophobicContact CD2-CB 3.66Å; C89-D91 PolarHBondContact O-N 3.3Å; C89-C92 PolarHBondContact O-N 3.31Å; C89-C92 VanDerWaalsContact O-N 3.11Å; C89-C92 PolarHBondContact SG-N 2.94Å; C89-C92 VanDerWaalsContact SG-N 3.36Å; C89-C92 PolarHBondContact SG-SG 3.23Å; C89-Y93 PolarHBondContact O-N 2.9Å
90	N	84.4	Confident	84.5	Confident	44 Å²	44	58 Å²	58	24%	0.235	30%	0.304	C	S	.	.	H	α-helix	trans	-53.2	-39.4	178.1	-84.8	-36.8	0	0	0	112.5	P79 C92 Y93 C94	P79-N90 WeakPolarHBondContact CB-ND2 3.4Å; P79-N90 PolarHBondContact O-ND2 2.85Å; N90-C92 PolarHBondContact O-N 3.02Å; N90-Y93 PolarHBondContact O-N 2.88Å; N90-C94 WeakPolarHBondContact O-CB 3.44Å; N90-C94 PolarHBondContact O-N 3.44Å; N90-C94 PolarHBondContact O-SG 3.09Å
91	D	83.9	Confident	84.5	Confident	96 Å²	96	55.4 Å²	55.4	51%	0.513	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-47.5	178.6	-61.6	-31.9	0	0	0	112.2	R73 C89 C94 N95	R73-D91 IonicContact CZ-OD2 3.84Å; R73-D91 IonicContact NH1-OD2 2.92Å; R73-D91 PolarHBondContact NH1-OD2 3.16Å; R73-D91 IonicContact NH2-OD2 3.7Å; C89-D91 PolarHBondContact O-N 3.3Å; D91-C94 PolarHBondContact O-N 3.49Å; D91-N95 WeakPolarHBondContact O-CB 3.26Å; D91-N95 PolarHBondContact O-N 2.76Å
92	C	87.5	Confident	84.6	Confident	25 Å²	25	57.7 Å²	57.7	17%	0.169	31%	0.306	C	S	.	.	H	α-helix	trans	-71.3	-41.8	-178.6	-71.2	0	0	0	0	111.8	R70 C89 N90 C94 N95 E96	R70-C92 HydrophobicContact CB-CB 4.04Å; R70-C92 HydrophobicContact CG-CB 4.37Å; C89-C92 PolarHBondContact O-N 3.31Å; C89-C92 VanDerWaalsContact O-N 3.11Å; C89-C92 PolarHBondContact SG-N 2.94Å; C89-C92 VanDerWaalsContact SG-N 3.36Å; C89-C92 PolarHBondContact SG-SG 3.23Å; N90-C92 PolarHBondContact O-N 3.02Å; C92-C94 VanDerWaalsContact C-N 3.32Å; C92-N95 PolarHBondContact O-N 3.06Å; C92-E96 PolarHBondContact O-N 3.4Å
93	Y	85.5	Confident	84.7	Confident	49 Å²	49	58.8 Å²	58.8	19%	0.192	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-45.9	174.1	178.5	-107.6	0	0	0	111	T81 Q83 L88 C89 N90 N95 E96 F97 P110	T81-Y93 HydrophobicContact CG2-CD1 4.31Å; T81-Y93 HydrophobicContact CG2-CD2 3.88Å; T81-Y93 HydrophobicContact CG2-CE1 4.23Å; T81-Y93 HydrophobicContact CG2-CE2 3.84Å; T81-Y93 HydrophobicContact CG2-CG 4.13Å; Q83-Y93 VanDerWaalsContact OE1-CE2 3.31Å; L88-Y93 HydrophobicContact CD1-CD2 4.21Å; C89-Y93 PolarHBondContact O-N 2.9Å; N90-Y93 PolarHBondContact O-N 2.88Å; Y93-N95 PolarHBondContact O-N 2.83Å; Y93-E96 PolarHBondContact O-N 3.47Å; Y93-F97 AromaticContact CD2-CD2 3.58Å; Y93-F97 HydrophobicContact CD2-CD2 3.58Å; Y93-F97 HydrophobicContact CD2-CE2 4.17Å; Y93-F97 HydrophobicContact CD2-CG 4.48Å; Y93-F97 HydrophobicContact CE2-CB 4.4Å; Y93-F97 AromaticContact CE2-CD2 3.82Å; Y93-F97 HydrophobicContact CE2-CD2 3.82Å; Y93-F97 HydrophobicContact CE2-CG 4.34Å; Y93-F97 HydrophobicContact CG-CD2 4.34Å; Y93-F97 WeakPolarHBondContact O-CB 3.43Å; Y93-F97 VanDerWaalsContact O-CD2 3.28Å; Y93-F97 WeakPolarHBondContact O-CD2 3.47Å; Y93-F97 PolarHBondContact O-N 3.15Å; Y93-P110 HydrophobicContact CE1-CB 4.22Å; Y93-P110 HydrophobicContact CE1-CG 3.71Å
94	C	78.8	Confident	85	Confident	4 Å²	4	58.3 Å²	58.3	3%	0.027	32%	0.32	C	S	.	.	H	α-helix	trans	-63.5	-41.6	179	-76.6	0	0	0	0	112.7	N90 D91 C92 E96 S98 I107 M109	N90-C94 WeakPolarHBondContact O-CB 3.44Å; N90-C94 PolarHBondContact O-N 3.44Å; N90-C94 PolarHBondContact O-SG 3.09Å; D91-C94 PolarHBondContact O-N 3.49Å; C92-C94 VanDerWaalsContact C-N 3.32Å; C94-E96 VanDerWaalsContact C-N 3.35Å; C94-E96 PolarHBondContact O-N 3.32Å; C94-S98 WeakPolarHBondContact CA-OG 3.41Å; C94-S98 WeakPolarHBondContact O-CB 3.2Å; C94-S98 PolarHBondContact O-N 3.47Å; C94-S98 VanDerWaalsContact O-N 3.09Å; C94-S98 PolarHBondContact O-OG 2.78Å; C94-I107 HydrophobicContact CB-CB 4.42Å; C94-I107 HydrophobicContact CB-CD1 3.51Å; C94-I107 HydrophobicContact CB-CG2 3.83Å; C94-M109 PolarHBondContact SG-SD 3.49Å
95	N	78.4	Confident	85.1	Confident	102 Å²	102	57.3 Å²	57.3	55%	0.545	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-36.8	-179.5	-173.7	66.5	0	0	0	113.3	D91 C92 Y93	D91-N95 WeakPolarHBondContact O-CB 3.26Å; D91-N95 PolarHBondContact O-N 2.76Å; C92-N95 PolarHBondContact O-N 3.06Å; Y93-N95 PolarHBondContact O-N 2.83Å
96	E	74.1	Confident	85.2	Confident	108 Å²	108	59.4 Å²	59.4	51%	0.505	32%	0.319	S	S	.	.	H	α-helix	trans	-84.2	-35.5	-177.6	-71.1	-71.9	111	0	0	112.7	R70 C92 Y93 C94	R70-E96 IonicContact NH2-OE2 3.91Å; C92-E96 PolarHBondContact O-N 3.4Å; Y93-E96 PolarHBondContact O-N 3.47Å; C94-E96 VanDerWaalsContact C-N 3.35Å; C94-E96 PolarHBondContact O-N 3.32Å
97	F	72	Confident	85	Confident	101 Å²	101	60.3 Å²	60.3	44%	0.443	32%	0.319	S	S	.	.	H	α-helix	trans	-120.2	-4	-163.5	-55.7	-68.9	0	0	0	115.1	L88 Y93	L88-F97 HydrophobicContact CD1-CE2 4.2Å; Y93-F97 AromaticContact CD2-CD2 3.58Å; Y93-F97 HydrophobicContact CD2-CD2 3.58Å; Y93-F97 HydrophobicContact CD2-CE2 4.17Å; Y93-F97 HydrophobicContact CD2-CG 4.48Å; Y93-F97 HydrophobicContact CE2-CB 4.4Å; Y93-F97 AromaticContact CE2-CD2 3.82Å; Y93-F97 HydrophobicContact CE2-CD2 3.82Å; Y93-F97 HydrophobicContact CE2-CG 4.34Å; Y93-F97 HydrophobicContact CG-CD2 4.34Å; Y93-F97 WeakPolarHBondContact O-CB 3.43Å; Y93-F97 VanDerWaalsContact O-CD2 3.28Å; Y93-F97 WeakPolarHBondContact O-CD2 3.47Å; Y93-F97 PolarHBondContact O-N 3.15Å
98	S	73.8	Confident	84.7	Confident	21 Å²	21	59.9 Å²	59.9	15%	0.147	32%	0.317	C	S	.	.			trans	-112.4	142.3	-171.8	-54.3	0	0	0	0	114.2	C94 P110	C94-S98 WeakPolarHBondContact CA-OG 3.41Å; C94-S98 WeakPolarHBondContact O-CB 3.2Å; C94-S98 PolarHBondContact O-N 3.47Å; C94-S98 VanDerWaalsContact O-N 3.09Å; C94-S98 PolarHBondContact O-OG 2.78Å; S98-P110 VanDerWaalsContact OG-CD 3.26Å; S98-P110 WeakPolarHBondContact OG-CD 3.01Å; S98-P110 WeakPolarHBondContact OG-CG 3.16Å
99	S	80.5	Confident	84.2	Confident	46 Å²	46	63.3 Å²	63.3	32%	0.322	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-70.1	138.9	175.1	-48.1	0	0	0	0	110.8	V108	S99-V108 WeakPolarHBondContact O-CB 3.25Å; S99-V108 PolarHBondContact O-N 2.92Å
100	K	88.2	Confident	83.3	Confident	127 Å²	127	66 Å²	66	55%	0.552	35%	0.351	S	S	*	.	B	Isolated β-bridge	trans	-86.4	140.9	173.3	-65.6	-178.2	-178.5	179.2	0	110.4	V102	K100-V102 PolarHBondContact O-N 3.01Å
101	C	90.6	Very high	82.8	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.007	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-73.6	124	173.2	175.7	0	0	0	0	110	A103 C104 D105 K106 V108 T121 H123	C101-A103 PolarHBondContact O-N 2.94Å; C101-A103 PolarHBondContact SG-N 3.23Å; C101-C104 PolarHBondContact O-N 2.84Å; C101-D105 VanDerWaalsContact O-CA 3.25Å; C101-D105 WeakPolarHBondContact O-CA 3.25Å; C101-D105 PolarHBondContact O-N 3.09Å; C101-K106 WeakPolarHBondContact CB-O 3.31Å; C101-K106 PolarHBondContact N-O 2.84Å; C101-V108 HydrophobicContact CB-CG2 3.8Å; C101-T121 VanDerWaalsContact CA-O 3.28Å; C101-T121 WeakPolarHBondContact CA-O 3.42Å; C101-H123 VanDerWaalsContact CB-CE1 3.42Å; C101-H123 WeakPolarHBondContact CB-CE1 3.28Å; C101-H123 VanDerWaalsContact CB-ND1 3.31Å; C101-H123 WeakPolarHBondContact CB-ND1 3.44Å
102	V	91	Very high	82.6	Confident	83 Å²	83	67 Å²	67	50%	0.503	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.2	-179.3	177.8	0	0	0	0	113	K100 T121 W122	K100-V102 PolarHBondContact O-N 3.01Å; V102-T121 PolarHBondContact N-O 3.48Å; V102-W122 HydrophobicContact CB-CZ2 4.46Å
103	A	90.5	Very high	82.4	Confident	60 Å²	60	73.4 Å²	73.4	50%	0.496	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-25.9	-176.8	0	0	0	0	0	114.4	C101 C126	C101-A103 PolarHBondContact O-N 2.94Å; C101-A103 PolarHBondContact SG-N 3.23Å; A103-C126 HydrophobicContact CB-CB 3.95Å
104	C	91.8	Very high	82.5	Confident	45 Å²	45	75.5 Å²	75.5	30%	0.304	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	1	-177	72.7	0	0	0	0	114.8	C101 K106 H123	C101-C104 PolarHBondContact O-N 2.84Å; C104-K106 PolarHBondContact O-N 3.28Å; C104-H123 VanDerWaalsContact SG-CE1 3.51Å; C104-H123 PolarHBondContact SG-ND1 2.97Å; C104-H123 VanDerWaalsContact SG-ND1 3.42Å
105	D	88	Confident	83	Confident	129 Å²	129	76.5 Å²	76.5	69%	0.69	42%	0.417	S	S	*	.			trans	57.9	5.2	-177.4	-66.9	-47.7	0	0	0	115.9	C101	C101-D105 VanDerWaalsContact O-CA 3.25Å; C101-D105 WeakPolarHBondContact O-CA 3.25Å; C101-D105 PolarHBondContact O-N 3.09Å
106	K	87.3	Confident	83.5	Confident	148 Å²	148	77.6 Å²	77.6	64%	0.643	42%	0.418	S	S	*	.			trans	-84.3	156.2	175.6	-61.6	178.9	-175.5	179.1	0	111.2	C101 C104	C101-K106 WeakPolarHBondContact CB-O 3.31Å; C101-K106 PolarHBondContact N-O 2.84Å; C104-K106 PolarHBondContact O-N 3.28Å
107	I	84.3	Confident	84.2	Confident	46 Å²	46	76.4 Å²	76.4	24%	0.236	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-69.1	137.6	-179.8	-58.8	175.8	0	0	0	110.6	C94 H123	C94-I107 HydrophobicContact CB-CB 4.42Å; C94-I107 HydrophobicContact CB-CD1 3.51Å; C94-I107 HydrophobicContact CB-CG2 3.83Å; I107-H123 PolarHBondContact O-NE2 2.93Å
108	V	86.2	Confident	85	Confident	6 Å²	6	75.7 Å²	75.7	4%	0.036	42%	0.423	C	S	.	.			trans	-91.5	104.3	170.4	-175	0	0	0	0	107.6	S99 C101 K114 T121	S99-V108 WeakPolarHBondContact O-CB 3.25Å; S99-V108 PolarHBondContact O-N 2.92Å; C101-V108 HydrophobicContact CB-CG2 3.8Å; V108-K114 HydrophobicContact CG1-CB 3.57Å; V108-K114 HydrophobicContact CG1-CD 4.35Å; V108-T121 HydrophobicContact CB-CG2 4.39Å; V108-T121 HydrophobicContact CG1-CG2 4.42Å; V108-T121 HydrophobicContact CG2-CG2 4.07Å
109	M	79.6	Confident	85.5	Confident	83 Å²	83	78.9 Å²	78.9	41%	0.409	46%	0.458	S	S	.	.			trans	-57.3	134.1	-173	-61.6	-68.6	-93.4	0	0	111.2	C94 T112	C94-M109 PolarHBondContact SG-SD 3.49Å; M109-T112 HydrophobicContact CB-CG2 3.72Å; M109-T112 WeakPolarHBondContact O-CB 3.36Å; M109-T112 PolarHBondContact O-N 3.12Å; M109-T112 PolarHBondContact O-OG1 2.9Å
110	P	73.3	Confident	85.9	Confident	61 Å²	61	78.6 Å²	78.6	40%	0.396	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	143.1	174	-28.5	39.8	0	0	0	111.6	Y93 S98 T112	Y93-P110 HydrophobicContact CE1-CB 4.22Å; Y93-P110 HydrophobicContact CE1-CG 3.71Å; S98-P110 VanDerWaalsContact OG-CD 3.26Å; S98-P110 WeakPolarHBondContact OG-CD 3.01Å; S98-P110 WeakPolarHBondContact OG-CG 3.16Å; P110-T112 PolarHBondContact O-N 2.97Å
111	G	73.7	Confident	86	Confident	92 Å²	92	73.1 Å²	73.1	95%	0.948	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	-8	-176.5	0	0	0	0	0	115.6
112	T	80.1	Confident	86.1	Confident	70 Å²	70	74.1 Å²	74.1	43%	0.429	44%	0.438	S	S	.	.	S	Bend	trans	-85.5	155.4	172.1	68.1	0	0	0	0	112.1	M109 P110 K114	M109-T112 HydrophobicContact CB-CG2 3.72Å; M109-T112 WeakPolarHBondContact O-CB 3.36Å; M109-T112 PolarHBondContact O-N 3.12Å; M109-T112 PolarHBondContact O-OG1 2.9Å; P110-T112 PolarHBondContact O-N 2.97Å; T112-K114 PolarHBondContact O-N 3.39Å
113	R	82.9	Confident	86.1	Confident	160 Å²	160	72.3 Å²	72.3	60%	0.604	42%	0.424	S	S	*	.			trans	-66.9	120.1	176.2	-67.3	179.4	74.7	-141.8	-2.5	109.3	E124 S138	R113-E124 IonicContact CZ-OE1 2.88Å; R113-E124 VanDerWaalsContact CZ-OE1 3.23Å; R113-E124 IonicContact CZ-OE2 3.52Å; R113-E124 IonicContact NE-OE2 3.51Å; R113-E124 IonicContact NH1-OE1 3.37Å; R113-E124 PolarHBondContact NH1-OE1 3.23Å; R113-E124 IonicContact NH1-OE2 3.39Å; R113-E124 PolarHBondContact NH1-OE2 3.39Å; R113-E124 IonicContact NH2-OE1 3.79Å; R113-E124 PolarHBondContact NH2-OE1 3.48Å; R113-S138 PolarHBondContact NH2-OG 2.78Å
114	K	87.6	Confident	86	Confident	93 Å²	93	72.5 Å²	72.5	40%	0.404	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	158.8	177.6	65.2	173.5	175.4	161	0	110.8	V108 T112 E116 T121	V108-K114 HydrophobicContact CG1-CB 3.57Å; V108-K114 HydrophobicContact CG1-CD 4.35Å; T112-K114 PolarHBondContact O-N 3.39Å; K114-E116 HydrophobicContact CD-CG 4.23Å; K114-E116 VanDerWaalsContact CE-CD 3.49Å; K114-E116 VanDerWaalsContact CE-OE2 3.27Å; K114-E116 WeakPolarHBondContact CE-OE2 3.14Å; K114-E116 VanDerWaalsContact NZ-CD 3.27Å; K114-E116 IonicContact NZ-OE1 3.48Å; K114-E116 PolarHBondContact NZ-OE1 3.17Å; K114-E116 IonicContact NZ-OE2 2.99Å; K114-E116 PolarHBondContact NZ-OE2 2.65Å; K114-T121 HydrophobicContact CB-CG2 4.17Å; K114-T121 HydrophobicContact CD-CG2 3.8Å; K114-T121 HydrophobicContact CG-CG2 4.46Å
115	L	89.6	Confident	85.9	Confident	25 Å²	25	72.5 Å²	72.5	13%	0.131	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	134.8	169.3	-170.6	131.8	0	0	0	109.6	T121 W122 F127 G137	L115-T121 WeakPolarHBondContact O-CA 3.27Å; L115-W122 HydrophobicContact CD2-CE3 3.93Å; L115-W122 HydrophobicContact CD2-CZ3 4.34Å; L115-W122 PolarHBondContact N-O 3.42Å; L115-W122 PolarHBondContact O-N 3.46Å; L115-F127 HydrophobicContact CD1-CD1 4.01Å; L115-F127 HydrophobicContact CD1-CE1 4.4Å; L115-F127 HydrophobicContact CD1-CG 4.43Å; L115-F127 HydrophobicContact CD2-CB 4.36Å; L115-F127 HydrophobicContact CD2-CD1 3.84Å; L115-F127 HydrophobicContact CD2-CD2 3.71Å; L115-F127 HydrophobicContact CD2-CE1 3.96Å; L115-F127 HydrophobicContact CD2-CE2 3.83Å; L115-F127 HydrophobicContact CD2-CG 3.71Å; L115-F127 HydrophobicContact CD2-CZ 3.95Å; L115-G137 WeakPolarHBondContact CD1-O 3.4Å
116	E	89.6	Confident	86.2	Confident	124 Å²	124	68.2 Å²	68.2	58%	0.579	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.7	177.9	-69.3	174.6	121.2	0	0	108.8	K114 S120 T121	K114-E116 HydrophobicContact CD-CG 4.23Å; K114-E116 VanDerWaalsContact CE-CD 3.49Å; K114-E116 VanDerWaalsContact CE-OE2 3.27Å; K114-E116 WeakPolarHBondContact CE-OE2 3.14Å; K114-E116 VanDerWaalsContact NZ-CD 3.27Å; K114-E116 IonicContact NZ-OE1 3.48Å; K114-E116 PolarHBondContact NZ-OE1 3.17Å; K114-E116 IonicContact NZ-OE2 2.99Å; K114-E116 PolarHBondContact NZ-OE2 2.65Å; E116-S120 WeakPolarHBondContact CA-O 3.46Å; E116-T121 HydrophobicContact CG-CG2 4.19Å
