A0A087XIP8_POEFO Loading...

Dual adapter for phosphotyrosine and 3-phosphotyrosine and 3-phosphoinositide

May act as a B-cell-associated adapter that regulates B-cell antigen receptor (BCR)-signaling downstream of PI3K.

AlphaFold DB , UniProt , Accession A0A087XIP8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 251 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38	Very low	44.8	Very low	244 Å²	244	124.9 Å²	124.9	100%	1.202	69%	0.688	S	S	*	*				0	102.7	0	-91.6	175.2	-178.8	0	0	108
2	S	34.2	Very low	46.1	Very low	116 Å²	116	117.4 Å²	117.4	81%	0.811	65%	0.646	S	S	*	*			trans	-123.4	86.3	158.1	61.7	0	0	0	0	106.4	Y4	S2-Y4 PolarHBondContact O-N 2.67Å
3	V	36.6	Very low	47.2	Very low	130 Å²	130	112.5 Å²	112.5	79%	0.788	62%	0.624	S	S	*	*			trans	-78.5	89.2	166	-98.4	0	0	0	0	106.3
4	Y	37.1	Very low	48.4	Very low	217 Å²	217	111.6 Å²	111.6	85%	0.851	62%	0.618	S	S	*	*			trans	-142.4	134	164.4	-89.9	-79.2	0	0	0	108.8	S2	S2-Y4 PolarHBondContact O-N 2.67Å
5	S	46.1	Very low	50.5	Low	85 Å²	85	109.1 Å²	109.1	59%	0.594	60%	0.599	S	S	*	*			trans	67.2	72.2	169.7	67.5	0	0	0	0	119.4
6	D	43.2	Very low	52.4	Low	132 Å²	132	102.4 Å²	102.4	71%	0.706	56%	0.563	S	S	*	*	S	Bend	trans	-106.4	-33.4	145.2	-116.2	-16.1	0	0	0	111.3	S8 N9	D6-S8 VanDerWaalsContact C-N 3.29Å; D6-S8 PolarHBondContact O-N 3.25Å; D6-N9 PolarHBondContact O-N 2.93Å
7	A	41.7	Very low	54	Low	69 Å²	69	101.4 Å²	101.4	57%	0.57	55%	0.553	S	S	*	*	H	α-helix	trans	-59	-33.6	-178.2	0	0	0	0	0	114.4	N9 D11	A7-N9 VanDerWaalsContact C-N 3.27Å; A7-N9 PolarHBondContact O-N 2.98Å; A7-D11 PolarHBondContact O-N 3.15Å
8	S	53.8	Low	55.6	Low	63 Å²	63	101.7 Å²	101.7	44%	0.441	56%	0.559	S	S	.	*	H	α-helix	trans	-70.3	-22	179.1	59.5	0	0	0	0	113	D6 L12	D6-S8 VanDerWaalsContact C-N 3.29Å; D6-S8 PolarHBondContact O-N 3.25Å; S8-L12 WeakPolarHBondContact O-CD1 3.17Å; S8-L12 WeakPolarHBondContact O-CG 3.24Å; S8-L12 PolarHBondContact O-N 3.01Å
9	N	50.5	Low	57.1	Low	65 Å²	65	97 Å²	97	35%	0.348	53%	0.533	S	S	.	.	H	α-helix	trans	-85.7	-30.7	-178.4	-81.6	-37.6	0	0	0	113.5	D6 A7 L12 C13	D6-N9 PolarHBondContact O-N 2.93Å; A7-N9 VanDerWaalsContact C-N 3.27Å; A7-N9 PolarHBondContact O-N 2.98Å; N9-L12 WeakPolarHBondContact O-CB 3.49Å; N9-L12 PolarHBondContact O-N 2.9Å; N9-L12 WeakPolarHBondContact OD1-CD1 3.45Å; N9-C13 PolarHBondContact O-N 3.33Å
10	E	53.3	Low	58.5	Low	142 Å²	142	94.2 Å²	94.2	66%	0.664	53%	0.527	S	S	*	.	H	α-helix	trans	-70.2	-44.7	174.9	-70.7	-178.1	156.2	0	0	110.5	L12 C13 D14	E10-L12 PolarHBondContact O-N 2.04Å; E10-C13 PolarHBondContact O-N 3.43Å; E10-D14 PolarHBondContact O-N 3.24Å
11	D	58	Low	60	Low	111 Å²	111	90.6 Å²	90.6	59%	0.594	51%	0.505	S	S	*	.	H	α-helix	trans	-60.3	-28	174.1	-69.5	-28.3	0	0	0	112.9	A7 E15	A7-D11 PolarHBondContact O-N 3.15Å; D11-E15 PolarHBondContact O-N 3.31Å
12	L	61.2	Low	62.6	Low	35 Å²	35	79.3 Å²	79.3	18%	0.183	45%	0.449	C	S	.	.	H	α-helix	trans	-70	-41.2	177.2	-77.5	169.8	0	0	0	113	S8 N9 E10 R73	S8-L12 WeakPolarHBondContact O-CD1 3.17Å; S8-L12 WeakPolarHBondContact O-CG 3.24Å; S8-L12 PolarHBondContact O-N 3.01Å; N9-L12 WeakPolarHBondContact O-CB 3.49Å; N9-L12 PolarHBondContact O-N 2.9Å; N9-L12 WeakPolarHBondContact OD1-CD1 3.45Å; E10-L12 PolarHBondContact O-N 2.04Å; L12-R73 VanDerWaalsContact CD2-NE 3.31Å; L12-R73 VanDerWaalsContact CD2-NH1 3.26Å
13	C	60.5	Low	65.2	Low	54 Å²	54	74.8 Å²	74.8	37%	0.365	42%	0.415	S	S	.	.	H	α-helix	trans	-65.7	-49.9	177.5	-77.2	0	0	0	0	109	N9 E10 E15 L16 E17	N9-C13 PolarHBondContact O-N 3.33Å; E10-C13 PolarHBondContact O-N 3.43Å; C13-E15 VanDerWaalsContact C-N 3.3Å; C13-E15 PolarHBondContact O-N 3.45Å; C13-L16 PolarHBondContact O-N 3.45Å; C13-L16 VanDerWaalsContact O-N 3.1Å; C13-E17 WeakPolarHBondContact O-CB 3.16Å; C13-E17 WeakPolarHBondContact O-CG 3.24Å; C13-E17 PolarHBondContact O-N 2.72Å
14	D	64.1	Low	67.7	Low	99 Å²	99	71.5 Å²	71.5	53%	0.529	39%	0.389	S	S	.	.	H	α-helix	trans	-56.4	-39.3	-175.1	-73	-3.3	0	0	0	113.5	E10	E10-D14 PolarHBondContact O-N 3.24Å
15	E	79.7	Confident	70.1	Confident	74 Å²	74	67.9 Å²	67.9	35%	0.346	38%	0.384	S	S	.	.	H	α-helix	trans	-71.2	-42.3	178.6	-157.1	-166	176.8	0	0	112.2	D11 C13 T18 R73 L88	D11-E15 PolarHBondContact O-N 3.31Å; C13-E15 VanDerWaalsContact C-N 3.3Å; C13-E15 PolarHBondContact O-N 3.45Å; E15-T18 WeakPolarHBondContact O-CB 3.1Å; E15-T18 PolarHBondContact O-N 2.91Å; E15-T18 PolarHBondContact O-OG1 2.96Å; E15-R73 IonicContact OE2-CZ 2.76Å; E15-R73 IonicContact OE2-NH1 3.59Å; E15-R73 PolarHBondContact OE2-NH1 3.2Å; E15-R73 VanDerWaalsContact OE2-NH1 3.09Å; E15-R73 IonicContact OE2-NH2 3.76Å; E15-R73 PolarHBondContact OE2-NH2 2.88Å; E15-L88 HydrophobicContact CB-CD2 4.42Å; E15-L88 HydrophobicContact CG-CD2 3.66Å; E15-L88 WeakPolarHBondContact O-CD2 3.18Å; E15-L88 WeakPolarHBondContact OE1-CB 3.44Å
16	L	81	Confident	72.1	Confident	2 Å²	2	65.4 Å²	65.4	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-73.5	-26.8	179.3	-74.1	172.8	0	0	0	112.8	C13 T18 L19 Y22 L46 F56 Y78 L88	C13-L16 PolarHBondContact O-N 3.45Å; C13-L16 VanDerWaalsContact O-N 3.1Å; L16-T18 PolarHBondContact O-N 3.12Å; L16-L19 HydrophobicContact CD2-CD1 3.66Å; L16-L19 WeakPolarHBondContact O-CB 3.44Å; L16-L19 WeakPolarHBondContact O-CG 3.35Å; L16-L19 PolarHBondContact O-N 2.87Å; L16-Y22 HydrophobicContact CB-CD1 3.87Å; L16-Y22 HydrophobicContact CB-CE1 3.92Å; L16-Y22 HydrophobicContact CB-CG 4.29Å; L16-L46 HydrophobicContact CD2-CD2 4.17Å; L16-F56 HydrophobicContact CD1-CD1 4.5Å; L16-F56 HydrophobicContact CD1-CE1 3.53Å; L16-F56 HydrophobicContact CD1-CE2 4.33Å; L16-F56 HydrophobicContact CD1-CZ 3.43Å; L16-F56 VanDerWaalsContact CD1-CZ 3.43Å; L16-Y78 HydrophobicContact CD2-CE1 4.27Å; L16-L88 HydrophobicContact CD2-CD1 3.93Å; L16-L88 HydrophobicContact CD2-CD2 4.44Å
17	E	79.9	Confident	74.2	Confident	85 Å²	85	61.7 Å²	61.7	40%	0.397	35%	0.349	S	S	.	.	H	α-helix	trans	-62	-24.8	174.3	-75.8	-172.7	-175.6	0	0	113	C13 L19 Y24	C13-E17 WeakPolarHBondContact O-CB 3.16Å; C13-E17 WeakPolarHBondContact O-CG 3.24Å; C13-E17 PolarHBondContact O-N 2.72Å; E17-L19 PolarHBondContact O-N 2.85Å; E17-Y24 HydrophobicContact CG-CE1 3.64Å; E17-Y24 WeakPolarHBondContact CG-OH 3.32Å
18	T	82.7	Confident	76.4	Confident	108 Å²	108	64.9 Å²	64.9	66%	0.663	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-20.7	172.1	72.9	0	0	0	0	112.5	E15 L16 G20	E15-T18 WeakPolarHBondContact O-CB 3.1Å; E15-T18 PolarHBondContact O-N 2.91Å; E15-T18 PolarHBondContact O-OG1 2.96Å; L16-T18 PolarHBondContact O-N 3.12Å; T18-G20 PolarHBondContact O-N 3.45Å
19	L	84	Confident	77.9	Confident	12 Å²	12	68.6 Å²	68.6	6%	0.063	36%	0.356	C	S	.	.			trans	-75.2	109.4	174.6	-57.6	178.8	0	0	0	109.9	L16 E17 W21 Y22 L46 L88 V92	L16-L19 HydrophobicContact CD2-CD1 3.66Å; L16-L19 WeakPolarHBondContact O-CB 3.44Å; L16-L19 WeakPolarHBondContact O-CG 3.35Å; L16-L19 PolarHBondContact O-N 2.87Å; E17-L19 PolarHBondContact O-N 2.85Å; L19-W21 HydrophobicContact CD1-CH2 4.43Å; L19-W21 HydrophobicContact CD1-CZ2 4.02Å; L19-W21 HydrophobicContact CD2-CZ2 4.17Å; L19-W21 PolarHBondContact O-N 3.33Å; L19-Y22 PolarHBondContact O-N 2.87Å; L19-Y22 VanDerWaalsContact O-N 3.09Å; L19-L46 HydrophobicContact CD1-CD2 4.14Å; L19-L88 HydrophobicContact CD1-CD1 4.03Å; L19-L88 HydrophobicContact CD2-CD1 4.3Å; L19-L88 HydrophobicContact CD2-CD2 4.3Å; L19-L88 HydrophobicContact CG-CD1 4.45Å; L19-L88 HydrophobicContact CG-CD2 4.36Å; L19-V92 HydrophobicContact CD2-CG2 3.47Å; L19-V92 VanDerWaalsContact CD2-CG2 3.47Å
20	G	85.3	Confident	79.5	Confident	40 Å²	40	67.1 Å²	67.1	41%	0.412	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-2.5	174	0	0	0	0	0	115.7	T18 P116 W117	T18-G20 PolarHBondContact O-N 3.45Å; G20-P116 CarbonylContact O-C 3.53Å; G20-P116 WeakPolarHBondContact O-CA 3.3Å; G20-W117 PolarHBondContact O-N 2.74Å
21	W	89.6	Confident	81	Confident	20 Å²	20	60.4 Å²	60.4	8%	0.076	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.9	16.3	-177.3	56	-83.7	0	0	0	113.5	L19 H23 Y44 L46 L58 F91 V92 F95 P114 Y115	L19-W21 HydrophobicContact CD1-CH2 4.43Å; L19-W21 HydrophobicContact CD1-CZ2 4.02Å; L19-W21 HydrophobicContact CD2-CZ2 4.17Å; L19-W21 PolarHBondContact O-N 3.33Å; W21-H23 PolarHBondContact O-CD2 2.84Å; W21-Y44 HydrophobicContact CD2-CE2 4.06Å; W21-Y44 AromaticContact CE3-CD2 3.89Å; W21-Y44 HydrophobicContact CE3-CD2 3.89Å; W21-Y44 AromaticContact CE3-CE2 3.76Å; W21-Y44 HydrophobicContact CE3-CE2 3.76Å; W21-Y44 HydrophobicContact CH2-CE2 4.2Å; W21-Y44 HydrophobicContact CZ2-CE2 4.47Å; W21-Y44 AromaticContact CZ3-CD2 3.95Å; W21-Y44 HydrophobicContact CZ3-CD2 3.95Å; W21-Y44 AromaticContact CZ3-CE2 3.81Å; W21-Y44 HydrophobicContact CZ3-CE2 3.81Å; W21-L46 HydrophobicContact CE3-CB 3.78Å; W21-L46 HydrophobicContact CH2-CB 4.45Å; W21-L46 HydrophobicContact CZ3-CB 3.55Å; W21-L46 HydrophobicContact CZ3-CG 4.48Å; W21-L46 PolarHBondContact O-N 2.81Å; W21-L58 HydrophobicContact CZ3-CD1 3.89Å; W21-F91 HydrophobicContact CH2-CE1 4.14Å; W21-V92 HydrophobicContact CZ2-CG2 4.37Å; W21-F95 HydrophobicContact CH2-CD2 4.24Å; W21-F95 HydrophobicContact CH2-CE2 4.11Å; W21-F95 HydrophobicContact CH2-CZ 4.38Å; W21-P114 HydrophobicContact CB-CB 3.66Å; W21-P114 HydrophobicContact CD2-CB 4.2Å; W21-P114 HydrophobicContact CG-CB 3.55Å; W21-Y115 WeakPolarHBondContact CA-O 3.49Å; W21-Y115 WeakPolarHBondContact CB-O 3.19Å
22	Y	91.8	Very high	82.4	Confident	7 Å²	7	57.3 Å²	57.3	3%	0.027	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-91.1	126.7	166.9	174.9	-122	0	0	0	110.2	L16 L19 Y24 L46 N48 F56 W117	L16-Y22 HydrophobicContact CB-CD1 3.87Å; L16-Y22 HydrophobicContact CB-CE1 3.92Å; L16-Y22 HydrophobicContact CB-CG 4.29Å; L19-Y22 PolarHBondContact O-N 2.87Å; L19-Y22 VanDerWaalsContact O-N 3.09Å; Y22-Y24 HydrophobicContact CD1-CD1 4.18Å; Y22-Y24 HydrophobicContact CD1-CE1 4.23Å; Y22-Y24 HydrophobicContact CD1-CG 4.41Å; Y22-Y24 AromaticContact CE1-CD1 3.58Å; Y22-Y24 HydrophobicContact CE1-CD1 3.58Å; Y22-Y24 AromaticContact CE1-CE1 3.9Å; Y22-Y24 HydrophobicContact CE1-CE1 3.9Å; Y22-Y24 HydrophobicContact CE1-CG 4.04Å; Y22-L46 CarbonylContact C-O 3.54Å; Y22-L46 WeakPolarHBondContact CA-O 3.5Å; Y22-L46 HydrophobicContact CD2-CB 4.18Å; Y22-L46 HydrophobicContact CD2-CD2 4.02Å; Y22-L46 HydrophobicContact CD2-CG 4.05Å; Y22-N48 PolarHBondContact OH-ND2 2.82Å; Y22-N48 PolarHBondContact OH-OD1 2.82Å; Y22-F56 HydrophobicContact CE2-CD1 4.15Å; Y22-F56 HydrophobicContact CE2-CE1 4.15Å; Y22-W117 VanDerWaalsContact O-CB 3.26Å; Y22-W117 WeakPolarHBondContact O-CB 3.44Å
23	H	89.5	Confident	83.2	Confident	21 Å²	21	58.2 Å²	58.2	10%	0.097	32%	0.316	C	S	.	.			trans	-113.2	21.3	-171.4	-71.3	-121.2	0	0	0	112.9	W21 D25 L26 L45 L46 Y115 P116 W117	W21-H23 PolarHBondContact O-CD2 2.84Å; H23-D25 PolarHBondContact O-N 3.46Å; H23-L26 HydrophobicContact CB-CB 3.69Å; H23-L26 HydrophobicContact CB-CD2 3.65Å; H23-L26 HydrophobicContact CB-CG 4.28Å; H23-L26 WeakPolarHBondContact O-CB 3.4Å; H23-L26 PolarHBondContact O-N 2.85Å; H23-L45 HydrophobicContact CB-CD1 4.45Å; H23-L46 PolarHBondContact N-O 3.49Å; H23-Y115 AromaticContact CE1-CD1 3.81Å; H23-Y115 AromaticContact NE2-CD1 3.97Å; H23-Y115 PolarHBondContact NE2-O 3.25Å; H23-P116 PolarHBondContact CE1-O 3.36Å; H23-P116 PolarHBondContact NE2-O 3.09Å; H23-W117 VanDerWaalsContact CE1-CA 3.48Å; H23-W117 WeakPolarHBondContact CE1-CA 3.28Å; H23-W117 WeakPolarHBondContact NE2-CA 3.3Å
24	Y	89.6	Confident	84.3	Confident	61 Å²	61	57.8 Å²	57.8	24%	0.239	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	-125.9	174.3	-51.2	-92.8	0	0	0	113.1	E17 Y22 L26 N48 W117	E17-Y24 HydrophobicContact CG-CE1 3.64Å; E17-Y24 WeakPolarHBondContact CG-OH 3.32Å; Y22-Y24 HydrophobicContact CD1-CD1 4.18Å; Y22-Y24 HydrophobicContact CD1-CE1 4.23Å; Y22-Y24 HydrophobicContact CD1-CG 4.41Å; Y22-Y24 AromaticContact CE1-CD1 3.58Å; Y22-Y24 HydrophobicContact CE1-CD1 3.58Å; Y22-Y24 AromaticContact CE1-CE1 3.9Å; Y22-Y24 HydrophobicContact CE1-CE1 3.9Å; Y22-Y24 HydrophobicContact CE1-CG 4.04Å; Y24-L26 PolarHBondContact O-N 3.24Å; Y24-N48 VanDerWaalsContact O-CB 3.31Å; Y24-N48 WeakPolarHBondContact O-CB 3.21Å; Y24-N48 PolarHBondContact O-N 3Å; Y24-N48 PolarHBondContact O-ND2 3.28Å; Y24-W117 HydrophobicContact CE2-CD2 4.49Å; Y24-W117 HydrophobicContact CE2-CE3 4.36Å
25	D	87.1	Confident	85.3	Confident	140 Å²	140	53 Å²	53	75%	0.749	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	14.5	-177.9	68.8	-33.7	0	0	0	114.3	H23 S27	H23-D25 PolarHBondContact O-N 3.46Å; D25-S27 PolarHBondContact O-N 2.96Å
26	L	88	Confident	85.3	Confident	33 Å²	33	52 Å²	52	17%	0.173	28%	0.281	C	S	.	.			trans	-49.1	120.5	175.1	-177.4	73.1	0	0	0	110.4	H23 Y24 A30 A31 L34 L45 R47	H23-L26 HydrophobicContact CB-CB 3.69Å; H23-L26 HydrophobicContact CB-CD2 3.65Å; H23-L26 HydrophobicContact CB-CG 4.28Å; H23-L26 WeakPolarHBondContact O-CB 3.4Å; H23-L26 PolarHBondContact O-N 2.85Å; Y24-L26 PolarHBondContact O-N 3.24Å; L26-A30 HydrophobicContact CD1-CB 3.54Å; L26-A30 HydrophobicContact CG-CB 4.19Å; L26-A31 HydrophobicContact CD2-CB 3.75Å; L26-A31 HydrophobicContact CG-CB 4.26Å; L26-L34 HydrophobicContact CD1-CD1 3.91Å; L26-L34 HydrophobicContact CD2-CD1 3.95Å; L26-L45 HydrophobicContact CD2-CD1 3.9Å; L26-L45 HydrophobicContact CD2-CD2 4.02Å; L26-R47 HydrophobicContact CB-CB 4.29Å; L26-R47 VanDerWaalsContact O-CD 3.27Å; L26-R47 WeakPolarHBondContact O-CD 3.35Å
27	S	87.7	Confident	85.2	Confident	54 Å²	54	53 Å²	53	38%	0.378	29%	0.288	S	S	.	.			trans	-65.6	154.8	-177.7	75.9	0	0	0	0	111.8	D25 H29 A30 A31	D25-S27 PolarHBondContact O-N 2.96Å; S27-H29 VanDerWaalsContact C-N 3.27Å; S27-H29 PolarHBondContact O-N 3.29Å; S27-A30 PolarHBondContact O-N 2.93Å; S27-A30 VanDerWaalsContact O-N 3.16Å; S27-A30 VanDerWaalsContact OG-CB 3.24Å; S27-A30 WeakPolarHBondContact OG-CB 3.19Å; S27-A30 PolarHBondContact OG-N 3.49Å; S27-A30 VanDerWaalsContact OG-N 3.09Å; S27-A31 PolarHBondContact O-N 3.01Å
28	R	86.8	Confident	85.2	Confident	137 Å²	137	50 Å²	50	52%	0.517	28%	0.275	S	S	.	.	H	α-helix	trans	-49.1	-48.9	173.2	-178.9	-178.5	174.3	168.8	1	112.3	A31 E32	R28-A31 PolarHBondContact O-N 2.86Å; R28-E32 IonicContact NE-OE1 3.38Å; R28-E32 PolarHBondContact NE-OE1 3.12Å; R28-E32 WeakPolarHBondContact O-CG 3.42Å; R28-E32 PolarHBondContact O-N 2.92Å
29	H	85.9	Confident	85	Confident	141 Å²	141	45.4 Å²	45.4	65%	0.653	25%	0.249	S	C	*	.	H	α-helix	trans	-67.9	-39.3	-178.2	-62.2	100.9	0	0	0	112.2	S27 E32 A33	S27-H29 VanDerWaalsContact C-N 3.27Å; S27-H29 PolarHBondContact O-N 3.29Å; H29-E32 PolarHBondContact O-N 3.46Å; H29-A33 PolarHBondContact O-N 3.36Å
30	A	83.5	Confident	84.8	Confident	34 Å²	34	46.1 Å²	46.1	28%	0.281	26%	0.259	S	S	.	.	H	α-helix	trans	-65.3	-41.3	176.7	0	0	0	0	0	111.6	L26 S27 E32 A33 L34	L26-A30 HydrophobicContact CD1-CB 3.54Å; L26-A30 HydrophobicContact CG-CB 4.19Å; S27-A30 PolarHBondContact O-N 2.93Å; S27-A30 VanDerWaalsContact O-N 3.16Å; S27-A30 VanDerWaalsContact OG-CB 3.24Å; S27-A30 WeakPolarHBondContact OG-CB 3.19Å; S27-A30 PolarHBondContact OG-N 3.49Å; S27-A30 VanDerWaalsContact OG-N 3.09Å; A30-E32 VanDerWaalsContact C-N 3.34Å; A30-E32 PolarHBondContact O-N 3.34Å; A30-A33 PolarHBondContact O-N 3.08Å; A30-L34 WeakPolarHBondContact O-CB 3.36Å; A30-L34 WeakPolarHBondContact O-CG 3.45Å; A30-L34 PolarHBondContact O-N 3.05Å
31	A	85.5	Confident	84.7	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-42.6	173.1	0	0	0	0	0	112.3	L26 S27 R28 L34 L35 L45	L26-A31 HydrophobicContact CD2-CB 3.75Å; L26-A31 HydrophobicContact CG-CB 4.26Å; S27-A31 PolarHBondContact O-N 3.01Å; R28-A31 PolarHBondContact O-N 2.86Å; A31-L34 PolarHBondContact O-N 2.64Å; A31-L35 WeakPolarHBondContact O-CB 3.46Å; A31-L35 WeakPolarHBondContact O-CG 3.31Å; A31-L35 PolarHBondContact O-N 3.22Å; A31-L45 HydrophobicContact CB-CD1 4.04Å; A31-L45 HydrophobicContact CB-CD2 4.43Å