117	Y	88.3	Confident	86.5	Confident	84 Å²	84	61.2 Å²	61.2	33%	0.329	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	135.3	-178.9	178	-109.8	0	0	0	109.5	G119 S120 W122 F141 P143 H148	Y117-G119 PolarHBondContact O-N 3.24Å; Y117-G119 VanDerWaalsContact O-N 3.09Å; Y117-S120 PolarHBondContact N-O 3.22Å; Y117-S120 VanDerWaalsContact N-O 3.12Å; Y117-S120 PolarHBondContact O-N 3.43Å; Y117-W122 HydrophobicContact CD1-CH2 4.41Å; Y117-W122 WeakPolarHBondContact O-CH2 3.39Å; Y117-W122 VanDerWaalsContact O-CZ3 3.25Å; Y117-W122 WeakPolarHBondContact O-CZ3 3.36Å; Y117-F141 HydrophobicContact CD1-CE2 4.28Å; Y117-F141 HydrophobicContact CD1-CZ 4.14Å; Y117-F141 HydrophobicContact CD2-CE2 4.35Å; Y117-F141 AromaticContact CD2-CZ 3.64Å; Y117-F141 HydrophobicContact CD2-CZ 3.64Å; Y117-F141 HydrophobicContact CE1-CE2 4.11Å; Y117-F141 HydrophobicContact CE1-CZ 4.3Å; Y117-F141 HydrophobicContact CE2-CE2 4.17Å; Y117-F141 AromaticContact CE2-CZ 3.82Å; Y117-F141 HydrophobicContact CE2-CZ 3.82Å; Y117-F141 HydrophobicContact CG-CE2 4.4Å; Y117-F141 AromaticContact CG-CZ 3.81Å; Y117-F141 HydrophobicContact CG-CZ 3.81Å; Y117-P143 HydrophobicContact CE1-CB 4.39Å; Y117-P143 WeakPolarHBondContact OH-CB 3.33Å; Y117-P143 WeakPolarHBondContact OH-CG 3.49Å; Y117-H148 AromaticContact CD1-NE2 3.96Å; Y117-H148 AromaticContact CE1-NE2 3.98Å
118	A	87.3	Confident	86.9	Confident	86 Å²	86	62.6 Å²	62.6	71%	0.711	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	37.5	-179.4	0	0	0	0	0	114.7	S120	A118-S120 PolarHBondContact O-N 3Å
119	G	85.6	Confident	87.4	Confident	87 Å²	87	62.3 Å²	62.3	90%	0.897	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	3	-179.9	0	0	0	0	0	115.3	Y117	Y117-G119 PolarHBondContact O-N 3.24Å; Y117-G119 VanDerWaalsContact O-N 3.09Å
120	S	89.5	Confident	88	Confident	40 Å²	40	63.3 Å²	63.3	28%	0.28	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	157.9	176.5	-72.3	0	0	0	0	111.2	E116 Y117 A118 W122	E116-S120 WeakPolarHBondContact CA-O 3.46Å; Y117-S120 PolarHBondContact N-O 3.22Å; Y117-S120 VanDerWaalsContact N-O 3.12Å; Y117-S120 PolarHBondContact O-N 3.43Å; A118-S120 PolarHBondContact O-N 3Å; S120-W122 VanDerWaalsContact CB-CZ3 3.43Å; S120-W122 WeakPolarHBondContact O-CZ3 3.46Å
121	T	90.5	Very high	89	Confident	13 Å²	13	63.4 Å²	63.4	8%	0.08	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	142.1	-179.6	-48.2	0	0	0	0	111	C101 V102 V108 K114 L115 E116	C101-T121 VanDerWaalsContact CA-O 3.28Å; C101-T121 WeakPolarHBondContact CA-O 3.42Å; V102-T121 PolarHBondContact N-O 3.48Å; V108-T121 HydrophobicContact CB-CG2 4.39Å; V108-T121 HydrophobicContact CG1-CG2 4.42Å; V108-T121 HydrophobicContact CG2-CG2 4.07Å; K114-T121 HydrophobicContact CB-CG2 4.17Å; K114-T121 HydrophobicContact CD-CG2 3.8Å; K114-T121 HydrophobicContact CG-CG2 4.46Å; L115-T121 WeakPolarHBondContact O-CA 3.27Å; E116-T121 HydrophobicContact CG-CG2 4.19Å
122	W	91.8	Very high	90	Very high	22 Å²	22	61.4 Å²	61.4	8%	0.083	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151	175.6	-61.2	-101.4	0	0	0	111.8	V102 L115 Y117 S120 F127	V102-W122 HydrophobicContact CB-CZ2 4.46Å; L115-W122 HydrophobicContact CD2-CE3 3.93Å; L115-W122 HydrophobicContact CD2-CZ3 4.34Å; L115-W122 PolarHBondContact N-O 3.42Å; L115-W122 PolarHBondContact O-N 3.46Å; Y117-W122 HydrophobicContact CD1-CH2 4.41Å; Y117-W122 WeakPolarHBondContact O-CH2 3.39Å; Y117-W122 VanDerWaalsContact O-CZ3 3.25Å; Y117-W122 WeakPolarHBondContact O-CZ3 3.36Å; S120-W122 VanDerWaalsContact CB-CZ3 3.43Å; S120-W122 WeakPolarHBondContact O-CZ3 3.46Å; W122-F127 HydrophobicContact CB-CB 4.08Å; W122-F127 HydrophobicContact CB-CD2 4.37Å; W122-F127 AromaticContact CD2-CD2 3.77Å; W122-F127 HydrophobicContact CD2-CD2 3.77Å; W122-F127 HydrophobicContact CD2-CE2 4.25Å; W122-F127 HydrophobicContact CE3-CD2 4.15Å; W122-F127 HydrophobicContact CE3-CE2 4.36Å; W122-F127 HydrophobicContact CG-CB 4.38Å; W122-F127 AromaticContact CG-CD2 3.87Å; W122-F127 HydrophobicContact CG-CD2 3.87Å; W122-F127 HydrophobicContact CH2-CE2 4.37Å; W122-F127 HydrophobicContact CZ2-CE2 4.33Å; W122-F127 HydrophobicContact CZ3-CE2 4.43Å
123	H	90.8	Very high	90.7	Very high	45 Å²	45	65.1 Å²	65.1	21%	0.208	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	148.6	158.8	-55.8	104.3	0	0	0	109.6	C101 C104 I107 G125 C126 F127	C101-H123 VanDerWaalsContact CB-CE1 3.42Å; C101-H123 WeakPolarHBondContact CB-CE1 3.28Å; C101-H123 VanDerWaalsContact CB-ND1 3.31Å; C101-H123 WeakPolarHBondContact CB-ND1 3.44Å; C104-H123 VanDerWaalsContact SG-CE1 3.51Å; C104-H123 PolarHBondContact SG-ND1 2.97Å; C104-H123 VanDerWaalsContact SG-ND1 3.42Å; I107-H123 PolarHBondContact O-NE2 2.93Å; H123-G125 PolarHBondContact O-N 3.27Å; H123-G125 VanDerWaalsContact O-N 3.15Å; H123-C126 HydrophobicContact CB-CB 4.03Å; H123-C126 PolarHBondContact O-N 2.72Å; H123-F127 PolarHBondContact O-N 3.15Å
124	E	88.6	Confident	91.2	Very high	63 Å²	63	63.3 Å²	63.3	29%	0.294	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-34.7	178.6	-167.9	176.6	-176.2	0	0	112.5	R113	R113-E124 IonicContact CZ-OE1 2.88Å; R113-E124 VanDerWaalsContact CZ-OE1 3.23Å; R113-E124 IonicContact CZ-OE2 3.52Å; R113-E124 IonicContact NE-OE2 3.51Å; R113-E124 IonicContact NH1-OE1 3.37Å; R113-E124 PolarHBondContact NH1-OE1 3.23Å; R113-E124 IonicContact NH1-OE2 3.39Å; R113-E124 PolarHBondContact NH1-OE2 3.39Å; R113-E124 IonicContact NH2-OE1 3.79Å; R113-E124 PolarHBondContact NH2-OE1 3.48Å
125	G	90.6	Very high	91.5	Very high	46 Å²	46	61.9 Å²	61.9	47%	0.474	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-18.6	176.2	0	0	0	0	0	115.1	H123 I128	H123-G125 PolarHBondContact O-N 3.27Å; H123-G125 VanDerWaalsContact O-N 3.15Å; G125-I128 WeakPolarHBondContact O-CG2 3.37Å
126	C	92.6	Very high	91.7	Very high	38 Å²	38	60.9 Å²	60.9	26%	0.257	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	-14.5	-176.8	-68.2	0	0	0	0	113.1	A103 H123 I128	A103-C126 HydrophobicContact CB-CB 3.95Å; H123-C126 HydrophobicContact CB-CB 4.03Å; H123-C126 PolarHBondContact O-N 2.72Å; C126-I128 PolarHBondContact O-N 2.83Å
127	F	93.4	Very high	91.3	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.009	33%	0.334	C	S	.	.	S	Bend	trans	-84.2	87.9	172.4	-162.8	-107.3	0	0	0	110	L115 W122 H123 I136 F141 H148	L115-F127 HydrophobicContact CD1-CD1 4.01Å; L115-F127 HydrophobicContact CD1-CE1 4.4Å; L115-F127 HydrophobicContact CD1-CG 4.43Å; L115-F127 HydrophobicContact CD2-CB 4.36Å; L115-F127 HydrophobicContact CD2-CD1 3.84Å; L115-F127 HydrophobicContact CD2-CD2 3.71Å; L115-F127 HydrophobicContact CD2-CE1 3.96Å; L115-F127 HydrophobicContact CD2-CE2 3.83Å; L115-F127 HydrophobicContact CD2-CG 3.71Å; L115-F127 HydrophobicContact CD2-CZ 3.95Å; W122-F127 HydrophobicContact CB-CB 4.08Å; W122-F127 HydrophobicContact CB-CD2 4.37Å; W122-F127 AromaticContact CD2-CD2 3.77Å; W122-F127 HydrophobicContact CD2-CD2 3.77Å; W122-F127 HydrophobicContact CD2-CE2 4.25Å; W122-F127 HydrophobicContact CE3-CD2 4.15Å; W122-F127 HydrophobicContact CE3-CE2 4.36Å; W122-F127 HydrophobicContact CG-CB 4.38Å; W122-F127 AromaticContact CG-CD2 3.87Å; W122-F127 HydrophobicContact CG-CD2 3.87Å; W122-F127 HydrophobicContact CH2-CE2 4.37Å; W122-F127 HydrophobicContact CZ2-CE2 4.33Å; W122-F127 HydrophobicContact CZ3-CE2 4.43Å; H123-F127 PolarHBondContact O-N 3.15Å; F127-I136 HydrophobicContact CD1-CB 4.01Å; F127-I136 HydrophobicContact CD1-CD1 4.34Å; F127-I136 HydrophobicContact CD1-CG2 4.31Å; F127-I136 HydrophobicContact CE1-CB 4.48Å; F127-I136 HydrophobicContact CE1-CD1 4.21Å; F127-I136 HydrophobicContact CE1-CG2 4.42Å; F127-I136 PolarHBondContact O-N 2.9Å; F127-F141 AromaticContact CE1-CD1 3.84Å; F127-F141 HydrophobicContact CE1-CD1 3.84Å; F127-F141 HydrophobicContact CE1-CD2 4.14Å; F127-F141 AromaticContact CE1-CE1 3.98Å; F127-F141 HydrophobicContact CE1-CE1 3.98Å; F127-F141 HydrophobicContact CE1-CE2 4.26Å; F127-F141 AromaticContact CE1-CG 3.93Å; F127-F141 HydrophobicContact CE1-CG 3.93Å; F127-F141 HydrophobicContact CE1-CZ 4.18Å; F127-F141 HydrophobicContact CZ-CD1 4.4Å; F127-F141 HydrophobicContact CZ-CD2 4.11Å; F127-F141 HydrophobicContact CZ-CE1 4.19Å; F127-F141 AromaticContact CZ-CE2 3.89Å; F127-F141 HydrophobicContact CZ-CE2 3.89Å; F127-F141 HydrophobicContact CZ-CG 4.36Å; F127-F141 AromaticContact CZ-CZ 3.93Å; F127-F141 HydrophobicContact CZ-CZ 3.93Å; F127-H148 HydrophobicContact CE1-CB 4.41Å; F127-H148 HydrophobicContact CE2-CB 4.48Å; F127-H148 AromaticContact CE2-CD2 3.63Å; F127-H148 AromaticContact CE2-CE1 3.98Å; F127-H148 AromaticContact CE2-CG 3.77Å; F127-H148 AromaticContact CE2-ND1 3.99Å; F127-H148 AromaticContact CE2-NE2 3.74Å; F127-H148 HydrophobicContact CZ-CB 4Å; F127-H148 AromaticContact CZ-CD2 3.35Å; F127-H148 WeakPolarHBondContact CZ-CD2 3.37Å; F127-H148 AromaticContact CZ-CG 3.6Å; F127-H148 AromaticContact CZ-NE2 3.92Å
128	I	94.3	Very high	90.9	Very high	75 Å²	75	55.5 Å²	55.5	39%	0.385	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-105.1	153.2	-171.3	62.8	172.6	0	0	0	112.7	G125 C126 Q134 P135	G125-I128 WeakPolarHBondContact O-CG2 3.37Å; C126-I128 PolarHBondContact O-N 2.83Å; I128-Q134 WeakPolarHBondContact CA-O 3.33Å; I128-P135 HydrophobicContact CG2-CG 4.43Å
129	C	95.3	Very high	90.8	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	35%	0.346	C	S	.	.			trans	-73.1	127.5	171.2	176.3	0	0	0	0	110.3	S131 C132 E133 Q134 I136 H148 C150	C129-S131 PolarHBondContact O-N 2.88Å; C129-S131 PolarHBondContact SG-N 2.85Å; C129-S131 VanDerWaalsContact SG-N 3.42Å; C129-C132 WeakPolarHBondContact CB-SG 3.35Å; C129-C132 PolarHBondContact O-N 3.19Å; C129-C132 VanDerWaalsContact SG-SG 3.65Å; C129-E133 WeakPolarHBondContact O-CA 3.32Å; C129-E133 PolarHBondContact O-N 2.92Å; C129-Q134 PolarHBondContact N-O 3.33Å; C129-I136 HydrophobicContact CB-CD1 4.09Å; C129-I136 HydrophobicContact CB-CG1 4.02Å; C129-H148 CarbonylContact C-O 3.59Å; C129-H148 VanDerWaalsContact CA-O 3.32Å; C129-H148 WeakPolarHBondContact CA-O 3.5Å; C129-C150 HydrophobicContact CB-CB 4.17Å; C129-C150 PolarHBondContact SG-N 2.99Å; C129-C150 VanDerWaalsContact SG-SG 3.66Å
130	H	93.9	Very high	91.1	Very high	103 Å²	103	59.1 Å²	59.1	48%	0.477	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-31	176.9	-175.9	99.9	0	0	0	112.7	D147 H148 Y149	H130-D147 HydrophobicContact CB-CB 4.03Å; H130-D147 IonicContact CE1-OD1 3.23Å; H130-D147 PolarHBondContact CE1-OD1 2.94Å; H130-D147 IonicContact CE1-OD2 3.39Å; H130-D147 IonicContact CG-OD1 2.77Å; H130-D147 IonicContact CG-OD2 3.5Å; H130-D147 IonicContact ND1-OD1 3.21Å; H130-D147 PolarHBondContact ND1-OD1 2.82Å; H130-D147 IonicContact ND1-OD2 2.72Å; H130-D147 PolarHBondContact ND1-OD2 3.25Å; H130-D147 IonicContact NE2-OD2 3.84Å; H130-H148 PolarHBondContact N-O 2.94Å; H130-Y149 HydrophobicContact CB-CE1 4.13Å
131	S	93.5	Very high	91.2	Very high	64 Å²	64	59.6 Å²	59.6	45%	0.448	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-33.7	-175.6	-175.5	0	0	0	0	115.1	C129	C129-S131 PolarHBondContact O-N 2.88Å; C129-S131 PolarHBondContact SG-N 2.85Å; C129-S131 VanDerWaalsContact SG-N 3.42Å
132	C	94.7	Very high	91.3	Very high	49 Å²	49	61.1 Å²	61.1	33%	0.331	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-1.9	-175.2	67.9	0	0	0	0	113.7	C129 Q134	C129-C132 WeakPolarHBondContact CB-SG 3.35Å; C129-C132 PolarHBondContact O-N 3.19Å; C129-C132 VanDerWaalsContact SG-SG 3.65Å; C132-Q134 HydrophobicContact CB-CG 4.47Å; C132-Q134 PolarHBondContact O-N 3.48Å
133	E	94.1	Very high	91.3	Very high	148 Å²	148	62.9 Å²	62.9	69%	0.692	35%	0.354	S	S	*	.			trans	58.2	11.9	178.9	-55.8	-179.7	161.5	0	0	114.1	C129	C129-E133 WeakPolarHBondContact O-CA 3.32Å; C129-E133 PolarHBondContact O-N 2.92Å
134	Q	94.6	Very high	91.2	Very high	123 Å²	123	63.2 Å²	63.2	58%	0.575	36%	0.357	S	S	*	.			trans	-85.6	144	177.4	-63.3	-54.3	-62	0	0	111.1	I128 C129 C132 I136	I128-Q134 WeakPolarHBondContact CA-O 3.33Å; C129-Q134 PolarHBondContact N-O 3.33Å; C132-Q134 HydrophobicContact CB-CG 4.47Å; C132-Q134 PolarHBondContact O-N 3.48Å; Q134-I136 PolarHBondContact O-N 3.21Å
135	P	93.4	Very high	91.1	Very high	62 Å²	62	69.3 Å²	69.3	40%	0.403	38%	0.383	S	S	.	.	B	Isolated β-bridge	trans	-56.6	124.3	171.1	-24.5	33.9	0	0	0	111.7	I128	I128-P135 HydrophobicContact CG2-CG 4.43Å
136	I	93.1	Very high	90.8	Very high	5 Å²	5	74.2 Å²	74.2	3%	0.026	40%	0.398	C	S	.	.			trans	-76.6	-40	171	-62.6	175.3	0	0	0	108.9	F127 C129 Q134 S138 K139 F141 H148 C150	F127-I136 HydrophobicContact CD1-CB 4.01Å; F127-I136 HydrophobicContact CD1-CD1 4.34Å; F127-I136 HydrophobicContact CD1-CG2 4.31Å; F127-I136 HydrophobicContact CE1-CB 4.48Å; F127-I136 HydrophobicContact CE1-CD1 4.21Å; F127-I136 HydrophobicContact CE1-CG2 4.42Å; F127-I136 PolarHBondContact O-N 2.9Å; C129-I136 HydrophobicContact CB-CD1 4.09Å; C129-I136 HydrophobicContact CB-CG1 4.02Å; Q134-I136 PolarHBondContact O-N 3.21Å; I136-S138 PolarHBondContact O-N 2.88Å; I136-K139 HydrophobicContact CG2-CB 4.21Å; I136-K139 WeakPolarHBondContact CG2-O 3.46Å; I136-K139 VanDerWaalsContact O-CB 3.29Å; I136-K139 WeakPolarHBondContact O-CB 3.44Å; I136-K139 VanDerWaalsContact O-CG 3.31Å; I136-K139 WeakPolarHBondContact O-CG 3.06Å; I136-K139 PolarHBondContact O-N 3.41Å; I136-F141 HydrophobicContact CD1-CB 3.94Å; I136-F141 HydrophobicContact CG2-CB 3.88Å; I136-H148 HydrophobicContact CD1-CB 4.24Å; I136-C150 HydrophobicContact CG1-CB 4.24Å