32	E	86.1	Confident	84.4	Confident	47 Å²	47	46.9 Å²	46.9	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-59.8	-49.4	174	-70.5	175.3	-179	0	0	111.3	R28 H29 A30 L34 L35 L36 V66 H68	R28-E32 IonicContact NE-OE1 3.38Å; R28-E32 PolarHBondContact NE-OE1 3.12Å; R28-E32 WeakPolarHBondContact O-CG 3.42Å; R28-E32 PolarHBondContact O-N 2.92Å; H29-E32 PolarHBondContact O-N 3.46Å; A30-E32 VanDerWaalsContact C-N 3.34Å; A30-E32 PolarHBondContact O-N 3.34Å; E32-L34 PolarHBondContact O-N 3.39Å; E32-L35 PolarHBondContact O-N 2.86Å; E32-L36 WeakPolarHBondContact O-CB 3.1Å; E32-L36 WeakPolarHBondContact O-CG 3.4Å; E32-L36 PolarHBondContact O-N 3.03Å; E32-V66 HydrophobicContact CB-CB 4.48Å; E32-V66 HydrophobicContact CG-CB 4.01Å; E32-V66 HydrophobicContact CG-CG1 4.01Å; E32-H68 VanDerWaalsContact CG-NE2 3.34Å; E32-H68 WeakPolarHBondContact CG-NE2 3.37Å; E32-H68 IonicContact OE1-CD2 3.25Å; E32-H68 IonicContact OE1-CE1 3.66Å; E32-H68 IonicContact OE1-NE2 2.73Å; E32-H68 PolarHBondContact OE1-NE2 3.15Å
33	A	79.1	Confident	84.3	Confident	53 Å²	53	47 Å²	47	44%	0.438	26%	0.257	S	S	.	.	H	α-helix	trans	-60.9	-43.4	180	0	0	0	0	0	112.5	H29 A30 S37	H29-A33 PolarHBondContact O-N 3.36Å; A30-A33 PolarHBondContact O-N 3.08Å; A33-S37 WeakPolarHBondContact O-CB 3.37Å; A33-S37 PolarHBondContact O-N 3.07Å; A33-S37 PolarHBondContact O-OG 3.41Å
34	L	84.3	Confident	84.4	Confident	45 Å²	45	46.7 Å²	46.7	24%	0.236	26%	0.255	C	S	.	.	H	α-helix	trans	-63.4	-52.3	178.5	-76.4	171.2	0	0	0	111.4	L26 A30 A31 E32 L36 S37 N38 G39	L26-L34 HydrophobicContact CD1-CD1 3.91Å; L26-L34 HydrophobicContact CD2-CD1 3.95Å; A30-L34 WeakPolarHBondContact O-CB 3.36Å; A30-L34 WeakPolarHBondContact O-CG 3.45Å; A30-L34 PolarHBondContact O-N 3.05Å; A31-L34 PolarHBondContact O-N 2.64Å; E32-L34 PolarHBondContact O-N 3.39Å; L34-L36 PolarHBondContact O-N 3.14Å; L34-S37 PolarHBondContact O-N 3.11Å; L34-N38 WeakPolarHBondContact O-CB 3.23Å; L34-N38 PolarHBondContact O-N 3.35Å; L34-G39 PolarHBondContact O-N 2.66Å
35	L	83.3	Confident	84.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.7	-36.3	-178.6	-73.9	175.9	0	0	0	112	A31 E32 G39 L45 S59 R61 V66 Y115	A31-L35 WeakPolarHBondContact O-CB 3.46Å; A31-L35 WeakPolarHBondContact O-CG 3.31Å; A31-L35 PolarHBondContact O-N 3.22Å; E32-L35 PolarHBondContact O-N 2.86Å; L35-G39 VanDerWaalsContact O-CA 3.26Å; L35-G39 WeakPolarHBondContact O-CA 3.34Å; L35-G39 PolarHBondContact O-N 3.48Å; L35-L45 HydrophobicContact CD1-CD2 4.16Å; L35-L45 HydrophobicContact CD1-CG 4.2Å; L35-L45 HydrophobicContact CD2-CD2 4.15Å; L35-L45 HydrophobicContact CG-CD2 3.94Å; L35-L45 HydrophobicContact CG-CG 4.49Å; L35-S59 WeakPolarHBondContact CD1-O 3.33Å; L35-R61 HydrophobicContact CB-CB 4.18Å; L35-R61 HydrophobicContact CD2-CB 4.44Å; L35-R61 WeakPolarHBondContact O-CD 3.4Å; L35-R61 PolarHBondContact O-NH1 3.05Å; L35-V66 HydrophobicContact CB-CG2 3.7Å; L35-V66 HydrophobicContact CD1-CG1 3.92Å; L35-V66 HydrophobicContact CD1-CG2 4.34Å; L35-Y115 HydrophobicContact CD2-CD2 4.09Å; L35-Y115 HydrophobicContact CD2-CG 4Å
36	L	81.4	Confident	84.8	Confident	53 Å²	53	37.1 Å²	37.1	28%	0.277	21%	0.208	S	C	.	.	H	α-helix	trans	-67.9	-37	175.9	-73.8	172.5	0	0	0	112.7	E32 L34 R61 V66	E32-L36 WeakPolarHBondContact O-CB 3.1Å; E32-L36 WeakPolarHBondContact O-CG 3.4Å; E32-L36 PolarHBondContact O-N 3.03Å; L34-L36 PolarHBondContact O-N 3.14Å; L36-R61 PolarHBondContact O-NH1 3.04Å; L36-V66 HydrophobicContact CD2-CG2 4.04Å; L36-V66 HydrophobicContact CG-CG2 3.82Å
37	S	78	Confident	85	Confident	23 Å²	23	36 Å²	36	16%	0.161	20%	0.202	C	C	.	.	H	α-helix	trans	-86.7	-35.1	-175	-55.3	0	0	0	0	113.6	A33 L34	A33-S37 WeakPolarHBondContact O-CB 3.37Å; A33-S37 PolarHBondContact O-N 3.07Å; A33-S37 PolarHBondContact O-OG 3.41Å; L34-S37 PolarHBondContact O-N 3.11Å
38	N	79.1	Confident	85.2	Confident	22 Å²	22	36 Å²	36	12%	0.118	20%	0.197	C	C	.	.	H	α-helix	trans	-127.6	-22.9	-167.9	-53.1	-40.4	0	0	0	113.8	L34 Y115 L150	L34-N38 WeakPolarHBondContact O-CB 3.23Å; L34-N38 PolarHBondContact O-N 3.35Å; N38-Y115 HydrophobicContact CB-CE2 3.94Å; N38-Y115 VanDerWaalsContact CB-OH 3.27Å; N38-Y115 WeakPolarHBondContact CB-OH 3.36Å; N38-Y115 PolarHBondContact ND2-OH 3.05Å; N38-L150 WeakPolarHBondContact ND2-CD2 2.98Å; N38-L150 PolarHBondContact OD1-O 2.88Å
39	G	78.3	Confident	85	Confident	11 Å²	11	31.2 Å²	31.2	11%	0.113	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-77.2	146.7	178.6	0	0	0	0	0	112.5	L34 L35 R61	L34-G39 PolarHBondContact O-N 2.66Å; L35-G39 VanDerWaalsContact O-CA 3.26Å; L35-G39 WeakPolarHBondContact O-CA 3.34Å; L35-G39 PolarHBondContact O-N 3.48Å; G39-R61 PolarHBondContact O-NH1 3.48Å
40	G	80.3	Confident	84.3	Confident	27 Å²	27	31.6 Å²	31.6	28%	0.278	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-84.5	168.3	167.8	0	0	0	0	0	111.9	G42 S43 R61	G40-G42 PolarHBondContact O-N 2.9Å; G40-S43 PolarHBondContact N-OG 3.46Å; G40-S43 WeakPolarHBondContact O-CB 3.42Å; G40-S43 PolarHBondContact O-N 2.8Å; G40-S43 PolarHBondContact O-OG 3.28Å; G40-S43 VanDerWaalsContact O-OG 3.09Å; G40-R61 VanDerWaalsContact O-CB 3.31Å; G40-R61 WeakPolarHBondContact O-CB 3.04Å; G40-R61 WeakPolarHBondContact O-CG 3.37Å
41	D	83.9	Confident	83.5	Confident	76 Å²	76	33.7 Å²	33.7	41%	0.406	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	127.9	171.2	176.6	60.7	0	0	0	110.3	S43 K63 K112	D41-S43 VanDerWaalsContact C-N 3.33Å; D41-K63 PolarHBondContact OD1-N 3.12Å; D41-K112 WeakPolarHBondContact O-CD 3.27Å; D41-K112 IonicContact OD2-NZ 2.62Å; D41-K112 PolarHBondContact OD2-NZ 2.71Å
42	G	83	Confident	82.9	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	3.5	-173.7	0	0	0	0	0	115.1	G40 R61 V110 K112 S113	G40-G42 PolarHBondContact O-N 2.9Å; G42-R61 WeakPolarHBondContact CA-O 3.43Å; G42-R61 PolarHBondContact N-O 3.43Å; G42-V110 WeakPolarHBondContact CA-O 3.39Å; G42-K112 PolarHBondContact O-N 2.75Å; G42-S113 PolarHBondContact O-N 3.33Å
43	S	88.8	Confident	82.5	Confident	10 Å²	10	40.3 Å²	40.3	7%	0.07	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	138.7	171.3	-65.3	0	0	0	0	111.4	G40 D41 R61 S113	G40-S43 PolarHBondContact N-OG 3.46Å; G40-S43 WeakPolarHBondContact O-CB 3.42Å; G40-S43 PolarHBondContact O-N 2.8Å; G40-S43 PolarHBondContact O-OG 3.28Å; G40-S43 VanDerWaalsContact O-OG 3.09Å; D41-S43 VanDerWaalsContact C-N 3.33Å; S43-R61 WeakPolarHBondContact O-CB 3.36Å; S43-R61 PolarHBondContact O-N 3.33Å; S43-S113 VanDerWaalsContact CA-O 3.25Å; S43-S113 WeakPolarHBondContact CA-O 3.1Å; S43-S113 PolarHBondContact OG-OG 3.02Å
44	Y	92.3	Very high	82.6	Confident	13 Å²	13	38.6 Å²	38.6	5%	0.051	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	154.6	-177.7	62.6	-91.9	0	0	0	113.3	W21 L58 S59 F95 L111 S113 P114 Y115	W21-Y44 HydrophobicContact CD2-CE2 4.06Å; W21-Y44 AromaticContact CE3-CD2 3.89Å; W21-Y44 HydrophobicContact CE3-CD2 3.89Å; W21-Y44 AromaticContact CE3-CE2 3.76Å; W21-Y44 HydrophobicContact CE3-CE2 3.76Å; W21-Y44 HydrophobicContact CH2-CE2 4.2Å; W21-Y44 HydrophobicContact CZ2-CE2 4.47Å; W21-Y44 AromaticContact CZ3-CD2 3.95Å; W21-Y44 HydrophobicContact CZ3-CD2 3.95Å; W21-Y44 AromaticContact CZ3-CE2 3.81Å; W21-Y44 HydrophobicContact CZ3-CE2 3.81Å; Y44-L58 HydrophobicContact CD2-CD1 3.92Å; Y44-S59 CarbonylContact C-O 3.44Å; Y44-S59 WeakPolarHBondContact CA-O 3.36Å; Y44-F95 HydrophobicContact CD2-CD1 4.44Å; Y44-F95 AromaticContact CE2-CD1 3.91Å; Y44-F95 HydrophobicContact CE2-CD1 3.91Å; Y44-F95 HydrophobicContact CE2-CE1 4.48Å; Y44-F95 HydrophobicContact CE2-CG 4.36Å; Y44-F95 AromaticContact CZ-CD1 3.98Å; Y44-L111 HydrophobicContact CD1-CB 3.94Å; Y44-L111 HydrophobicContact CD1-CD2 3.99Å; Y44-L111 HydrophobicContact CD1-CG 4.42Å; Y44-L111 HydrophobicContact CE1-CB 4.02Å; Y44-L111 HydrophobicContact CG-CD2 4.23Å; Y44-S113 VanDerWaalsContact CD1-O 3.31Å; Y44-S113 WeakPolarHBondContact CD1-O 2.91Å; Y44-S113 WeakPolarHBondContact CE1-O 3.42Å; Y44-S113 PolarHBondContact N-O 2.86Å; Y44-P114 HydrophobicContact CE2-CB 3.91Å; Y44-P114 CarbonylContact O-C 3.54Å; Y44-Y115 WeakPolarHBondContact O-CB 3.49Å; Y44-Y115 PolarHBondContact O-N 3.29Å
45	L	93.1	Very high	82.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	153.9	171.9	61.8	85	0	0	0	111	H23 L26 A31 L35 R47 S59 Y115	H23-L45 HydrophobicContact CB-CD1 4.45Å; L26-L45 HydrophobicContact CD2-CD1 3.9Å; L26-L45 HydrophobicContact CD2-CD2 4.02Å; A31-L45 HydrophobicContact CB-CD1 4.04Å; A31-L45 HydrophobicContact CB-CD2 4.43Å; L35-L45 HydrophobicContact CD1-CD2 4.16Å; L35-L45 HydrophobicContact CD1-CG 4.2Å; L35-L45 HydrophobicContact CD2-CD2 4.15Å; L35-L45 HydrophobicContact CG-CD2 3.94Å; L35-L45 HydrophobicContact CG-CG 4.49Å; L45-R47 HydrophobicContact CD1-CB 4.17Å; L45-R47 HydrophobicContact CD1-CG 4.22Å; L45-S59 PolarHBondContact N-O 2.71Å; L45-S59 PolarHBondContact O-N 3.28Å; L45-Y115 HydrophobicContact CD2-CD1 4.21Å
46	L	93	Very high	83.2	Confident	0 Å²	0	38 Å²	38	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.9	172.6	-168.7	67.4	0	0	0	109.4	L16 L19 W21 Y22 H23 F56 L58 V71	L16-L46 HydrophobicContact CD2-CD2 4.17Å; L19-L46 HydrophobicContact CD1-CD2 4.14Å; W21-L46 HydrophobicContact CE3-CB 3.78Å; W21-L46 HydrophobicContact CH2-CB 4.45Å; W21-L46 HydrophobicContact CZ3-CB 3.55Å; W21-L46 HydrophobicContact CZ3-CG 4.48Å; W21-L46 PolarHBondContact O-N 2.81Å; Y22-L46 CarbonylContact C-O 3.54Å; Y22-L46 WeakPolarHBondContact CA-O 3.5Å; Y22-L46 HydrophobicContact CD2-CB 4.18Å; Y22-L46 HydrophobicContact CD2-CD2 4.02Å; Y22-L46 HydrophobicContact CD2-CG 4.05Å; H23-L46 PolarHBondContact N-O 3.49Å; L46-F56 HydrophobicContact CD1-CB 3.82Å; L46-F56 HydrophobicContact CG-CB 4.35Å; L46-L58 HydrophobicContact CD1-CD1 4.5Å; L46-V71 HydrophobicContact CD1-CG2 4.47Å
47	R	92.4	Very high	83.7	Confident	11 Å²	11	35.6 Å²	35.6	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	162.8	176	60.2	178.8	-173.1	76.9	3.4	110.2	L26 L45 F56 A57 S59 H68	L26-R47 HydrophobicContact CB-CB 4.29Å; L26-R47 VanDerWaalsContact O-CD 3.27Å; L26-R47 WeakPolarHBondContact O-CD 3.35Å; L45-R47 HydrophobicContact CD1-CB 4.17Å; L45-R47 HydrophobicContact CD1-CG 4.22Å; R47-F56 CarbonylContact O-C 3.55Å; R47-F56 WeakPolarHBondContact O-CA 3.28Å; R47-F56 WeakPolarHBondContact O-CB 3.44Å; R47-A57 HydrophobicContact CG-CB 4.1Å; R47-A57 WeakPolarHBondContact CG-O 3.37Å; R47-A57 VanDerWaalsContact CZ-CB 3.5Å; R47-A57 PolarHBondContact N-O 3.11Å; R47-A57 PolarHBondContact O-N 2.99Å; R47-S59 PolarHBondContact NE-OG 2.62Å; R47-H68 PolarHBondContact NH2-ND1 3.35Å
48	N	90.5	Very high	84.4	Confident	53 Å²	53	34.5 Å²	34.5	28%	0.283	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	142.6	171.4	-68.6	-22.1	0	0	0	110.6	Y22 Y24 F56	Y22-N48 PolarHBondContact OH-ND2 2.82Å; Y22-N48 PolarHBondContact OH-OD1 2.82Å; Y24-N48 VanDerWaalsContact O-CB 3.31Å; Y24-N48 WeakPolarHBondContact O-CB 3.21Å; Y24-N48 PolarHBondContact O-N 3Å; Y24-N48 PolarHBondContact O-ND2 3.28Å; N48-F56 WeakPolarHBondContact OD1-CD1 3.4Å; N48-F56 VanDerWaalsContact OD1-CE1 3.29Å; N48-F56 WeakPolarHBondContact OD1-CE1 3.37Å
49	S	83.7	Confident	85	Confident	37 Å²	37	33.5 Å²	33.5	26%	0.259	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-94.4	136.9	168.8	-171.8	0	0	0	0	108.8	G51 C55	S49-G51 PolarHBondContact O-N 3.45Å; S49-C55 WeakPolarHBondContact CB-O 3.29Å; S49-C55 PolarHBondContact N-O 3.06Å
50	N	70.6	Confident	85.7	Confident	148 Å²	148	33 Å²	33	79%	0.791	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	125	-177.2	-71.9	7.4	0	0	0	111
51	G	66.2	Low	86.1	Confident	79 Å²	79	33.5 Å²	33.5	81%	0.814	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	105.9	-2.6	154.8	0	0	0	0	0	117.8	S49	S49-G51 PolarHBondContact O-N 3.45Å
52	T	72.9	Confident	86.1	Confident	86 Å²	86	30.2 Å²	30.2	53%	0.528	19%	0.194	S	C	.	.	S	Bend	trans	-151.6	128.7	176.2	-45.3	0	0	0	0	112.2	C55	T52-C55 WeakPolarHBondContact O-CB 3.29Å; T52-C55 PolarHBondContact O-N 2.86Å
53	P	78.8	Confident	85.8	Confident	100 Å²	100	37.6 Å²	37.6	65%	0.649	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.7	140.6	170	-24.3	34.3	0	0	0	111.6	C55	P53-C55 PolarHBondContact O-N 2.93Å
54	G	81.6	Confident	85.4	Confident	16 Å²	16	43.3 Å²	43.3	17%	0.165	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.2	-0.3	-177.3	0	0	0	0	0	115	F56 T72 R73	G54-F56 WeakPolarHBondContact O-CD2 3.3Å; G54-F56 WeakPolarHBondContact O-CE2 3.45Å; G54-T72 CarbonylContact O-C 3.55Å; G54-T72 WeakPolarHBondContact O-CA 3.36Å; G54-R73 PolarHBondContact O-N 3.44Å
55	C	87.9	Confident	85	Confident	21 Å²	21	44.8 Å²	44.8	14%	0.142	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	121	172.7	-70.5	0	0	0	0	111	S49 T52 P53	S49-C55 WeakPolarHBondContact CB-O 3.29Å; S49-C55 PolarHBondContact N-O 3.06Å; T52-C55 WeakPolarHBondContact O-CB 3.29Å; T52-C55 PolarHBondContact O-N 2.86Å; P53-C55 PolarHBondContact O-N 2.93Å
56	F	91.4	Very high	84.7	Confident	11 Å²	11	45.6 Å²	45.6	5%	0.048	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	162.1	-179.2	-51.5	-85.4	0	0	0	110.7	L16 Y22 L46 R47 N48 G54 V71 R73	L16-F56 HydrophobicContact CD1-CD1 4.5Å; L16-F56 HydrophobicContact CD1-CE1 3.53Å; L16-F56 HydrophobicContact CD1-CE2 4.33Å; L16-F56 HydrophobicContact CD1-CZ 3.43Å; L16-F56 VanDerWaalsContact CD1-CZ 3.43Å; Y22-F56 HydrophobicContact CE2-CD1 4.15Å; Y22-F56 HydrophobicContact CE2-CE1 4.15Å; L46-F56 HydrophobicContact CD1-CB 3.82Å; L46-F56 HydrophobicContact CG-CB 4.35Å; R47-F56 CarbonylContact O-C 3.55Å; R47-F56 WeakPolarHBondContact O-CA 3.28Å; R47-F56 WeakPolarHBondContact O-CB 3.44Å; N48-F56 WeakPolarHBondContact OD1-CD1 3.4Å; N48-F56 VanDerWaalsContact OD1-CE1 3.29Å; N48-F56 WeakPolarHBondContact OD1-CE1 3.37Å; G54-F56 WeakPolarHBondContact O-CD2 3.3Å; G54-F56 WeakPolarHBondContact O-CE2 3.45Å; F56-V71 HydrophobicContact CB-CB 4.11Å; F56-V71 PolarHBondContact N-O 3.24Å; F56-V71 PolarHBondContact O-N 3.05Å; F56-V71 VanDerWaalsContact O-O 3.08Å; F56-R73 HydrophobicContact CE2-CB 4.17Å
57	A	91.6	Very high	84.5	Confident	4 Å²	4	48.6 Å²	48.6	3%	0.033	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	124.2	171.2	0	0	0	0	0	109.1	R47 S59 F69	R47-A57 HydrophobicContact CG-CB 4.1Å; R47-A57 WeakPolarHBondContact CG-O 3.37Å; R47-A57 VanDerWaalsContact CZ-CB 3.5Å; R47-A57 PolarHBondContact N-O 3.11Å; R47-A57 PolarHBondContact O-N 2.99Å; A57-S59 PolarHBondContact O-N 3.34Å; A57-F69 CarbonylContact C-O 3.59Å; A57-F69 WeakPolarHBondContact CA-O 3.46Å
58	L	92.4	Very high	84.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	106.5	167.6	-175.7	78.3	0	0	0	108.2	W21 Y44 L46 V60 H68 F69 V71 F80 F95 L101 L111	W21-L58 HydrophobicContact CZ3-CD1 3.89Å; Y44-L58 HydrophobicContact CD2-CD1 3.92Å; L46-L58 HydrophobicContact CD1-CD1 4.5Å; L58-V60 HydrophobicContact CD2-CG2 3.85Å; L58-V60 HydrophobicContact CG-CG2 3.86Å; L58-H68 WeakPolarHBondContact O-CA 3.28Å; L58-F69 HydrophobicContact CB-CB 4.37Å; L58-F69 PolarHBondContact N-O 3.01Å; L58-F69 PolarHBondContact O-N 2.87Å; L58-V71 HydrophobicContact CB-CG2 4.07Å; L58-F80 HydrophobicContact CD2-CE1 4.49Å; L58-F80 HydrophobicContact CD2-CE2 3.83Å; L58-F80 HydrophobicContact CD2-CZ 3.63Å; L58-F95 HydrophobicContact CD1-CE1 3.97Å; L58-F95 HydrophobicContact CD1-CZ 4.25Å; L58-F95 HydrophobicContact CD2-CE1 3.69Å; L58-F95 HydrophobicContact CD2-CZ 4.17Å; L58-L101 HydrophobicContact CD2-CD1 4.32Å; L58-L111 HydrophobicContact CD2-CD1 4.02Å
59	S	93.1	Very high	84.3	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	125.1	175.9	-65.7	0	0	0	0	109.7	L35 Y44 L45 R47 A57 K67 H68	L35-S59 WeakPolarHBondContact CD1-O 3.33Å; Y44-S59 CarbonylContact C-O 3.44Å; Y44-S59 WeakPolarHBondContact CA-O 3.36Å; L45-S59 PolarHBondContact N-O 2.71Å; L45-S59 PolarHBondContact O-N 3.28Å; R47-S59 PolarHBondContact NE-OG 2.62Å; A57-S59 PolarHBondContact O-N 3.34Å; S59-K67 CarbonylContact C-O 3.55Å; S59-K67 WeakPolarHBondContact CA-O 3.12Å; S59-H68 PolarHBondContact OG-CE1 3.03Å; S59-H68 PolarHBondContact OG-ND1 3.12Å
60	V	91.5	Very high	84.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	126.5	-171	-173.6	0	0	0	0	110.3	L58 A62 V66 K67 F69 L101 I109 L111	L58-V60 HydrophobicContact CD2-CG2 3.85Å; L58-V60 HydrophobicContact CG-CG2 3.86Å; V60-A62 PolarHBondContact O-N 3.06Å; V60-V66 CarbonylContact O-C 3.49Å; V60-V66 VanDerWaalsContact O-CA 3.28Å; V60-V66 WeakPolarHBondContact O-CA 3.34Å; V60-K67 PolarHBondContact N-O 3.34Å; V60-K67 PolarHBondContact O-N 3.11Å; V60-F69 HydrophobicContact CB-CD2 4.45Å; V60-F69 HydrophobicContact CB-CE2 4.14Å; V60-F69 HydrophobicContact CG2-CD2 3.75Å; V60-F69 HydrophobicContact CG2-CE2 3.85Å; V60-L101 HydrophobicContact CG2-CD1 4.21Å; V60-I109 HydrophobicContact CG1-CG2 3.64Å; V60-L111 HydrophobicContact CB-CD2 4.16Å; V60-L111 HydrophobicContact CG1-CD2 3.36Å; V60-L111 HydrophobicContact CG2-CD2 3.64Å