137	G	82	Confident	90.7	Very high	6 Å²	6	75 Å²	75	6%	0.062	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	-133.3	-175.8	0	0	0	0	0	111.3	L115 K139	L115-G137 WeakPolarHBondContact CD1-O 3.4Å; G137-K139 VanDerWaalsContact C-N 3.26Å; G137-K139 PolarHBondContact O-N 2.77Å
138	S	79	Confident	90.7	Very high	89 Å²	89	76.7 Å²	76.7	62%	0.622	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	11.7	178.9	64.8	0	0	0	0	115	R113 I136	R113-S138 PolarHBondContact NH2-OG 2.78Å; I136-S138 PolarHBondContact O-N 2.88Å
139	K	86.5	Confident	90.7	Very high	151 Å²	151	73.3 Å²	73.3	66%	0.657	39%	0.39	S	S	*	.	S	Bend	trans	-78.1	157.8	178.1	-61.6	172.1	-173.9	166.7	0	110.5	I136 G137	I136-K139 HydrophobicContact CG2-CB 4.21Å; I136-K139 WeakPolarHBondContact CG2-O 3.46Å; I136-K139 VanDerWaalsContact O-CB 3.29Å; I136-K139 WeakPolarHBondContact O-CB 3.44Å; I136-K139 VanDerWaalsContact O-CG 3.31Å; I136-K139 WeakPolarHBondContact O-CG 3.06Å; I136-K139 PolarHBondContact O-N 3.41Å; G137-K139 VanDerWaalsContact C-N 3.26Å; G137-K139 PolarHBondContact O-N 2.77Å
140	S	90.1	Very high	90.6	Very high	98 Å²	98	74.5 Å²	74.5	69%	0.685	40%	0.398	S	S	*	.			trans	-58.3	140.2	170.9	-55.4	0	0	0	0	111.3
141	F	93.2	Very high	90.5	Very high	50 Å²	50	71.7 Å²	71.7	22%	0.219	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	166.6	177.5	68.9	-85.3	0	0	0	110.7	Y117 F127 I136 P143 Y149	Y117-F141 HydrophobicContact CD1-CE2 4.28Å; Y117-F141 HydrophobicContact CD1-CZ 4.14Å; Y117-F141 HydrophobicContact CD2-CE2 4.35Å; Y117-F141 AromaticContact CD2-CZ 3.64Å; Y117-F141 HydrophobicContact CD2-CZ 3.64Å; Y117-F141 HydrophobicContact CE1-CE2 4.11Å; Y117-F141 HydrophobicContact CE1-CZ 4.3Å; Y117-F141 HydrophobicContact CE2-CE2 4.17Å; Y117-F141 AromaticContact CE2-CZ 3.82Å; Y117-F141 HydrophobicContact CE2-CZ 3.82Å; Y117-F141 HydrophobicContact CG-CE2 4.4Å; Y117-F141 AromaticContact CG-CZ 3.81Å; Y117-F141 HydrophobicContact CG-CZ 3.81Å; F127-F141 AromaticContact CE1-CD1 3.84Å; F127-F141 HydrophobicContact CE1-CD1 3.84Å; F127-F141 HydrophobicContact CE1-CD2 4.14Å; F127-F141 AromaticContact CE1-CE1 3.98Å; F127-F141 HydrophobicContact CE1-CE1 3.98Å; F127-F141 HydrophobicContact CE1-CE2 4.26Å; F127-F141 AromaticContact CE1-CG 3.93Å; F127-F141 HydrophobicContact CE1-CG 3.93Å; F127-F141 HydrophobicContact CE1-CZ 4.18Å; F127-F141 HydrophobicContact CZ-CD1 4.4Å; F127-F141 HydrophobicContact CZ-CD2 4.11Å; F127-F141 HydrophobicContact CZ-CE1 4.19Å; F127-F141 AromaticContact CZ-CE2 3.89Å; F127-F141 HydrophobicContact CZ-CE2 3.89Å; F127-F141 HydrophobicContact CZ-CG 4.36Å; F127-F141 AromaticContact CZ-CZ 3.93Å; F127-F141 HydrophobicContact CZ-CZ 3.93Å; I136-F141 HydrophobicContact CD1-CB 3.94Å; I136-F141 HydrophobicContact CG2-CB 3.88Å; F141-P143 HydrophobicContact CE2-CB 4.33Å; F141-P143 HydrophobicContact CE2-CG 4.47Å; F141-Y149 WeakPolarHBondContact CA-O 3.46Å; F141-Y149 WeakPolarHBondContact CB-O 3.21Å
142	I	91.9	Very high	90.3	Very high	44 Å²	44	72.9 Å²	72.9	23%	0.226	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	114.2	178.3	-60.4	170.9	0	0	0	107.3	Y149 V151 Y154	I142-Y149 PolarHBondContact N-O 3.12Å; I142-Y149 PolarHBondContact O-N 3.42Å; I142-V151 HydrophobicContact CD1-CG2 4.31Å; I142-V151 HydrophobicContact CG1-CG2 4.37Å; I142-Y154 HydrophobicContact CB-CD1 4.42Å; I142-Y154 HydrophobicContact CB-CD2 3.96Å; I142-Y154 HydrophobicContact CB-CE2 4.42Å; I142-Y154 HydrophobicContact CB-CG 3.96Å; I142-Y154 HydrophobicContact CD1-CD1 3.4Å; I142-Y154 VanDerWaalsContact CD1-CD1 3.4Å; I142-Y154 HydrophobicContact CD1-CD2 4.43Å; I142-Y154 HydrophobicContact CD1-CE1 4.11Å; I142-Y154 HydrophobicContact CD1-CG 3.6Å; I142-Y154 HydrophobicContact CG1-CD1 4.48Å; I142-Y154 HydrophobicContact CG1-CG 4.36Å; I142-Y154 HydrophobicContact CG2-CD1 4.11Å; I142-Y154 HydrophobicContact CG2-CD2 3.61Å; I142-Y154 HydrophobicContact CG2-CE1 4.06Å; I142-Y154 HydrophobicContact CG2-CE2 3.57Å; I142-Y154 HydrophobicContact CG2-CG 3.89Å
143	P	91.6	Very high	90.2	Very high	60 Å²	60	71.7 Å²	71.7	39%	0.39	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	134.1	172.3	30.9	-32.9	0	0	0	109.7	Y117 F141	Y117-P143 HydrophobicContact CE1-CB 4.39Å; Y117-P143 WeakPolarHBondContact OH-CB 3.33Å; Y117-P143 WeakPolarHBondContact OH-CG 3.49Å; F141-P143 HydrophobicContact CE2-CB 4.33Å; F141-P143 HydrophobicContact CE2-CG 4.47Å
144	D	89.1	Confident	90	Very high	51 Å²	51	67.8 Å²	67.8	27%	0.273	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	103.7	171.9	179.9	46.8	0	0	0	108.7	D146 D147 Y149 Y154	D144-D146 PolarHBondContact O-N 3.17Å; D144-D147 PolarHBondContact N-O 3.47Å; D144-D147 PolarHBondContact O-N 3.29Å; D144-Y149 HydrophobicContact CB-CD2 4.06Å; D144-Y149 HydrophobicContact CB-CE2 3.89Å; D144-Y154 HydrophobicContact CB-CE2 4.33Å
145	K	86.3	Confident	89.7	Confident	191 Å²	191	65 Å²	65	83%	0.83	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	-116.3	-170.7	-53.5	173.6	-174.5	171.9	0	110.9
146	D	84.9	Confident	89.4	Confident	149 Å²	149	67.4 Å²	67.4	80%	0.797	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-4.6	179.3	-58.2	-60.6	0	0	0	112.7	D144	D144-D146 PolarHBondContact O-N 3.17Å
147	D	90.3	Very high	89	Confident	54 Å²	54	72.8 Å²	72.8	29%	0.289	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	154.1	-177.6	-71.2	-40.5	0	0	0	112.6	H130 D144 Y149	H130-D147 HydrophobicContact CB-CB 4.03Å; H130-D147 IonicContact CE1-OD1 3.23Å; H130-D147 PolarHBondContact CE1-OD1 2.94Å; H130-D147 IonicContact CE1-OD2 3.39Å; H130-D147 IonicContact CG-OD1 2.77Å; H130-D147 IonicContact CG-OD2 3.5Å; H130-D147 IonicContact ND1-OD1 3.21Å; H130-D147 PolarHBondContact ND1-OD1 2.82Å; H130-D147 IonicContact ND1-OD2 2.72Å; H130-D147 PolarHBondContact ND1-OD2 3.25Å; H130-D147 IonicContact NE2-OD2 3.84Å; D144-D147 PolarHBondContact N-O 3.47Å; D144-D147 PolarHBondContact O-N 3.29Å; D147-Y149 HydrophobicContact CB-CD2 4.32Å; D147-Y149 HydrophobicContact CB-CE2 3.56Å
148	H	92.6	Very high	89.1	Confident	38 Å²	38	76.6 Å²	76.6	18%	0.176	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.2	178.6	-49.3	89	0	0	0	108.8	Y117 F127 C129 H130 I136	Y117-H148 AromaticContact CD1-NE2 3.96Å; Y117-H148 AromaticContact CE1-NE2 3.98Å; F127-H148 HydrophobicContact CE1-CB 4.41Å; F127-H148 HydrophobicContact CE2-CB 4.48Å; F127-H148 AromaticContact CE2-CD2 3.63Å; F127-H148 AromaticContact CE2-CE1 3.98Å; F127-H148 AromaticContact CE2-CG 3.77Å; F127-H148 AromaticContact CE2-ND1 3.99Å; F127-H148 AromaticContact CE2-NE2 3.74Å; F127-H148 HydrophobicContact CZ-CB 4Å; F127-H148 AromaticContact CZ-CD2 3.35Å; F127-H148 WeakPolarHBondContact CZ-CD2 3.37Å; F127-H148 AromaticContact CZ-CG 3.6Å; F127-H148 AromaticContact CZ-NE2 3.92Å; C129-H148 CarbonylContact C-O 3.59Å; C129-H148 VanDerWaalsContact CA-O 3.32Å; C129-H148 WeakPolarHBondContact CA-O 3.5Å; H130-H148 PolarHBondContact N-O 2.94Å; I136-H148 HydrophobicContact CD1-CB 4.24Å
149	Y	94	Very high	89.5	Confident	4 Å²	4	73.4 Å²	73.4	2%	0.016	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	137.3	178.8	-64.8	-93.7	0	0	0	110.3	H130 F141 I142 D144 D147 Y154 K157	H130-Y149 HydrophobicContact CB-CE1 4.13Å; F141-Y149 WeakPolarHBondContact CA-O 3.46Å; F141-Y149 WeakPolarHBondContact CB-O 3.21Å; I142-Y149 PolarHBondContact N-O 3.12Å; I142-Y149 PolarHBondContact O-N 3.42Å; D144-Y149 HydrophobicContact CB-CD2 4.06Å; D144-Y149 HydrophobicContact CB-CE2 3.89Å; D147-Y149 HydrophobicContact CB-CD2 4.32Å; D147-Y149 HydrophobicContact CB-CE2 3.56Å; Y149-Y154 HydrophobicContact CD2-CD2 4.24Å; Y149-Y154 HydrophobicContact CG-CD2 4.22Å; Y149-K157 HydrophobicContact CE1-CD 4.36Å; Y149-K157 PolarHBondContact OH-NZ 2.9Å; Y149-K157 VanDerWaalsContact OH-NZ 3.12Å
150	C	94.3	Very high	89.7	Confident	25 Å²	25	69.9 Å²	69.9	17%	0.169	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	148	163.5	70.9	0	0	0	0	109.1	C129 I136 P152 C153 Y154	C129-C150 HydrophobicContact CB-CB 4.17Å; C129-C150 PolarHBondContact SG-N 2.99Å; C129-C150 VanDerWaalsContact SG-SG 3.66Å; I136-C150 HydrophobicContact CG1-CB 4.24Å; C150-P152 VanDerWaalsContact C-CD 3.46Å; C150-P152 VanDerWaalsContact C-N 3.32Å; C150-C153 PolarHBondContact O-N 3.01Å; C150-C153 VanDerWaalsContact O-N 3.08Å; C150-C153 PolarHBondContact SG-SG 2.88Å; C150-Y154 PolarHBondContact O-N 3.08Å
151	V	90.8	Very high	89.8	Confident	44 Å²	44	72 Å²	72	27%	0.267	36%	0.361	S	S	.	.	H	α-helix	trans	-49.1	-47.1	-176.9	176.1	0	0	0	0	112.5	I142 C153 Y154 E155	I142-V151 HydrophobicContact CD1-CG2 4.31Å; I142-V151 HydrophobicContact CG1-CG2 4.37Å; V151-C153 PolarHBondContact O-N 3.2Å; V151-Y154 PolarHBondContact O-N 3.38Å; V151-E155 HydrophobicContact CG1-CG 4.14Å; V151-E155 WeakPolarHBondContact O-CB 3.31Å; V151-E155 VanDerWaalsContact O-CG 3.3Å; V151-E155 WeakPolarHBondContact O-CG 3.29Å; V151-E155 PolarHBondContact O-N 3.13Å
152	P	90.1	Very high	89.8	Confident	89 Å²	89	69.7 Å²	69.7	58%	0.578	35%	0.351	S	S	*	.	H	α-helix	trans	-61.7	-41.2	179.9	-23.6	34.4	0	0	0	114.2	C150 E156	C150-P152 VanDerWaalsContact C-CD 3.46Å; C150-P152 VanDerWaalsContact C-N 3.32Å; P152-E156 WeakPolarHBondContact O-CB 3.42Å; P152-E156 PolarHBondContact O-N 3.42Å
153	C	92.3	Very high	89.9	Confident	24 Å²	24	69 Å²	69	16%	0.162	35%	0.349	C	S	.	.	H	α-helix	trans	-71.8	-37.4	-179.7	-72.4	0	0	0	0	111.9	C150 V151 K157	C150-C153 PolarHBondContact O-N 3.01Å; C150-C153 VanDerWaalsContact O-N 3.08Å; C150-C153 PolarHBondContact SG-SG 2.88Å; V151-C153 PolarHBondContact O-N 3.2Å; C153-K157 WeakPolarHBondContact O-CB 2.92Å; C153-K157 PolarHBondContact O-N 2.87Å; C153-K157 VanDerWaalsContact O-N 3.13Å
154	Y	90.9	Very high	90	Very high	66 Å²	66	71.9 Å²	71.9	26%	0.259	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-46.9	174.1	-171.3	-88	0	0	0	110.8	I142 D144 Y149 C150 V151 E156 K157 F158	I142-Y154 HydrophobicContact CB-CD1 4.42Å; I142-Y154 HydrophobicContact CB-CD2 3.96Å; I142-Y154 HydrophobicContact CB-CE2 4.42Å; I142-Y154 HydrophobicContact CB-CG 3.96Å; I142-Y154 HydrophobicContact CD1-CD1 3.4Å; I142-Y154 VanDerWaalsContact CD1-CD1 3.4Å; I142-Y154 HydrophobicContact CD1-CD2 4.43Å; I142-Y154 HydrophobicContact CD1-CE1 4.11Å; I142-Y154 HydrophobicContact CD1-CG 3.6Å; I142-Y154 HydrophobicContact CG1-CD1 4.48Å; I142-Y154 HydrophobicContact CG1-CG 4.36Å; I142-Y154 HydrophobicContact CG2-CD1 4.11Å; I142-Y154 HydrophobicContact CG2-CD2 3.61Å; I142-Y154 HydrophobicContact CG2-CE1 4.06Å; I142-Y154 HydrophobicContact CG2-CE2 3.57Å; I142-Y154 HydrophobicContact CG2-CG 3.89Å; D144-Y154 HydrophobicContact CB-CE2 4.33Å; Y149-Y154 HydrophobicContact CD2-CD2 4.24Å; Y149-Y154 HydrophobicContact CG-CD2 4.22Å; C150-Y154 PolarHBondContact O-N 3.08Å; V151-Y154 PolarHBondContact O-N 3.38Å; Y154-E156 PolarHBondContact O-N 3.25Å; Y154-K157 PolarHBondContact O-N 3.45Å; Y154-F158 HydrophobicContact CD1-CB 4.44Å; Y154-F158 HydrophobicContact CD1-CD2 4.04Å; Y154-F158 AromaticContact CD2-CD2 3.39Å; Y154-F158 HydrophobicContact CD2-CD2 3.39Å; Y154-F158 AromaticContact CD2-CE2 3.54Å; Y154-F158 HydrophobicContact CD2-CE2 3.54Å; Y154-F158 HydrophobicContact CE1-CB 4.07Å; Y154-F158 HydrophobicContact CE1-CD2 4.01Å; Y154-F158 HydrophobicContact CE1-CG 4.38Å; Y154-F158 AromaticContact CE2-CD2 3.34Å; Y154-F158 HydrophobicContact CE2-CD2 3.34Å; 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 4.2Å; Y154-F158 HydrophobicContact CE2-CZ 4.45Å; Y154-F158 AromaticContact CG-CD2 3.75Å; Y154-F158 HydrophobicContact CG-CD2 3.75Å; Y154-F158 HydrophobicContact CG-CE2 4.3Å; Y154-F158 AromaticContact CZ-CD2 3.66Å; Y154-F158 WeakPolarHBondContact O-CB 3.3Å; Y154-F158 WeakPolarHBondContact O-CD2 3.4Å; Y154-F158 PolarHBondContact O-N 3.34Å
155	E	88	Confident	90.3	Very high	64 Å²	64	71.8 Å²	71.8	30%	0.299	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-43.7	176.8	-74	178.6	161.1	0	0	111.9	V151 K157 A159 A170	V151-E155 HydrophobicContact CG1-CG 4.14Å; V151-E155 WeakPolarHBondContact O-CB 3.31Å; V151-E155 VanDerWaalsContact O-CG 3.3Å; V151-E155 WeakPolarHBondContact O-CG 3.29Å; V151-E155 PolarHBondContact O-N 3.13Å; E155-K157 VanDerWaalsContact C-N 3.3Å; E155-K157 PolarHBondContact O-N 2.94Å; E155-A159 HydrophobicContact CB-CB 4.48Å; E155-A159 WeakPolarHBondContact O-CA 3.26Å; E155-A159 WeakPolarHBondContact O-CB 3.41Å; E155-A159 PolarHBondContact O-N 3.39Å; E155-A170 HydrophobicContact CG-CB 4.43Å; E155-A170 VanDerWaalsContact OE2-CB 3.26Å; E155-A170 WeakPolarHBondContact OE2-CB 3.38Å
156	E	85.9	Confident	90.6	Very high	113 Å²	113	69.2 Å²	69.2	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-63.4	-36.7	178.3	-174.8	59	-143.7	0	0	112.6	P152 Y154 R161	P152-E156 WeakPolarHBondContact O-CB 3.42Å; P152-E156 PolarHBondContact O-N 3.42Å; Y154-E156 PolarHBondContact O-N 3.25Å; E156-R161 IonicContact OE1-NH2 3.59Å; E156-R161 PolarHBondContact OE1-NH2 3.43Å
157	K	85.1	Confident	90.8	Very high	119 Å²	119	69.2 Å²	69.2	52%	0.517	34%	0.336	S	S	.	.	H	α-helix	trans	-80.2	-38.7	-177.1	-172.1	172.7	175.3	-175.5	0	113	Y149 C153 Y154 E155	Y149-K157 HydrophobicContact CE1-CD 4.36Å; Y149-K157 PolarHBondContact OH-NZ 2.9Å; Y149-K157 VanDerWaalsContact OH-NZ 3.12Å; C153-K157 WeakPolarHBondContact O-CB 2.92Å; C153-K157 PolarHBondContact O-N 2.87Å; C153-K157 VanDerWaalsContact O-N 3.13Å; Y154-K157 PolarHBondContact O-N 3.45Å; E155-K157 VanDerWaalsContact C-N 3.3Å; E155-K157 PolarHBondContact O-N 2.94Å