61	R	89.7	Confident	85.6	Confident	39 Å²	39	45.3 Å²	45.3	15%	0.147	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	117.4	173.9	-179.4	58.5	-166.8	-94.5	7.6	110.2	L35 L36 G39 G40 G42 S43 K63	L35-R61 HydrophobicContact CB-CB 4.18Å; L35-R61 HydrophobicContact CD2-CB 4.44Å; L35-R61 WeakPolarHBondContact O-CD 3.4Å; L35-R61 PolarHBondContact O-NH1 3.05Å; L36-R61 PolarHBondContact O-NH1 3.04Å; G39-R61 PolarHBondContact O-NH1 3.48Å; G40-R61 VanDerWaalsContact O-CB 3.31Å; G40-R61 WeakPolarHBondContact O-CB 3.04Å; G40-R61 WeakPolarHBondContact O-CG 3.37Å; G42-R61 WeakPolarHBondContact CA-O 3.43Å; G42-R61 PolarHBondContact N-O 3.43Å; S43-R61 WeakPolarHBondContact O-CB 3.36Å; S43-R61 PolarHBondContact O-N 3.33Å; R61-K63 PolarHBondContact NH2-O 2.91Å
62	A	83.5	Confident	86.7	Confident	7 Å²	7	42.6 Å²	42.6	6%	0.058	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	169.9	160.5	0	0	0	0	0	109.5	V60 D64 S65 I109	V60-A62 PolarHBondContact O-N 3.06Å; A62-D64 VanDerWaalsContact C-N 3.34Å; A62-D64 PolarHBondContact O-N 3.24Å; A62-D64 VanDerWaalsContact O-N 3.09Å; A62-S65 CarbonylContact C-O 3.54Å; A62-S65 WeakPolarHBondContact CA-O 3.43Å; A62-S65 PolarHBondContact N-O 3.24Å; A62-S65 PolarHBondContact O-N 3.08Å; A62-I109 HydrophobicContact CB-CD1 3.9Å; A62-I109 HydrophobicContact CB-CG1 4.15Å
63	K	77.5	Confident	87.3	Confident	155 Å²	155	40 Å²	40	67%	0.674	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-34.4	-60.1	-179.5	-166.8	179.4	178.4	-179.3	0	114.4	D41 R61	D41-K63 PolarHBondContact OD1-N 3.12Å; R61-K63 PolarHBondContact NH2-O 2.91Å
64	D	78.9	Confident	87.6	Confident	130 Å²	130	43 Å²	43	70%	0.695	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.5	9.6	-174.2	-57.6	-53.7	0	0	0	114.1	A62	A62-D64 VanDerWaalsContact C-N 3.34Å; A62-D64 PolarHBondContact O-N 3.24Å; A62-D64 VanDerWaalsContact O-N 3.09Å
65	S	85.1	Confident	87.6	Confident	44 Å²	44	50 Å²	50	31%	0.308	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	167.6	-178.4	65.4	0	0	0	0	111.9	A62	A62-S65 CarbonylContact C-O 3.54Å; A62-S65 WeakPolarHBondContact CA-O 3.43Å; A62-S65 PolarHBondContact N-O 3.24Å; A62-S65 PolarHBondContact O-N 3.08Å
66	V	87.1	Confident	87.2	Confident	17 Å²	17	53.8 Å²	53.8	10%	0.103	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.5	170.1	171.4	0	0	0	0	108	E32 L35 L36 V60	E32-V66 HydrophobicContact CB-CB 4.48Å; E32-V66 HydrophobicContact CG-CB 4.01Å; E32-V66 HydrophobicContact CG-CG1 4.01Å; L35-V66 HydrophobicContact CB-CG2 3.7Å; L35-V66 HydrophobicContact CD1-CG1 3.92Å; L35-V66 HydrophobicContact CD1-CG2 4.34Å; L36-V66 HydrophobicContact CD2-CG2 4.04Å; L36-V66 HydrophobicContact CG-CG2 3.82Å; V60-V66 CarbonylContact O-C 3.49Å; V60-V66 VanDerWaalsContact O-CA 3.28Å; V60-V66 WeakPolarHBondContact O-CA 3.34Å
67	K	88.7	Confident	87	Confident	62 Å²	62	55.3 Å²	55.3	27%	0.27	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	147.9	175.2	-59.8	-57.4	-175.1	176.7	0	109.3	S59 V60 F69 I109	S59-K67 CarbonylContact C-O 3.55Å; S59-K67 WeakPolarHBondContact CA-O 3.12Å; V60-K67 PolarHBondContact N-O 3.34Å; V60-K67 PolarHBondContact O-N 3.11Å; K67-F69 HydrophobicContact CB-CE2 3.79Å; K67-F69 HydrophobicContact CB-CZ 4.18Å; K67-I109 HydrophobicContact CB-CD1 4.07Å; K67-I109 HydrophobicContact CG-CD1 3.56Å
68	H	90.1	Very high	86.9	Confident	47 Å²	47	55.1 Å²	55.1	22%	0.218	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	119.9	179	-57.5	-93.9	0	0	0	107.9	E32 R47 L58 S59	E32-H68 VanDerWaalsContact CG-NE2 3.34Å; E32-H68 WeakPolarHBondContact CG-NE2 3.37Å; E32-H68 IonicContact OE1-CD2 3.25Å; E32-H68 IonicContact OE1-CE1 3.66Å; E32-H68 IonicContact OE1-NE2 2.73Å; E32-H68 PolarHBondContact OE1-NE2 3.15Å; R47-H68 PolarHBondContact NH2-ND1 3.35Å; L58-H68 WeakPolarHBondContact O-CA 3.28Å; S59-H68 PolarHBondContact OG-CE1 3.03Å; S59-H68 PolarHBondContact OG-ND1 3.12Å
69	F	89.1	Confident	86.7	Confident	34 Å²	34	56.9 Å²	56.9	15%	0.149	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	138.4	177	-60.3	-91.8	0	0	0	109.3	A57 L58 V60 K67 F80 L101 I109	A57-F69 CarbonylContact C-O 3.59Å; A57-F69 WeakPolarHBondContact CA-O 3.46Å; L58-F69 HydrophobicContact CB-CB 4.37Å; L58-F69 PolarHBondContact N-O 3.01Å; L58-F69 PolarHBondContact O-N 2.87Å; V60-F69 HydrophobicContact CB-CD2 4.45Å; V60-F69 HydrophobicContact CB-CE2 4.14Å; V60-F69 HydrophobicContact CG2-CD2 3.75Å; V60-F69 HydrophobicContact CG2-CE2 3.85Å; K67-F69 HydrophobicContact CB-CE2 3.79Å; K67-F69 HydrophobicContact CB-CZ 4.18Å; F69-F80 HydrophobicContact CB-CD2 4.48Å; F69-F80 HydrophobicContact CB-CE2 3.57Å; F69-F80 HydrophobicContact CB-CZ 4.36Å; F69-F80 HydrophobicContact CG-CE2 4.21Å; F69-L101 HydrophobicContact CD1-CD1 4.4Å; F69-L101 HydrophobicContact CD2-CD1 3.68Å; F69-L101 HydrophobicContact CE1-CB 4.02Å; F69-L101 HydrophobicContact CE1-CD1 4.18Å; F69-L101 HydrophobicContact CE2-CB 4.25Å; F69-L101 HydrophobicContact CE2-CD1 3.42Å; F69-L101 VanDerWaalsContact CE2-CD1 3.42Å; F69-L101 HydrophobicContact CG-CD1 4.17Å; F69-L101 HydrophobicContact CZ-CB 3.68Å; F69-L101 HydrophobicContact CZ-CD1 3.69Å; F69-L101 HydrophobicContact CZ-CG 4.36Å; F69-I109 HydrophobicContact CZ-CD1 4.44Å
70	H	89.6	Confident	86.6	Confident	99 Å²	99	57.3 Å²	57.3	46%	0.458	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	135.1	179.3	-165	68.4	0	0	0	110.2	T72	H70-T72 PolarHBondContact CD2-OG1 3.23Å; H70-T72 PolarHBondContact NE2-OG1 2.92Å
71	V	90.6	Very high	86.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	129.6	172.3	176.2	0	0	0	0	106.6	L46 F56 L58 Y78 I79 F80 F91	L46-V71 HydrophobicContact CD1-CG2 4.47Å; F56-V71 HydrophobicContact CB-CB 4.11Å; F56-V71 PolarHBondContact N-O 3.24Å; F56-V71 PolarHBondContact O-N 3.05Å; F56-V71 VanDerWaalsContact O-O 3.08Å; L58-V71 HydrophobicContact CB-CG2 4.07Å; V71-Y78 HydrophobicContact CG1-CD1 4.43Å; V71-I79 WeakPolarHBondContact CA-O 3.26Å; V71-F80 HydrophobicContact CG2-CB 4.34Å; V71-F80 HydrophobicContact CG2-CD2 3.56Å; V71-F80 HydrophobicContact CG2-CE2 4.19Å; V71-F80 HydrophobicContact CG2-CG 4.25Å; V71-F91 HydrophobicContact CG1-CE2 4.13Å; V71-F91 HydrophobicContact CG1-CZ 3.88Å; V71-F91 HydrophobicContact CG2-CZ 4.15Å
72	T	89.9	Confident	85.9	Confident	22 Å²	22	68.7 Å²	68.7	14%	0.135	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	138.4	178.4	-40.8	0	0	0	0	109.2	G54 H70 R74 I79	G54-T72 CarbonylContact O-C 3.55Å; G54-T72 WeakPolarHBondContact O-CA 3.36Å; H70-T72 PolarHBondContact CD2-OG1 3.23Å; H70-T72 PolarHBondContact NE2-OG1 2.92Å; T72-R74 HydrophobicContact CG2-CG 4.28Å; T72-I79 PolarHBondContact N-O 2.88Å; T72-I79 PolarHBondContact O-N 2.85Å
73	R	85.1	Confident	85.9	Confident	33 Å²	33	72.1 Å²	72.1	13%	0.125	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.2	169.2	-172.3	179.3	173.8	160	-0.8	108.9	L12 E15 G54 F56 N76 V77 Y78	L12-R73 VanDerWaalsContact CD2-NE 3.31Å; L12-R73 VanDerWaalsContact CD2-NH1 3.26Å; E15-R73 IonicContact OE2-CZ 2.76Å; E15-R73 IonicContact OE2-NH1 3.59Å; E15-R73 PolarHBondContact OE2-NH1 3.2Å; E15-R73 VanDerWaalsContact OE2-NH1 3.09Å; E15-R73 IonicContact OE2-NH2 3.76Å; E15-R73 PolarHBondContact OE2-NH2 2.88Å; G54-R73 PolarHBondContact O-N 3.44Å; F56-R73 HydrophobicContact CE2-CB 4.17Å; R73-N76 PolarHBondContact NE-OD1 2.82Å; R73-N76 PolarHBondContact NH2-OD1 2.96Å; R73-V77 CarbonylContact C-O 3.51Å; R73-V77 VanDerWaalsContact CA-O 3.3Å; R73-V77 WeakPolarHBondContact CA-O 3.35Å; R73-Y78 HydrophobicContact CB-CD1 4.36Å; R73-Y78 HydrophobicContact CB-CE1 4.44Å; R73-Y78 HydrophobicContact CG-CD1 4.49Å; R73-Y78 HydrophobicContact CG-CE1 4.41Å; R73-Y78 HydrophobicContact CG-CE2 4.41Å; R73-Y78 PolarHBondContact NH1-OH 3.04Å
74	R	84.9	Confident	86.6	Confident	162 Å²	162	71.4 Å²	71.4	61%	0.611	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.7	173.5	-64.7	-175.8	-175.1	163.3	2.3	108.6	T72 N76 V77 I79	T72-R74 HydrophobicContact CG2-CG 4.28Å; R74-N76 VanDerWaalsContact C-N 3.27Å; R74-N76 PolarHBondContact O-N 3.45Å; R74-V77 PolarHBondContact N-O 3.17Å; R74-V77 WeakPolarHBondContact O-CA 3.44Å; R74-V77 WeakPolarHBondContact O-CB 3.31Å; R74-V77 PolarHBondContact O-N 3.39Å; R74-I79 HydrophobicContact CG-CD1 4.3Å
75	D	81.8	Confident	87.1	Confident	163 Å²	163	66.1 Å²	66.1	87%	0.872	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	46.8	176.7	-55.5	-40.6	0	0	0	113.7	V77	D75-V77 PolarHBondContact O-N 2.82Å
76	N	80.8	Confident	87.3	Confident	100 Å²	100	68.3 Å²	68.3	54%	0.535	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	-1.9	-174	-67.6	-18.4	0	0	0	117.4	R73 R74	R73-N76 PolarHBondContact NE-OD1 2.82Å; R73-N76 PolarHBondContact NH2-OD1 2.96Å; R74-N76 VanDerWaalsContact C-N 3.27Å; R74-N76 PolarHBondContact O-N 3.45Å
77	V	86.6	Confident	87.3	Confident	43 Å²	43	69.3 Å²	69.3	26%	0.261	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	124.9	172.9	-174.9	0	0	0	0	109.8	R73 R74 D75 I79 E84 F85	R73-V77 CarbonylContact C-O 3.51Å; R73-V77 VanDerWaalsContact CA-O 3.3Å; R73-V77 WeakPolarHBondContact CA-O 3.35Å; R74-V77 PolarHBondContact N-O 3.17Å; R74-V77 WeakPolarHBondContact O-CA 3.44Å; R74-V77 WeakPolarHBondContact O-CB 3.31Å; R74-V77 PolarHBondContact O-N 3.39Å; D75-V77 PolarHBondContact O-N 2.82Å; V77-I79 HydrophobicContact CG1-CG1 4.5Å; V77-E84 HydrophobicContact CG1-CB 3.91Å; V77-F85 CarbonylContact C-O 3.52Å; V77-F85 WeakPolarHBondContact CA-O 3.43Å
78	Y	89.1	Confident	87.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	130.1	171.2	-68	-101	0	0	0	109.8	L16 V71 R73 E84 F85 L88 F91	L16-Y78 HydrophobicContact CD2-CE1 4.27Å; V71-Y78 HydrophobicContact CG1-CD1 4.43Å; R73-Y78 HydrophobicContact CB-CD1 4.36Å; R73-Y78 HydrophobicContact CB-CE1 4.44Å; R73-Y78 HydrophobicContact CG-CD1 4.49Å; R73-Y78 HydrophobicContact CG-CE1 4.41Å; R73-Y78 HydrophobicContact CG-CE2 4.41Å; R73-Y78 PolarHBondContact NH1-OH 3.04Å; Y78-E84 CarbonylContact O-C 3.58Å; Y78-E84 WeakPolarHBondContact O-CA 3.33Å; Y78-F85 PolarHBondContact N-O 3.16Å; Y78-F85 WeakPolarHBondContact O-CD2 3.44Å; Y78-F85 PolarHBondContact O-N 2.89Å; Y78-L88 HydrophobicContact CE1-CD1 4.28Å; Y78-L88 HydrophobicContact CE2-CB 3.91Å; Y78-L88 HydrophobicContact CE2-CD1 4.29Å; Y78-F91 HydrophobicContact CD1-CD1 4.28Å; Y78-F91 HydrophobicContact CD1-CG 4.34Å; Y78-F91 HydrophobicContact CD2-CB 4.44Å; Y78-F91 HydrophobicContact CG-CB 4.24Å; Y78-F91 HydrophobicContact CG-CG 4.22Å
79	I	89.1	Confident	86.9	Confident	37 Å²	37	71.6 Å²	71.6	19%	0.19	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.5	-179.1	-53	176.5	0	0	0	107.7	V71 T72 R74 V77 E84	V71-I79 WeakPolarHBondContact CA-O 3.26Å; T72-I79 PolarHBondContact N-O 2.88Å; T72-I79 PolarHBondContact O-N 2.85Å; R74-I79 HydrophobicContact CG-CD1 4.3Å; V77-I79 HydrophobicContact CG1-CG1 4.5Å; I79-E84 HydrophobicContact CG1-CG 4.39Å
80	F	89.8	Confident	86.8	Confident	9 Å²	9	73.3 Å²	73.3	4%	0.039	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	111.8	178.4	174	-119	0	0	0	110.5	L58 F69 V71 F82 N83 F85 F91 L101	L58-F80 HydrophobicContact CD2-CE1 4.49Å; L58-F80 HydrophobicContact CD2-CE2 3.83Å; L58-F80 HydrophobicContact CD2-CZ 3.63Å; F69-F80 HydrophobicContact CB-CD2 4.48Å; F69-F80 HydrophobicContact CB-CE2 3.57Å; F69-F80 HydrophobicContact CB-CZ 4.36Å; F69-F80 HydrophobicContact CG-CE2 4.21Å; V71-F80 HydrophobicContact CG2-CB 4.34Å; V71-F80 HydrophobicContact CG2-CD2 3.56Å; V71-F80 HydrophobicContact CG2-CE2 4.19Å; V71-F80 HydrophobicContact CG2-CG 4.25Å; F80-F82 PolarHBondContact O-N 3.18Å; F80-N83 PolarHBondContact N-O 3.01Å; F80-N83 PolarHBondContact O-N 2.77Å; F80-N83 VanDerWaalsContact O-N 3.12Å; F80-F85 HydrophobicContact CB-CE2 4.09Å; F80-F91 HydrophobicContact CB-CE2 3.98Å; F80-F91 HydrophobicContact CG-CE2 4.37Å; F80-L101 HydrophobicContact CE1-CD2 3.6Å; F80-L101 HydrophobicContact CZ-CD1 3.83Å; F80-L101 HydrophobicContact CZ-CD2 3.5Å; F80-L101 HydrophobicContact CZ-CG 4.33Å
81	G	83.5	Confident	86.7	Confident	63 Å²	63	68.6 Å²	68.6	65%	0.649	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	-123.1	-170	0	0	0	0	0	111
82	F	82.5	Confident	86.4	Confident	216 Å²	216	70.9 Å²	70.9	95%	0.947	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	1.3	176.5	-60.2	-77.3	0	0	0	113.5	F80	F80-F82 PolarHBondContact O-N 3.18Å
83	N	85.4	Confident	86.1	Confident	78 Å²	78	72.5 Å²	72.5	42%	0.417	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.5	-177.3	-60.8	-59.8	0	0	0	110.8	F80 F85	F80-N83 PolarHBondContact N-O 3.01Å; F80-N83 PolarHBondContact O-N 2.77Å; F80-N83 VanDerWaalsContact O-N 3.12Å; N83-F85 HydrophobicContact CB-CD2 4.48Å; N83-F85 HydrophobicContact CB-CE1 4.36Å; N83-F85 HydrophobicContact CB-CE2 3.55Å; N83-F85 HydrophobicContact CB-CZ 3.49Å; N83-F85 VanDerWaalsContact CB-CZ 3.49Å
84	E	91	Very high	86	Confident	140 Å²	140	73 Å²	73	65%	0.654	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.4	172	-63.6	-175.4	-179.9	0	0	108.8	V77 Y78 I79	V77-E84 HydrophobicContact CG1-CB 3.91Å; Y78-E84 CarbonylContact O-C 3.58Å; Y78-E84 WeakPolarHBondContact O-CA 3.33Å; I79-E84 HydrophobicContact CG1-CG 4.39Å
85	F	89.6	Confident	85.6	Confident	19 Å²	19	65.6 Å²	65.6	8%	0.083	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115	-177.7	-56.4	-82.8	0	0	0	108.6	V77 Y78 F80 N83 S87 D90 F91 H94	V77-F85 CarbonylContact C-O 3.52Å; V77-F85 WeakPolarHBondContact CA-O 3.43Å; Y78-F85 PolarHBondContact N-O 3.16Å; Y78-F85 WeakPolarHBondContact O-CD2 3.44Å; Y78-F85 PolarHBondContact O-N 2.89Å; F80-F85 HydrophobicContact CB-CE2 4.09Å; N83-F85 HydrophobicContact CB-CD2 4.48Å; N83-F85 HydrophobicContact CB-CE1 4.36Å; N83-F85 HydrophobicContact CB-CE2 3.55Å; N83-F85 HydrophobicContact CB-CZ 3.49Å; N83-F85 VanDerWaalsContact CB-CZ 3.49Å; F85-S87 PolarHBondContact O-N 2.86Å; F85-S87 VanDerWaalsContact O-N 3.16Å; F85-D90 HydrophobicContact CB-CB 4.2Å; F85-D90 HydrophobicContact CD1-CB 4.33Å; F85-F91 HydrophobicContact CB-CB 3.96Å; F85-F91 HydrophobicContact CD2-CB 4.48Å; F85-F91 AromaticContact CD2-CD2 3.65Å; F85-F91 HydrophobicContact CD2-CD2 3.65Å; F85-F91 HydrophobicContact CD2-CE2 4.47Å; F85-F91 HydrophobicContact CE2-CD2 4.01Å; F85-F91 HydrophobicContact CG-CB 4.12Å; F85-F91 HydrophobicContact CG-CD2 4.13Å; F85-H94 HydrophobicContact CD1-CB 4.25Å; F85-H94 HydrophobicContact CE1-CB 3.43Å; F85-H94 VanDerWaalsContact CE1-CB 3.43Å; F85-H94 AromaticContact CE1-CG 3.56Å; F85-H94 AromaticContact CE1-ND1 3.79Å; F85-H94 HydrophobicContact CZ-CB 3.78Å; F85-H94 AromaticContact CZ-CD2 3.71Å; F85-H94 AromaticContact CZ-CG 3.46Å; F85-H94 VanDerWaalsContact CZ-CG 3.46Å; F85-H94 AromaticContact CZ-ND1 3.72Å
86	P	88.5	Confident	85.3	Confident	91 Å²	91	61.7 Å²	61.7	59%	0.591	35%	0.349	S	S	*	.	S	Bend	trans	-64.9	-18.2	-175.3	-23.3	33.7	0	0	0	114.9
87	S	88.2	Confident	85	Confident	37 Å²	37	63.4 Å²	63.4	26%	0.259	36%	0.358	S	S	.	.	S	Bend	trans	-145.7	163.5	-177.7	71.9	0	0	0	0	111.9	F85 Q89 D90 F91	F85-S87 PolarHBondContact O-N 2.86Å; F85-S87 VanDerWaalsContact O-N 3.16Å; S87-Q89 PolarHBondContact O-N 3.39Å; S87-Q89 PolarHBondContact OG-N 3.04Å; S87-D90 PolarHBondContact N-OD2 2.83Å; S87-D90 PolarHBondContact O-N 2.81Å; S87-D90 PolarHBondContact OG-N 3.13Å; S87-D90 VanDerWaalsContact OG-N 3.1Å; S87-D90 PolarHBondContact OG-OD2 3.21Å; S87-F91 PolarHBondContact O-N 2.84Å; S87-F91 VanDerWaalsContact O-N 3.08Å
88	L	84.4	Confident	84.4	Confident	9 Å²	9	66.3 Å²	66.3	5%	0.047	37%	0.369	C	S	.	.	H	α-helix	trans	-60.3	-37.6	171	179.4	60.7	0	0	0	111.4	E15 L16 L19 Y78 D90 F91 V92	E15-L88 HydrophobicContact CB-CD2 4.42Å; E15-L88 HydrophobicContact CG-CD2 3.66Å; E15-L88 WeakPolarHBondContact O-CD2 3.18Å; E15-L88 WeakPolarHBondContact OE1-CB 3.44Å; L16-L88 HydrophobicContact CD2-CD1 3.93Å; L16-L88 HydrophobicContact CD2-CD2 4.44Å; L19-L88 HydrophobicContact CD1-CD1 4.03Å; L19-L88 HydrophobicContact CD2-CD1 4.3Å; L19-L88 HydrophobicContact CD2-CD2 4.3Å; L19-L88 HydrophobicContact CG-CD1 4.45Å; L19-L88 HydrophobicContact CG-CD2 4.36Å; Y78-L88 HydrophobicContact CE1-CD1 4.28Å; Y78-L88 HydrophobicContact CE2-CB 3.91Å; Y78-L88 HydrophobicContact CE2-CD1 4.29Å; L88-D90 VanDerWaalsContact C-N 3.34Å; L88-D90 PolarHBondContact O-N 3Å; L88-F91 HydrophobicContact CD1-CD1 4.16Å; L88-F91 WeakPolarHBondContact O-CB 3.49Å; L88-F91 PolarHBondContact O-N 3.49Å; L88-V92 HydrophobicContact CD1-CG2 4.06Å; L88-V92 HydrophobicContact CG-CG2 4.21Å; L88-V92 VanDerWaalsContact O-CG2 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.45Å; L88-V92 PolarHBondContact O-N 3.4Å