158	F	84.6	Confident	90.8	Very high	86 Å²	86	67.6 Å²	67.6	38%	0.377	33%	0.33	S	S	.	.	H	α-helix	trans	-119	-15.9	-167.5	-57.9	-72.2	0	0	0	114.7	Y154	Y154-F158 HydrophobicContact CD1-CB 4.44Å; Y154-F158 HydrophobicContact CD1-CD2 4.04Å; Y154-F158 AromaticContact CD2-CD2 3.39Å; Y154-F158 HydrophobicContact CD2-CD2 3.39Å; Y154-F158 AromaticContact CD2-CE2 3.54Å; Y154-F158 HydrophobicContact CD2-CE2 3.54Å; Y154-F158 HydrophobicContact CE1-CB 4.07Å; Y154-F158 HydrophobicContact CE1-CD2 4.01Å; Y154-F158 HydrophobicContact CE1-CG 4.38Å; Y154-F158 AromaticContact CE2-CD2 3.34Å; Y154-F158 HydrophobicContact CE2-CD2 3.34Å; 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 4.2Å; Y154-F158 HydrophobicContact CE2-CZ 4.45Å; Y154-F158 AromaticContact CG-CD2 3.75Å; Y154-F158 HydrophobicContact CG-CD2 3.75Å; Y154-F158 HydrophobicContact CG-CE2 4.3Å; Y154-F158 AromaticContact CZ-CD2 3.66Å; Y154-F158 WeakPolarHBondContact O-CB 3.3Å; Y154-F158 WeakPolarHBondContact O-CD2 3.4Å; Y154-F158 PolarHBondContact O-N 3.34Å
159	A	87.4	Confident	90.7	Very high	21 Å²	21	66.4 Å²	66.4	17%	0.174	33%	0.325	C	S	.	.	S	Bend	trans	-68.1	140.2	179.1	0	0	0	0	0	110.4	E155 A168	E155-A159 HydrophobicContact CB-CB 4.48Å; E155-A159 WeakPolarHBondContact O-CA 3.26Å; E155-A159 WeakPolarHBondContact O-CB 3.41Å; E155-A159 PolarHBondContact O-N 3.39Å; A159-A168 HydrophobicContact CB-CB 4.15Å
160	P	89.8	Confident	90	Very high	77 Å²	77	68.4 Å²	68.4	50%	0.5	34%	0.343	S	S	.	.			trans	-56.9	151	173.3	20.9	-29	0	0	0	110.4	L169 P180	P160-L169 HydrophobicContact CB-CD1 4.19Å; P160-L169 HydrophobicContact CG-CB 4.26Å; P160-L169 HydrophobicContact CG-CD1 4.29Å; P160-L169 WeakPolarHBondContact O-CB 3.38Å; P160-L169 WeakPolarHBondContact O-CD1 3.49Å; P160-L169 PolarHBondContact O-N 3.39Å; P160-P180 HydrophobicContact CB-CB 4.04Å; P160-P180 HydrophobicContact CB-CG 3.87Å
161	R	92.1	Very high	89.3	Confident	144 Å²	144	77 Å²	77	54%	0.543	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-104.4	130.9	-178.3	-70	-174.7	170.4	-158.8	-7.4	111.1	E156 T163 P180	E156-R161 IonicContact OE1-NH2 3.59Å; E156-R161 PolarHBondContact OE1-NH2 3.43Å; R161-T163 PolarHBondContact O-N 2.87Å; R161-P180 WeakPolarHBondContact O-CG 3.47Å
162	C	94.6	Very high	88.7	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.388	C	S	.	.			trans	-60.8	128	-177.8	172.2	0	0	0	0	111	R164 C165 K166 K167 L169 P180 H182 C185	C162-R164 PolarHBondContact O-N 2.92Å; C162-R164 VanDerWaalsContact O-N 3.16Å; C162-C165 VanDerWaalsContact CB-SG 3.58Å; C162-C165 VanDerWaalsContact SG-SG 3.67Å; C162-K166 WeakPolarHBondContact O-CA 3.35Å; C162-K166 PolarHBondContact O-N 3.43Å; C162-K167 PolarHBondContact N-O 2.91Å; C162-L169 HydrophobicContact CB-CD1 4.09Å; C162-L169 HydrophobicContact CB-CG 4.5Å; C162-P180 CarbonylContact C-O 3.59Å; C162-P180 VanDerWaalsContact CA-O 3.31Å; C162-P180 WeakPolarHBondContact CA-O 3.19Å; C162-H182 VanDerWaalsContact CB-CE1 3.42Å; C162-H182 WeakPolarHBondContact CB-CE1 3.06Å; C162-H182 WeakPolarHBondContact CB-ND1 3.46Å; C162-H182 PolarHBondContact SG-N 2.91Å; C162-H182 VanDerWaalsContact SG-N 3.37Å; C162-H182 PolarHBondContact SG-ND1 3.07Å; C162-H182 VanDerWaalsContact SG-ND1 3.4Å; C162-C185 VanDerWaalsContact SG-CB 3.5Å; C162-C185 VanDerWaalsContact SG-SG 3.69Å
163	T	94.3	Very high	88.7	Confident	29 Å²	29	74.6 Å²	74.6	18%	0.178	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-35.4	-178.2	-61.5	0	0	0	0	112.9	R161 K166 E179 P180 W181	R161-T163 PolarHBondContact O-N 2.87Å; T163-K166 VanDerWaalsContact O-CE 3.27Å; T163-K166 WeakPolarHBondContact O-CE 3.41Å; T163-K166 PolarHBondContact O-NZ 3.13Å; T163-E179 WeakPolarHBondContact CG2-OE2 3.13Å; T163-E179 WeakPolarHBondContact OG1-CB 3.44Å; T163-P180 PolarHBondContact N-O 2.96Å; T163-P180 PolarHBondContact OG1-O 2.94Å; T163-W181 HydrophobicContact CG2-CH2 3.94Å; T163-W181 HydrophobicContact CG2-CZ2 3.48Å; T163-W181 VanDerWaalsContact CG2-CZ2 3.48Å
164	R	93.2	Very high	88.8	Confident	122 Å²	122	75.2 Å²	75.2	46%	0.46	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-55.8	-179.2	-165.4	173.2	172	-160	-7.3	114.1	C162 W181 C185	C162-R164 PolarHBondContact O-N 2.92Å; C162-R164 VanDerWaalsContact O-N 3.16Å; R164-W181 HydrophobicContact CB-CE3 3.78Å; R164-W181 HydrophobicContact CB-CH2 4.49Å; R164-W181 HydrophobicContact CB-CZ3 3.56Å; R164-W181 HydrophobicContact CG-CZ3 4.22Å; R164-C185 HydrophobicContact CB-CB 3.87Å; R164-C185 WeakPolarHBondContact CD-O 3.48Å; R164-C185 HydrophobicContact CG-CB 4.45Å; R164-C185 PolarHBondContact NH1-O 3.21Å
165	C	94.2	Very high	88.9	Confident	49 Å²	49	77.1 Å²	77.1	33%	0.331	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-6.9	-169.4	74.1	0	0	0	0	113.4	C162 K167 H182	C162-C165 VanDerWaalsContact CB-SG 3.58Å; C162-C165 VanDerWaalsContact SG-SG 3.67Å; C165-K167 PolarHBondContact O-N 3.36Å; C165-K167 VanDerWaalsContact O-N 3.13Å; C165-H182 PolarHBondContact SG-CE1 2.63Å; C165-H182 PolarHBondContact SG-ND1 2.89Å
166	K	92.6	Very high	89.2	Confident	136 Å²	136	75.5 Å²	75.5	59%	0.591	39%	0.39	S	S	*	.			trans	61.8	10.6	-178.9	-50.6	-55.3	-171.4	-168.8	0	115.5	C162 T163	C162-K166 WeakPolarHBondContact O-CA 3.35Å; C162-K166 PolarHBondContact O-N 3.43Å; T163-K166 VanDerWaalsContact O-CE 3.27Å; T163-K166 WeakPolarHBondContact O-CE 3.41Å; T163-K166 PolarHBondContact O-NZ 3.13Å
167	K	90.5	Very high	89.4	Confident	149 Å²	149	75.7 Å²	75.7	65%	0.648	39%	0.386	S	S	*	.			trans	-88.8	153.5	175.5	-59.6	-178.8	179.1	-176.2	0	112	C162 C165 H182	C162-K167 PolarHBondContact N-O 2.91Å; C165-K167 PolarHBondContact O-N 3.36Å; C165-K167 VanDerWaalsContact O-N 3.13Å; K167-H182 PolarHBondContact O-CE1 3.18Å
168	A	89.9	Confident	89.6	Confident	20 Å²	20	77.5 Å²	77.5	17%	0.165	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-59.4	145.1	177.8	0	0	0	0	0	113.4	A159 A170 H182	A159-A168 HydrophobicContact CB-CB 4.15Å; A168-A170 PolarHBondContact O-N 3.33Å; A168-H182 PolarHBondContact O-NE2 3.43Å
169	L	89.6	Confident	90.1	Very high	13 Å²	13	77.6 Å²	77.6	7%	0.068	40%	0.403	C	S	.	.			trans	-94.4	67.6	175.9	-77.5	117.4	0	0	0	112.2	P160 C162 K171 P180 W181	P160-L169 HydrophobicContact CB-CD1 4.19Å; P160-L169 HydrophobicContact CG-CB 4.26Å; P160-L169 HydrophobicContact CG-CD1 4.29Å; P160-L169 WeakPolarHBondContact O-CB 3.38Å; P160-L169 WeakPolarHBondContact O-CD1 3.49Å; P160-L169 PolarHBondContact O-N 3.39Å; C162-L169 HydrophobicContact CB-CD1 4.09Å; C162-L169 HydrophobicContact CB-CG 4.5Å; L169-K171 PolarHBondContact O-N 3.45Å; L169-P180 HydrophobicContact CD1-CB 3.75Å; L169-P180 HydrophobicContact CD1-CG 4.23Å; L169-W181 WeakPolarHBondContact CD2-O 3.17Å
170	A	80	Confident	90.4	Very high	46 Å²	46	78.3 Å²	78.3	38%	0.38	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-39.3	178.9	0	0	0	0	0	113.9	E155 A168	E155-A170 HydrophobicContact CG-CB 4.43Å; E155-A170 VanDerWaalsContact OE2-CB 3.26Å; E155-A170 WeakPolarHBondContact OE2-CB 3.38Å; A168-A170 PolarHBondContact O-N 3.33Å
171	K	78.7	Confident	90.7	Very high	207 Å²	207	76.3 Å²	76.3	90%	0.9	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	26.4	-173.4	-62.2	-175.8	179.6	-178.6	0	113.8	L169	L169-K171 PolarHBondContact O-N 3.45Å
172	G	78.9	Confident	90.9	Very high	47 Å²	47	71 Å²	71	49%	0.485	37%	0.37	S	S	.	.			trans	69.4	-178.4	-171.3	0	0	0	0	0	113.1
173	G	90.3	Very high	90.9	Very high	35 Å²	35	75.9 Å²	75.9	36%	0.361	39%	0.391	S	S	.	.			trans	-166.2	-157	-173.8	0	0	0	0	0	112.9	W181	G173-W181 WeakPolarHBondContact CA-O 3.41Å
174	V	94.1	Very high	90.9	Very high	36 Å²	36	80.5 Å²	80.5	22%	0.218	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	146.4	168	-68	0	0	0	0	109.4	W181 K183 F186 A196	V174-W181 HydrophobicContact CG2-CB 4.06Å; V174-W181 PolarHBondContact N-O 2.87Å; V174-W181 PolarHBondContact O-N 3.17Å; V174-K183 HydrophobicContact CG1-CG 4.22Å; V174-F186 HydrophobicContact CG2-CB 3.78Å; V174-F186 HydrophobicContact CG2-CD1 4.02Å; V174-F186 HydrophobicContact CG2-CG 3.94Å; V174-A196 HydrophobicContact CG1-CB 3.86Å
175	T	94.2	Very high	91	Very high	106 Å²	106	75.6 Å²	75.6	65%	0.65	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.8	170.1	-53	0	0	0	0	108.2	E179	T175-E179 WeakPolarHBondContact CA-O 3.42Å
176	Y	92.5	Very high	91.1	Very high	30 Å²	30	73.6 Å²	73.6	12%	0.118	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	119.2	173.6	174.6	-113.9	0	0	0	108.2	D178 E179 F186 F200 S202	Y176-D178 VanDerWaalsContact C-N 3.31Å; Y176-D178 PolarHBondContact O-N 3.16Å; Y176-E179 PolarHBondContact N-O 3.41Å; Y176-E179 WeakPolarHBondContact O-CB 3.31Å; Y176-E179 PolarHBondContact O-N 2.92Å; Y176-F186 AromaticContact CD1-CE2 3.58Å; Y176-F186 HydrophobicContact CD1-CE2 3.58Å; Y176-F186 HydrophobicContact CD1-CZ 4.14Å; Y176-F186 HydrophobicContact CD2-CE2 4.18Å; Y176-F186 AromaticContact CD2-CZ 3.91Å; Y176-F186 HydrophobicContact CD2-CZ 3.91Å; Y176-F186 HydrophobicContact CE1-CE2 4.24Å; Y176-F186 HydrophobicContact CE2-CZ 4.45Å; Y176-F186 AromaticContact CG-CE2 3.53Å; Y176-F186 HydrophobicContact CG-CE2 3.53Å; Y176-F186 AromaticContact CG-CZ 3.73Å; Y176-F186 HydrophobicContact CG-CZ 3.73Å; Y176-F200 HydrophobicContact CD2-CE2 4.01Å; Y176-F200 AromaticContact CD2-CZ 3.71Å; Y176-F200 HydrophobicContact CD2-CZ 3.71Å; Y176-F200 AromaticContact CE2-CE2 3.5Å; Y176-F200 HydrophobicContact CE2-CE2 3.5Å; Y176-F200 VanDerWaalsContact CE2-CE2 3.5Å; Y176-F200 AromaticContact CE2-CZ 3.63Å; Y176-F200 HydrophobicContact CE2-CZ 3.63Å; Y176-S202 WeakPolarHBondContact OH-CB 3.47Å; Y176-S202 PolarHBondContact OH-OG 3.16Å
177	R	90.4	Very high	91.3	Very high	117 Å²	117	67.9 Å²	67.9	44%	0.442	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	48.8	-175.6	-59.3	176.5	171.4	-162.4	0.2	112.6	E179 S202 D205	R177-E179 PolarHBondContact O-N 3.4Å; R177-S202 PolarHBondContact NH2-OG 3.37Å; R177-D205 IonicContact CZ-OD1 3.79Å; R177-D205 VanDerWaalsContact NH1-CG 3.3Å; R177-D205 IonicContact NH1-OD1 2.92Å; R177-D205 PolarHBondContact NH1-OD1 2.92Å; R177-D205 IonicContact NH2-OD1 2.63Å
178	D	90.8	Very high	91.6	Very high	158 Å²	158	60.8 Å²	60.8	85%	0.845	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	4.5	-177.9	-54.6	-61.9	0	0	0	115.3	Y176	Y176-D178 VanDerWaalsContact C-N 3.31Å; Y176-D178 PolarHBondContact O-N 3.16Å
179	E	93.7	Very high	91.8	Very high	88 Å²	88	62 Å²	62	41%	0.411	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.6	174.9	-67.4	-167.9	128.9	0	0	110.9	T163 T175 Y176 R177	T163-E179 WeakPolarHBondContact CG2-OE2 3.13Å; T163-E179 WeakPolarHBondContact OG1-CB 3.44Å; T175-E179 WeakPolarHBondContact CA-O 3.42Å; Y176-E179 PolarHBondContact N-O 3.41Å; Y176-E179 WeakPolarHBondContact O-CB 3.31Å; Y176-E179 PolarHBondContact O-N 2.92Å; R177-E179 PolarHBondContact O-N 3.4Å
180	P	95.2	Very high	92.1	Very high	35 Å²	35	65.6 Å²	65.6	23%	0.227	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	138	-179.3	34.9	-34.7	0	0	0	111.9	P160 R161 C162 T163 L169	P160-P180 HydrophobicContact CB-CB 4.04Å; P160-P180 HydrophobicContact CB-CG 3.87Å; R161-P180 WeakPolarHBondContact O-CG 3.47Å; C162-P180 CarbonylContact C-O 3.59Å; C162-P180 VanDerWaalsContact CA-O 3.31Å; C162-P180 WeakPolarHBondContact CA-O 3.19Å; T163-P180 PolarHBondContact N-O 2.96Å; T163-P180 PolarHBondContact OG1-O 2.94Å; L169-P180 HydrophobicContact CD1-CB 3.75Å; L169-P180 HydrophobicContact CD1-CG 4.23Å
181	W	95.6	Very high	92.8	Very high	35 Å²	35	66 Å²	66	13%	0.133	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.2	-178.8	-60.9	71.6	0	0	0	110.9	T163 R164 L169 G173 V174 F186	T163-W181 HydrophobicContact CG2-CH2 3.94Å; T163-W181 HydrophobicContact CG2-CZ2 3.48Å; T163-W181 VanDerWaalsContact CG2-CZ2 3.48Å; R164-W181 HydrophobicContact CB-CE3 3.78Å; R164-W181 HydrophobicContact CB-CH2 4.49Å; R164-W181 HydrophobicContact CB-CZ3 3.56Å; R164-W181 HydrophobicContact CG-CZ3 4.22Å; L169-W181 WeakPolarHBondContact CD2-O 3.17Å; G173-W181 WeakPolarHBondContact CA-O 3.41Å; V174-W181 HydrophobicContact CG2-CB 4.06Å; V174-W181 PolarHBondContact N-O 2.87Å; V174-W181 PolarHBondContact O-N 3.17Å; W181-F186 HydrophobicContact CB-CB 4.04Å; W181-F186 HydrophobicContact CD2-CD2 4.12Å; W181-F186 HydrophobicContact CE3-CD2 4.26Å; W181-F186 HydrophobicContact CG-CD2 4.2Å
182	H	95.4	Very high	93.6	Very high	33 Å²	33	62 Å²	62	15%	0.153	33%	0.332	C	S	.	.			trans	-60.4	144.7	162.6	-62.9	114.1	0	0	0	108.8	C162 C165 K167 A168 E184 C185 F186	C162-H182 VanDerWaalsContact CB-CE1 3.42Å; C162-H182 WeakPolarHBondContact CB-CE1 3.06Å; C162-H182 WeakPolarHBondContact CB-ND1 3.46Å; C162-H182 PolarHBondContact SG-N 2.91Å; C162-H182 VanDerWaalsContact SG-N 3.37Å; C162-H182 PolarHBondContact SG-ND1 3.07Å; C162-H182 VanDerWaalsContact SG-ND1 3.4Å; C165-H182 PolarHBondContact SG-CE1 2.63Å; C165-H182 PolarHBondContact SG-ND1 2.89Å; K167-H182 PolarHBondContact O-CE1 3.18Å; A168-H182 PolarHBondContact O-NE2 3.43Å; H182-E184 WeakPolarHBondContact CB-OE2 3.48Å; H182-E184 PolarHBondContact O-N 2.84Å; H182-C185 HydrophobicContact CB-CB 3.89Å; H182-C185 WeakPolarHBondContact O-CA 3.44Å; H182-C185 WeakPolarHBondContact O-CB 3.27Å; H182-C185 PolarHBondContact O-N 2.83Å; H182-F186 PolarHBondContact O-N 2.82Å
183	K	94.5	Very high	94.4	Very high	103 Å²	103	63 Å²	63	45%	0.448	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-35.6	178.7	-59.2	-177.2	176.8	174.9	0	110.6	V174 C185 Q194 A196	V174-K183 HydrophobicContact CG1-CG 4.22Å; K183-C185 VanDerWaalsContact C-N 3.35Å; K183-Q194 WeakPolarHBondContact O-CG 3.34Å; K183-Q194 PolarHBondContact O-NE2 3.23Å; K183-A196 HydrophobicContact CB-CB 4.02Å; K183-A196 HydrophobicContact CG-CB 4.31Å
184	E	94.6	Very high	94.7	Very high	126 Å²	126	65.3 Å²	65.3	59%	0.589	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-21.6	179.9	-50.4	69.5	-142.5	0	0	112.2	H182 V187	H182-E184 WeakPolarHBondContact CB-OE2 3.48Å; H182-E184 PolarHBondContact O-N 2.84Å; E184-V187 WeakPolarHBondContact O-CG1 3.28Å
185	C	95.7	Very high	94.8	Very high	19 Å²	19	63.6 Å²	63.6	13%	0.128	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-29.7	174.9	-76.4	0	0	0	0	112.1	C162 R164 H182 K183 V187	C162-C185 VanDerWaalsContact SG-CB 3.5Å; C162-C185 VanDerWaalsContact SG-SG 3.69Å; R164-C185 HydrophobicContact CB-CB 3.87Å; R164-C185 WeakPolarHBondContact CD-O 3.48Å; R164-C185 HydrophobicContact CG-CB 4.45Å; R164-C185 PolarHBondContact NH1-O 3.21Å; H182-C185 HydrophobicContact CB-CB 3.89Å; H182-C185 WeakPolarHBondContact O-CA 3.44Å; H182-C185 WeakPolarHBondContact O-CB 3.27Å; H182-C185 PolarHBondContact O-N 2.83Å; K183-C185 VanDerWaalsContact C-N 3.35Å; C185-V187 PolarHBondContact O-N 3.06Å
186	F	96.5	Very high	94.8	Very high	6 Å²	6	59.7 Å²	59.7	3%	0.026	30%	0.299	C	S	.	.	S	Bend	trans	-79.2	86.3	178.1	-167.4	-115.8	0	0	0	111.3	V174 Y176 W181 H182 L195 F200 P207	V174-F186 HydrophobicContact CG2-CB 3.78Å; V174-F186 HydrophobicContact CG2-CD1 4.02Å; V174-F186 HydrophobicContact CG2-CG 3.94Å; Y176-F186 AromaticContact CD1-CE2 3.58Å; Y176-F186 HydrophobicContact CD1-CE2 3.58Å; Y176-F186 HydrophobicContact CD1-CZ 4.14Å; Y176-F186 HydrophobicContact CD2-CE2 4.18Å; Y176-F186 AromaticContact CD2-CZ 3.91Å; Y176-F186 HydrophobicContact CD2-CZ 3.91Å; Y176-F186 HydrophobicContact CE1-CE2 4.24Å; Y176-F186 HydrophobicContact CE2-CZ 4.45Å; Y176-F186 AromaticContact CG-CE2 3.53Å; Y176-F186 HydrophobicContact CG-CE2 3.53Å; Y176-F186 AromaticContact CG-CZ 3.73Å; Y176-F186 HydrophobicContact CG-CZ 3.73Å; W181-F186 HydrophobicContact CB-CB 4.04Å; W181-F186 HydrophobicContact CD2-CD2 4.12Å; W181-F186 HydrophobicContact CE3-CD2 4.26Å; W181-F186 HydrophobicContact CG-CD2 4.2Å; H182-F186 PolarHBondContact O-N 2.82Å; F186-L195 HydrophobicContact CD1-CB 3.68Å; F186-L195 HydrophobicContact CE1-CB 3.6Å; F186-L195 HydrophobicContact CE1-CD1 4.42Å; F186-L195 HydrophobicContact CZ-CB 4.44Å; F186-L195 PolarHBondContact O-N 2.92Å; F186-F200 HydrophobicContact CE1-CD1 4.2Å; F186-F200 AromaticContact CE1-CE1 3.79Å; F186-F200 HydrophobicContact CE1-CE1 3.79Å; F186-F200 HydrophobicContact CE1-CE2 4.31Å; F186-F200 AromaticContact CE1-CZ 3.86Å; F186-F200 HydrophobicContact CE1-CZ 3.86Å; F186-F200 HydrophobicContact CZ-CD2 4.28Å; F186-F200 AromaticContact CZ-CE1 3.96Å; F186-F200 HydrophobicContact CZ-CE1 3.96Å; F186-F200 AromaticContact CZ-CE2 3.7Å; F186-F200 HydrophobicContact CZ-CE2 3.7Å; F186-F200 AromaticContact CZ-CZ 3.53Å; F186-F200 HydrophobicContact CZ-CZ 3.53Å; F186-P207 HydrophobicContact CE2-CB 4.11Å; F186-P207 HydrophobicContact CE2-CG 4.05Å; F186-P207 HydrophobicContact CZ-CB 4.21Å
187	V	96.8	Very high	94.7	Very high	16 Å²	16	62.6 Å²	62.6	10%	0.097	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-128.2	159.2	-172.5	-52.6	0	0	0	0	112.3	E184 C185 T189 K192 T193	E184-V187 WeakPolarHBondContact O-CG1 3.28Å; C185-V187 PolarHBondContact O-N 3.06Å; V187-T189 PolarHBondContact O-N 2.98Å; V187-K192 WeakPolarHBondContact CB-O 3.46Å; V187-K192 WeakPolarHBondContact CG1-O 3.35Å; V187-K192 HydrophobicContact CG2-CB 4.37Å; V187-K192 HydrophobicContact CG2-CD 4.2Å; V187-T193 CarbonylContact C-O 3.49Å; V187-T193 VanDerWaalsContact CA-O 3.24Å; V187-T193 WeakPolarHBondContact CA-O 3.14Å; V187-T193 WeakPolarHBondContact CB-O 3.4Å
188	C	96.3	Very high	94.8	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.342	C	S	.	.			trans	-58.1	128.3	172.1	179.4	0	0	0	0	110.9	N190 C191 K192 T193 L195 P207 C209	C188-N190 PolarHBondContact O-N 2.89Å; C188-N190 VanDerWaalsContact O-N 3.16Å; C188-C191 VanDerWaalsContact CB-SG 3.53Å; C188-K192 VanDerWaalsContact O-CA 3.23Å; C188-K192 WeakPolarHBondContact O-CA 3.49Å; C188-K192 PolarHBondContact O-N 2.98Å; C188-T193 PolarHBondContact N-O 2.85Å; C188-L195 HydrophobicContact CB-CD1 4.5Å; C188-L195 HydrophobicContact CB-CD2 4.1Å; C188-L195 HydrophobicContact CB-CG 4.43Å; C188-P207 WeakPolarHBondContact CA-O 3.24Å; C188-C209 HydrophobicContact CB-CB 4.16Å; C188-C209 PolarHBondContact SG-N 2.99Å; C188-C209 VanDerWaalsContact SG-SG 3.69Å
189	T	95	Very high	94.8	Very high	47 Å²	47	62.7 Å²	62.7	29%	0.288	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-34.6	178.5	-64.5	0	0	0	0	112.4	V187 K192 P207 Y208	V187-T189 PolarHBondContact O-N 2.98Å; T189-K192 PolarHBondContact O-NZ 3.21Å; T189-P207 PolarHBondContact N-O 3.33Å; T189-P207 PolarHBondContact OG1-O 2.83Å; T189-Y208 HydrophobicContact CG2-CE1 4.16Å
190	N	94.7	Very high	94.7	Very high	88 Å²	88	61.7 Å²	61.7	47%	0.471	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-61	-179	-170.9	58.9	0	0	0	113.6	C188 Y208 C212 L216	C188-N190 PolarHBondContact O-N 2.89Å; C188-N190 VanDerWaalsContact O-N 3.16Å; N190-Y208 HydrophobicContact CB-CD1 4.25Å; N190-Y208 HydrophobicContact CB-CE1 4.26Å; N190-C212 HydrophobicContact CB-CB 3.9Å; N190-C212 PolarHBondContact ND2-SG 3.12Å; N190-L216 HydrophobicContact CB-CD1 3.99Å
191	C	95.9	Very high	94.5	Very high	53 Å²	53	62.2 Å²	62.2	36%	0.358	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-2.5	-171.4	67.9	0	0	0	0	114.8	C188 T193	C188-C191 VanDerWaalsContact CB-SG 3.53Å; C191-T193 PolarHBondContact O-N 3.37Å; C191-T193 PolarHBondContact SG-OG1 2.93Å
192	K	95.5	Very high	94.3	Very high	123 Å²	123	62.5 Å²	62.5	54%	0.535	34%	0.343	S	S	.	.			trans	59.3	12.9	-178.6	-46.7	-54	-175.6	-167	0	115.6	V187 C188 T189	V187-K192 WeakPolarHBondContact CB-O 3.46Å; V187-K192 WeakPolarHBondContact CG1-O 3.35Å; V187-K192 HydrophobicContact CG2-CB 4.37Å; V187-K192 HydrophobicContact CG2-CD 4.2Å; C188-K192 VanDerWaalsContact O-CA 3.23Å; C188-K192 WeakPolarHBondContact O-CA 3.49Å; C188-K192 PolarHBondContact O-N 2.98Å; T189-K192 PolarHBondContact O-NZ 3.21Å
193	T	96	Very high	93.9	Very high	70 Å²	70	66 Å²	66	43%	0.429	35%	0.354	S	S	.	.			trans	-67.5	138.5	171.1	-52.4	0	0	0	0	110.7	V187 C188 C191	V187-T193 CarbonylContact C-O 3.49Å; V187-T193 VanDerWaalsContact CA-O 3.24Å; V187-T193 WeakPolarHBondContact CA-O 3.14Å; V187-T193 WeakPolarHBondContact CB-O 3.4Å; C188-T193 PolarHBondContact N-O 2.85Å; C191-T193 PolarHBondContact O-N 3.37Å; C191-T193 PolarHBondContact SG-OG1 2.93Å
194	Q	96.3	Very high	93.6	Very high	82 Å²	82	67.2 Å²	67.2	38%	0.383	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-57.9	132.2	175.9	-178.3	167.7	30.7	0	0	112.1	K183 A196	K183-Q194 WeakPolarHBondContact O-CG 3.34Å; K183-Q194 PolarHBondContact O-NE2 3.23Å; Q194-A196 HydrophobicContact CG-CB 4.1Å
195	L	96.3	Very high	93.2	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.005	37%	0.368	C	S	.	.			trans	-104.2	-12.4	-179	-61.6	179.4	0	0	0	113.2	F186 C188 G197 Q198 F200 P207 C209	F186-L195 HydrophobicContact CD1-CB 3.68Å; F186-L195 HydrophobicContact CE1-CB 3.6Å; F186-L195 HydrophobicContact CE1-CD1 4.42Å; F186-L195 HydrophobicContact CZ-CB 4.44Å; F186-L195 PolarHBondContact O-N 2.92Å; C188-L195 HydrophobicContact CB-CD1 4.5Å; C188-L195 HydrophobicContact CB-CD2 4.1Å; C188-L195 HydrophobicContact CB-CG 4.43Å; L195-G197 PolarHBondContact O-N 2.9Å; L195-Q198 PolarHBondContact O-N 3.21Å; L195-F200 HydrophobicContact CB-CB 4.37Å; L195-F200 HydrophobicContact CB-CD1 4.38Å; L195-F200 HydrophobicContact CB-CG 4.39Å; L195-F200 HydrophobicContact CD1-CB 4.01Å; L195-F200 HydrophobicContact CD1-CD2 4.33Å; L195-F200 HydrophobicContact CD1-CG 4.19Å; L195-F200 HydrophobicContact CD2-CB 3.93Å; L195-F200 HydrophobicContact CG-CB 4.33Å; L195-P207 HydrophobicContact CD1-CB 3.65Å; L195-P207 HydrophobicContact CD1-CG 4.21Å; L195-C209 HydrophobicContact CD2-CB 3.68Å
196	A	93.8	Very high	93	Very high	23 Å²	23	67.9 Å²	67.9	19%	0.19	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	122.4	176.9	0	0	0	0	0	110.5	V174 K183 Q194 Q198	V174-A196 HydrophobicContact CG1-CB 3.86Å; K183-A196 HydrophobicContact CB-CB 4.02Å; K183-A196 HydrophobicContact CG-CB 4.31Å; Q194-A196 HydrophobicContact CG-CB 4.1Å; A196-Q198 PolarHBondContact O-N 2.99Å
197	G	90.6	Very high	92.9	Very high	91 Å²	91	68.2 Å²	68.2	94%	0.938	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	5.4	-177.6	0	0	0	0	0	115.3	L195	L195-G197 PolarHBondContact O-N 2.9Å
198	Q	91.6	Very high	92.7	Very high	115 Å²	115	68.6 Å²	68.6	54%	0.537	38%	0.378	S	S	.	.	S	Bend	trans	-110.2	159.4	175.7	-60.5	-150.9	-4.6	0	0	111.7	L195 A196 F200	L195-Q198 PolarHBondContact O-N 3.21Å; A196-Q198 PolarHBondContact O-N 2.99Å; Q198-F200 WeakPolarHBondContact O-CD1 3.29Å
199	H	90.1	Very high	92.6	Very high	162 Å²	162	69.3 Å²	69.3	75%	0.75	38%	0.383	S	S	*	.			trans	-70.9	131.1	168.1	-63.5	-74.6	0	0	0	110.4	L210	H199-L210 HydrophobicContact CB-CD1 3.72Å; H199-L210 HydrophobicContact CB-CG 4.19Å
200	F	92.9	Very high	92.3	Very high	68 Å²	68	69 Å²	69	30%	0.298	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	169.3	178.3	73.8	-86.7	0	0	0	109.6	Y176 F186 L195 Q198 P207 Y208	Y176-F200 HydrophobicContact CD2-CE2 4.01Å; Y176-F200 AromaticContact CD2-CZ 3.71Å; Y176-F200 HydrophobicContact CD2-CZ 3.71Å; Y176-F200 AromaticContact CE2-CE2 3.5Å; Y176-F200 HydrophobicContact CE2-CE2 3.5Å; Y176-F200 VanDerWaalsContact CE2-CE2 3.5Å; Y176-F200 AromaticContact CE2-CZ 3.63Å; Y176-F200 HydrophobicContact CE2-CZ 3.63Å; F186-F200 HydrophobicContact CE1-CD1 4.2Å; F186-F200 AromaticContact CE1-CE1 3.79Å; F186-F200 HydrophobicContact CE1-CE1 3.79Å; F186-F200 HydrophobicContact CE1-CE2 4.31Å; F186-F200 AromaticContact CE1-CZ 3.86Å; F186-F200 HydrophobicContact CE1-CZ 3.86Å; F186-F200 HydrophobicContact CZ-CD2 4.28Å; F186-F200 AromaticContact CZ-CE1 3.96Å; F186-F200 HydrophobicContact CZ-CE1 3.96Å; F186-F200 AromaticContact CZ-CE2 3.7Å; F186-F200 HydrophobicContact CZ-CE2 3.7Å; F186-F200 AromaticContact CZ-CZ 3.53Å; F186-F200 HydrophobicContact CZ-CZ 3.53Å; L195-F200 HydrophobicContact CB-CB 4.37Å; L195-F200 HydrophobicContact CB-CD1 4.38Å; L195-F200 HydrophobicContact CB-CG 4.39Å; L195-F200 HydrophobicContact CD1-CB 4.01Å; L195-F200 HydrophobicContact CD1-CD2 4.33Å; L195-F200 HydrophobicContact CD1-CG 4.19Å; L195-F200 HydrophobicContact CD2-CB 3.93Å; L195-F200 HydrophobicContact CG-CB 4.33Å; Q198-F200 WeakPolarHBondContact O-CD1 3.29Å; F200-P207 HydrophobicContact CD2-CB 4.17Å; F200-P207 HydrophobicContact CE2-CB 4.37Å; F200-Y208 WeakPolarHBondContact CA-O 3.5Å; F200-Y208 WeakPolarHBondContact CB-O 3.08Å
201	T	90.4	Very high	92.1	Very high	46 Å²	46	73.5 Å²	73.5	28%	0.282	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	167.2	171.5	-171.6	0	0	0	0	109.5	Y208 L210 F213	T201-Y208 PolarHBondContact N-O 2.78Å; T201-Y208 PolarHBondContact O-N 3.04Å; T201-Y208 VanDerWaalsContact O-O 3.09Å; T201-L210 HydrophobicContact CG2-CD2 4.32Å; T201-F213 HydrophobicContact CG2-CB 3.67Å; T201-F213 HydrophobicContact CG2-CD1 3.64Å; T201-F213 HydrophobicContact CG2-CD2 3.34Å; T201-F213 HydrophobicContact CG2-CE1 4.1Å; T201-F213 HydrophobicContact CG2-CE2 3.82Å; T201-F213 HydrophobicContact CG2-CG 3.24Å; T201-F213 HydrophobicContact CG2-CZ 4.18Å
202	S	91.1	Very high	91.9	Very high	41 Å²	41	71.5 Å²	71.5	29%	0.287	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	145.6	-178	58.9	0	0	0	0	111.9	Y176 R177 S206	Y176-S202 WeakPolarHBondContact OH-CB 3.47Å; Y176-S202 PolarHBondContact OH-OG 3.16Å; R177-S202 PolarHBondContact NH2-OG 3.37Å; S202-S206 VanDerWaalsContact CA-O 3.28Å; S202-S206 WeakPolarHBondContact CA-O 3.13Å
203	R	88.4	Confident	91.6	Very high	105 Å²	105	68 Å²	68	40%	0.396	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	133.8	171.7	172.8	173.6	-174.7	157	8.4	108.7	D205 S206 Y208 F213 Y217	R203-D205 PolarHBondContact O-N 3.37Å; R203-S206 PolarHBondContact N-O 2.86Å; R203-S206 WeakPolarHBondContact O-CA 3.43Å; R203-S206 WeakPolarHBondContact O-CB 3.4Å; R203-S206 PolarHBondContact O-N 3.14Å; R203-Y208 HydrophobicContact CB-CD2 4.48Å; R203-Y208 HydrophobicContact CB-CE2 4.27Å; R203-F213 HydrophobicContact CB-CE2 3.99Å; R203-Y217 VanDerWaalsContact NH1-CG 3.32Å
204	D	88.1	Confident	91.2	Very high	130 Å²	130	64.8 Å²	64.8	70%	0.695	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.1	47.3	-178.8	-50.2	-44.1	0	0	0	110.8	S206	D204-S206 PolarHBondContact O-N 3.15Å
205	D	85.6	Confident	90.7	Very high	118 Å²	118	64.7 Å²	64.7	63%	0.631	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	2.5	-178	-50.4	-32.5	0	0	0	116.5	R177 R203	R177-D205 IonicContact CZ-OD1 3.79Å; R177-D205 VanDerWaalsContact NH1-CG 3.3Å; R177-D205 IonicContact NH1-OD1 2.92Å; R177-D205 PolarHBondContact NH1-OD1 2.92Å; R177-D205 IonicContact NH2-OD1 2.63Å; R203-D205 PolarHBondContact O-N 3.37Å
206	S	90.9	Very high	90.2	Very high	40 Å²	40	68.6 Å²	68.6	28%	0.28	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.5	177.9	-73.8	0	0	0	0	111.5	S202 R203 D204 Y208	S202-S206 VanDerWaalsContact CA-O 3.28Å; S202-S206 WeakPolarHBondContact CA-O 3.13Å; R203-S206 PolarHBondContact N-O 2.86Å; R203-S206 WeakPolarHBondContact O-CA 3.43Å; R203-S206 WeakPolarHBondContact O-CB 3.4Å; R203-S206 PolarHBondContact O-N 3.14Å; D204-S206 PolarHBondContact O-N 3.15Å; S206-Y208 WeakPolarHBondContact O-CD2 3.49Å; S206-Y208 VanDerWaalsContact O-CE2 3.29Å; S206-Y208 WeakPolarHBondContact O-CE2 3.49Å