89	Q	86.3	Confident	83.9	Confident	149 Å²	149	67.2 Å²	67.2	70%	0.696	37%	0.374	S	S	*	.	H	α-helix	trans	-62	-42.3	179.4	-174.9	176.3	9.1	0	0	111.8	S87 V92 S93	S87-Q89 PolarHBondContact O-N 3.39Å; S87-Q89 PolarHBondContact OG-N 3.04Å; Q89-V92 PolarHBondContact O-N 3.47Å; Q89-S93 VanDerWaalsContact O-CB 3.27Å; Q89-S93 WeakPolarHBondContact O-CB 3.05Å; Q89-S93 PolarHBondContact O-N 3.24Å; Q89-S93 PolarHBondContact O-OG 3.35Å
90	D	86.3	Confident	83.4	Confident	70 Å²	70	70.2 Å²	70.2	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-66.5	-42.1	176.4	-62.6	-45.5	0	0	0	111.1	F85 S87 L88 V92 S93 H94	F85-D90 HydrophobicContact CB-CB 4.2Å; F85-D90 HydrophobicContact CD1-CB 4.33Å; S87-D90 PolarHBondContact N-OD2 2.83Å; S87-D90 PolarHBondContact O-N 2.81Å; S87-D90 PolarHBondContact OG-N 3.13Å; S87-D90 VanDerWaalsContact OG-N 3.1Å; S87-D90 PolarHBondContact OG-OD2 3.21Å; L88-D90 VanDerWaalsContact C-N 3.34Å; L88-D90 PolarHBondContact O-N 3Å; D90-V92 PolarHBondContact O-N 2.83Å; D90-S93 PolarHBondContact O-N 3.44Å; D90-H94 PolarHBondContact O-N 2.93Å
91	F	87.2	Confident	83	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-58.3	-48.7	174.9	-179	-113.3	0	0	0	110.9	W21 V71 Y78 F80 F85 S87 L88 H94 F95	W21-F91 HydrophobicContact CH2-CE1 4.14Å; V71-F91 HydrophobicContact CG1-CE2 4.13Å; V71-F91 HydrophobicContact CG1-CZ 3.88Å; V71-F91 HydrophobicContact CG2-CZ 4.15Å; Y78-F91 HydrophobicContact CD1-CD1 4.28Å; Y78-F91 HydrophobicContact CD1-CG 4.34Å; Y78-F91 HydrophobicContact CD2-CB 4.44Å; Y78-F91 HydrophobicContact CG-CB 4.24Å; Y78-F91 HydrophobicContact CG-CG 4.22Å; F80-F91 HydrophobicContact CB-CE2 3.98Å; F80-F91 HydrophobicContact CG-CE2 4.37Å; F85-F91 HydrophobicContact CB-CB 3.96Å; F85-F91 HydrophobicContact CD2-CB 4.48Å; F85-F91 AromaticContact CD2-CD2 3.65Å; F85-F91 HydrophobicContact CD2-CD2 3.65Å; F85-F91 HydrophobicContact CD2-CE2 4.47Å; F85-F91 HydrophobicContact CE2-CD2 4.01Å; F85-F91 HydrophobicContact CG-CB 4.12Å; F85-F91 HydrophobicContact CG-CD2 4.13Å; S87-F91 PolarHBondContact O-N 2.84Å; S87-F91 VanDerWaalsContact O-N 3.08Å; L88-F91 HydrophobicContact CD1-CD1 4.16Å; L88-F91 WeakPolarHBondContact O-CB 3.49Å; L88-F91 PolarHBondContact O-N 3.49Å; F91-H94 VanDerWaalsContact O-CB 3.31Å; F91-H94 WeakPolarHBondContact O-CB 3.34Å; F91-H94 PolarHBondContact O-N 2.77Å; F91-F95 AromaticContact CD1-CE2 3.79Å; F91-F95 HydrophobicContact CD1-CE2 3.79Å; F91-F95 AromaticContact CD2-CE2 3.82Å; F91-F95 HydrophobicContact CD2-CE2 3.82Å; F91-F95 HydrophobicContact CD2-CZ 4.43Å; F91-F95 AromaticContact CE1-CE2 3.49Å; F91-F95 HydrophobicContact CE1-CE2 3.49Å; F91-F95 VanDerWaalsContact CE1-CE2 3.49Å; F91-F95 AromaticContact CE1-CZ 3.96Å; F91-F95 HydrophobicContact CE1-CZ 3.96Å; F91-F95 AromaticContact CE2-CE2 3.51Å; F91-F95 HydrophobicContact CE2-CE2 3.51Å; F91-F95 AromaticContact CE2-CZ 3.7Å; F91-F95 HydrophobicContact CE2-CZ 3.7Å; F91-F95 AromaticContact CG-CE2 3.97Å; F91-F95 HydrophobicContact CG-CE2 3.97Å; F91-F95 AromaticContact CZ-CE2 3.35Å; F91-F95 HydrophobicContact CZ-CE2 3.35Å; F91-F95 AromaticContact CZ-CZ 3.43Å; F91-F95 HydrophobicContact CZ-CZ 3.43Å; F91-F95 VanDerWaalsContact CZ-CZ 3.43Å; F91-F95 WeakPolarHBondContact O-CD2 3.3Å; F91-F95 VanDerWaalsContact O-CE2 3.25Å; F91-F95 WeakPolarHBondContact O-CE2 3.23Å
92	V	84.7	Confident	82.5	Confident	48 Å²	48	70 Å²	70	29%	0.291	39%	0.386	S	S	.	.	H	α-helix	trans	-64.8	-42.4	177.7	175.2	0	0	0	0	111.7	L19 W21 L88 Q89 D90 H94 F95 A96	L19-V92 HydrophobicContact CD2-CG2 3.47Å; L19-V92 VanDerWaalsContact CD2-CG2 3.47Å; W21-V92 HydrophobicContact CZ2-CG2 4.37Å; L88-V92 HydrophobicContact CD1-CG2 4.06Å; L88-V92 HydrophobicContact CG-CG2 4.21Å; L88-V92 VanDerWaalsContact O-CG2 3.26Å; L88-V92 WeakPolarHBondContact O-CG2 3.45Å; L88-V92 PolarHBondContact O-N 3.4Å; Q89-V92 PolarHBondContact O-N 3.47Å; D90-V92 PolarHBondContact O-N 2.83Å; V92-H94 PolarHBondContact O-N 3.43Å; V92-F95 WeakPolarHBondContact O-CB 3.19Å; V92-F95 PolarHBondContact O-N 3.43Å; V92-A96 PolarHBondContact O-N 3.3Å
93	S	83.8	Confident	81.8	Confident	56 Å²	56	60.5 Å²	60.5	39%	0.392	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-31	179.4	-60.8	0	0	0	0	112	Q89 D90 F95 A96 N97	Q89-S93 VanDerWaalsContact O-CB 3.27Å; Q89-S93 WeakPolarHBondContact O-CB 3.05Å; Q89-S93 PolarHBondContact O-N 3.24Å; Q89-S93 PolarHBondContact O-OG 3.35Å; D90-S93 PolarHBondContact O-N 3.44Å; S93-F95 VanDerWaalsContact C-N 3.34Å; S93-F95 PolarHBondContact O-N 2.93Å; S93-A96 WeakPolarHBondContact O-CB 3.42Å; S93-A96 PolarHBondContact O-N 2.95Å; S93-N97 PolarHBondContact O-ND2 3.32Å
94	H	82	Confident	80.9	Confident	44 Å²	44	65.5 Å²	65.5	20%	0.204	37%	0.374	C	S	.	.	H	α-helix	trans	-59.1	-43.5	171.4	-179.5	74	0	0	0	112.2	F85 D90 F91 V92 A96 N97 P99	F85-H94 HydrophobicContact CD1-CB 4.25Å; F85-H94 HydrophobicContact CE1-CB 3.43Å; F85-H94 VanDerWaalsContact CE1-CB 3.43Å; F85-H94 AromaticContact CE1-CG 3.56Å; F85-H94 AromaticContact CE1-ND1 3.79Å; F85-H94 HydrophobicContact CZ-CB 3.78Å; F85-H94 AromaticContact CZ-CD2 3.71Å; F85-H94 AromaticContact CZ-CG 3.46Å; F85-H94 VanDerWaalsContact CZ-CG 3.46Å; F85-H94 AromaticContact CZ-ND1 3.72Å; D90-H94 PolarHBondContact O-N 2.93Å; F91-H94 VanDerWaalsContact O-CB 3.31Å; F91-H94 WeakPolarHBondContact O-CB 3.34Å; F91-H94 PolarHBondContact O-N 2.77Å; V92-H94 PolarHBondContact O-N 3.43Å; H94-A96 VanDerWaalsContact C-N 3.29Å; H94-A96 PolarHBondContact O-N 3.26Å; H94-N97 PolarHBondContact O-N 3.29Å; H94-P99 WeakPolarHBondContact NE2-CB 3.47Å; H94-P99 WeakPolarHBondContact O-CD 3.48Å
95	F	77.7	Confident	79.7	Confident	6 Å²	6	62.5 Å²	62.5	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-66.9	-28.7	177.9	-64.7	-87.8	0	0	0	113.1	W21 Y44 L58 F91 V92 S93 N97 Q98 L111	W21-F95 HydrophobicContact CH2-CD2 4.24Å; W21-F95 HydrophobicContact CH2-CE2 4.11Å; W21-F95 HydrophobicContact CH2-CZ 4.38Å; Y44-F95 HydrophobicContact CD2-CD1 4.44Å; Y44-F95 AromaticContact CE2-CD1 3.91Å; Y44-F95 HydrophobicContact CE2-CD1 3.91Å; Y44-F95 HydrophobicContact CE2-CE1 4.48Å; Y44-F95 HydrophobicContact CE2-CG 4.36Å; Y44-F95 AromaticContact CZ-CD1 3.98Å; L58-F95 HydrophobicContact CD1-CE1 3.97Å; L58-F95 HydrophobicContact CD1-CZ 4.25Å; L58-F95 HydrophobicContact CD2-CE1 3.69Å; L58-F95 HydrophobicContact CD2-CZ 4.17Å; F91-F95 AromaticContact CD1-CE2 3.79Å; F91-F95 HydrophobicContact CD1-CE2 3.79Å; F91-F95 AromaticContact CD2-CE2 3.82Å; F91-F95 HydrophobicContact CD2-CE2 3.82Å; F91-F95 HydrophobicContact CD2-CZ 4.43Å; F91-F95 AromaticContact CE1-CE2 3.49Å; F91-F95 HydrophobicContact CE1-CE2 3.49Å; F91-F95 VanDerWaalsContact CE1-CE2 3.49Å; F91-F95 AromaticContact CE1-CZ 3.96Å; F91-F95 HydrophobicContact CE1-CZ 3.96Å; F91-F95 AromaticContact CE2-CE2 3.51Å; F91-F95 HydrophobicContact CE2-CE2 3.51Å; F91-F95 AromaticContact CE2-CZ 3.7Å; F91-F95 HydrophobicContact CE2-CZ 3.7Å; F91-F95 AromaticContact CG-CE2 3.97Å; F91-F95 HydrophobicContact CG-CE2 3.97Å; F91-F95 AromaticContact CZ-CE2 3.35Å; F91-F95 HydrophobicContact CZ-CE2 3.35Å; F91-F95 AromaticContact CZ-CZ 3.43Å; F91-F95 HydrophobicContact CZ-CZ 3.43Å; F91-F95 VanDerWaalsContact CZ-CZ 3.43Å; F91-F95 WeakPolarHBondContact O-CD2 3.3Å; F91-F95 VanDerWaalsContact O-CE2 3.25Å; F91-F95 WeakPolarHBondContact O-CE2 3.23Å; V92-F95 WeakPolarHBondContact O-CB 3.19Å; V92-F95 PolarHBondContact O-N 3.43Å; S93-F95 VanDerWaalsContact C-N 3.34Å; S93-F95 PolarHBondContact O-N 2.93Å; F95-N97 PolarHBondContact O-N 3.25Å; F95-Q98 PolarHBondContact O-N 3.27Å; F95-L111 HydrophobicContact CD1-CD1 3.32Å; F95-L111 HydrophobicContact CE1-CD1 3.34Å
96	A	74.6	Confident	78.7	Confident	81 Å²	81	64.7 Å²	64.7	67%	0.669	40%	0.4	S	S	*	.	H	α-helix	trans	-60.8	-26.7	177.4	0	0	0	0	0	112.6	V92 S93 H94 Q98	V92-A96 PolarHBondContact O-N 3.3Å; S93-A96 WeakPolarHBondContact O-CB 3.42Å; S93-A96 PolarHBondContact O-N 2.95Å; H94-A96 VanDerWaalsContact C-N 3.29Å; H94-A96 PolarHBondContact O-N 3.26Å; A96-Q98 VanDerWaalsContact C-N 3.27Å; A96-Q98 PolarHBondContact O-N 2.62Å
97	N	75.6	Confident	77.9	Confident	135 Å²	135	63.2 Å²	63.2	72%	0.722	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	12.6	178.4	-64.4	-51.4	0	0	0	113.8	S93 H94 F95	S93-N97 PolarHBondContact O-ND2 3.32Å; H94-N97 PolarHBondContact O-N 3.29Å; F95-N97 PolarHBondContact O-N 3.25Å
98	Q	74.1	Confident	77.4	Confident	105 Å²	105	67.1 Å²	67.1	49%	0.491	41%	0.407	S	S	.	.			trans	49	61.4	178.6	-60.6	-167.2	-33.4	0	0	113.7	F95 A96 V110 L111 K112	F95-Q98 PolarHBondContact O-N 3.27Å; A96-Q98 VanDerWaalsContact C-N 3.27Å; A96-Q98 PolarHBondContact O-N 2.62Å; Q98-V110 HydrophobicContact CB-CG1 4.01Å; Q98-L111 VanDerWaalsContact CA-O 3.23Å; Q98-L111 WeakPolarHBondContact CA-O 3.31Å; Q98-L111 VanDerWaalsContact CB-O 3.28Å; Q98-L111 WeakPolarHBondContact CB-O 3.28Å; Q98-L111 WeakPolarHBondContact CG-O 3.43Å; Q98-K112 PolarHBondContact NE2-O 3.31Å
99	P	77.3	Confident	77.2	Confident	18 Å²	18	67 Å²	67	12%	0.117	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-63.2	147.7	-174.6	29.2	-37.1	0	0	0	111.4	H94 L111	H94-P99 WeakPolarHBondContact NE2-CB 3.47Å; H94-P99 WeakPolarHBondContact O-CD 3.48Å; P99-L111 HydrophobicContact CG-CB 4.26Å; P99-L111 HydrophobicContact CG-CD1 3.8Å; P99-L111 HydrophobicContact CG-CG 4.25Å; P99-L111 PolarHBondContact O-N 3.2Å; P99-L111 VanDerWaalsContact O-N 3.08Å
100	L	79.1	Confident	77.1	Confident	101 Å²	101	62.5 Å²	62.5	53%	0.529	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	119.4	177	-170	73.6	0	0	0	109.7	L108 V110	L100-L108 HydrophobicContact CD1-CB 4.07Å; L100-L108 HydrophobicContact CD2-CB 4.41Å; L100-L108 HydrophobicContact CD2-CD1 4.22Å; L100-L108 HydrophobicContact CD2-CD2 4.07Å; L100-L108 HydrophobicContact CD2-CG 4.47Å; L100-L108 HydrophobicContact CG-CB 4.33Å; L100-L108 HydrophobicContact CG-CD2 4.33Å; L100-V110 HydrophobicContact CD1-CB 4.44Å; L100-V110 HydrophobicContact CD1-CG2 3.44Å; L100-V110 VanDerWaalsContact CD1-CG2 3.44Å
101	L	80.9	Confident	77	Confident	16 Å²	16	59.1 Å²	59.1	8%	0.084	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	128.6	177.7	-54.3	-175.6	0	0	0	110.5	L58 V60 F69 F80 L108 I109 L111	L58-L101 HydrophobicContact CD2-CD1 4.32Å; V60-L101 HydrophobicContact CG2-CD1 4.21Å; F69-L101 HydrophobicContact CD1-CD1 4.4Å; F69-L101 HydrophobicContact CD2-CD1 3.68Å; F69-L101 HydrophobicContact CE1-CB 4.02Å; F69-L101 HydrophobicContact CE1-CD1 4.18Å; F69-L101 HydrophobicContact CE2-CB 4.25Å; F69-L101 HydrophobicContact CE2-CD1 3.42Å; F69-L101 VanDerWaalsContact CE2-CD1 3.42Å; F69-L101 HydrophobicContact CG-CD1 4.17Å; F69-L101 HydrophobicContact CZ-CB 3.68Å; F69-L101 HydrophobicContact CZ-CD1 3.69Å; F69-L101 HydrophobicContact CZ-CG 4.36Å; F80-L101 HydrophobicContact CE1-CD2 3.6Å; F80-L101 HydrophobicContact CZ-CD1 3.83Å; F80-L101 HydrophobicContact CZ-CD2 3.5Å; F80-L101 HydrophobicContact CZ-CG 4.33Å; L101-L108 CarbonylContact O-C 3.56Å; L101-L108 WeakPolarHBondContact O-CA 3.5Å; L101-I109 PolarHBondContact N-O 2.88Å; L101-I109 PolarHBondContact O-N 3.41Å; L101-L111 HydrophobicContact CD1-CD1 3.96Å; L101-L111 HydrophobicContact CD1-CD2 3.76Å; L101-L111 HydrophobicContact CD1-CG 3.92Å; L101-L111 HydrophobicContact CG-CD1 4.32Å; L101-L111 HydrophobicContact CG-CD2 4.41Å; L101-L111 HydrophobicContact CG-CG 4.12Å
102	G	73.5	Confident	76.8	Confident	50 Å²	50	63.8 Å²	63.8	52%	0.515	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	131.3	165.5	0	0	0	0	0	110.3
103	S	67.9	Low	76.9	Confident	18 Å²	18	63.8 Å²	63.8	13%	0.126	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-93	158.4	165.4	67.3	0	0	0	0	111	A105 G106 T107	S103-A105 PolarHBondContact O-N 3.25Å; S103-G106 PolarHBondContact O-N 3.39Å; S103-T107 PolarHBondContact N-O 3.39Å; S103-T107 WeakPolarHBondContact OG-CB 3.38Å; S103-T107 PolarHBondContact OG-N 3.47Å; S103-T107 PolarHBondContact OG-O 3.28Å
104	D	66.6	Low	77.1	Confident	183 Å²	183	64.1 Å²	64.1	98%	0.979	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.8	177	-51.9	-21.1	0	0	0	113.4	G106	D104-G106 VanDerWaalsContact C-N 3.27Å; D104-G106 PolarHBondContact O-N 3.3Å
105	A	65.6	Low	77.4	Confident	77 Å²	77	62.8 Å²	62.8	64%	0.636	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	9.6	174.8	0	0	0	0	0	113.6	S103 T107	S103-A105 PolarHBondContact O-N 3.25Å; A105-T107 PolarHBondContact O-N 3.06Å
106	G	67.6	Low	77.7	Confident	64 Å²	64	65.5 Å²	65.5	66%	0.66	41%	0.406	S	S	*	.	S	Bend	trans	73.9	4.4	-179.5	0	0	0	0	0	115	S103 D104	S103-G106 PolarHBondContact O-N 3.39Å; D104-G106 VanDerWaalsContact C-N 3.27Å; D104-G106 PolarHBondContact O-N 3.3Å
107	T	71.6	Confident	78.1	Confident	61 Å²	61	66.2 Å²	66.2	37%	0.374	39%	0.391	S	S	.	.			trans	-75.2	128.8	175.1	-48.8	0	0	0	0	110.1	S103 A105 I109	S103-T107 PolarHBondContact N-O 3.39Å; S103-T107 WeakPolarHBondContact OG-CB 3.38Å; S103-T107 PolarHBondContact OG-N 3.47Å; S103-T107 PolarHBondContact OG-O 3.28Å; A105-T107 PolarHBondContact O-N 3.06Å; T107-I109 HydrophobicContact CG2-CG1 4.18Å
108	L	78.3	Confident	78	Confident	119 Å²	119	68.6 Å²	68.6	62%	0.623	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.6	173.1	-62.6	173.3	0	0	0	109.9	L100 L101	L100-L108 HydrophobicContact CD1-CB 4.07Å; L100-L108 HydrophobicContact CD2-CB 4.41Å; L100-L108 HydrophobicContact CD2-CD1 4.22Å; L100-L108 HydrophobicContact CD2-CD2 4.07Å; L100-L108 HydrophobicContact CD2-CG 4.47Å; L100-L108 HydrophobicContact CG-CB 4.33Å; L100-L108 HydrophobicContact CG-CD2 4.33Å; L101-L108 CarbonylContact O-C 3.56Å; L101-L108 WeakPolarHBondContact O-CA 3.5Å
109	I	81.4	Confident	77.5	Confident	7 Å²	7	65.7 Å²	65.7	4%	0.036	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	122.3	-177.1	-53.8	168.7	0	0	0	108.9	V60 A62 K67 F69 L101 T107	V60-I109 HydrophobicContact CG1-CG2 3.64Å; A62-I109 HydrophobicContact CB-CD1 3.9Å; A62-I109 HydrophobicContact CB-CG1 4.15Å; K67-I109 HydrophobicContact CB-CD1 4.07Å; K67-I109 HydrophobicContact CG-CD1 3.56Å; F69-I109 HydrophobicContact CZ-CD1 4.44Å; L101-I109 PolarHBondContact N-O 2.88Å; L101-I109 PolarHBondContact O-N 3.41Å; T107-I109 HydrophobicContact CG2-CG1 4.18Å
110	V	83.7	Confident	76.3	Confident	53 Å²	53	73.3 Å²	73.3	32%	0.321	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	126.6	172.5	-179.9	0	0	0	0	108.4	G42 Q98 L100 K112	G42-V110 WeakPolarHBondContact CA-O 3.39Å; Q98-V110 HydrophobicContact CB-CG1 4.01Å; L100-V110 HydrophobicContact CD1-CB 4.44Å; L100-V110 HydrophobicContact CD1-CG2 3.44Å; L100-V110 VanDerWaalsContact CD1-CG2 3.44Å; V110-K112 HydrophobicContact CB-CG 4.37Å; V110-K112 HydrophobicContact CG1-CG 4.01Å; V110-K112 PolarHBondContact O-N 2.81Å
111	L	83.9	Confident	75	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	42%	0.418	C	S	.	.			trans	-75.5	109.4	169.7	-62.8	-172.4	0	0	0	109.3	Y44 L58 V60 F95 Q98 P99 L101	Y44-L111 HydrophobicContact CD1-CB 3.94Å; Y44-L111 HydrophobicContact CD1-CD2 3.99Å; Y44-L111 HydrophobicContact CD1-CG 4.42Å; Y44-L111 HydrophobicContact CE1-CB 4.02Å; Y44-L111 HydrophobicContact CG-CD2 4.23Å; L58-L111 HydrophobicContact CD2-CD1 4.02Å; V60-L111 HydrophobicContact CB-CD2 4.16Å; V60-L111 HydrophobicContact CG1-CD2 3.36Å; V60-L111 HydrophobicContact CG2-CD2 3.64Å; F95-L111 HydrophobicContact CD1-CD1 3.32Å; F95-L111 HydrophobicContact CE1-CD1 3.34Å; Q98-L111 VanDerWaalsContact CA-O 3.23Å; Q98-L111 WeakPolarHBondContact CA-O 3.31Å; Q98-L111 VanDerWaalsContact CB-O 3.28Å; Q98-L111 WeakPolarHBondContact CB-O 3.28Å; Q98-L111 WeakPolarHBondContact CG-O 3.43Å; P99-L111 HydrophobicContact CG-CB 4.26Å; P99-L111 HydrophobicContact CG-CD1 3.8Å; P99-L111 HydrophobicContact CG-CG 4.25Å; P99-L111 PolarHBondContact O-N 3.2Å; P99-L111 VanDerWaalsContact O-N 3.08Å; L101-L111 HydrophobicContact CD1-CD1 3.96Å; L101-L111 HydrophobicContact CD1-CD2 3.76Å; L101-L111 HydrophobicContact CD1-CG 3.92Å; L101-L111 HydrophobicContact CG-CD1 4.32Å; L101-L111 HydrophobicContact CG-CD2 4.41Å; L101-L111 HydrophobicContact CG-CG 4.12Å
112	K	83.2	Confident	73.3	Confident	98 Å²	98	75.9 Å²	75.9	43%	0.426	43%	0.426	S	S	.	.			trans	-99.5	-46.9	-173.5	-65.4	-175.5	-168.1	157.1	0	112.7	D41 G42 Q98 V110	D41-K112 WeakPolarHBondContact O-CD 3.27Å; D41-K112 IonicContact OD2-NZ 2.62Å; D41-K112 PolarHBondContact OD2-NZ 2.71Å; G42-K112 PolarHBondContact O-N 2.75Å; Q98-K112 PolarHBondContact NE2-O 3.31Å; V110-K112 HydrophobicContact CB-CG 4.37Å; V110-K112 HydrophobicContact CG1-CG 4.01Å; V110-K112 PolarHBondContact O-N 2.81Å
113	S	85.8	Confident	72.2	Confident	47 Å²	47	78.9 Å²	78.9	33%	0.329	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	133.6	-169	64.7	0	0	0	0	113.2	G42 S43 Y44	G42-S113 PolarHBondContact O-N 3.33Å; S43-S113 VanDerWaalsContact CA-O 3.25Å; S43-S113 WeakPolarHBondContact CA-O 3.1Å; S43-S113 PolarHBondContact OG-OG 3.02Å; Y44-S113 VanDerWaalsContact CD1-O 3.31Å; Y44-S113 WeakPolarHBondContact CD1-O 2.91Å; Y44-S113 WeakPolarHBondContact CE1-O 3.42Å; Y44-S113 PolarHBondContact N-O 2.86Å
114	P	89.6	Confident	71.2	Confident	64 Å²	64	80.4 Å²	80.4	42%	0.416	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	138.9	171.6	27.9	-32.5	0	0	0	110.9	W21 Y44	W21-P114 HydrophobicContact CB-CB 3.66Å; W21-P114 HydrophobicContact CD2-CB 4.2Å; W21-P114 HydrophobicContact CG-CB 3.55Å; Y44-P114 HydrophobicContact CE2-CB 3.91Å; Y44-P114 CarbonylContact O-C 3.54Å
115	Y	86.5	Confident	70.4	Confident	16 Å²	16	78.1 Å²	78.1	6%	0.063	42%	0.424	C	S	.	.			trans	-94.2	115	176.2	-171.4	-84.8	0	0	0	109.2	W21 H23 L35 N38 Y44 L45 V119	W21-Y115 WeakPolarHBondContact CA-O 3.49Å; W21-Y115 WeakPolarHBondContact CB-O 3.19Å; H23-Y115 AromaticContact CE1-CD1 3.81Å; H23-Y115 AromaticContact NE2-CD1 3.97Å; H23-Y115 PolarHBondContact NE2-O 3.25Å; L35-Y115 HydrophobicContact CD2-CD2 4.09Å; L35-Y115 HydrophobicContact CD2-CG 4Å; N38-Y115 HydrophobicContact CB-CE2 3.94Å; N38-Y115 VanDerWaalsContact CB-OH 3.27Å; N38-Y115 WeakPolarHBondContact CB-OH 3.36Å; N38-Y115 PolarHBondContact ND2-OH 3.05Å; Y44-Y115 WeakPolarHBondContact O-CB 3.49Å; Y44-Y115 PolarHBondContact O-N 3.29Å; L45-Y115 HydrophobicContact CD2-CD1 4.21Å; Y115-V119 HydrophobicContact CE1-CG2 3.82Å
116	P	85.6	Confident	69.5	Low	62 Å²	62	83.1 Å²	83.1	40%	0.403	43%	0.434	S	S	.	.			trans	-68.4	144.7	-169	27.9	-34.8	0	0	0	112.2	G20 H23	G20-P116 CarbonylContact O-C 3.53Å; G20-P116 WeakPolarHBondContact O-CA 3.3Å; H23-P116 PolarHBondContact CE1-O 3.36Å; H23-P116 PolarHBondContact NE2-O 3.09Å
117	W	81.9	Confident	68.5	Low	96 Å²	96	83.7 Å²	83.7	36%	0.364	43%	0.428	S	S	.	.	S	Bend	trans	-72.9	-32.9	175.6	84.2	-95.3	0	0	0	112	G20 Y22 H23 Y24	G20-W117 PolarHBondContact O-N 2.74Å; Y22-W117 VanDerWaalsContact O-CB 3.26Å; Y22-W117 WeakPolarHBondContact O-CB 3.44Å; H23-W117 VanDerWaalsContact CE1-CA 3.48Å; H23-W117 WeakPolarHBondContact CE1-CA 3.28Å; H23-W117 WeakPolarHBondContact NE2-CA 3.3Å; Y24-W117 HydrophobicContact CE2-CD2 4.49Å; Y24-W117 HydrophobicContact CE2-CE3 4.36Å
118	R	73.4	Confident	67.7	Low	185 Å²	185	86.8 Å²	86.8	70%	0.698	45%	0.446	S	S	*	.			trans	-92.7	100.9	166.6	-68.7	-172.5	-174.2	-155.1	3.6	109.5
119	V	63.5	Low	66.7	Low	45 Å²	45	91.7 Å²	91.7	27%	0.273	46%	0.456	S	S	.	.			trans	-90.9	123.4	163.9	-175.2	0	0	0	0	106.4	Y115 E121	Y115-V119 HydrophobicContact CE1-CG2 3.82Å; V119-E121 PolarHBondContact O-N 2.93Å
120	E	53.1	Low	65.2	Low	177 Å²	177	97.2 Å²	97.2	83%	0.827	49%	0.49	S	S	*	.			trans	-59.4	103.8	170.5	-75.5	-176	162.8	0	0	108.5
121	E	51.1	Low	63.3	Low	133 Å²	133	103 Å²	103	62%	0.621	51%	0.514	S	S	*	.			trans	-66.3	128	170.3	-67.9	-170.7	161.8	0	0	107.6	V119 S123 Y125	V119-E121 PolarHBondContact O-N 2.93Å; E121-S123 PolarHBondContact O-N 2.96Å; E121-Y125 HydrophobicContact CB-CE2 4.43Å
122	P	46.5	Very low	61.8	Low	38 Å²	38	108.7 Å²	108.7	25%	0.247	55%	0.548	C	S	.	.			trans	-55.9	138.3	170.5	-16.7	28	0	0	0	108	I124	P122-I124 HydrophobicContact CB-CD1 4.19Å; P122-I124 HydrophobicContact CB-CG1 4Å; P122-I124 HydrophobicContact CB-CG2 3.93Å; P122-I124 HydrophobicContact CG-CD1 4.49Å; P122-I124 PolarHBondContact O-N 3.19Å
123	S	49.2	Very low	60.7	Low	114 Å²	114	108 Å²	108	80%	0.797	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	33.7	179.3	72.4	0	0	0	0	113.3	E121	E121-S123 PolarHBondContact O-N 2.96Å
124	I	47.6	Very low	59.3	Low	49 Å²	49	113.3 Å²	113.3	25%	0.251	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.3	-8.1	-176.4	63.1	173.9	0	0	0	112	P122 E126 K238	P122-I124 HydrophobicContact CB-CD1 4.19Å; P122-I124 HydrophobicContact CB-CG1 4Å; P122-I124 HydrophobicContact CB-CG2 3.93Å; P122-I124 HydrophobicContact CG-CD1 4.49Å; P122-I124 PolarHBondContact O-N 3.19Å; I124-E126 PolarHBondContact O-N 2.78Å; I124-K238 HydrophobicContact CG2-CD 4.12Å
125	Y	48.8	Very low	57.4	Low	136 Å²	136	115.8 Å²	115.8	53%	0.533	59%	0.59	S	S	.	*			trans	-84.8	103.1	177.3	-60.6	-70.6	0	0	0	109.2	E121	E121-Y125 HydrophobicContact CB-CE2 4.43Å
126	E	47.6	Very low	56.2	Low	182 Å²	182	121.9 Å²	121.9	85%	0.85	63%	0.629	S	S	*	*			trans	-69	131.6	176.8	-161.7	175.6	-151.1	0	0	110.1	I124 V128	I124-E126 PolarHBondContact O-N 2.78Å; E126-V128 PolarHBondContact O-N 2.82Å
127	S	46.1	Very low	55.1	Low	76 Å²	76	122.5 Å²	122.5	53%	0.531	65%	0.647	S	S	.	*			trans	-66.5	115.6	174.8	62.9	0	0	0	0	109.7	R129	S127-R129 PolarHBondContact O-N 2.73Å
128	V	55.6	Low	54.2	Low	125 Å²	125	126.2 Å²	126.2	76%	0.758	66%	0.66	S	S	*	*			trans	-67.2	105.5	178.3	-178.6	0	0	0	0	109.5	E126 V130	E126-V128 PolarHBondContact O-N 2.82Å; V128-V130 VanDerWaalsContact CG1-O 3.31Å; V128-V130 WeakPolarHBondContact CG1-O 3.36Å
129	R	57.7	Low	54.2	Low	222 Å²	222	121 Å²	121	84%	0.838	65%	0.649	S	S	*	*			trans	-92.3	-14.2	178.6	-64.3	-156.7	-178.6	-102.6	-0.3	114.4	S127	S127-R129 PolarHBondContact O-N 2.73Å
130	V	49.7	Very low	54.2	Low	124 Å²	124	126.9 Å²	126.9	75%	0.752	67%	0.674	S	S	*	*			trans	-132.5	125.2	179.5	-177.3	0	0	0	0	108.5	V128	V128-V130 VanDerWaalsContact CG1-O 3.31Å; V128-V130 WeakPolarHBondContact CG1-O 3.36Å
131	H	42.3	Very low	54.9	Low	175 Å²	175	125.1 Å²	125.1	81%	0.81	67%	0.67	S	S	*	*			trans	-122	125.4	170.7	62.8	-75.4	0	0	0	108.1
132	T	52	Low	55.5	Low	119 Å²	119	123.2 Å²	123.2	73%	0.73	66%	0.664	S	S	*	*			trans	-136.9	142.4	170.2	-136.1	0	0	0	0	108.3	I134	T132-I134 PolarHBondContact O-N 2.71Å
133	A	60.2	Low	56.1	Low	82 Å²	82	127.8 Å²	127.8	68%	0.678	69%	0.686	S	S	*	*			trans	-74.9	111.8	177.1	0	0	0	0	0	109.6	Q135	A133-Q135 VanDerWaalsContact C-N 3.31Å
134	I	56.4	Low	56.6	Low	159 Å²	159	127.4 Å²	127.4	82%	0.815	68%	0.679	S	S	*	*	S	Bend	trans	-77	-20.7	177.9	-61.5	174.2	0	0	0	111.3	T132	T132-I134 PolarHBondContact O-N 2.71Å
135	Q	51.5	Low	56.6	Low	117 Å²	117	130.9 Å²	130.9	55%	0.547	70%	0.704	S	S	.	*			trans	-136.6	123.1	-179.3	-68.1	179.8	-1.5	0	0	110.5	A133 R138	A133-Q135 VanDerWaalsContact C-N 3.31Å; Q135-R138 VanDerWaalsContact OE1-NE 3.1Å
136	T	59.6	Low	56.5	Low	143 Å²	143	133.6 Å²	133.6	88%	0.877	72%	0.719	S	S	*	*	S	Bend	trans	-92.5	130.3	169.9	53.4	0	0	0	0	109
137	G	63.2	Low	56.3	Low	76 Å²	76	129 Å²	129	78%	0.784	71%	0.712	S	S	*	*			trans	119.3	2	178.2	0	0	0	0	0	116
138	R	62.6	Low	56.3	Low	173 Å²	173	130.4 Å²	130.4	65%	0.653	72%	0.719	S	S	*	*			trans	-78.4	141.1	167.2	-69.8	-170.7	-179.7	173.8	-0.6	110.9	Q135 D142	Q135-R138 VanDerWaalsContact OE1-NE 3.1Å; R138-D142 WeakPolarHBondContact CA-OD2 3.18Å; R138-D142 HydrophobicContact CB-CB 4.28Å; R138-D142 VanDerWaalsContact CB-OD2 3.3Å; R138-D142 WeakPolarHBondContact CB-OD2 3.46Å
139	T	73.6	Confident	56.3	Low	76 Å²	76	126.3 Å²	126.3	47%	0.466	70%	0.696	S	S	.	*			trans	-103.1	173.9	179	70.3	0	0	0	0	111.1	D141 D142	T139-D141 PolarHBondContact O-N 3.02Å; T139-D141 PolarHBondContact OG1-N 2.99Å; T139-D141 PolarHBondContact OG1-OD2 2.87Å; T139-D142 PolarHBondContact N-OD2 3.39Å; T139-D142 WeakPolarHBondContact O-CB 3.28Å; T139-D142 PolarHBondContact O-N 3.48Å; T139-D142 VanDerWaalsContact O-N 3.12Å
140	Q	63.3	Low	56.5	Low	169 Å²	169	117.7 Å²	117.7	79%	0.79	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-60.5	-26.2	172.7	-72	-177.3	-19.4	0	0	112.3	D142 L143	Q140-D142 PolarHBondContact O-N 3.34Å; Q140-L143 HydrophobicContact CB-CD1 4.36Å; Q140-L143 HydrophobicContact CG-CD1 4.43Å; Q140-L143 VanDerWaalsContact O-CB 3.22Å; Q140-L143 WeakPolarHBondContact O-CB 3.28Å; Q140-L143 WeakPolarHBondContact O-CG 3.39Å; Q140-L143 PolarHBondContact O-N 2.64Å; Q140-L143 VanDerWaalsContact O-N 3.08Å
141	D	68.1	Low	57.4	Low	139 Å²	139	112.3 Å²	112.3	74%	0.743	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-67.8	-20.4	177.3	-53.8	-53.7	0	0	0	112.6	T139 L143	T139-D141 PolarHBondContact O-N 3.02Å; T139-D141 PolarHBondContact OG1-N 2.99Å; T139-D141 PolarHBondContact OG1-OD2 2.87Å; D141-L143 PolarHBondContact O-N 3.49Å
142	D	64.1	Low	59.5	Low	94 Å²	94	105.7 Å²	105.7	50%	0.503	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-78.3	-7.5	174.3	-62.9	-50	0	0	0	112.9	R138 T139 Q140 V144	R138-D142 WeakPolarHBondContact CA-OD2 3.18Å; R138-D142 HydrophobicContact CB-CB 4.28Å; R138-D142 VanDerWaalsContact CB-OD2 3.3Å; R138-D142 WeakPolarHBondContact CB-OD2 3.46Å; T139-D142 PolarHBondContact N-OD2 3.39Å; T139-D142 WeakPolarHBondContact O-CB 3.28Å; T139-D142 PolarHBondContact O-N 3.48Å; T139-D142 VanDerWaalsContact O-N 3.12Å; Q140-D142 PolarHBondContact O-N 3.34Å; D142-V144 PolarHBondContact O-N 2.94Å
143	L	58.5	Low	61.4	Low	134 Å²	134	102.2 Å²	102.2	70%	0.702	58%	0.583	S	S	*	*			trans	-77.5	49.9	177.9	-59.5	174.4	0	0	0	111.7	Q140 D141 P145	Q140-L143 HydrophobicContact CB-CD1 4.36Å; Q140-L143 HydrophobicContact CG-CD1 4.43Å; Q140-L143 VanDerWaalsContact O-CB 3.22Å; Q140-L143 WeakPolarHBondContact O-CB 3.28Å; Q140-L143 WeakPolarHBondContact O-CG 3.39Å; Q140-L143 PolarHBondContact O-N 2.64Å; Q140-L143 VanDerWaalsContact O-N 3.08Å; D141-L143 PolarHBondContact O-N 3.49Å; L143-P145 WeakPolarHBondContact O-CD 3.23Å
144	V	61	Low	63.1	Low	106 Å²	106	103.5 Å²	103.5	64%	0.642	58%	0.575	S	S	*	*			trans	-75.9	115.8	172.1	-177.5	0	0	0	0	108.4	D142 K146	D142-V144 PolarHBondContact O-N 2.94Å; V144-K146 PolarHBondContact O-N 3.32Å
145	P	46.1	Very low	64.9	Low	121 Å²	121	96.6 Å²	96.6	79%	0.786	54%	0.542	S	S	*	.			trans	-66.7	99.9	178.4	-16.6	31.4	0	0	0	110	L143 A147	L143-P145 WeakPolarHBondContact O-CD 3.23Å; P145-A147 VanDerWaalsContact C-N 3.32Å; P145-A147 PolarHBondContact O-N 3.27Å
146	K	47.3	Very low	67.1	Low	193 Å²	193	95.4 Å²	95.4	84%	0.839	53%	0.534	S	S	*	.			trans	-92.7	71	161.1	-80.4	-173.3	176.7	179.4	0	108.2	V144 P148	V144-K146 PolarHBondContact O-N 3.32Å; K146-P148 VanDerWaalsContact O-CD 3.3Å; K146-P148 WeakPolarHBondContact O-CD 3.24Å
147	A	44	Very low	69	Low	86 Å²	86	88.7 Å²	88.7	71%	0.711	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-64.1	120.3	172.3	0	0	0	0	0	108.6	P145 S149	P145-A147 VanDerWaalsContact C-N 3.32Å; P145-A147 PolarHBondContact O-N 3.27Å; A147-S149 PolarHBondContact O-N 3.09Å
148	P	45.3	Very low	70.6	Confident	105 Å²	105	87.4 Å²	87.4	68%	0.682	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-61.7	127.9	168.7	24.7	-30	0	0	0	108	K146 L150	K146-P148 VanDerWaalsContact O-CD 3.3Å; K146-P148 WeakPolarHBondContact O-CD 3.24Å; P148-L150 PolarHBondContact O-N 3.35Å
149	S	55.3	Low	72.2	Confident	39 Å²	39	79.9 Å²	79.9	27%	0.273	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-54.5	135.8	173	49.4	0	0	0	0	109.7	A147 G151 T152 H175	A147-S149 PolarHBondContact O-N 3.09Å; S149-G151 PolarHBondContact O-N 2.8Å; S149-T152 VanDerWaalsContact O-CG2 3.28Å; S149-T152 WeakPolarHBondContact O-CG2 3.37Å; S149-T152 PolarHBondContact O-N 3.02Å; S149-T152 PolarHBondContact O-OG1 3Å; S149-T152 WeakPolarHBondContact OG-CG2 3.47Å; S149-H175 PolarHBondContact OG-CE1 3.49Å; S149-H175 PolarHBondContact OG-ND1 2.99Å
150	L	61.7	Low	73.2	Confident	42 Å²	42	77.2 Å²	77.2	22%	0.22	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	138.6	-178	-165.8	71.9	0	0	0	111.4	N38 P148	N38-L150 WeakPolarHBondContact ND2-CD2 2.98Å; N38-L150 PolarHBondContact OD1-O 2.88Å; P148-L150 PolarHBondContact O-N 3.35Å
151	G	70.4	Confident	74.6	Confident	10 Å²	10	69.6 Å²	69.6	10%	0.103	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	23.8	-179.4	0	0	0	0	0	114.7	S149 K243	S149-G151 PolarHBondContact O-N 2.8Å; G151-K243 WeakPolarHBondContact O-CE 3.3Å
152	T	86.4	Confident	75.5	Confident	37 Å²	37	65.3 Å²	65.3	23%	0.227	37%	0.374	C	S	.	.			trans	-100.4	153.3	165.5	60.9	0	0	0	0	111.9	S149 L174 H175 I239	S149-T152 VanDerWaalsContact O-CG2 3.28Å; S149-T152 WeakPolarHBondContact O-CG2 3.37Å; S149-T152 PolarHBondContact O-N 3.02Å; S149-T152 PolarHBondContact O-OG1 3Å; S149-T152 WeakPolarHBondContact OG-CG2 3.47Å; T152-L174 VanDerWaalsContact CA-O 3.24Å; T152-L174 WeakPolarHBondContact CA-O 2.94Å; T152-L174 VanDerWaalsContact CB-O 3.23Å; T152-L174 WeakPolarHBondContact CB-O 3.26Å; T152-L174 WeakPolarHBondContact CG2-O 3.4Å; T152-H175 HydrophobicContact CG2-CB 4.42Å; T152-H175 WeakPolarHBondContact CG2-ND1 3.38Å; T152-I239 VanDerWaalsContact O-CD1 3.3Å; T152-I239 WeakPolarHBondContact O-CD1 3.35Å
153	K	91.5	Very high	76.6	Confident	45 Å²	45	68.4 Å²	68.4	20%	0.196	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	142.7	169.9	-172.1	171.2	-177.5	68.3	0	109.2	L174 E235 W236 I239	K153-L174 PolarHBondContact N-O 3.26Å; K153-L174 PolarHBondContact O-N 2.68Å; K153-E235 IonicContact NZ-OE2 3.09Å; K153-E235 PolarHBondContact NZ-OE2 3.09Å; K153-W236 HydrophobicContact CB-CH2 4.23Å; K153-W236 HydrophobicContact CB-CZ3 4.15Å; K153-W236 HydrophobicContact CD-CD2 3.74Å; K153-W236 HydrophobicContact CD-CE3 3.99Å; K153-W236 HydrophobicContact CD-CG 4.09Å; K153-W236 HydrophobicContact CD-CZ2 4.37Å; K153-W236 HydrophobicContact CD-CZ3 4.39Å; K153-W236 HydrophobicContact CG-CD2 4.29Å; K153-W236 HydrophobicContact CG-CE3 4.36Å; K153-W236 HydrophobicContact CG-CH2 4.11Å; K153-W236 HydrophobicContact CG-CZ2 4.04Å; K153-W236 HydrophobicContact CG-CZ3 4.26Å; K153-I239 HydrophobicContact CB-CD1 3.73Å; K153-I239 HydrophobicContact CB-CG2 4.21Å; K153-I239 HydrophobicContact CD-CG2 3.91Å
154	E	95.3	Very high	78	Confident	110 Å²	110	66.8 Å²	66.8	51%	0.514	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.6	171.7	62.2	175.6	-144.5	0	0	110.1	W171 F172 T173	E154-W171 HydrophobicContact CB-CH2 4.05Å; E154-W171 HydrophobicContact CB-CZ2 3.56Å; E154-W171 HydrophobicContact CG-CH2 3.9Å; E154-W171 HydrophobicContact CG-CZ2 3.63Å; E154-W171 WeakPolarHBondContact OE1-CZ2 3.37Å; E154-F172 VanDerWaalsContact CA-O 3.23Å; E154-F172 WeakPolarHBondContact CA-O 3.21Å; E154-T173 HydrophobicContact CB-CG2 4.11Å
155	G	95.1	Very high	79.4	Confident	13 Å²	13	67.6 Å²	67.6	13%	0.134	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.5	160.6	-176.4	0	0	0	0	0	113.2	W171 F172	G155-W171 VanDerWaalsContact CA-CZ3 3.46Å; G155-F172 PolarHBondContact N-O 3.5Å; G155-F172 PolarHBondContact O-N 3.09Å
156	Y	97.6	Very high	81.6	Confident	93 Å²	93	64.9 Å²	64.9	37%	0.365	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	131.6	172.7	-75.2	-74.1	0	0	0	110.5	Q169 R170 W171	Y156-Q169 HydrophobicContact CD1-CG 3.71Å; Y156-Q169 VanDerWaalsContact CD1-NE2 3.28Å; Y156-Q169 HydrophobicContact CG-CG 4.22Å; Y156-Q169 VanDerWaalsContact CG-NE2 3.26Å; Y156-R170 WeakPolarHBondContact CA-O 3.25Å; Y156-W171 HydrophobicContact CD1-CB 4.27Å; Y156-W171 HydrophobicContact CD1-CE3 4.04Å; Y156-W171 AromaticContact CD2-CE3 3.65Å; Y156-W171 HydrophobicContact CD2-CE3 3.65Å; Y156-W171 AromaticContact CD2-CZ3 3.78Å; Y156-W171 HydrophobicContact CD2-CZ3 3.78Å; Y156-W171 HydrophobicContact CE1-CB 3.93Å; Y156-W171 HydrophobicContact CE1-CE3 4Å; Y156-W171 AromaticContact CE2-CE3 3.59Å; Y156-W171 HydrophobicContact CE2-CE3 3.59Å; Y156-W171 AromaticContact CE2-CZ3 3.81Å; Y156-W171 HydrophobicContact CE2-CZ3 3.81Å; Y156-W171 AromaticContact CG-CE3 3.87Å; Y156-W171 HydrophobicContact CG-CE3 3.87Å; Y156-W171 HydrophobicContact CG-CZ3 4.36Å; Y156-W171 AromaticContact CZ-CE3 3.77Å