207	P	94.1	Very high	89.8	Confident	13 Å²	13	71.1 Å²	71.1	8%	0.084	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	134.1	179.9	34.1	-36.3	0	0	0	112	F186 C188 T189 L195 F200	F186-P207 HydrophobicContact CE2-CB 4.11Å; F186-P207 HydrophobicContact CE2-CG 4.05Å; F186-P207 HydrophobicContact CZ-CB 4.21Å; C188-P207 WeakPolarHBondContact CA-O 3.24Å; T189-P207 PolarHBondContact N-O 3.33Å; T189-P207 PolarHBondContact OG1-O 2.83Å; L195-P207 HydrophobicContact CD1-CB 3.65Å; L195-P207 HydrophobicContact CD1-CG 4.21Å; F200-P207 HydrophobicContact CD2-CB 4.17Å; F200-P207 HydrophobicContact CE2-CB 4.37Å
208	Y	94.1	Very high	89.5	Confident	24 Å²	24	68 Å²	68	9%	0.094	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137.8	179.3	-66.1	-94.5	0	0	0	110.8	T189 N190 F200 T201 R203 S206 L216 Y217	T189-Y208 HydrophobicContact CG2-CE1 4.16Å; N190-Y208 HydrophobicContact CB-CD1 4.25Å; N190-Y208 HydrophobicContact CB-CE1 4.26Å; F200-Y208 WeakPolarHBondContact CA-O 3.5Å; F200-Y208 WeakPolarHBondContact CB-O 3.08Å; T201-Y208 PolarHBondContact N-O 2.78Å; T201-Y208 PolarHBondContact O-N 3.04Å; T201-Y208 VanDerWaalsContact O-O 3.09Å; R203-Y208 HydrophobicContact CB-CD2 4.48Å; R203-Y208 HydrophobicContact CB-CE2 4.27Å; S206-Y208 WeakPolarHBondContact O-CD2 3.49Å; S206-Y208 VanDerWaalsContact O-CE2 3.29Å; S206-Y208 WeakPolarHBondContact O-CE2 3.49Å; Y208-L216 HydrophobicContact CD1-CD1 4.24Å; Y208-L216 HydrophobicContact CE1-CD1 4.03Å; Y208-Y217 HydrophobicContact CD1-CE2 4.26Å; Y208-Y217 HydrophobicContact CD2-CE2 4.34Å; Y208-Y217 HydrophobicContact CE1-CE2 4.09Å; Y208-Y217 HydrophobicContact CE2-CE2 4.19Å; Y208-Y217 HydrophobicContact CG-CE2 4.39Å; Y208-Y217 VanDerWaalsContact CZ-OH 3.28Å; Y208-Y217 PolarHBondContact OH-OH 3.42Å; Y208-Y217 VanDerWaalsContact OH-OH 3.08Å
209	C	94.1	Very high	89.1	Confident	15 Å²	15	69 Å²	69	10%	0.101	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	152.1	165.7	73.4	0	0	0	0	109.7	C188 L195 K211 C212 F213	C188-C209 HydrophobicContact CB-CB 4.16Å; C188-C209 PolarHBondContact SG-N 2.99Å; C188-C209 VanDerWaalsContact SG-SG 3.69Å; L195-C209 HydrophobicContact CD2-CB 3.68Å; C209-K211 PolarHBondContact O-N 3.31Å; C209-K211 VanDerWaalsContact O-N 3.15Å; C209-C212 PolarHBondContact O-N 2.9Å; C209-C212 VanDerWaalsContact O-N 3.14Å; C209-C212 PolarHBondContact SG-N 3.16Å; C209-C212 VanDerWaalsContact SG-N 3.42Å; C209-F213 WeakPolarHBondContact O-CB 3.42Å; C209-F213 PolarHBondContact O-N 3.08Å
210	L	88.8	Confident	89.1	Confident	41 Å²	41	67.6 Å²	67.6	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-57.6	-34.9	-175.3	-55.9	-171.5	0	0	0	113	H199 T201 G214 F231	H199-L210 HydrophobicContact CB-CD1 3.72Å; H199-L210 HydrophobicContact CB-CG 4.19Å; T201-L210 HydrophobicContact CG2-CD2 4.32Å; L210-G214 PolarHBondContact O-N 3.37Å; L210-F231 HydrophobicContact CB-CD2 4.33Å; L210-F231 HydrophobicContact CB-CE2 4Å; L210-F231 HydrophobicContact CB-CZ 4.29Å; L210-F231 HydrophobicContact CD1-CD1 3.77Å; L210-F231 HydrophobicContact CD1-CD2 4.16Å; L210-F231 HydrophobicContact CD1-CE1 3.83Å; L210-F231 HydrophobicContact CD1-CE2 4.24Å; L210-F231 HydrophobicContact CD1-CG 3.98Å; L210-F231 HydrophobicContact CD1-CZ 4.1Å; L210-F231 HydrophobicContact CD2-CE1 3.75Å; L210-F231 HydrophobicContact CD2-CE2 4.15Å; L210-F231 HydrophobicContact CD2-CZ 3.55Å; L210-F231 HydrophobicContact CG-CE1 4.31Å; L210-F231 HydrophobicContact CG-CE2 4.34Å; L210-F231 HydrophobicContact CG-CZ 4.18Å
211	K	88.8	Confident	88.9	Confident	182 Å²	182	64.4 Å²	64.4	79%	0.791	33%	0.326	S	S	*	.	H	α-helix	trans	-63.2	-50.8	177.2	-175.7	-177.9	179.8	-177.9	0	111.9	C209 S215	C209-K211 PolarHBondContact O-N 3.31Å; C209-K211 VanDerWaalsContact O-N 3.15Å; K211-S215 WeakPolarHBondContact O-CB 3.2Å; K211-S215 PolarHBondContact O-N 2.93Å
212	C	92.1	Very high	88.9	Confident	12 Å²	12	66.5 Å²	66.5	8%	0.081	33%	0.332	C	S	.	.	H	α-helix	trans	-68.3	-41.5	179.5	-70.5	0	0	0	0	111.4	N190 C209 G214 S215 L216	N190-C212 HydrophobicContact CB-CB 3.9Å; N190-C212 PolarHBondContact ND2-SG 3.12Å; C209-C212 PolarHBondContact O-N 2.9Å; C209-C212 VanDerWaalsContact O-N 3.14Å; C209-C212 PolarHBondContact SG-N 3.16Å; C209-C212 VanDerWaalsContact SG-N 3.42Å; C212-G214 PolarHBondContact O-N 3.46Å; C212-S215 PolarHBondContact O-N 2.79Å; C212-L216 WeakPolarHBondContact O-CB 3.43Å; C212-L216 VanDerWaalsContact O-CG 3.25Å; C212-L216 WeakPolarHBondContact O-CG 3.47Å; C212-L216 PolarHBondContact O-N 2.91Å
213	F	90.1	Very high	88.9	Confident	50 Å²	50	67.6 Å²	67.6	22%	0.219	34%	0.344	C	S	.	.	H	α-helix	trans	-59	-48.3	176.5	-173	-91.2	0	0	0	111.5	T201 R203 C209 S215 L216 Y217	T201-F213 HydrophobicContact CG2-CB 3.67Å; T201-F213 HydrophobicContact CG2-CD1 3.64Å; T201-F213 HydrophobicContact CG2-CD2 3.34Å; T201-F213 HydrophobicContact CG2-CE1 4.1Å; T201-F213 HydrophobicContact CG2-CE2 3.82Å; T201-F213 HydrophobicContact CG2-CG 3.24Å; T201-F213 HydrophobicContact CG2-CZ 4.18Å; R203-F213 HydrophobicContact CB-CE2 3.99Å; C209-F213 WeakPolarHBondContact O-CB 3.42Å; C209-F213 PolarHBondContact O-N 3.08Å; F213-S215 PolarHBondContact O-N 2.9Å; F213-L216 PolarHBondContact O-N 3.47Å; F213-Y217 AromaticContact CD2-CD2 3.42Å; F213-Y217 HydrophobicContact CD2-CD2 3.42Å; F213-Y217 VanDerWaalsContact CD2-CD2 3.42Å; F213-Y217 AromaticContact CD2-CE2 3.95Å; F213-Y217 HydrophobicContact CD2-CE2 3.95Å; F213-Y217 HydrophobicContact CD2-CG 4.49Å; F213-Y217 AromaticContact CE2-CD2 3.62Å; F213-Y217 HydrophobicContact CE2-CD2 3.62Å; F213-Y217 HydrophobicContact CE2-CE2 4.27Å; F213-Y217 HydrophobicContact CE2-CG 4.38Å; F213-Y217 AromaticContact CG-CD2 3.96Å; F213-Y217 HydrophobicContact CG-CD2 3.96Å; F213-Y217 HydrophobicContact CZ-CD2 4.3Å; F213-Y217 WeakPolarHBondContact O-CB 3.25Å; F213-Y217 PolarHBondContact O-N 2.9Å
214	G	86.8	Confident	88.9	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.01	34%	0.34	C	S	.	.	H	α-helix	trans	-59.8	-44.8	175.9	0	0	0	0	0	112.7	L210 C212 L216 A218 P227	L210-G214 PolarHBondContact O-N 3.37Å; C212-G214 PolarHBondContact O-N 3.46Å; G214-L216 PolarHBondContact O-N 3.27Å; G214-A218 WeakPolarHBondContact O-CB 3.33Å; G214-A218 PolarHBondContact O-N 3.34Å; G214-A218 VanDerWaalsContact O-N 3.12Å; G214-P227 WeakPolarHBondContact O-CB 3.23Å
215	S	86.4	Confident	88.9	Confident	81 Å²	81	62.8 Å²	62.8	57%	0.566	34%	0.336	S	S	*	.	H	α-helix	trans	-66.4	-33.9	-180	-172.5	0	0	0	0	114	K211 C212 F213	K211-S215 WeakPolarHBondContact O-CB 3.2Å; K211-S215 PolarHBondContact O-N 2.93Å; C212-S215 PolarHBondContact O-N 2.79Å; F213-S215 PolarHBondContact O-N 2.9Å
216	L	86.3	Confident	89	Confident	82 Å²	82	63.9 Å²	63.9	43%	0.429	34%	0.336	S	S	.	.	H	α-helix	trans	-90	-33.1	-175	-68.6	170.1	0	0	0	112.6	N190 Y208 C212 F213 G214	N190-L216 HydrophobicContact CB-CD1 3.99Å; Y208-L216 HydrophobicContact CD1-CD1 4.24Å; Y208-L216 HydrophobicContact CE1-CD1 4.03Å; C212-L216 WeakPolarHBondContact O-CB 3.43Å; C212-L216 VanDerWaalsContact O-CG 3.25Å; C212-L216 WeakPolarHBondContact O-CG 3.47Å; C212-L216 PolarHBondContact O-N 2.91Å; F213-L216 PolarHBondContact O-N 3.47Å; G214-L216 PolarHBondContact O-N 3.27Å
217	Y	84.6	Confident	88.7	Confident	76 Å²	76	64 Å²	64	30%	0.298	34%	0.335	S	S	.	.	H	α-helix	trans	-129.4	-17.4	-164.3	-51.7	-56.5	0	0	0	115.1	R203 Y208 F213	R203-Y217 VanDerWaalsContact NH1-CG 3.32Å; Y208-Y217 HydrophobicContact CD1-CE2 4.26Å; Y208-Y217 HydrophobicContact CD2-CE2 4.34Å; Y208-Y217 HydrophobicContact CE1-CE2 4.09Å; Y208-Y217 HydrophobicContact CE2-CE2 4.19Å; Y208-Y217 HydrophobicContact CG-CE2 4.39Å; Y208-Y217 VanDerWaalsContact CZ-OH 3.28Å; Y208-Y217 PolarHBondContact OH-OH 3.42Å; Y208-Y217 VanDerWaalsContact OH-OH 3.08Å; F213-Y217 AromaticContact CD2-CD2 3.42Å; F213-Y217 HydrophobicContact CD2-CD2 3.42Å; F213-Y217 VanDerWaalsContact CD2-CD2 3.42Å; F213-Y217 AromaticContact CD2-CE2 3.95Å; F213-Y217 HydrophobicContact CD2-CE2 3.95Å; F213-Y217 HydrophobicContact CD2-CG 4.49Å; F213-Y217 AromaticContact CE2-CD2 3.62Å; F213-Y217 HydrophobicContact CE2-CD2 3.62Å; F213-Y217 HydrophobicContact CE2-CE2 4.27Å; F213-Y217 HydrophobicContact CE2-CG 4.38Å; F213-Y217 AromaticContact CG-CD2 3.96Å; F213-Y217 HydrophobicContact CG-CD2 3.96Å; F213-Y217 HydrophobicContact CZ-CD2 4.3Å; F213-Y217 WeakPolarHBondContact O-CB 3.25Å; F213-Y217 PolarHBondContact O-N 2.9Å
218	A	84.3	Confident	88.3	Confident	25 Å²	25	64.6 Å²	64.6	21%	0.207	34%	0.337	C	S	.	.	S	Bend	trans	-75.6	143.9	176.7	0	0	0	0	0	110.6	G214 P227 T229	G214-A218 WeakPolarHBondContact O-CB 3.33Å; G214-A218 PolarHBondContact O-N 3.34Å; G214-A218 VanDerWaalsContact O-N 3.12Å; A218-P227 HydrophobicContact CB-CB 4.05Å; A218-T229 HydrophobicContact CB-CG2 4.22Å
219	K	84.5	Confident	87.4	Confident	138 Å²	138	66.3 Å²	66.3	60%	0.6	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-59.6	144.5	166.9	-67.4	-72.9	-172.3	168.2	0	109.2	I228	K219-I228 PolarHBondContact O-N 2.87Å
220	K	88.4	Confident	86.1	Confident	132 Å²	132	68.4 Å²	68.4	57%	0.574	38%	0.375	S	S	*	.	B	Isolated β-bridge	trans	-94	143.1	-179.5	-65.9	179.3	-178.6	178	0	109.2
221	C	89.6	Confident	84.8	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.007	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-67.1	129.5	171.9	173	0	0	0	0	109.8	A223 C224 S225 K226 I228 Q243 H245 C248	C221-A223 VanDerWaalsContact C-N 3.28Å; C221-A223 PolarHBondContact O-N 3.18Å; C221-C224 VanDerWaalsContact SG-SG 3.67Å; C221-S225 WeakPolarHBondContact O-CA 3.48Å; C221-S225 PolarHBondContact O-N 3.33Å; C221-K226 PolarHBondContact N-O 3.45Å; C221-I228 HydrophobicContact CB-CD1 4.24Å; C221-I228 HydrophobicContact CB-CG1 4.03Å; C221-Q243 CarbonylContact C-O 3.59Å; C221-Q243 VanDerWaalsContact CA-O 3.28Å; C221-Q243 WeakPolarHBondContact CA-O 3.26Å; C221-H245 WeakPolarHBondContact CB-CE1 3.28Å; C221-H245 VanDerWaalsContact CB-ND1 3.26Å; C221-H245 WeakPolarHBondContact CB-ND1 3.36Å; C221-H245 PolarHBondContact SG-N 3.48Å; C221-H245 PolarHBondContact SG-ND1 3.31Å; C221-H245 VanDerWaalsContact SG-ND1 3.44Å; C221-C248 VanDerWaalsContact SG-CB 3.51Å
222	E	91.3	Very high	83.2	Confident	89 Å²	89	67.2 Å²	67.2	42%	0.416	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-39.6	-178	-162.1	63.2	-143.4	0	0	111.5	R242 Q243 W244	E222-R242 HydrophobicContact CG-CG 4.41Å; E222-Q243 PolarHBondContact N-O 3.21Å; E222-W244 HydrophobicContact CB-CD2 4.33Å; E222-W244 HydrophobicContact CB-CZ2 3.99Å; E222-W244 HydrophobicContact CG-CZ2 4.19Å
223	A	89.5	Confident	81.5	Confident	65 Å²	65	69.9 Å²	69.9	54%	0.537	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-35	-175.8	0	0	0	0	0	114.6	C221 C248	C221-A223 VanDerWaalsContact C-N 3.28Å; C221-A223 PolarHBondContact O-N 3.18Å; A223-C248 HydrophobicContact CB-CB 4.08Å
224	C	89.6	Confident	80	Confident	46 Å²	46	70 Å²	70	31%	0.311	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-2.9	-174.6	78	0	0	0	0	114.3	C221 K226 H245	C221-C224 VanDerWaalsContact SG-SG 3.67Å; C224-K226 PolarHBondContact O-N 2.93Å; C224-H245 PolarHBondContact SG-CE1 3.21Å; C224-H245 PolarHBondContact SG-ND1 3.31Å; C224-H245 VanDerWaalsContact SG-ND1 3.36Å
225	S	88.4	Confident	79.5	Confident	87 Å²	87	78 Å²	78	61%	0.608	47%	0.469	S	S	*	.			trans	58.1	4.7	-176.4	-65.3	0	0	0	0	115.7	C221	C221-S225 WeakPolarHBondContact O-CA 3.48Å; C221-S225 PolarHBondContact O-N 3.33Å
226	K	85.9	Confident	79.5	Confident	142 Å²	142	79.9 Å²	79.9	62%	0.617	47%	0.465	S	S	*	.			trans	-82.6	147	178.1	-62.7	177.5	-176.3	175.4	0	110.9	C221 C224 H245	C221-K226 PolarHBondContact N-O 3.45Å; C224-K226 PolarHBondContact O-N 2.93Å; K226-H245 PolarHBondContact O-CE1 2.97Å
227	P	85.4	Confident	79.6	Confident	42 Å²	42	78 Å²	78	27%	0.273	46%	0.455	S	S	.	.	B	Isolated β-bridge	trans	-50.8	135	172.8	-32.6	39.5	0	0	0	114	G214 A218 T229 H245	G214-P227 WeakPolarHBondContact O-CB 3.23Å; A218-P227 HydrophobicContact CB-CB 4.05Å; P227-T229 HydrophobicContact CB-CG2 3.81Å; P227-T229 PolarHBondContact O-N 2.83Å; P227-H245 PolarHBondContact O-NE2 3.07Å
228	I	85.3	Confident	79.9	Confident	25 Å²	25	78 Å²	78	13%	0.128	47%	0.466	C	S	.	.			trans	-87.8	90.9	168.2	-58	176.4	0	0	0	107.4	K219 C221 Y236 Q243	K219-I228 PolarHBondContact O-N 2.87Å; C221-I228 HydrophobicContact CB-CD1 4.24Å; C221-I228 HydrophobicContact CB-CG1 4.03Å; I228-Y236 HydrophobicContact CG2-CD1 4.24Å; I228-Y236 HydrophobicContact CG2-CG 4.02Å; I228-Q243 HydrophobicContact CD1-CB 3.47Å; I228-Q243 VanDerWaalsContact CD1-CB 3.47Å
229	T	75.6	Confident	80.1	Confident	60 Å²	60	80 Å²	80	37%	0.368	47%	0.47	S	S	.	.			trans	-99	129.1	179.1	63	0	0	0	0	109.6	A218 P227 F231	A218-T229 HydrophobicContact CB-CG2 4.22Å; P227-T229 HydrophobicContact CB-CG2 3.81Å; P227-T229 PolarHBondContact O-N 2.83Å; T229-F231 HydrophobicContact CG2-CE2 4.49Å; T229-F231 PolarHBondContact O-N 3.02Å
230	G	67.1	Low	80.3	Confident	59 Å²	59	80.3 Å²	80.3	61%	0.608	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-66.5	6	-173.8	0	0	0	0	0	116.1	G232	G230-G232 VanDerWaalsContact C-N 3.29Å; G230-G232 PolarHBondContact O-N 2.9Å
231	F	60.9	Low	80.2	Confident	121 Å²	121	81.5 Å²	81.5	53%	0.531	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-82.9	3.4	-169.3	-52.4	-67	0	0	0	114.6	L210 T229	L210-F231 HydrophobicContact CB-CD2 4.33Å; L210-F231 HydrophobicContact CB-CE2 4Å; L210-F231 HydrophobicContact CB-CZ 4.29Å; L210-F231 HydrophobicContact CD1-CD1 3.77Å; L210-F231 HydrophobicContact CD1-CD2 4.16Å; L210-F231 HydrophobicContact CD1-CE1 3.83Å; L210-F231 HydrophobicContact CD1-CE2 4.24Å; L210-F231 HydrophobicContact CD1-CG 3.98Å; L210-F231 HydrophobicContact CD1-CZ 4.1Å; L210-F231 HydrophobicContact CD2-CE1 3.75Å; L210-F231 HydrophobicContact CD2-CE2 4.15Å; L210-F231 HydrophobicContact CD2-CZ 3.55Å; L210-F231 HydrophobicContact CG-CE1 4.31Å; L210-F231 HydrophobicContact CG-CE2 4.34Å; L210-F231 HydrophobicContact CG-CZ 4.18Å; T229-F231 HydrophobicContact CG2-CE2 4.49Å; T229-F231 PolarHBondContact O-N 3.02Å