157	L	98	Very high	83.9	Confident	2 Å²	2	58.8 Å²	58.8	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	149.5	167.8	-64.7	171.6	0	0	0	109.2	Q169 R170 F172 F214 L225 A227 W236	L157-Q169 WeakPolarHBondContact O-CA 3.31Å; L157-R170 PolarHBondContact N-O 2.73Å; L157-R170 PolarHBondContact O-N 3.18Å; L157-F172 HydrophobicContact CB-CD2 3.64Å; L157-F172 HydrophobicContact CB-CE2 3.71Å; L157-F172 HydrophobicContact CB-CG 4.45Å; L157-F172 HydrophobicContact CD1-CB 4.31Å; L157-F172 HydrophobicContact CD1-CD1 4.38Å; L157-F172 HydrophobicContact CD1-CD2 4Å; L157-F172 HydrophobicContact CD1-CE2 4.39Å; L157-F172 HydrophobicContact CD1-CG 3.99Å; L157-F172 HydrophobicContact CG-CD2 4.12Å; L157-F214 HydrophobicContact CD1-CE1 4.49Å; L157-F214 HydrophobicContact CD1-CZ 3.83Å; L157-F214 HydrophobicContact CD2-CE1 4.18Å; L157-F214 HydrophobicContact CD2-CZ 4.31Å; L157-L225 HydrophobicContact CD1-CB 4.39Å; L157-L225 HydrophobicContact CD1-CD1 4.04Å; L157-A227 HydrophobicContact CD2-CB 3.71Å; L157-W236 HydrophobicContact CD1-CD2 3.97Å; L157-W236 HydrophobicContact CD1-CE3 4.47Å; L157-W236 HydrophobicContact CD1-CG 4.24Å; L157-W236 HydrophobicContact CD1-CZ2 4.23Å; L157-W236 HydrophobicContact CD2-CG 4.3Å; L157-W236 HydrophobicContact CG-CZ2 4.48Å
158	V	97.3	Very high	86.3	Confident	48 Å²	48	59.2 Å²	59.2	29%	0.291	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	120.6	171.4	-167.4	0	0	0	0	108	W167 L225 C226	V158-W167 HydrophobicContact CG1-CB 3.77Å; V158-W167 HydrophobicContact CG1-CE3 4.03Å; V158-L225 CarbonylContact O-C 3.5Å; V158-L225 WeakPolarHBondContact O-CA 3.3Å; V158-C226 PolarHBondContact N-O 2.77Å; V158-C226 PolarHBondContact O-N 2.83Å
159	K	96.1	Very high	88.8	Confident	15 Å²	15	59.3 Å²	59.3	7%	0.065	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	144.8	-176.4	62.6	158.8	-60.5	-55.6	0	113	W167 K168 R170 F172 Y181 Y224 L225	K159-W167 WeakPolarHBondContact O-CA 3.48Å; K159-K168 WeakPolarHBondContact CG-O 3.48Å; K159-K168 PolarHBondContact N-O 3.08Å; K159-K168 PolarHBondContact O-N 3.42Å; K159-R170 HydrophobicContact CD-CB 4.4Å; K159-R170 HydrophobicContact CD-CG 3.79Å; K159-R170 HydrophobicContact CG-CB 4.37Å; K159-R170 HydrophobicContact CG-CG 3.83Å; K159-F172 HydrophobicContact CB-CE2 4.36Å; K159-F172 HydrophobicContact CB-CZ 4.1Å; K159-F172 HydrophobicContact CD-CE2 4.47Å; K159-F172 HydrophobicContact CD-CZ 4.04Å; K159-F172 HydrophobicContact CG-CE2 4.42Å; K159-F172 HydrophobicContact CG-CZ 4.31Å; K159-Y181 HydrophobicContact CD-CD1 4.42Å; K159-Y181 HydrophobicContact CD-CD2 4.02Å; K159-Y181 HydrophobicContact CD-CE1 4.25Å; K159-Y181 HydrophobicContact CD-CE2 3.88Å; K159-Y181 HydrophobicContact CD-CG 4.32Å; K159-Y224 WeakPolarHBondContact CA-O 3.22Å; K159-L225 HydrophobicContact CB-CD2 3.41Å; K159-L225 VanDerWaalsContact CB-CD2 3.41Å
160	Q	95.6	Very high	90.8	Very high	21 Å²	21	59.9 Å²	59.9	10%	0.098	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.4	173.4	-161.7	-176.1	52.5	0	0	111.7	K165 N166 W167 R221 Y224	Q160-K165 HydrophobicContact CG-CB 4.19Å; Q160-K165 HydrophobicContact CG-CD 4.31Å; Q160-N166 CarbonylContact C-O 3.52Å; Q160-N166 WeakPolarHBondContact CA-O 3.28Å; Q160-W167 HydrophobicContact CB-CD2 4.2Å; Q160-W167 HydrophobicContact CB-CE3 4.15Å; Q160-W167 HydrophobicContact CB-CH2 3.93Å; Q160-W167 HydrophobicContact CB-CZ2 3.92Å; Q160-W167 HydrophobicContact CB-CZ3 4.03Å; Q160-W167 HydrophobicContact CG-CD2 4.46Å; Q160-W167 HydrophobicContact CG-CZ2 4.06Å; Q160-R221 PolarHBondContact O-NH2 2.81Å; Q160-Y224 PolarHBondContact N-O 2.79Å
161	G	92.6	Very high	92.5	Very high	9 Å²	9	59.1 Å²	59.1	9%	0.093	30%	0.297	C	S	.	.			trans	-65.1	155.7	174	0	0	0	0	0	112.6	V164 N166	G161-V164 CarbonylContact C-O 3.57Å; G161-V164 WeakPolarHBondContact CA-O 3.23Å; G161-N166 PolarHBondContact N-O 3.4Å
162	A	86.8	Confident	93.8	Very high	48 Å²	48	58.7 Å²	58.7	40%	0.397	29%	0.293	S	S	.	.	S	Bend	trans	-75.9	-55	-174.9	0	0	0	0	0	111.5	K165 R221	A162-K165 PolarHBondContact O-NZ 3.49Å; A162-R221 VanDerWaalsContact CA-CZ 3.48Å
163	I	86.9	Confident	94.3	Very high	159 Å²	159	58.3 Å²	58.3	82%	0.815	29%	0.29	S	S	*	.	S	Bend	trans	-90.9	-68.3	-175.8	-58.3	168	0	0	0	107.9	K165	I163-K165 PolarHBondContact O-N 3.35Å
164	V	88.9	Confident	94.4	Very high	100 Å²	100	56.3 Å²	56.3	61%	0.606	28%	0.282	S	S	*	.	S	Bend	trans	-81.2	116.8	171.4	-173.9	0	0	0	0	108.1	G161 N166	G161-V164 CarbonylContact C-O 3.57Å; G161-V164 WeakPolarHBondContact CA-O 3.23Å; V164-N166 HydrophobicContact CG1-CB 4.27Å; V164-N166 PolarHBondContact O-N 2.88Å; V164-N166 PolarHBondContact O-OD1 3.3Å
165	K	90.1	Very high	94.1	Very high	123 Å²	123	55 Å²	55	54%	0.535	28%	0.275	S	S	.	.			trans	-73.1	30.8	-176.3	-56.8	-56.6	-173.5	-174.9	0	114.3	Q160 A162 I163	Q160-K165 HydrophobicContact CG-CB 4.19Å; Q160-K165 HydrophobicContact CG-CD 4.31Å; A162-K165 PolarHBondContact O-NZ 3.49Å; I163-K165 PolarHBondContact O-N 3.35Å
166	N	92.1	Very high	93.6	Very high	65 Å²	65	61.2 Å²	61.2	35%	0.348	30%	0.295	S	S	.	.			trans	-71.9	155.8	173.3	62.3	15	0	0	0	111.4	Q160 G161 V164 K168	Q160-N166 CarbonylContact C-O 3.52Å; Q160-N166 WeakPolarHBondContact CA-O 3.28Å; G161-N166 PolarHBondContact N-O 3.4Å; V164-N166 HydrophobicContact CG1-CB 4.27Å; V164-N166 PolarHBondContact O-N 2.88Å; V164-N166 PolarHBondContact O-OD1 3.3Å; N166-K168 WeakPolarHBondContact ND2-CE 3.38Å; N166-K168 WeakPolarHBondContact OD1-CE 3.27Å
167	W	94.6	Very high	93.2	Very high	65 Å²	65	59.4 Å²	59.4	25%	0.246	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.3	-179.3	-70.6	88.9	0	0	0	109.6	V158 K159 Q160 Q208 K210 C226	V158-W167 HydrophobicContact CG1-CB 3.77Å; V158-W167 HydrophobicContact CG1-CE3 4.03Å; K159-W167 WeakPolarHBondContact O-CA 3.48Å; Q160-W167 HydrophobicContact CB-CD2 4.2Å; Q160-W167 HydrophobicContact CB-CE3 4.15Å; Q160-W167 HydrophobicContact CB-CH2 3.93Å; Q160-W167 HydrophobicContact CB-CZ2 3.92Å; Q160-W167 HydrophobicContact CB-CZ3 4.03Å; Q160-W167 HydrophobicContact CG-CD2 4.46Å; Q160-W167 HydrophobicContact CG-CZ2 4.06Å; W167-Q208 HydrophobicContact CH2-CB 4.08Å; W167-Q208 HydrophobicContact CH2-CG 3.87Å; W167-Q208 HydrophobicContact CZ2-CB 3.81Å; W167-Q208 HydrophobicContact CZ2-CG 3.8Å; W167-K210 VanDerWaalsContact CD1-CE 3.44Å; W167-K210 HydrophobicContact CD2-CD 3.94Å; W167-K210 VanDerWaalsContact CE2-CE 3.49Å; W167-K210 HydrophobicContact CE3-CD 4.27Å; W167-K210 HydrophobicContact CG-CD 4.43Å; W167-K210 HydrophobicContact CH2-CD 4.25Å; W167-K210 HydrophobicContact CZ2-CD 3.95Å; W167-K210 HydrophobicContact CZ3-CD 4.41Å; W167-C226 WeakPolarHBondContact CZ3-SG 3.12Å
168	K	95.3	Very high	93.1	Very high	94 Å²	94	62.8 Å²	62.8	41%	0.409	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	129.3	-178.7	-62.1	-170.8	-178.4	-176	0	110.3	K159 N166	K159-K168 WeakPolarHBondContact CG-O 3.48Å; K159-K168 PolarHBondContact N-O 3.08Å; K159-K168 PolarHBondContact O-N 3.42Å; N166-K168 WeakPolarHBondContact ND2-CE 3.38Å; N166-K168 WeakPolarHBondContact OD1-CE 3.27Å
169	Q	96.6	Very high	93.1	Very high	108 Å²	108	60.6 Å²	60.6	51%	0.505	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.1	170.7	-175.2	172.4	-22.5	0	0	109.9	Y156 L157	Y156-Q169 HydrophobicContact CD1-CG 3.71Å; Y156-Q169 VanDerWaalsContact CD1-NE2 3.28Å; Y156-Q169 HydrophobicContact CG-CG 4.22Å; Y156-Q169 VanDerWaalsContact CG-NE2 3.26Å; L157-Q169 WeakPolarHBondContact O-CA 3.31Å
170	R	98	Very high	93.1	Very high	50 Å²	50	62.6 Å²	62.6	19%	0.189	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.4	177.8	-66.5	-65.2	178.6	-107.3	13.6	109.2	Y156 L157 K159 F172 Y181 F182	Y156-R170 WeakPolarHBondContact CA-O 3.25Å; L157-R170 PolarHBondContact N-O 2.73Å; L157-R170 PolarHBondContact O-N 3.18Å; K159-R170 HydrophobicContact CD-CB 4.4Å; K159-R170 HydrophobicContact CD-CG 3.79Å; K159-R170 HydrophobicContact CG-CB 4.37Å; K159-R170 HydrophobicContact CG-CG 3.83Å; R170-F172 HydrophobicContact CB-CD2 4.18Å; R170-F172 HydrophobicContact CB-CE2 3.74Å; R170-F172 WeakPolarHBondContact O-CD2 3.31Å; R170-Y181 HydrophobicContact CB-CD2 4.24Å; R170-Y181 HydrophobicContact CG-CD2 4.06Å; R170-F182 WeakPolarHBondContact CA-O 3.19Å; R170-F182 WeakPolarHBondContact CB-O 3.44Å; R170-F182 WeakPolarHBondContact CD-O 3.48Å
171	W	97.7	Very high	93.3	Very high	27 Å²	27	62.2 Å²	62.2	10%	0.102	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	121.6	171.8	179.9	-110.8	0	0	0	108.4	E154 G155 Y156 Y181 F182 K185	E154-W171 HydrophobicContact CB-CH2 4.05Å; E154-W171 HydrophobicContact CB-CZ2 3.56Å; E154-W171 HydrophobicContact CG-CH2 3.9Å; E154-W171 HydrophobicContact CG-CZ2 3.63Å; E154-W171 WeakPolarHBondContact OE1-CZ2 3.37Å; G155-W171 VanDerWaalsContact CA-CZ3 3.46Å; Y156-W171 HydrophobicContact CD1-CB 4.27Å; Y156-W171 HydrophobicContact CD1-CE3 4.04Å; Y156-W171 AromaticContact CD2-CE3 3.65Å; Y156-W171 HydrophobicContact CD2-CE3 3.65Å; Y156-W171 AromaticContact CD2-CZ3 3.78Å; Y156-W171 HydrophobicContact CD2-CZ3 3.78Å; Y156-W171 HydrophobicContact CE1-CB 3.93Å; Y156-W171 HydrophobicContact CE1-CE3 4Å; Y156-W171 AromaticContact CE2-CE3 3.59Å; Y156-W171 HydrophobicContact CE2-CE3 3.59Å; Y156-W171 AromaticContact CE2-CZ3 3.81Å; Y156-W171 HydrophobicContact CE2-CZ3 3.81Å; Y156-W171 AromaticContact CG-CE3 3.87Å; Y156-W171 HydrophobicContact CG-CE3 3.87Å; Y156-W171 HydrophobicContact CG-CZ3 4.36Å; Y156-W171 AromaticContact CZ-CE3 3.77Å; W171-Y181 CarbonylContact O-C 3.57Å; W171-Y181 WeakPolarHBondContact O-CA 3.48Å; W171-F182 HydrophobicContact CB-CB 4.36Å; W171-F182 AromaticContact CD1-CD2 3.99Å; W171-F182 PolarHBondContact N-O 2.81Å; W171-F182 VanDerWaalsContact N-O 3.17Å; W171-F182 PolarHBondContact O-N 3.48Å; W171-K185 HydrophobicContact CD2-CB 4.02Å; W171-K185 HydrophobicContact CE3-CB 4.46Å; W171-K185 HydrophobicContact CG-CB 4.15Å; W171-K185 HydrophobicContact CH2-CD 4.24Å; W171-K185 HydrophobicContact CZ2-CD 3.99Å; W171-K185 HydrophobicContact CZ2-CG 4.25Å
172	F	98.1	Very high	93.5	Very high	1 Å²	1	62.8 Å²	62.8	0%	0.004	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	141.3	177.8	-79	-104.5	0	0	0	110.1	E154 G155 L157 K159 R170 L179 K180 Y181 L225 W236	E154-F172 VanDerWaalsContact CA-O 3.23Å; E154-F172 WeakPolarHBondContact CA-O 3.21Å; G155-F172 PolarHBondContact N-O 3.5Å; G155-F172 PolarHBondContact O-N 3.09Å; L157-F172 HydrophobicContact CB-CD2 3.64Å; L157-F172 HydrophobicContact CB-CE2 3.71Å; L157-F172 HydrophobicContact CB-CG 4.45Å; L157-F172 HydrophobicContact CD1-CB 4.31Å; L157-F172 HydrophobicContact CD1-CD1 4.38Å; L157-F172 HydrophobicContact CD1-CD2 4Å; L157-F172 HydrophobicContact CD1-CE2 4.39Å; L157-F172 HydrophobicContact CD1-CG 3.99Å; L157-F172 HydrophobicContact CG-CD2 4.12Å; K159-F172 HydrophobicContact CB-CE2 4.36Å; K159-F172 HydrophobicContact CB-CZ 4.1Å; K159-F172 HydrophobicContact CD-CE2 4.47Å; K159-F172 HydrophobicContact CD-CZ 4.04Å; K159-F172 HydrophobicContact CG-CE2 4.42Å; K159-F172 HydrophobicContact CG-CZ 4.31Å; R170-F172 HydrophobicContact CB-CD2 4.18Å; R170-F172 HydrophobicContact CB-CE2 3.74Å; R170-F172 WeakPolarHBondContact O-CD2 3.31Å; F172-L179 HydrophobicContact CD1-CD1 4.04Å; F172-L179 HydrophobicContact CD1-CD2 4.22Å; F172-L179 HydrophobicContact CD1-CG 4.03Å; F172-L179 HydrophobicContact CE1-CD2 4.45Å; F172-K180 CarbonylContact C-O 3.44Å; F172-K180 VanDerWaalsContact CA-O 3.28Å; F172-K180 WeakPolarHBondContact CA-O 3.43Å; F172-Y181 HydrophobicContact CD1-CD1 4.49Å; F172-Y181 AromaticContact CE1-CD1 3.72Å; F172-Y181 HydrophobicContact CE1-CD1 3.72Å; F172-Y181 AromaticContact CE1-CG 3.97Å; F172-Y181 HydrophobicContact CE1-CG 3.97Å; F172-Y181 HydrophobicContact CE2-CG 4.45Å; F172-Y181 AromaticContact CZ-CD1 3.94Å; F172-Y181 HydrophobicContact CZ-CD1 3.94Å; F172-Y181 AromaticContact CZ-CG 3.93Å; F172-Y181 HydrophobicContact CZ-CG 3.93Å; F172-L225 HydrophobicContact CE1-CD1 4.18Å; F172-L225 HydrophobicContact CE1-CD2 4.01Å; F172-L225 HydrophobicContact CE2-CD2 4.2Å; F172-L225 HydrophobicContact CZ-CD1 4.4Å; F172-L225 HydrophobicContact CZ-CD2 3.47Å; F172-L225 VanDerWaalsContact CZ-CD2 3.47Å; F172-W236 HydrophobicContact CB-CH2 3.74Å; F172-W236 HydrophobicContact CB-CZ2 4Å
173	T	95.9	Very high	93.9	Very high	29 Å²	29	66.9 Å²	66.9	18%	0.178	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	131.1	170.2	66.6	0	0	0	0	109.3	E154 L179 K180 F182	E154-T173 HydrophobicContact CB-CG2 4.11Å; T173-L179 WeakPolarHBondContact O-CA 3.26Å; T173-K180 PolarHBondContact N-O 3.34Å; T173-K180 PolarHBondContact O-N 3.43Å; T173-F182 HydrophobicContact CG2-CE2 4.05Å; T173-F182 WeakPolarHBondContact OG1-CE2 3.07Å
174	L	94.8	Very high	94.3	Very high	3 Å²	3	61.3 Å²	61.3	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	116.3	171.2	174.5	60.1	0	0	0	107.8	T152 K153 L179 L196 W236 I239 L240 K243	T152-L174 VanDerWaalsContact CA-O 3.24Å; T152-L174 WeakPolarHBondContact CA-O 2.94Å; T152-L174 VanDerWaalsContact CB-O 3.23Å; T152-L174 WeakPolarHBondContact CB-O 3.26Å; T152-L174 WeakPolarHBondContact CG2-O 3.4Å; K153-L174 PolarHBondContact N-O 3.26Å; K153-L174 PolarHBondContact O-N 2.68Å; L174-L179 HydrophobicContact CB-CD1 4.06Å; L174-L196 HydrophobicContact CD1-CD1 3.52Å; L174-W236 HydrophobicContact CB-CZ3 4.13Å; L174-I239 HydrophobicContact CD2-CB 4.49Å; L174-I239 HydrophobicContact CD2-CD1 4.04Å; L174-I239 HydrophobicContact CD2-CG1 3.96Å; L174-I239 HydrophobicContact CD2-CG2 3.85Å; L174-L240 HydrophobicContact CD1-CD2 4.36Å; L174-L240 HydrophobicContact CD2-CD2 4Å; L174-K243 HydrophobicContact CD2-CG 4.21Å
175	H	88.3	Confident	94.5	Very high	81 Å²	81	62.6 Å²	62.6	38%	0.375	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	132.8	174.6	-169.5	73.6	0	0	0	110.6	S149 T152 N177 E178	S149-H175 PolarHBondContact OG-CE1 3.49Å; S149-H175 PolarHBondContact OG-ND1 2.99Å; T152-H175 HydrophobicContact CG2-CB 4.42Å; T152-H175 WeakPolarHBondContact CG2-ND1 3.38Å; H175-N177 PolarHBondContact O-N 3.45Å; H175-N177 VanDerWaalsContact O-N 3.16Å; H175-E178 PolarHBondContact N-O 3.08Å; H175-E178 PolarHBondContact O-N 3.34Å
176	R	84.8	Confident	94.5	Very high	144 Å²	144	62.7 Å²	62.7	54%	0.543	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	-113.7	-170.5	-59.8	171.6	179.6	-173.2	-4.1	111.2	K243	R176-K243 WeakPolarHBondContact O-CD 3.46Å; R176-K243 WeakPolarHBondContact O-CE 3.35Å; R176-K243 PolarHBondContact O-NZ 2.92Å; R176-K243 VanDerWaalsContact O-NZ 3.13Å
177	N	89.8	Confident	94.3	Very high	56 Å²	56	61.7 Å²	61.7	30%	0.299	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	13.2	173.8	-65.6	-18.7	0	0	0	111.8	H175 L196 T197 I247	H175-N177 PolarHBondContact O-N 3.45Å; H175-N177 VanDerWaalsContact O-N 3.16Å; N177-L196 VanDerWaalsContact O-CB 3.26Å; N177-L196 WeakPolarHBondContact O-CB 3.26Å; N177-L196 WeakPolarHBondContact O-CG 3.43Å; N177-L196 PolarHBondContact O-N 2.78Å; N177-T197 HydrophobicContact CB-CG2 4.43Å; N177-I247 HydrophobicContact CB-CD1 4.23Å
178	E	94.6	Very high	94	Very high	73 Å²	73	67.1 Å²	67.1	34%	0.341	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.7	-178.7	-61.2	-173.2	143.9	0	0	110.3	H175 K180 T193 L194	H175-E178 PolarHBondContact N-O 3.08Å; H175-E178 PolarHBondContact O-N 3.34Å; E178-K180 WeakPolarHBondContact OE2-CE 3.44Å; E178-K180 IonicContact OE2-NZ 2.75Å; E178-K180 PolarHBondContact OE2-NZ 2.84Å; E178-T193 HydrophobicContact CB-CG2 4.01Å; E178-T193 HydrophobicContact CG-CG2 4.09Å; E178-L194 WeakPolarHBondContact CA-O 3.41Å
179	L	97.4	Very high	93.9	Very high	1 Å²	1	69.9 Å²	69.9	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	108.6	166.8	-176.9	68.9	0	0	0	108.9	F172 T173 L174 L194 L196 L216 W236 L240	F172-L179 HydrophobicContact CD1-CD1 4.04Å; F172-L179 HydrophobicContact CD1-CD2 4.22Å; F172-L179 HydrophobicContact CD1-CG 4.03Å; F172-L179 HydrophobicContact CE1-CD2 4.45Å; T173-L179 WeakPolarHBondContact O-CA 3.26Å; L174-L179 HydrophobicContact CB-CD1 4.06Å; L179-L194 HydrophobicContact CB-CB 4.31Å; L179-L194 HydrophobicContact CD2-CD1 4.33Å; L179-L194 PolarHBondContact N-O 3.44Å; L179-L194 WeakPolarHBondContact O-CB 3.35Å; L179-L194 PolarHBondContact O-N 3.1Å; L179-L196 HydrophobicContact CB-CD2 4.25Å; L179-L196 HydrophobicContact CB-CG 4.45Å; L179-L216 HydrophobicContact CD2-CD1 3.39Å; L179-W236 HydrophobicContact CD1-CH2 4.4Å; L179-W236 HydrophobicContact CD1-CZ3 3.84Å; L179-L240 HydrophobicContact CD2-CD2 4.41Å
180	K	97.5	Very high	93.9	Very high	58 Å²	58	66.6 Å²	66.6	25%	0.252	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	150.9	179.8	-66.2	176.8	-175.7	170.7	0	110.2	F172 T173 E178 F182 P190 R192 T193	F172-K180 CarbonylContact C-O 3.44Å; F172-K180 VanDerWaalsContact CA-O 3.28Å; F172-K180 WeakPolarHBondContact CA-O 3.43Å; T173-K180 PolarHBondContact N-O 3.34Å; T173-K180 PolarHBondContact O-N 3.43Å; E178-K180 WeakPolarHBondContact OE2-CE 3.44Å; E178-K180 IonicContact OE2-NZ 2.75Å; E178-K180 PolarHBondContact OE2-NZ 2.84Å; K180-F182 HydrophobicContact CB-CE2 3.68Å; K180-F182 HydrophobicContact CB-CZ 4.02Å; K180-F182 HydrophobicContact CD-CZ 4.37Å; K180-P190 HydrophobicContact CB-CB 4.1Å; K180-P190 HydrophobicContact CD-CB 4.41Å; K180-P190 HydrophobicContact CD-CG 4.33Å; K180-P190 HydrophobicContact CG-CB 4.34Å; K180-R192 WeakPolarHBondContact CA-O 3.18Å; K180-T193 HydrophobicContact CD-CG2 4.44Å; K180-T193 HydrophobicContact CG-CG2 3.9Å
181	Y	97.8	Very high	93.8	Very high	13 Å²	13	68.3 Å²	68.3	5%	0.051	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144	165.5	69.3	-99.6	0	0	0	113.5	K159 R170 W171 F172 I191 R192 F223	K159-Y181 HydrophobicContact CD-CD1 4.42Å; K159-Y181 HydrophobicContact CD-CD2 4.02Å; K159-Y181 HydrophobicContact CD-CE1 4.25Å; K159-Y181 HydrophobicContact CD-CE2 3.88Å; K159-Y181 HydrophobicContact CD-CG 4.32Å; R170-Y181 HydrophobicContact CB-CD2 4.24Å; R170-Y181 HydrophobicContact CG-CD2 4.06Å; W171-Y181 CarbonylContact O-C 3.57Å; W171-Y181 WeakPolarHBondContact O-CA 3.48Å; F172-Y181 HydrophobicContact CD1-CD1 4.49Å; F172-Y181 AromaticContact CE1-CD1 3.72Å; F172-Y181 HydrophobicContact CE1-CD1 3.72Å; F172-Y181 AromaticContact CE1-CG 3.97Å; F172-Y181 HydrophobicContact CE1-CG 3.97Å; F172-Y181 HydrophobicContact CE2-CG 4.45Å; F172-Y181 AromaticContact CZ-CD1 3.94Å; F172-Y181 HydrophobicContact CZ-CD1 3.94Å; F172-Y181 AromaticContact CZ-CG 3.93Å; F172-Y181 HydrophobicContact CZ-CG 3.93Å; Y181-I191 HydrophobicContact CD2-CB 3.92Å; Y181-I191 HydrophobicContact CD2-CD1 4.41Å; Y181-I191 HydrophobicContact CD2-CG2 4.36Å; Y181-I191 HydrophobicContact CE2-CB 3.59Å; Y181-I191 HydrophobicContact CE2-CD1 4.38Å; Y181-I191 HydrophobicContact CE2-CG2 3.53Å; Y181-I191 WeakPolarHBondContact O-CB 3.44Å; Y181-I191 PolarHBondContact O-N 2.88Å; Y181-R192 HydrophobicContact CD1-CB 4.23Å; Y181-R192 HydrophobicContact CE1-CB 3.51Å; Y181-R192 HydrophobicContact CE1-CG 4.21Å; Y181-R192 HydrophobicContact CE2-CB 4.25Å; Y181-R192 VanDerWaalsContact CZ-CB 3.47Å; Y181-R192 PolarHBondContact N-O 2.99Å; Y181-R192 PolarHBondContact O-N 2.84Å; Y181-R192 WeakPolarHBondContact OH-CB 3.18Å; Y181-F223 HydrophobicContact CE1-CE1 4.33Å
182	F	97.9	Very high	93.8	Very high	20 Å²	20	72.8 Å²	72.8	9%	0.088	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	162.4	-172.7	-55.1	-101.4	0	0	0	109.5	R170 W171 T173 K180 D184 C187 E188 E189 P190	R170-F182 WeakPolarHBondContact CA-O 3.19Å; R170-F182 WeakPolarHBondContact CB-O 3.44Å; R170-F182 WeakPolarHBondContact CD-O 3.48Å; W171-F182 HydrophobicContact CB-CB 4.36Å; W171-F182 AromaticContact CD1-CD2 3.99Å; W171-F182 PolarHBondContact N-O 2.81Å; W171-F182 VanDerWaalsContact N-O 3.17Å; W171-F182 PolarHBondContact O-N 3.48Å; T173-F182 HydrophobicContact CG2-CE2 4.05Å; T173-F182 WeakPolarHBondContact OG1-CE2 3.07Å; K180-F182 HydrophobicContact CB-CE2 3.68Å; K180-F182 HydrophobicContact CB-CZ 4.02Å; K180-F182 HydrophobicContact CD-CZ 4.37Å; F182-D184 VanDerWaalsContact CB-O 3.28Å; F182-D184 WeakPolarHBondContact CB-O 3.47Å; F182-D184 PolarHBondContact O-N 2.76Å; F182-C187 HydrophobicContact CB-CB 4.25Å; F182-C187 HydrophobicContact CD1-CB 4.3Å; F182-C187 WeakPolarHBondContact CD1-O 3.47Å; F182-E188 WeakPolarHBondContact CE1-O 3.34Å; F182-E189 VanDerWaalsContact CD1-C 3.49Å; F182-E189 VanDerWaalsContact CD1-O 3.3Å; F182-E189 WeakPolarHBondContact CD1-O 3.48Å; F182-P190 HydrophobicContact CD1-CB 4.17Å; F182-P190 VanDerWaalsContact CE1-CA 3.45Å; F182-P190 HydrophobicContact CE1-CB 3.7Å; F182-P190 HydrophobicContact CE1-CG 4.3Å; F182-P190 VanDerWaalsContact CE1-N 3.27Å; F182-P190 HydrophobicContact CE2-CB 4.35Å; F182-P190 HydrophobicContact CZ-CB 3.79Å; F182-P190 HydrophobicContact CZ-CG 4.47Å
183	K	95.7	Very high	93.7	Very high	135 Å²	135	75.6 Å²	75.6	59%	0.587	36%	0.364	S	S	*	.	S	Bend	trans	-57.3	-44.2	173.7	-172.9	-176	174.2	-170.1	0	110.3	I191	K183-I191 HydrophobicContact CB-CD1 4.13Å
184	D	94.1	Very high	93.7	Very high	42 Å²	42	74.8 Å²	74.8	23%	0.225	36%	0.358	C	S	.	.	S	Bend	trans	-157.8	178.7	178.8	52.7	61.3	0	0	0	109.8	F182 T186 C187	F182-D184 VanDerWaalsContact CB-O 3.28Å; F182-D184 WeakPolarHBondContact CB-O 3.47Å; F182-D184 PolarHBondContact O-N 2.76Å; D184-T186 PolarHBondContact O-N 3.43Å; D184-T186 PolarHBondContact OD1-N 3.4Å; D184-T186 PolarHBondContact OD1-OG1 3.42Å; D184-C187 PolarHBondContact OD1-N 2.89Å; D184-C187 PolarHBondContact OD1-SG 2.89Å
185	K	93.4	Very high	93.8	Very high	127 Å²	127	78.2 Å²	78.2	55%	0.552	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.9	-178.5	175.6	170.5	177.7	164.2	0	114.3	W171	W171-K185 HydrophobicContact CD2-CB 4.02Å; W171-K185 HydrophobicContact CE3-CB 4.46Å; W171-K185 HydrophobicContact CG-CB 4.15Å; W171-K185 HydrophobicContact CH2-CD 4.24Å; W171-K185 HydrophobicContact CZ2-CD 3.99Å; W171-K185 HydrophobicContact CZ2-CG 4.25Å
186	T	89.4	Confident	94.1	Very high	124 Å²	124	74.4 Å²	74.4	76%	0.761	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-11.9	-175.3	60.4	0	0	0	0	113.7	D184	D184-T186 PolarHBondContact O-N 3.43Å; D184-T186 PolarHBondContact OD1-N 3.4Å; D184-T186 PolarHBondContact OD1-OG1 3.42Å
187	C	87.9	Confident	94.5	Very high	45 Å²	45	69.9 Å²	69.9	30%	0.304	35%	0.348	S	S	.	.			trans	-78.4	132.9	178.7	-64.7	0	0	0	0	111.2	F182 D184	F182-C187 HydrophobicContact CB-CB 4.25Å; F182-C187 HydrophobicContact CD1-CB 4.3Å; F182-C187 WeakPolarHBondContact CD1-O 3.47Å; D184-C187 PolarHBondContact OD1-N 2.89Å; D184-C187 PolarHBondContact OD1-SG 2.89Å
188	E	88.8	Confident	94.8	Very high	179 Å²	179	70.2 Å²	70.2	84%	0.836	35%	0.354	S	S	*	.	S	Bend	trans	-81.4	-33.9	176.2	-62.3	-174	165	0	0	112.6	F182	F182-E188 WeakPolarHBondContact CE1-O 3.34Å
189	E	93.2	Very high	94.9	Very high	152 Å²	152	67.2 Å²	67.2	71%	0.71	34%	0.341	S	S	*	.	S	Bend	trans	-96.3	128.2	-176.5	-71.4	-60.3	144.7	0	0	112.4	F182	F182-E189 VanDerWaalsContact CD1-C 3.49Å; F182-E189 VanDerWaalsContact CD1-O 3.3Å; F182-E189 WeakPolarHBondContact CD1-O 3.48Å
190	P	96.8	Very high	94.8	Very high	38 Å²	38	70.2 Å²	70.2	25%	0.247	36%	0.362	C	S	.	.			trans	-71.6	141	177.9	29.9	-33.7	0	0	0	110.5	K180 F182 R192	K180-P190 HydrophobicContact CB-CB 4.1Å; K180-P190 HydrophobicContact CD-CB 4.41Å; K180-P190 HydrophobicContact CD-CG 4.33Å; K180-P190 HydrophobicContact CG-CB 4.34Å; F182-P190 HydrophobicContact CD1-CB 4.17Å; F182-P190 VanDerWaalsContact CE1-CA 3.45Å; F182-P190 HydrophobicContact CE1-CB 3.7Å; F182-P190 HydrophobicContact CE1-CG 4.3Å; F182-P190 VanDerWaalsContact CE1-N 3.27Å; F182-P190 HydrophobicContact CE2-CB 4.35Å; F182-P190 HydrophobicContact CZ-CB 3.79Å; F182-P190 HydrophobicContact CZ-CG 4.47Å; P190-R192 PolarHBondContact O-N 3.47Å
191	I	96.5	Very high	94.7	Very high	87 Å²	87	68.4 Å²	68.4	45%	0.446	36%	0.358	S	S	.	.	S	Bend	trans	-65	-32.6	168.3	-62.5	172.3	0	0	0	109.7	Y181 K183	Y181-I191 HydrophobicContact CD2-CB 3.92Å; Y181-I191 HydrophobicContact CD2-CD1 4.41Å; Y181-I191 HydrophobicContact CD2-CG2 4.36Å; Y181-I191 HydrophobicContact CE2-CB 3.59Å; Y181-I191 HydrophobicContact CE2-CD1 4.38Å; Y181-I191 HydrophobicContact CE2-CG2 3.53Å; Y181-I191 WeakPolarHBondContact O-CB 3.44Å; Y181-I191 PolarHBondContact O-N 2.88Å; K183-I191 HydrophobicContact CB-CD1 4.13Å
192	R	96.3	Very high	94.6	Very high	121 Å²	121	68.1 Å²	68.1	46%	0.457	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	144.3	174.4	-172.3	170.1	-71.8	-119.1	-4.3	110.9	K180 Y181 P190 L194	K180-R192 WeakPolarHBondContact CA-O 3.18Å; Y181-R192 HydrophobicContact CD1-CB 4.23Å; Y181-R192 HydrophobicContact CE1-CB 3.51Å; Y181-R192 HydrophobicContact CE1-CG 4.21Å; Y181-R192 HydrophobicContact CE2-CB 4.25Å; Y181-R192 VanDerWaalsContact CZ-CB 3.47Å; Y181-R192 PolarHBondContact N-O 2.99Å; Y181-R192 PolarHBondContact O-N 2.84Å; Y181-R192 WeakPolarHBondContact OH-CB 3.18Å; P190-R192 PolarHBondContact O-N 3.47Å; R192-L194 HydrophobicContact CG-CD2 3.83Å; R192-L194 HydrophobicContact CG-CG 4.43Å
193	T	97	Very high	94.4	Very high	60 Å²	60	72.6 Å²	72.6	37%	0.368	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	130.2	165.5	-56.4	0	0	0	0	108.6	E178 K180	E178-T193 HydrophobicContact CB-CG2 4.01Å; E178-T193 HydrophobicContact CG-CG2 4.09Å; K180-T193 HydrophobicContact CD-CG2 4.44Å; K180-T193 HydrophobicContact CG-CG2 3.9Å
194	L	96.6	Very high	94.3	Very high	12 Å²	12	70.4 Å²	70.4	6%	0.063	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.5	175.6	-55.4	175	0	0	0	108.7	E178 L179 R192 L196 F218 F223	E178-L194 WeakPolarHBondContact CA-O 3.41Å; L179-L194 HydrophobicContact CB-CB 4.31Å; L179-L194 HydrophobicContact CD2-CD1 4.33Å; L179-L194 PolarHBondContact N-O 3.44Å; L179-L194 WeakPolarHBondContact O-CB 3.35Å; L179-L194 PolarHBondContact O-N 3.1Å; R192-L194 HydrophobicContact CG-CD2 3.83Å; R192-L194 HydrophobicContact CG-CG 4.43Å; L194-L196 PolarHBondContact O-N 3.25Å; L194-F218 HydrophobicContact CB-CE1 4.06Å; L194-F218 HydrophobicContact CB-CE2 4.47Å; L194-F218 HydrophobicContact CB-CZ 3.71Å; L194-F218 HydrophobicContact CD1-CE2 4.15Å; L194-F218 HydrophobicContact CD1-CZ 4.18Å; L194-F218 HydrophobicContact CG-CZ 4.39Å; L194-F223 HydrophobicContact CD1-CD1 4.24Å; L194-F223 HydrophobicContact CD1-CD2 4.33Å; L194-F223 HydrophobicContact CD1-CE1 4.19Å; L194-F223 HydrophobicContact CD1-CE2 4.28Å; L194-F223 HydrophobicContact CD1-CG 4.31Å; L194-F223 HydrophobicContact CD1-CZ 4.22Å; L194-F223 HydrophobicContact CD2-CE1 4.06Å; L194-F223 HydrophobicContact CD2-CE2 3.73Å; L194-F223 HydrophobicContact CD2-CZ 3.45Å; L194-F223 VanDerWaalsContact CD2-CZ 3.45Å; L194-F223 HydrophobicContact CG-CZ 4.48Å
195	D	95.5	Very high	94.1	Very high	75 Å²	75	69.2 Å²	69.2	40%	0.401	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	110.1	175.5	-179	1.7	0	0	0	110.6	T197 S198 F218	D195-T197 PolarHBondContact O-N 3.09Å; D195-T197 VanDerWaalsContact O-N 3.12Å; D195-T197 WeakPolarHBondContact OD1-CB 3.42Å; D195-T197 VanDerWaalsContact OD1-CG2 3.28Å; D195-T197 WeakPolarHBondContact OD1-CG2 3.17Å; D195-T197 PolarHBondContact OD1-N 3.03Å; D195-T197 PolarHBondContact OD1-OG1 2.79Å; D195-T197 PolarHBondContact OD2-OG1 3.49Å; D195-S198 PolarHBondContact O-N 3.44Å; D195-S198 VanDerWaalsContact O-N 3.08Å; D195-F218 WeakPolarHBondContact O-CE1 3.48Å
196	L	95.5	Very high	93.8	Very high	1 Å²	1	72.4 Å²	72.4	1%	0.005	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-63.9	-14.3	-179	-64.5	179.4	0	0	0	113.4	L174 N177 L179 L194 S198 C199 F218 L240 K243 L244 I247	L174-L196 HydrophobicContact CD1-CD1 3.52Å; N177-L196 VanDerWaalsContact O-CB 3.26Å; N177-L196 WeakPolarHBondContact O-CB 3.26Å; N177-L196 WeakPolarHBondContact O-CG 3.43Å; N177-L196 PolarHBondContact O-N 2.78Å; L179-L196 HydrophobicContact CB-CD2 4.25Å; L179-L196 HydrophobicContact CB-CG 4.45Å; L194-L196 PolarHBondContact O-N 3.25Å; L196-S198 PolarHBondContact O-N 2.93Å; L196-C199 HydrophobicContact CD2-CB 4.16Å; L196-C199 WeakPolarHBondContact O-CB 3.46Å; L196-C199 PolarHBondContact O-N 2.92Å; L196-F218 HydrophobicContact CD2-CZ 4.18Å; L196-L240 HydrophobicContact CD1-CD2 3.87Å; L196-L240 HydrophobicContact CD2-CD2 4.18Å; L196-K243 HydrophobicContact CD1-CB 4.25Å; L196-L244 HydrophobicContact CB-CD2 4.36Å; L196-L244 WeakPolarHBondContact O-CD2 3.3Å; L196-I247 HydrophobicContact CB-CD1 3.96Å
197	T	93.6	Very high	93.4	Very high	49 Å²	49	70.3 Å²	70.3	30%	0.301	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-63.5	-23.1	172.2	70.3	0	0	0	0	113	N177 D195 I247 R251	N177-T197 HydrophobicContact CB-CG2 4.43Å; D195-T197 PolarHBondContact O-N 3.09Å; D195-T197 VanDerWaalsContact O-N 3.12Å; D195-T197 WeakPolarHBondContact OD1-CB 3.42Å; D195-T197 VanDerWaalsContact OD1-CG2 3.28Å; D195-T197 WeakPolarHBondContact OD1-CG2 3.17Å; D195-T197 PolarHBondContact OD1-N 3.03Å; D195-T197 PolarHBondContact OD1-OG1 2.79Å; D195-T197 PolarHBondContact OD2-OG1 3.49Å; T197-I247 HydrophobicContact CG2-CD1 4.43Å; T197-I247 HydrophobicContact CG2-CG2 4.35Å; T197-R251 PolarHBondContact O-NH2 3.27Å
198	S	94.8	Very high	93.1	Very high	63 Å²	63	70.1 Å²	70.1	44%	0.441	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-94.3	-6.8	175.4	-61.6	0	0	0	0	113	D195 L196 P219	D195-S198 PolarHBondContact O-N 3.44Å; D195-S198 VanDerWaalsContact O-N 3.08Å; L196-S198 PolarHBondContact O-N 2.93Å; S198-P219 VanDerWaalsContact O-CD 3.29Å; S198-P219 WeakPolarHBondContact O-CD 3.21Å
199	C	96.8	Very high	92.7	Very high	9 Å²	9	69.2 Å²	69.2	6%	0.061	36%	0.359	C	S	.	.			trans	-79.3	123.2	-179.9	-176.5	0	0	0	0	110.2	L196 A201 V217 F218 L244	L196-C199 HydrophobicContact CD2-CB 4.16Å; L196-C199 WeakPolarHBondContact O-CB 3.46Å; L196-C199 PolarHBondContact O-N 2.92Å; C199-A201 PolarHBondContact SG-O 3.48Å; C199-V217 WeakPolarHBondContact CA-O 3.2Å; C199-F218 HydrophobicContact CB-CD1 4.21Å; C199-F218 HydrophobicContact CB-CE1 3.76Å; C199-F218 HydrophobicContact CB-CE2 4.32Å; C199-F218 HydrophobicContact CB-CZ 3.81Å; C199-L244 HydrophobicContact CB-CD2 3.91Å
200	S	95.5	Very high	92.4	Very high	65 Å²	65	66.3 Å²	66.3	46%	0.455	34%	0.344	S	S	.	.			trans	-88.9	-31.2	-177.2	61.2	0	0	0	0	112.8	V217 R248	S200-V217 PolarHBondContact N-O 3.47Å; S200-V217 WeakPolarHBondContact OG-CB 3.16Å; S200-V217 VanDerWaalsContact OG-CG1 3.32Å; S200-V217 WeakPolarHBondContact OG-CG1 3.31Å; S200-V217 PolarHBondContact OG-O 2.95Å; S200-R248 PolarHBondContact O-NH2 3.28Å
201	A	94.8	Very high	92	Very high	20 Å²	20	70 Å²	70	17%	0.165	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	149.3	-177.6	0	0	0	0	0	112.9	C199 Q203 L216 V217	C199-A201 PolarHBondContact SG-O 3.48Å; A201-Q203 HydrophobicContact CB-CG 4.34Å; A201-L216 WeakPolarHBondContact O-CA 3.25Å; A201-V217 HydrophobicContact CB-CB 4.32Å; A201-V217 HydrophobicContact CB-CG2 4.21Å; A201-V217 PolarHBondContact O-N 3.25Å
202	V	96.9	Very high	91.8	Very high	6 Å²	6	68.1 Å²	68.1	4%	0.036	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.5	162.1	-179.6	0	0	0	0	107.3	F214 C215 L216 I237 L240 H241 L244	V202-F214 HydrophobicContact CG1-CD2 4.17Å; V202-C215 VanDerWaalsContact CA-O 3.3Å; V202-C215 WeakPolarHBondContact CA-O 3.17Å; V202-L216 HydrophobicContact CB-CD2 3.9Å; V202-L216 HydrophobicContact CG1-CD2 3.65Å; V202-L216 HydrophobicContact CG2-CD2 3.27Å; V202-I237 HydrophobicContact CG1-CB 4.48Å; V202-I237 HydrophobicContact CG1-CG1 4.21Å; V202-I237 HydrophobicContact CG1-CG2 4.28Å; V202-L240 HydrophobicContact CG1-CB 4.32Å; V202-L240 HydrophobicContact CG1-CD1 4.39Å; V202-L240 HydrophobicContact CG2-CB 3.81Å; V202-H241 PolarHBondContact O-NE2 3.31Å; V202-L244 HydrophobicContact CG2-CD1 3.76Å
203	Q	94.1	Very high	91.8	Very high	114 Å²	114	62.5 Å²	62.5	53%	0.533	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147.5	-175.5	-62.8	177.9	-8.5	0	0	110.5	A201 F214 C215	A201-Q203 HydrophobicContact CB-CG 4.34Å; Q203-F214 CarbonylContact O-C 3.57Å; Q203-F214 WeakPolarHBondContact O-CA 2.98Å; Q203-F214 WeakPolarHBondContact O-CB 3.31Å; Q203-C215 PolarHBondContact N-O 3.47Å; Q203-C215 VanDerWaalsContact N-O 3.12Å; Q203-C215 PolarHBondContact O-N 3.06Å
204	F	92.9	Very high	91.9	Very high	89 Å²	89	59.7 Å²	59.7	39%	0.39	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	140.3	165.2	-78.6	-77.9	0	0	0	109.6	Y206 I237	F204-Y206 HydrophobicContact CB-CE2 3.9Å; F204-I237 HydrophobicContact CD1-CD1 3.5Å; F204-I237 VanDerWaalsContact CD1-CD1 3.5Å; F204-I237 HydrophobicContact CD2-CD1 3.89Å; F204-I237 HydrophobicContact CE1-CD1 3.21Å; F204-I237 HydrophobicContact CE2-CD1 3.61Å; F204-I237 HydrophobicContact CG-CD1 3.84Å; F204-I237 HydrophobicContact CZ-CD1 3.27Å
205	D	89.5	Confident	91.9	Very high	18 Å²	18	59.5 Å²	59.5	10%	0.096	32%	0.318	C	S	.	.			trans	-122.6	122.7	176.1	-178.1	87.7	0	0	0	109.7	S207 Q208 C213 C215 Y224	D205-S207 PolarHBondContact OD1-OG 3.45Å; D205-S207 PolarHBondContact OD2-N 3.42Å; D205-S207 PolarHBondContact OD2-OG 3.49Å; D205-Q208 VanDerWaalsContact OD2-CG 3.24Å; D205-Q208 WeakPolarHBondContact OD2-CG 3.42Å; D205-Q208 PolarHBondContact OD2-N 3.19Å; D205-C213 PolarHBondContact N-O 2.9Å; D205-C213 WeakPolarHBondContact O-CB 3.37Å; D205-C215 HydrophobicContact CB-CB 4.46Å; D205-Y224 HydrophobicContact CB-CD1 4.31Å