232	G	55.5	Low	80.3	Confident	78 Å²	78	83.9 Å²	83.9	80%	0.804	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-122	29.3	-176.6	0	0	0	0	0	115.6	G230	G230-G232 VanDerWaalsContact C-N 3.29Å; G230-G232 PolarHBondContact O-N 2.9Å
233	G	56.2	Low	80.3	Confident	67 Å²	67	81.5 Å²	81.5	69%	0.691	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.5	18.7	179.3	0	0	0	0	0	115.5	K235	G233-K235 VanDerWaalsContact C-N 3.3Å; G233-K235 PolarHBondContact O-N 3.43Å
234	G	59.7	Low	80.4	Confident	54 Å²	54	78.8 Å²	78.8	56%	0.557	46%	0.46	S	S	*	.	S	Bend	trans	68.5	5.7	150.1	0	0	0	0	0	119
235	K	74.3	Confident	80.4	Confident	167 Å²	167	78.6 Å²	78.6	73%	0.726	46%	0.455	S	S	*	.			trans	-111.4	115.9	-179.2	-63.1	-176.1	-175.6	-178.1	0	111.2	G233	G233-K235 VanDerWaalsContact C-N 3.3Å; G233-K235 PolarHBondContact O-N 3.43Å
236	Y	87.3	Confident	80.4	Confident	122 Å²	122	78.5 Å²	78.5	48%	0.478	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	155.7	170.4	62.7	-86.2	0	0	0	108.4	I228 W244	I228-Y236 HydrophobicContact CG2-CD1 4.24Å; I228-Y236 HydrophobicContact CG2-CG 4.02Å; Y236-W244 WeakPolarHBondContact CA-O 3.39Å; Y236-W244 WeakPolarHBondContact CB-O 3.44Å
237	I	89	Confident	80.6	Confident	43 Å²	43	76.9 Å²	76.9	22%	0.221	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	129.6	176.4	-54.1	-61	0	0	0	107.4	Q243 W244 F249	I237-Q243 CarbonylContact O-C 3.59Å; I237-Q243 WeakPolarHBondContact O-CA 3.35Å; I237-W244 PolarHBondContact N-O 3.48Å; I237-W244 PolarHBondContact O-N 3.49Å; I237-F249 HydrophobicContact CB-CB 4.35Å; I237-F249 HydrophobicContact CB-CD2 4.13Å; I237-F249 HydrophobicContact CB-CG 4.09Å; I237-F249 HydrophobicContact CG1-CB 4.01Å; I237-F249 HydrophobicContact CG1-CD1 4.26Å; I237-F249 HydrophobicContact CG1-CG 4.04Å; I237-F249 HydrophobicContact CG2-CD1 4.07Å; I237-F249 HydrophobicContact CG2-CD2 3.79Å; I237-F249 HydrophobicContact CG2-CE1 4.08Å; I237-F249 HydrophobicContact CG2-CE2 3.81Å; I237-F249 HydrophobicContact CG2-CG 3.93Å; I237-F249 HydrophobicContact CG2-CZ 3.96Å
238	S	90.1	Very high	80.9	Confident	75 Å²	75	76.3 Å²	76.3	52%	0.524	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130	175	56.4	0	0	0	0	109.8
239	F	89.6	Confident	81.3	Confident	67 Å²	67	75.3 Å²	75.3	29%	0.294	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	125.2	171.1	177.4	-102	0	0	0	108.1	D241 R242 W244 F263 P265	F239-D241 PolarHBondContact O-N 3.36Å; F239-R242 PolarHBondContact N-O 3.33Å; F239-R242 VanDerWaalsContact N-O 3.07Å; F239-R242 PolarHBondContact O-N 3.44Å; F239-R242 VanDerWaalsContact O-O 3.13Å; F239-W244 HydrophobicContact CB-CH2 4.48Å; F239-W244 HydrophobicContact CB-CZ3 3.96Å; F239-F263 HydrophobicContact CB-CZ 4.14Å; F239-F263 AromaticContact CD1-CE2 3.93Å; F239-F263 HydrophobicContact CD1-CE2 3.93Å; F239-F263 HydrophobicContact CD1-CZ 4.07Å; F239-F263 HydrophobicContact CD2-CE2 4.23Å; F239-F263 AromaticContact CD2-CZ 3.59Å; F239-F263 HydrophobicContact CD2-CZ 3.59Å; F239-F263 HydrophobicContact CE1-CE2 4.08Å; F239-F263 HydrophobicContact CE1-CZ 4.4Å; F239-F263 HydrophobicContact CE2-CE2 4.36Å; F239-F263 AromaticContact CE2-CZ 3.94Å; F239-F263 HydrophobicContact CE2-CZ 3.94Å; F239-F263 AromaticContact CG-CE2 4Å; F239-F263 HydrophobicContact CG-CE2 4Å; F239-F263 AromaticContact CG-CZ 3.65Å; F239-F263 HydrophobicContact CG-CZ 3.65Å; F239-F263 HydrophobicContact CZ-CE2 4.29Å; F239-F263 HydrophobicContact CZ-CZ 4.33Å; F239-P265 HydrophobicContact CE1-CB 4.29Å; F239-P265 HydrophobicContact CE1-CG 4.14Å; F239-P265 HydrophobicContact CZ-CG 4.37Å
240	E	88.3	Confident	82.2	Confident	144 Å²	144	74.4 Å²	74.4	67%	0.673	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	-132.7	-167.8	-58.9	178.7	158.8	0	0	110.9	R242	E240-R242 VanDerWaalsContact C-N 3.31Å
241	D	86.7	Confident	83.5	Confident	158 Å²	158	71.6 Å²	71.6	85%	0.845	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-1.2	176.7	-69.8	-60.4	0	0	0	113.7	F239	F239-D241 PolarHBondContact O-N 3.36Å
242	R	90	Very high	85	Confident	50 Å²	50	68.9 Å²	68.9	19%	0.189	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	148.2	-175.7	-62.1	176.4	-176.8	174.5	1.2	111.4	E222 F239 E240 W244 G267 D268	E222-R242 HydrophobicContact CG-CG 4.41Å; F239-R242 PolarHBondContact N-O 3.33Å; F239-R242 VanDerWaalsContact N-O 3.07Å; F239-R242 PolarHBondContact O-N 3.44Å; F239-R242 VanDerWaalsContact O-O 3.13Å; E240-R242 VanDerWaalsContact C-N 3.31Å; R242-W244 HydrophobicContact CB-CE3 4.39Å; R242-W244 HydrophobicContact CB-CH2 3.21Å; R242-W244 HydrophobicContact CB-CZ2 3.87Å; R242-W244 HydrophobicContact CB-CZ3 3.51Å; R242-W244 HydrophobicContact CG-CH2 4.17Å; R242-W244 WeakPolarHBondContact O-CZ3 3.35Å; R242-G267 VanDerWaalsContact CZ-O 3.31Å; R242-G267 PolarHBondContact NH1-O 3.21Å; R242-G267 PolarHBondContact NH2-O 2.95Å; R242-D268 IonicContact CZ-OD1 3.35Å; R242-D268 IonicContact NH2-OD1 3.43Å; R242-D268 PolarHBondContact NH2-OD1 3.09Å
243	Q	91.6	Very high	86.8	Confident	39 Å²	39	70.7 Å²	70.7	18%	0.182	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	144.7	-176.9	-59.1	-176.3	-10.7	0	0	110.7	C221 E222 I228 I237	C221-Q243 CarbonylContact C-O 3.59Å; C221-Q243 VanDerWaalsContact CA-O 3.28Å; C221-Q243 WeakPolarHBondContact CA-O 3.26Å; E222-Q243 PolarHBondContact N-O 3.21Å; I228-Q243 HydrophobicContact CD1-CB 3.47Å; I228-Q243 VanDerWaalsContact CD1-CB 3.47Å; I237-Q243 CarbonylContact O-C 3.59Å; I237-Q243 WeakPolarHBondContact O-CA 3.35Å
244	W	91.7	Very high	88.5	Confident	9 Å²	9	70.6 Å²	70.6	3%	0.034	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	145.5	178.3	-62.6	-103.3	0	0	0	110.5	E222 Y236 I237 F239 R242 C248 F249 I270	E222-W244 HydrophobicContact CB-CD2 4.33Å; E222-W244 HydrophobicContact CB-CZ2 3.99Å; E222-W244 HydrophobicContact CG-CZ2 4.19Å; Y236-W244 WeakPolarHBondContact CA-O 3.39Å; Y236-W244 WeakPolarHBondContact CB-O 3.44Å; I237-W244 PolarHBondContact N-O 3.48Å; I237-W244 PolarHBondContact O-N 3.49Å; F239-W244 HydrophobicContact CB-CH2 4.48Å; F239-W244 HydrophobicContact CB-CZ3 3.96Å; R242-W244 HydrophobicContact CB-CE3 4.39Å; R242-W244 HydrophobicContact CB-CH2 3.21Å; R242-W244 HydrophobicContact CB-CZ2 3.87Å; R242-W244 HydrophobicContact CB-CZ3 3.51Å; R242-W244 HydrophobicContact CG-CH2 4.17Å; R242-W244 WeakPolarHBondContact O-CZ3 3.35Å; W244-C248 HydrophobicContact CB-CB 4.49Å; W244-F249 HydrophobicContact CB-CB 4.17Å; W244-F249 HydrophobicContact CB-CD2 4.13Å; W244-F249 AromaticContact CD2-CD2 3.82Å; W244-F249 HydrophobicContact CD2-CD2 3.82Å; W244-F249 HydrophobicContact CD2-CE2 4.24Å; W244-F249 AromaticContact CE3-CD2 3.97Å; W244-F249 HydrophobicContact CE3-CD2 3.97Å; W244-F249 HydrophobicContact CE3-CE2 4.06Å; W244-F249 AromaticContact CG-CD2 3.9Å; W244-F249 HydrophobicContact CG-CD2 3.9Å; W244-F249 HydrophobicContact CZ3-CE2 4.31Å; W244-I270 HydrophobicContact CZ2-CD1 4.34Å; W244-I270 HydrophobicContact CZ2-CG2 4.21Å
245	H	89.7	Confident	90.1	Very high	42 Å²	42	72.1 Å²	72.1	19%	0.194	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	143.3	156.4	-53.1	109.6	0	0	0	108.2	C221 C224 K226 P227 P247 C248 F249	C221-H245 WeakPolarHBondContact CB-CE1 3.28Å; C221-H245 VanDerWaalsContact CB-ND1 3.26Å; C221-H245 WeakPolarHBondContact CB-ND1 3.36Å; C221-H245 PolarHBondContact SG-N 3.48Å; C221-H245 PolarHBondContact SG-ND1 3.31Å; C221-H245 VanDerWaalsContact SG-ND1 3.44Å; C224-H245 PolarHBondContact SG-CE1 3.21Å; C224-H245 PolarHBondContact SG-ND1 3.31Å; C224-H245 VanDerWaalsContact SG-ND1 3.36Å; K226-H245 PolarHBondContact O-CE1 2.97Å; P227-H245 PolarHBondContact O-NE2 3.07Å; H245-P247 VanDerWaalsContact C-CD 3.49Å; H245-P247 VanDerWaalsContact C-N 3.34Å; H245-P247 HydrophobicContact CB-CG 4.12Å; H245-C248 HydrophobicContact CB-CB 4.03Å; H245-C248 CarbonylContact O-C 3.53Å; H245-C248 WeakPolarHBondContact O-CA 3.45Å; H245-C248 WeakPolarHBondContact O-CB 3.36Å; H245-C248 PolarHBondContact O-N 3.45Å; H245-F249 PolarHBondContact O-N 2.85Å
246	Q	89.3	Confident	91.1	Very high	84 Å²	84	68.8 Å²	68.8	39%	0.393	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-48.2	-46	175.8	-171.8	178.2	-25.9	0	0	114.3	C248 F249 V259	Q246-C248 PolarHBondContact O-N 2.82Å; Q246-F249 PolarHBondContact O-N 3.05Å; Q246-V259 HydrophobicContact CG-CG1 4.38Å; Q246-V259 HydrophobicContact CG-CG2 3.86Å
247	P	89.8	Confident	91.4	Very high	109 Å²	109	66.1 Å²	66.1	71%	0.708	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-69.6	-16.6	175.3	27.8	-37.4	0	0	0	114.4	H245	H245-P247 VanDerWaalsContact C-CD 3.49Å; H245-P247 VanDerWaalsContact C-N 3.34Å; H245-P247 HydrophobicContact CB-CG 4.12Å
248	C	91.4	Very high	91.6	Very high	29 Å²	29	64.2 Å²	64.2	20%	0.196	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-91.2	-4.5	178.3	-66	0	0	0	0	113	C221 A223 W244 H245 Q246 T250	C221-C248 VanDerWaalsContact SG-CB 3.51Å; A223-C248 HydrophobicContact CB-CB 4.08Å; W244-C248 HydrophobicContact CB-CB 4.49Å; H245-C248 HydrophobicContact CB-CB 4.03Å; H245-C248 CarbonylContact O-C 3.53Å; H245-C248 WeakPolarHBondContact O-CA 3.45Å; H245-C248 WeakPolarHBondContact O-CB 3.36Å; H245-C248 PolarHBondContact O-N 3.45Å; Q246-C248 PolarHBondContact O-N 2.82Å; C248-T250 VanDerWaalsContact C-N 3.33Å; C248-T250 PolarHBondContact O-N 2.79Å; C248-T250 VanDerWaalsContact O-N 3.11Å
249	F	93.6	Very high	91.7	Very high	5 Å²	5	63.1 Å²	63.1	2%	0.022	35%	0.348	C	S	.	.			trans	-85.3	77.7	177.5	-165.2	-111.9	0	0	0	110.1	I237 W244 H245 Q246 L258 V259 F263 I270	I237-F249 HydrophobicContact CB-CB 4.35Å; I237-F249 HydrophobicContact CB-CD2 4.13Å; I237-F249 HydrophobicContact CB-CG 4.09Å; I237-F249 HydrophobicContact CG1-CB 4.01Å; I237-F249 HydrophobicContact CG1-CD1 4.26Å; I237-F249 HydrophobicContact CG1-CG 4.04Å; I237-F249 HydrophobicContact CG2-CD1 4.07Å; I237-F249 HydrophobicContact CG2-CD2 3.79Å; I237-F249 HydrophobicContact CG2-CE1 4.08Å; I237-F249 HydrophobicContact CG2-CE2 3.81Å; I237-F249 HydrophobicContact CG2-CG 3.93Å; I237-F249 HydrophobicContact CG2-CZ 3.96Å; W244-F249 HydrophobicContact CB-CB 4.17Å; W244-F249 HydrophobicContact CB-CD2 4.13Å; W244-F249 AromaticContact CD2-CD2 3.82Å; W244-F249 HydrophobicContact CD2-CD2 3.82Å; W244-F249 HydrophobicContact CD2-CE2 4.24Å; W244-F249 AromaticContact CE3-CD2 3.97Å; W244-F249 HydrophobicContact CE3-CD2 3.97Å; W244-F249 HydrophobicContact CE3-CE2 4.06Å; W244-F249 AromaticContact CG-CD2 3.9Å; W244-F249 HydrophobicContact CG-CD2 3.9Å; W244-F249 HydrophobicContact CZ3-CE2 4.31Å; H245-F249 PolarHBondContact O-N 2.85Å; Q246-F249 PolarHBondContact O-N 3.05Å; F249-L258 HydrophobicContact CD1-CB 3.6Å; F249-L258 HydrophobicContact CE1-CB 3.48Å; F249-L258 VanDerWaalsContact CE1-CB 3.48Å; F249-L258 WeakPolarHBondContact CE1-O 3.42Å; F249-L258 HydrophobicContact CG-CB 4.48Å; F249-L258 HydrophobicContact CZ-CB 4.27Å; F249-L258 PolarHBondContact O-N 3.44Å; F249-V259 HydrophobicContact CB-CG2 4.18Å; F249-V259 HydrophobicContact CD1-CG2 4.1Å; F249-F263 HydrophobicContact CE1-CD1 4.14Å; F249-F263 HydrophobicContact CE1-CE1 4.37Å; F249-F263 AromaticContact CZ-CD1 3.74Å; F249-F263 HydrophobicContact CZ-CD1 3.74Å; F249-F263 HydrophobicContact CZ-CD2 4.31Å; F249-F263 AromaticContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE2 4.3Å; F249-F263 HydrophobicContact CZ-CG 4.04Å; F249-F263 HydrophobicContact CZ-CZ 4.01Å; F249-I270 HydrophobicContact CD2-CD1 3.66Å; F249-I270 HydrophobicContact CE2-CD1 3.56Å; F249-I270 HydrophobicContact CG-CD1 4.46Å; F249-I270 HydrophobicContact CZ-CD1 4.28Å
250	T	94.5	Very high	91.6	Very high	41 Å²	41	64.3 Å²	64.3	25%	0.252	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-130.9	155.7	-173.7	56.5	0	0	0	0	112.2	C248 S252 S255 I256 I270	C248-T250 VanDerWaalsContact C-N 3.33Å; C248-T250 PolarHBondContact O-N 2.79Å; C248-T250 VanDerWaalsContact O-N 3.11Å; T250-S252 PolarHBondContact O-N 3.34Å; T250-S255 WeakPolarHBondContact CB-O 3.36Å; T250-S255 WeakPolarHBondContact CG2-O 3.15Å; T250-I256 CarbonylContact C-O 3.6Å; T250-I256 WeakPolarHBondContact CA-O 3.16Å; T250-I256 WeakPolarHBondContact CB-O 3.39Å; T250-I270 WeakPolarHBondContact O-CG1 3.39Å
251	C	94.8	Very high	91.6	Very high	0 Å²	0	60 Å²	60	0%	0	37%	0.367	C	S	.	.			trans	-62.4	130	175.6	177.1	0	0	0	0	111.1	Q253 C254 S255 I256 L258 I270 C272 C275	C251-Q253 PolarHBondContact O-N 3.43Å; C251-Q253 VanDerWaalsContact O-N 3.13Å; C251-C254 VanDerWaalsContact CB-SG 3.56Å; C251-S255 WeakPolarHBondContact O-CA 3.48Å; C251-S255 PolarHBondContact O-N 2.92Å; C251-I256 HydrophobicContact CB-CG2 3.88Å; C251-I256 PolarHBondContact N-O 2.94Å; C251-L258 HydrophobicContact CB-CD1 4.4Å; C251-L258 HydrophobicContact CB-CD2 4.32Å; C251-L258 HydrophobicContact CB-CG 4.46Å; C251-I270 CarbonylContact C-O 3.53Å; C251-I270 WeakPolarHBondContact CA-O 3.43Å; C251-C272 HydrophobicContact CB-CB 4.09Å; C251-C272 PolarHBondContact SG-N 3.38Å; C251-C275 VanDerWaalsContact SG-SG 3.61Å
252	S	92.9	Very high	91.7	Very high	64 Å²	64	55.2 Å²	55.2	45%	0.448	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.3	-177.7	-54.6	0	0	0	0	114.6	T250 I270	T250-S252 PolarHBondContact O-N 3.34Å; S252-I270 PolarHBondContact N-O 3.23Å; S252-I270 PolarHBondContact OG-N 3.33Å; S252-I270 PolarHBondContact OG-O 2.86Å
253	Q	91.7	Very high	91.9	Very high	115 Å²	115	55.3 Å²	55.3	54%	0.537	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-47.2	178.5	-70.8	-175.3	1.6	0	0	113.1	C251 L271 C275	C251-Q253 PolarHBondContact O-N 3.43Å; C251-Q253 VanDerWaalsContact O-N 3.13Å; Q253-L271 HydrophobicContact CB-CD2 4.49Å; Q253-L271 HydrophobicContact CG-CD2 3.82Å; Q253-C275 HydrophobicContact CB-CB 4.31Å; Q253-C275 PolarHBondContact OE1-SG 3.49Å
254	C	93.8	Very high	92	Very high	66 Å²	66	57.3 Å²	57.3	45%	0.446	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-2.5	-173.6	68.7	0	0	0	0	114.3	C251 I256	C251-C254 VanDerWaalsContact CB-SG 3.56Å; C254-I256 PolarHBondContact O-N 2.88Å; C254-I256 VanDerWaalsContact O-N 3.07Å; C254-I256 WeakPolarHBondContact SG-CG2 3.49Å
255	S	93.1	Very high	92	Very high	86 Å²	86	60.2 Å²	60.2	60%	0.601	39%	0.386	S	S	*	.			trans	60.8	11.6	179.1	-56.2	0	0	0	0	116	T250 C251	T250-S255 WeakPolarHBondContact CB-O 3.36Å; T250-S255 WeakPolarHBondContact CG2-O 3.15Å; C251-S255 WeakPolarHBondContact O-CA 3.48Å; C251-S255 PolarHBondContact O-N 2.92Å
256	I	94.1	Very high	91.9	Very high	96 Å²	96	62.1 Å²	62.1	49%	0.492	40%	0.398	S	S	.	.			trans	-64.7	142.4	174.2	-160.5	168.6	0	0	0	110.6	T250 C251 C254 L258 C272	T250-I256 CarbonylContact C-O 3.6Å; T250-I256 WeakPolarHBondContact CA-O 3.16Å; T250-I256 WeakPolarHBondContact CB-O 3.39Å; C251-I256 HydrophobicContact CB-CG2 3.88Å; C251-I256 PolarHBondContact N-O 2.94Å; C254-I256 PolarHBondContact O-N 2.88Å; C254-I256 VanDerWaalsContact O-N 3.07Å; C254-I256 WeakPolarHBondContact SG-CG2 3.49Å; I256-L258 HydrophobicContact CG2-CD2 4.41Å; I256-L258 PolarHBondContact O-N 3.11Å; I256-C272 HydrophobicContact CG2-CB 3.91Å
257	S	93.8	Very high	91.7	Very high	67 Å²	67	60.9 Å²	60.9	47%	0.469	41%	0.407	S	S	.	.	B	Isolated β-bridge	trans	-63.8	131.1	174.8	-171.4	0	0	0	0	110.8	V259	S257-V259 PolarHBondContact OG-N 3.07Å
258	L	93.7	Very high	91.4	Very high	2 Å²	2	61.8 Å²	61.8	1%	0.01	41%	0.406	C	S	.	.			trans	-98.3	3.5	177.4	-63.3	174.4	0	0	0	112.1	F249 C251 I256 G260 A261 F263 I270 C272	F249-L258 HydrophobicContact CD1-CB 3.6Å; F249-L258 HydrophobicContact CE1-CB 3.48Å; F249-L258 VanDerWaalsContact CE1-CB 3.48Å; F249-L258 WeakPolarHBondContact CE1-O 3.42Å; F249-L258 HydrophobicContact CG-CB 4.48Å; F249-L258 HydrophobicContact CZ-CB 4.27Å; F249-L258 PolarHBondContact O-N 3.44Å; C251-L258 HydrophobicContact CB-CD1 4.4Å; C251-L258 HydrophobicContact CB-CD2 4.32Å; C251-L258 HydrophobicContact CB-CG 4.46Å; I256-L258 HydrophobicContact CG2-CD2 4.41Å; I256-L258 PolarHBondContact O-N 3.11Å; L258-G260 PolarHBondContact O-N 2.93Å; L258-A261 PolarHBondContact O-N 2.77Å; L258-A261 VanDerWaalsContact O-N 3.09Å; L258-F263 HydrophobicContact CB-CB 4.44Å; L258-F263 HydrophobicContact CD1-CB 3.9Å; L258-F263 HydrophobicContact CD2-CB 4.27Å; L258-F263 HydrophobicContact CG-CB 4.44Å; L258-I270 HydrophobicContact CD1-CB 4.21Å; L258-I270 HydrophobicContact CD1-CD1 3.8Å; L258-I270 HydrophobicContact CD1-CG1 3.86Å; L258-C272 HydrophobicContact CD2-CB 3.61Å
259	V	91.2	Very high	91.3	Very high	53 Å²	53	66.2 Å²	66.2	32%	0.321	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	118.8	-177.4	179.4	0	0	0	0	109.7	Q246 F249 S257 A261	Q246-V259 HydrophobicContact CG-CG1 4.38Å; Q246-V259 HydrophobicContact CG-CG2 3.86Å; F249-V259 HydrophobicContact CB-CG2 4.18Å; F249-V259 HydrophobicContact CD1-CG2 4.1Å; S257-V259 PolarHBondContact OG-N 3.07Å; V259-A261 PolarHBondContact O-N 2.92Å
260	G	88.1	Confident	91.3	Very high	91 Å²	91	66.3 Å²	66.3	94%	0.938	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	2.6	-177.6	0	0	0	0	0	114.7	L258	L258-G260 PolarHBondContact O-N 2.93Å
261	A	88.1	Confident	91.3	Very high	53 Å²	53	64.4 Å²	64.4	44%	0.438	41%	0.411	S	S	.	.	S	Bend	trans	-103.9	158.7	174.6	0	0	0	0	0	110.9	L258 V259	L258-A261 PolarHBondContact O-N 2.77Å; L258-A261 VanDerWaalsContact O-N 3.09Å; V259-A261 PolarHBondContact O-N 2.92Å
262	G	89.6	Confident	91.3	Very high	58 Å²	58	64.9 Å²	64.9	60%	0.598	41%	0.414	S	S	*	.			trans	-69.8	138	168.4	0	0	0	0	0	111.1
263	F	94	Very high	91.2	Very high	53 Å²	53	70.3 Å²	70.3	23%	0.232	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	160.7	178.5	68.6	-84.5	0	0	0	111.1	F239 F249 L258 I270 L271	F239-F263 HydrophobicContact CB-CZ 4.14Å; F239-F263 AromaticContact CD1-CE2 3.93Å; F239-F263 HydrophobicContact CD1-CE2 3.93Å; F239-F263 HydrophobicContact CD1-CZ 4.07Å; F239-F263 HydrophobicContact CD2-CE2 4.23Å; F239-F263 AromaticContact CD2-CZ 3.59Å; F239-F263 HydrophobicContact CD2-CZ 3.59Å; F239-F263 HydrophobicContact CE1-CE2 4.08Å; F239-F263 HydrophobicContact CE1-CZ 4.4Å; F239-F263 HydrophobicContact CE2-CE2 4.36Å; F239-F263 AromaticContact CE2-CZ 3.94Å; F239-F263 HydrophobicContact CE2-CZ 3.94Å; F239-F263 AromaticContact CG-CE2 4Å; F239-F263 HydrophobicContact CG-CE2 4Å; F239-F263 AromaticContact CG-CZ 3.65Å; F239-F263 HydrophobicContact CG-CZ 3.65Å; F239-F263 HydrophobicContact CZ-CE2 4.29Å; F239-F263 HydrophobicContact CZ-CZ 4.33Å; F249-F263 HydrophobicContact CE1-CD1 4.14Å; F249-F263 HydrophobicContact CE1-CE1 4.37Å; F249-F263 AromaticContact CZ-CD1 3.74Å; F249-F263 HydrophobicContact CZ-CD1 3.74Å; F249-F263 HydrophobicContact CZ-CD2 4.31Å; F249-F263 AromaticContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE1 3.73Å; F249-F263 HydrophobicContact CZ-CE2 4.3Å; F249-F263 HydrophobicContact CZ-CG 4.04Å; F249-F263 HydrophobicContact CZ-CZ 4.01Å; L258-F263 HydrophobicContact CB-CB 4.44Å; L258-F263 HydrophobicContact CD1-CB 3.9Å; L258-F263 HydrophobicContact CD2-CB 4.27Å; L258-F263 HydrophobicContact CG-CB 4.44Å; F263-I270 HydrophobicContact CD2-CB 4.47Å; F263-I270 HydrophobicContact CD2-CG2 4.37Å; F263-L271 WeakPolarHBondContact CA-O 3.41Å
264	F	92.8	Very high	91.3	Very high	81 Å²	81	70.1 Å²	70.1	36%	0.355	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	118.3	-178.8	-62.4	-93.7	0	0	0	109.5	L271 R273 N276	F264-L271 PolarHBondContact N-O 2.92Å; F264-L271 PolarHBondContact O-N 2.91Å; F264-R273 HydrophobicContact CE2-CB 3.99Å; F264-R273 HydrophobicContact CE2-CG 4.16Å; F264-N276 HydrophobicContact CB-CB 4.04Å; F264-N276 WeakPolarHBondContact CB-OD1 3.43Å; F264-N276 HydrophobicContact CD2-CB 3.79Å; F264-N276 HydrophobicContact CE2-CB 4.5Å; F264-N276 HydrophobicContact CG-CB 3.93Å
265	P	91.1	Very high	91.2	Very high	70 Å²	70	67.7 Å²	67.7	46%	0.455	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	131.3	173.2	28.4	-30.7	0	0	0	110.8	F239	F239-P265 HydrophobicContact CE1-CB 4.29Å; F239-P265 HydrophobicContact CE1-CG 4.14Å; F239-P265 HydrophobicContact CZ-CG 4.37Å
266	D	88.2	Confident	91	Very high	82 Å²	82	66.1 Å²	66.1	44%	0.439	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	94.6	175.9	176.1	35.3	0	0	0	109.2	D268 K269 L271	D266-D268 PolarHBondContact O-N 3.3Å; D266-K269 PolarHBondContact N-O 3.25Å; D266-K269 WeakPolarHBondContact O-CB 3.4Å; D266-K269 PolarHBondContact O-N 2.89Å; D266-L271 HydrophobicContact CB-CD1 4.11Å
267	G	85.6	Confident	90.6	Very high	57 Å²	57	65.6 Å²	65.6	59%	0.588	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	-118.5	-172.2	0	0	0	0	0	111.9	R242 K269	R242-G267 VanDerWaalsContact CZ-O 3.31Å; R242-G267 PolarHBondContact NH1-O 3.21Å; R242-G267 PolarHBondContact NH2-O 2.95Å; G267-K269 VanDerWaalsContact C-N 3.35Å
268	D	84.3	Confident	89.7	Confident	129 Å²	129	69 Å²	69	69%	0.69	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-1.3	177	-63.6	-30.9	0	0	0	113.7	R242 D266	R242-D268 IonicContact CZ-OD1 3.35Å; R242-D268 IonicContact NH2-OD1 3.43Å; R242-D268 PolarHBondContact NH2-OD1 3.09Å; D266-D268 PolarHBondContact O-N 3.3Å
269	K	89.2	Confident	88.2	Confident	122 Å²	122	76.2 Å²	76.2	53%	0.53	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	155.7	-178.3	-62.4	176.9	-174.2	172	0	111.1	D266 G267	D266-K269 PolarHBondContact N-O 3.25Å; D266-K269 WeakPolarHBondContact O-CB 3.4Å; D266-K269 PolarHBondContact O-N 2.89Å; G267-K269 VanDerWaalsContact C-N 3.35Å
270	I	93.3	Very high	88	Confident	6 Å²	6	77.4 Å²	77.4	3%	0.031	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	131.8	170.4	58.7	176.9	0	0	0	108.8	W244 F249 T250 C251 S252 L258 F263	W244-I270 HydrophobicContact CZ2-CD1 4.34Å; W244-I270 HydrophobicContact CZ2-CG2 4.21Å; F249-I270 HydrophobicContact CD2-CD1 3.66Å; F249-I270 HydrophobicContact CE2-CD1 3.56Å; F249-I270 HydrophobicContact CG-CD1 4.46Å; F249-I270 HydrophobicContact CZ-CD1 4.28Å; T250-I270 WeakPolarHBondContact O-CG1 3.39Å; C251-I270 CarbonylContact C-O 3.53Å; C251-I270 WeakPolarHBondContact CA-O 3.43Å; S252-I270 PolarHBondContact N-O 3.23Å; S252-I270 PolarHBondContact OG-N 3.33Å; S252-I270 PolarHBondContact OG-O 2.86Å; L258-I270 HydrophobicContact CD1-CB 4.21Å; L258-I270 HydrophobicContact CD1-CD1 3.8Å; L258-I270 HydrophobicContact CD1-CG1 3.86Å; F263-I270 HydrophobicContact CD2-CB 4.47Å; F263-I270 HydrophobicContact CD2-CG2 4.37Å
271	L	93.9	Very high	88	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.005	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.7	-172.9	-58.6	176.8	0	0	0	111	Q253 F263 F264 D266 C275 N276 L279	Q253-L271 HydrophobicContact CB-CD2 4.49Å; Q253-L271 HydrophobicContact CG-CD2 3.82Å; F263-L271 WeakPolarHBondContact CA-O 3.41Å; F264-L271 PolarHBondContact N-O 2.92Å; F264-L271 PolarHBondContact O-N 2.91Å; D266-L271 HydrophobicContact CB-CD1 4.11Å; L271-C275 HydrophobicContact CB-CB 4.36Å; L271-C275 HydrophobicContact CD2-CB 4.41Å; L271-N276 HydrophobicContact CB-CB 4.26Å; L271-L279 HydrophobicContact CD1-CD1 3.26Å
272	C	94.5	Very high	88	Confident	11 Å²	11	77.9 Å²	77.9	7%	0.074	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	165.1	165.6	71.7	0	0	0	0	109.8	C251 I256 L258 D274 C275 N276	C251-C272 HydrophobicContact CB-CB 4.09Å; C251-C272 PolarHBondContact SG-N 3.38Å; I256-C272 HydrophobicContact CG2-CB 3.91Å; L258-C272 HydrophobicContact CD2-CB 3.61Å; C272-D274 VanDerWaalsContact C-N 3.26Å; C272-D274 PolarHBondContact O-N 2.99Å; C272-C275 PolarHBondContact O-N 2.69Å; C272-C275 PolarHBondContact SG-N 3.47Å; C272-C275 VanDerWaalsContact SG-N 3.38Å; C272-N276 WeakPolarHBondContact O-CB 3.2Å; C272-N276 PolarHBondContact O-N 2.84Å
273	R	92.1	Very high	87.9	Confident	178 Å²	178	79.1 Å²	79.1	67%	0.672	42%	0.423	S	S	*	.	H	α-helix	trans	-53.3	-41.6	177.5	-173.8	178.2	-177.8	175	0.2	113.3	F264 N276 S277	F264-R273 HydrophobicContact CE2-CB 3.99Å; F264-R273 HydrophobicContact CE2-CG 4.16Å; R273-N276 PolarHBondContact O-N 3.41Å; R273-S277 WeakPolarHBondContact O-CB 3.45Å; R273-S277 PolarHBondContact O-N 3.13Å; R273-S277 PolarHBondContact O-OG 3.17Å
274	D	92.1	Very high	87.5	Confident	110 Å²	110	80.8 Å²	80.8	59%	0.588	43%	0.434	S	S	*	.	H	α-helix	trans	-70.4	-44.2	-177.1	-56.4	-35.9	0	0	0	111.6	C272 N276 S277 N278	C272-D274 VanDerWaalsContact C-N 3.26Å; C272-D274 PolarHBondContact O-N 2.99Å; D274-N276 VanDerWaalsContact C-N 3.33Å; D274-N276 PolarHBondContact O-N 3.29Å; D274-S277 PolarHBondContact O-N 3.33Å; D274-N278 PolarHBondContact O-N 2.77Å; D274-N278 PolarHBondContact O-ND2 2.9Å
275	C	92	Very high	87.2	Confident	15 Å²	15	80.7 Å²	80.7	10%	0.101	44%	0.44	C	S	.	.	H	α-helix	trans	-64.7	-38.6	176.1	-73	0	0	0	0	111.7	C251 Q253 L271 C272 S277 N278	C251-C275 VanDerWaalsContact SG-SG 3.61Å; Q253-C275 HydrophobicContact CB-CB 4.31Å; Q253-C275 PolarHBondContact OE1-SG 3.49Å; L271-C275 HydrophobicContact CB-CB 4.36Å; L271-C275 HydrophobicContact CD2-CB 4.41Å; C272-C275 PolarHBondContact O-N 2.69Å; C272-C275 PolarHBondContact SG-N 3.47Å; C272-C275 VanDerWaalsContact SG-N 3.38Å; C275-S277 VanDerWaalsContact C-N 3.35Å; C275-N278 PolarHBondContact O-N 3.48Å
276	N	90.1	Very high	86.9	Confident	54 Å²	54	81.5 Å²	81.5	29%	0.289	44%	0.439	S	S	.	.	H	α-helix	trans	-69.1	-31.9	177.6	-171.5	83.9	0	0	0	112.9	F264 L271 C272 R273 D274 N278	F264-N276 HydrophobicContact CB-CB 4.04Å; F264-N276 WeakPolarHBondContact CB-OD1 3.43Å; F264-N276 HydrophobicContact CD2-CB 3.79Å; F264-N276 HydrophobicContact CE2-CB 4.5Å; F264-N276 HydrophobicContact CG-CB 3.93Å; L271-N276 HydrophobicContact CB-CB 4.26Å; C272-N276 WeakPolarHBondContact O-CB 3.2Å; C272-N276 PolarHBondContact O-N 2.84Å; R273-N276 PolarHBondContact O-N 3.41Å; D274-N276 VanDerWaalsContact C-N 3.33Å; D274-N276 PolarHBondContact O-N 3.29Å; N276-N278 VanDerWaalsContact C-N 3.29Å
277	S	84.8	Confident	86.8	Confident	85 Å²	85	81.5 Å²	81.5	59%	0.594	44%	0.439	S	S	*	.	H	α-helix	trans	-80.1	-11.8	179.5	-52.1	0	0	0	0	113.3	R273 D274 C275	R273-S277 WeakPolarHBondContact O-CB 3.45Å; R273-S277 PolarHBondContact O-N 3.13Å; R273-S277 PolarHBondContact O-OG 3.17Å; D274-S277 PolarHBondContact O-N 3.33Å; C275-S277 VanDerWaalsContact C-N 3.35Å
278	N	75.1	Confident	86.9	Confident	139 Å²	139	83.5 Å²	83.5	74%	0.743	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	13.3	178.5	-72	-57.1	0	0	0	112.8	D274 C275 N276	D274-N278 PolarHBondContact O-N 2.77Å; D274-N278 PolarHBondContact O-ND2 2.9Å; C275-N278 PolarHBondContact O-N 3.48Å; N276-N278 VanDerWaalsContact C-N 3.29Å
279	L	61.5	Low	87.1	Confident	152 Å²	152	79.4 Å²	79.4	80%	0.796	40%	0.402	S	S	*	.			trans	-90.1	0	175.1	-103.3	140.9	0	0	0	112	L271	L271-L279 HydrophobicContact CD1-CD1 3.26Å

Retrieved 279 of 279 residues in 519.8 ms (Link to these results)

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