206	Y	86.7	Confident	92	Very high	194 Å²	194	56 Å²	56	76%	0.761	30%	0.299	S	S	*	.			trans	-107.2	2.1	175	-54.2	-79.4	0	0	0	111.8	F204	F204-Y206 HydrophobicContact CB-CE2 3.9Å
207	S	81.8	Confident	92.1	Very high	80 Å²	80	57.8 Å²	57.8	56%	0.559	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-21.4	-173.7	75	0	0	0	0	113.1	D205 D209	D205-S207 PolarHBondContact OD1-OG 3.45Å; D205-S207 PolarHBondContact OD2-N 3.42Å; D205-S207 PolarHBondContact OD2-OG 3.49Å; S207-D209 PolarHBondContact O-N 3.19Å
208	Q	80.4	Confident	92.2	Very high	41 Å²	41	56.5 Å²	56.5	19%	0.192	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	9.2	-176	-67	-42.8	-74.1	0	0	115.5	W167 D205 K210 Y224	W167-Q208 HydrophobicContact CH2-CB 4.08Å; W167-Q208 HydrophobicContact CH2-CG 3.87Å; W167-Q208 HydrophobicContact CZ2-CB 3.81Å; W167-Q208 HydrophobicContact CZ2-CG 3.8Å; D205-Q208 VanDerWaalsContact OD2-CG 3.24Å; D205-Q208 WeakPolarHBondContact OD2-CG 3.42Å; D205-Q208 PolarHBondContact OD2-N 3.19Å; Q208-K210 WeakPolarHBondContact O-CG 3.43Å; Q208-K210 PolarHBondContact O-N 3.1Å; Q208-K210 VanDerWaalsContact O-N 3.15Å; Q208-Y224 HydrophobicContact CG-CD1 3.71Å; Q208-Y224 HydrophobicContact CG-CE1 4.36Å; Q208-Y224 HydrophobicContact CG-CG 3.99Å
209	D	81.9	Confident	92.2	Very high	159 Å²	159	58.5 Å²	58.5	85%	0.85	31%	0.312	S	S	*	.	S	Bend	trans	49.4	37.2	-173.8	-164.6	33.5	0	0	0	112.6	S207	S207-D209 PolarHBondContact O-N 3.19Å
210	K	85.8	Confident	92	Very high	92 Å²	92	65.9 Å²	65.9	40%	0.4	35%	0.351	S	S	.	.			trans	-140.9	143.4	-178.1	-75.4	-173.7	-178	-56.7	0	109.1	W167 Q208 C213	W167-K210 VanDerWaalsContact CD1-CE 3.44Å; W167-K210 HydrophobicContact CD2-CD 3.94Å; W167-K210 VanDerWaalsContact CE2-CE 3.49Å; W167-K210 HydrophobicContact CE3-CD 4.27Å; W167-K210 HydrophobicContact CG-CD 4.43Å; W167-K210 HydrophobicContact CH2-CD 4.25Å; W167-K210 HydrophobicContact CZ2-CD 3.95Å; W167-K210 HydrophobicContact CZ3-CD 4.41Å; Q208-K210 WeakPolarHBondContact O-CG 3.43Å; Q208-K210 PolarHBondContact O-N 3.1Å; Q208-K210 VanDerWaalsContact O-N 3.15Å; K210-C213 WeakPolarHBondContact CB-SG 3.42Å; K210-C213 PolarHBondContact O-SG 3.29Å
211	V	88.9	Confident	92	Very high	115 Å²	115	65 Å²	65	70%	0.697	34%	0.338	S	S	*	.	S	Bend	trans	-83.6	158.3	176.6	-63.4	0	0	0	0	111	C213	V211-C213 PolarHBondContact O-N 3.2Å; V211-C213 PolarHBondContact O-SG 3.28Å; V211-C213 VanDerWaalsContact O-SG 3.33Å
212	N	93.3	Very high	92	Very high	48 Å²	48	66.3 Å²	66.3	26%	0.257	34%	0.343	S	S	.	.	S	Bend	trans	59.6	30.3	176.3	-44.8	-36.4	0	0	0	112.9	C226 A227 G230 A233	N212-C226 WeakPolarHBondContact O-CA 3.45Å; N212-A227 PolarHBondContact O-N 3.43Å; N212-G230 PolarHBondContact ND2-N 3.16Å; N212-G230 VanDerWaalsContact OD1-CA 3.24Å; N212-G230 WeakPolarHBondContact OD1-CA 3.35Å; N212-G230 PolarHBondContact OD1-N 2.82Å; N212-A233 HydrophobicContact CB-CB 3.95Å
213	C	96.1	Very high	92	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.02	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	149.3	-179	-57.6	0	0	0	0	112.1	D205 K210 V211 L225 C226	D205-C213 PolarHBondContact N-O 2.9Å; D205-C213 WeakPolarHBondContact O-CB 3.37Å; K210-C213 WeakPolarHBondContact CB-SG 3.42Å; K210-C213 PolarHBondContact O-SG 3.29Å; V211-C213 PolarHBondContact O-N 3.2Å; V211-C213 PolarHBondContact O-SG 3.28Å; V211-C213 VanDerWaalsContact O-SG 3.33Å; C213-L225 CarbonylContact C-O 3.47Å; C213-L225 WeakPolarHBondContact CA-O 3.19Å; C213-C226 HydrophobicContact CB-CB 4.12Å; C213-C226 WeakPolarHBondContact CB-SG 3.44Å; C213-C226 WeakPolarHBondContact SG-CB 3.35Å; C213-C226 CovalentContact SG-SG 2.04Å; C213-C226 PolarHBondContact SG-SG 3.06Å
214	F	97.6	Very high	92.1	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	159.6	176.5	62.4	-83.8	0	0	0	109.5	L157 V202 Q203 L216 L225 A233 W236 I237 L240	L157-F214 HydrophobicContact CD1-CE1 4.49Å; L157-F214 HydrophobicContact CD1-CZ 3.83Å; L157-F214 HydrophobicContact CD2-CE1 4.18Å; L157-F214 HydrophobicContact CD2-CZ 4.31Å; V202-F214 HydrophobicContact CG1-CD2 4.17Å; Q203-F214 CarbonylContact O-C 3.57Å; Q203-F214 WeakPolarHBondContact O-CA 2.98Å; Q203-F214 WeakPolarHBondContact O-CB 3.31Å; F214-L216 HydrophobicContact CD2-CD2 4.31Å; F214-L216 HydrophobicContact CE2-CD2 4.32Å; F214-L225 HydrophobicContact CD1-CB 4.41Å; F214-L225 HydrophobicContact CD2-CB 4.37Å; F214-L225 HydrophobicContact CE1-CB 4Å; F214-L225 HydrophobicContact CE2-CB 3.97Å; F214-L225 HydrophobicContact CE2-CD1 3.68Å; F214-L225 HydrophobicContact CE2-CG 4.36Å; F214-L225 HydrophobicContact CZ-CB 3.77Å; F214-L225 HydrophobicContact CZ-CD1 3.93Å; F214-L225 HydrophobicContact CZ-CG 4.48Å; F214-L225 PolarHBondContact N-O 3.27Å; F214-L225 PolarHBondContact O-N 2.77Å; F214-L225 VanDerWaalsContact O-O 3.06Å; F214-A233 HydrophobicContact CD1-CB 4.46Å; F214-W236 HydrophobicContact CE1-CB 4.11Å; F214-W236 HydrophobicContact CE2-CB 4.42Å; F214-W236 HydrophobicContact CZ-CB 3.71Å; F214-W236 HydrophobicContact CZ-CG 4.22Å; F214-I237 HydrophobicContact CB-CD1 3.73Å; F214-I237 HydrophobicContact CB-CG1 3.84Å; F214-I237 HydrophobicContact CD1-CD1 4.34Å; F214-I237 HydrophobicContact CD1-CG1 4.22Å; F214-I237 HydrophobicContact CD2-CG1 4.1Å; F214-I237 HydrophobicContact CG-CD1 4.1Å; F214-I237 HydrophobicContact CG-CG1 3.81Å; F214-L240 HydrophobicContact CE2-CD1 3.99Å
215	C	96.9	Very high	92.3	Very high	9 Å²	9	59.5 Å²	59.5	6%	0.061	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.3	-179.9	71.9	0	0	0	0	111.8	V202 Q203 D205 T222 F223 Y224	V202-C215 VanDerWaalsContact CA-O 3.3Å; V202-C215 WeakPolarHBondContact CA-O 3.17Å; Q203-C215 PolarHBondContact N-O 3.47Å; Q203-C215 VanDerWaalsContact N-O 3.12Å; Q203-C215 PolarHBondContact O-N 3.06Å; D205-C215 HydrophobicContact CB-CB 4.46Å; C215-T222 HydrophobicContact CB-CG2 3.74Å; C215-F223 CarbonylContact C-O 3.5Å; C215-F223 WeakPolarHBondContact CA-O 3.37Å; C215-Y224 HydrophobicContact CB-CD1 3.72Å; C215-Y224 HydrophobicContact CB-CE1 3.8Å; C215-Y224 HydrophobicContact CB-CG 4.5Å
216	L	97.9	Very high	92.7	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.7	170.7	-50	175.9	0	0	0	108.2	L179 A201 V202 F214 F218 T222 F223 L225 L240	L179-L216 HydrophobicContact CD2-CD1 3.39Å; A201-L216 WeakPolarHBondContact O-CA 3.25Å; V202-L216 HydrophobicContact CB-CD2 3.9Å; V202-L216 HydrophobicContact CG1-CD2 3.65Å; V202-L216 HydrophobicContact CG2-CD2 3.27Å; F214-L216 HydrophobicContact CD2-CD2 4.31Å; F214-L216 HydrophobicContact CE2-CD2 4.32Å; L216-F218 HydrophobicContact CB-CD2 4.17Å; L216-F218 HydrophobicContact CB-CE2 3.62Å; L216-F218 HydrophobicContact CD1-CE2 4.33Å; L216-T222 CarbonylContact O-C 3.55Å; L216-T222 WeakPolarHBondContact O-CA 3.22Å; L216-F223 HydrophobicContact CB-CB 4.32Å; L216-F223 PolarHBondContact N-O 3.27Å; L216-F223 PolarHBondContact O-N 3.12Å; L216-L225 HydrophobicContact CD1-CD1 3.73Å; L216-L225 HydrophobicContact CG-CD1 4.17Å; L216-L240 HydrophobicContact CD2-CD1 3.75Å
217	V	97.1	Very high	93.2	Very high	39 Å²	39	50.1 Å²	50.1	24%	0.236	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	112.1	-175.7	-174.8	0	0	0	0	109.4	C199 S200 A201 T222	C199-V217 WeakPolarHBondContact CA-O 3.2Å; S200-V217 PolarHBondContact N-O 3.47Å; S200-V217 WeakPolarHBondContact OG-CB 3.16Å; S200-V217 VanDerWaalsContact OG-CG1 3.32Å; S200-V217 WeakPolarHBondContact OG-CG1 3.31Å; S200-V217 PolarHBondContact OG-O 2.95Å; A201-V217 HydrophobicContact CB-CB 4.32Å; A201-V217 HydrophobicContact CB-CG2 4.21Å; A201-V217 PolarHBondContact O-N 3.25Å; V217-T222 HydrophobicContact CG2-CG2 4.3Å
218	F	96.8	Very high	93.6	Very high	22 Å²	22	54.7 Å²	54.7	10%	0.096	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	159.4	171.2	-65.6	-101.2	0	0	0	110	L194 D195 L196 C199 L216 D220 R221 F223	L194-F218 HydrophobicContact CB-CE1 4.06Å; L194-F218 HydrophobicContact CB-CE2 4.47Å; L194-F218 HydrophobicContact CB-CZ 3.71Å; L194-F218 HydrophobicContact CD1-CE2 4.15Å; L194-F218 HydrophobicContact CD1-CZ 4.18Å; L194-F218 HydrophobicContact CG-CZ 4.39Å; D195-F218 WeakPolarHBondContact O-CE1 3.48Å; L196-F218 HydrophobicContact CD2-CZ 4.18Å; C199-F218 HydrophobicContact CB-CD1 4.21Å; C199-F218 HydrophobicContact CB-CE1 3.76Å; C199-F218 HydrophobicContact CB-CE2 4.32Å; C199-F218 HydrophobicContact CB-CZ 3.81Å; L216-F218 HydrophobicContact CB-CD2 4.17Å; L216-F218 HydrophobicContact CB-CE2 3.62Å; L216-F218 HydrophobicContact CD1-CE2 4.33Å; F218-D220 VanDerWaalsContact C-N 3.27Å; F218-D220 PolarHBondContact O-N 2.89Å; F218-R221 VanDerWaalsContact CB-O 3.3Å; F218-R221 WeakPolarHBondContact CB-O 3.24Å; F218-R221 PolarHBondContact N-O 3.08Å; F218-R221 CarbonylContact O-C 3.5Å; F218-R221 PolarHBondContact O-N 2.89Å; F218-R221 VanDerWaalsContact O-N 3.14Å; F218-F223 AromaticContact CD2-CD2 3.68Å; F218-F223 HydrophobicContact CD2-CD2 3.68Å; F218-F223 AromaticContact CD2-CE2 3.98Å; F218-F223 HydrophobicContact CD2-CE2 3.98Å; F218-F223 HydrophobicContact CE2-CD2 4.01Å; F218-F223 HydrophobicContact CE2-CE2 4.41Å
219	P	95.2	Very high	94.1	Very high	106 Å²	106	55.4 Å²	55.4	69%	0.688	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-43.8	-177.5	-28.7	35.6	0	0	0	113.2	S198	S198-P219 VanDerWaalsContact O-CD 3.29Å; S198-P219 WeakPolarHBondContact O-CD 3.21Å
220	D	92.3	Very high	94.3	Very high	163 Å²	163	49.7 Å²	49.7	87%	0.872	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-14.7	-175.5	-54	-44.3	0	0	0	113.3	F218	F218-D220 VanDerWaalsContact C-N 3.27Å; F218-D220 PolarHBondContact O-N 2.89Å
221	R	94.3	Very high	94.3	Very high	48 Å²	48	49.8 Å²	49.8	18%	0.181	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	138.6	-170.4	-176.4	167.6	174.9	-160.5	-2.1	114.1	Q160 A162 F218 F223	Q160-R221 PolarHBondContact O-NH2 2.81Å; A162-R221 VanDerWaalsContact CA-CZ 3.48Å; F218-R221 VanDerWaalsContact CB-O 3.3Å; F218-R221 WeakPolarHBondContact CB-O 3.24Å; F218-R221 PolarHBondContact N-O 3.08Å; F218-R221 CarbonylContact O-C 3.5Å; F218-R221 PolarHBondContact O-N 2.89Å; F218-R221 VanDerWaalsContact O-N 3.14Å; R221-F223 HydrophobicContact CB-CD2 4.46Å; R221-F223 HydrophobicContact CB-CE2 3.98Å; R221-F223 HydrophobicContact CG-CD2 4.13Å; R221-F223 HydrophobicContact CG-CE2 3.92Å; R221-F223 HydrophobicContact CG-CZ 4.31Å
222	T	95.3	Very high	94.4	Very high	46 Å²	46	47.2 Å²	47.2	28%	0.282	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	129.4	160.6	-58.9	0	0	0	0	111.1	C215 L216 V217 Y224	C215-T222 HydrophobicContact CB-CG2 3.74Å; L216-T222 CarbonylContact O-C 3.55Å; L216-T222 WeakPolarHBondContact O-CA 3.22Å; V217-T222 HydrophobicContact CG2-CG2 4.3Å; T222-Y224 HydrophobicContact CG2-CD2 4.37Å; T222-Y224 HydrophobicContact CG2-CE1 4.14Å; T222-Y224 HydrophobicContact CG2-CE2 3.81Å
223	F	96.9	Very high	94.3	Very high	6 Å²	6	45 Å²	45	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.7	175.4	-71.5	-101	0	0	0	109.8	Y181 L194 C215 L216 F218 R221	Y181-F223 HydrophobicContact CE1-CE1 4.33Å; L194-F223 HydrophobicContact CD1-CD1 4.24Å; L194-F223 HydrophobicContact CD1-CD2 4.33Å; L194-F223 HydrophobicContact CD1-CE1 4.19Å; L194-F223 HydrophobicContact CD1-CE2 4.28Å; L194-F223 HydrophobicContact CD1-CG 4.31Å; L194-F223 HydrophobicContact CD1-CZ 4.22Å; L194-F223 HydrophobicContact CD2-CE1 4.06Å; L194-F223 HydrophobicContact CD2-CE2 3.73Å; L194-F223 HydrophobicContact CD2-CZ 3.45Å; L194-F223 VanDerWaalsContact CD2-CZ 3.45Å; L194-F223 HydrophobicContact CG-CZ 4.48Å; C215-F223 CarbonylContact C-O 3.5Å; C215-F223 WeakPolarHBondContact CA-O 3.37Å; L216-F223 HydrophobicContact CB-CB 4.32Å; L216-F223 PolarHBondContact N-O 3.27Å; L216-F223 PolarHBondContact O-N 3.12Å; F218-F223 AromaticContact CD2-CD2 3.68Å; F218-F223 HydrophobicContact CD2-CD2 3.68Å; F218-F223 AromaticContact CD2-CE2 3.98Å; F218-F223 HydrophobicContact CD2-CE2 3.98Å; F218-F223 HydrophobicContact CE2-CD2 4.01Å; F218-F223 HydrophobicContact CE2-CE2 4.41Å; R221-F223 HydrophobicContact CB-CD2 4.46Å; R221-F223 HydrophobicContact CB-CE2 3.98Å; R221-F223 HydrophobicContact CG-CD2 4.13Å; R221-F223 HydrophobicContact CG-CE2 3.92Å; R221-F223 HydrophobicContact CG-CZ 4.31Å
224	Y	96.9	Very high	94	Very high	59 Å²	59	47.4 Å²	47.4	23%	0.231	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.6	172.6	-60.1	-86.5	0	0	0	110.3	K159 Q160 D205 Q208 C215 T222	K159-Y224 WeakPolarHBondContact CA-O 3.22Å; Q160-Y224 PolarHBondContact N-O 2.79Å; D205-Y224 HydrophobicContact CB-CD1 4.31Å; Q208-Y224 HydrophobicContact CG-CD1 3.71Å; Q208-Y224 HydrophobicContact CG-CE1 4.36Å; Q208-Y224 HydrophobicContact CG-CG 3.99Å; C215-Y224 HydrophobicContact CB-CD1 3.72Å; C215-Y224 HydrophobicContact CB-CE1 3.8Å; C215-Y224 HydrophobicContact CB-CG 4.5Å; T222-Y224 HydrophobicContact CG2-CD2 4.37Å; T222-Y224 HydrophobicContact CG2-CE1 4.14Å; T222-Y224 HydrophobicContact CG2-CE2 3.81Å
225	L	97.9	Very high	93.6	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	144.4	-174.8	-55.7	178.2	0	0	0	108.8	L157 V158 K159 F172 C213 F214 L216	L157-L225 HydrophobicContact CD1-CB 4.39Å; L157-L225 HydrophobicContact CD1-CD1 4.04Å; V158-L225 CarbonylContact O-C 3.5Å; V158-L225 WeakPolarHBondContact O-CA 3.3Å; K159-L225 HydrophobicContact CB-CD2 3.41Å; K159-L225 VanDerWaalsContact CB-CD2 3.41Å; F172-L225 HydrophobicContact CE1-CD1 4.18Å; F172-L225 HydrophobicContact CE1-CD2 4.01Å; F172-L225 HydrophobicContact CE2-CD2 4.2Å; F172-L225 HydrophobicContact CZ-CD1 4.4Å; F172-L225 HydrophobicContact CZ-CD2 3.47Å; F172-L225 VanDerWaalsContact CZ-CD2 3.47Å; C213-L225 CarbonylContact C-O 3.47Å; C213-L225 WeakPolarHBondContact CA-O 3.19Å; F214-L225 HydrophobicContact CD1-CB 4.41Å; F214-L225 HydrophobicContact CD2-CB 4.37Å; F214-L225 HydrophobicContact CE1-CB 4Å; F214-L225 HydrophobicContact CE2-CB 3.97Å; F214-L225 HydrophobicContact CE2-CD1 3.68Å; F214-L225 HydrophobicContact CE2-CG 4.36Å; F214-L225 HydrophobicContact CZ-CB 3.77Å; F214-L225 HydrophobicContact CZ-CD1 3.93Å; F214-L225 HydrophobicContact CZ-CG 4.48Å; F214-L225 PolarHBondContact N-O 3.27Å; F214-L225 PolarHBondContact O-N 2.77Å; F214-L225 VanDerWaalsContact O-O 3.06Å; L216-L225 HydrophobicContact CD1-CD1 3.73Å; L216-L225 HydrophobicContact CG-CD1 4.17Å
226	C	97	Very high	93.6	Very high	7 Å²	7	49.9 Å²	49.9	5%	0.047	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.9	172.9	-47.8	0	0	0	0	109.8	V158 W167 N212 C213	V158-C226 PolarHBondContact N-O 2.77Å; V158-C226 PolarHBondContact O-N 2.83Å; W167-C226 WeakPolarHBondContact CZ3-SG 3.12Å; N212-C226 WeakPolarHBondContact O-CA 3.45Å; C213-C226 HydrophobicContact CB-CB 4.12Å; C213-C226 WeakPolarHBondContact CB-SG 3.44Å; C213-C226 WeakPolarHBondContact SG-CB 3.35Å; C213-C226 CovalentContact SG-SG 2.04Å; C213-C226 PolarHBondContact SG-SG 3.06Å
227	A	96.3	Very high	93.4	Very high	8 Å²	8	50 Å²	50	7%	0.066	27%	0.271	C	S	.	.			trans	-90.2	165.7	175	0	0	0	0	0	111.4	L157 N212 T229 E232 A233	L157-A227 HydrophobicContact CD2-CB 3.71Å; N212-A227 PolarHBondContact O-N 3.43Å; A227-T229 VanDerWaalsContact C-N 3.33Å; A227-E232 HydrophobicContact CB-CB 3.65Å; A227-A233 HydrophobicContact CB-CB 3.82Å
228	K	90.9	Very high	93.2	Very high	177 Å²	177	52.3 Å²	52.3	77%	0.77	28%	0.278	S	S	*	.	S	Bend	trans	-70.2	-36.4	-180	-172.4	-179.1	177.1	-174.9	0	111.1	E232	K228-E232 VanDerWaalsContact CB-OE2 3.29Å; K228-E232 WeakPolarHBondContact CB-OE2 3.41Å; K228-E232 PolarHBondContact N-OE2 2.85Å
229	T	91.6	Very high	93	Very high	56 Å²	56	51.7 Å²	51.7	34%	0.344	28%	0.275	S	S	.	.	S	Bend	trans	-126.5	159.3	-178.9	71.5	0	0	0	0	110.9	A227 V231 E232 A233	A227-T229 VanDerWaalsContact C-N 3.33Å; T229-V231 PolarHBondContact O-N 2.87Å; T229-E232 PolarHBondContact O-N 2.76Å; T229-E232 WeakPolarHBondContact OG1-CG 3.28Å; T229-E232 PolarHBondContact OG1-N 3.21Å; T229-E232 VanDerWaalsContact OG1-N 3.08Å; T229-A233 PolarHBondContact O-N 2.78Å; T229-A233 VanDerWaalsContact O-N 3.12Å
230	G	85.1	Confident	93	Very high	38 Å²	38	46.7 Å²	46.7	39%	0.392	24%	0.242	S	C	.	.	H	α-helix	trans	-62.8	-33.2	174.4	0	0	0	0	0	112.4	N212 A233 D234	N212-G230 PolarHBondContact ND2-N 3.16Å; N212-G230 VanDerWaalsContact OD1-CA 3.24Å; N212-G230 WeakPolarHBondContact OD1-CA 3.35Å; N212-G230 PolarHBondContact OD1-N 2.82Å; G230-A233 PolarHBondContact O-N 3.5Å; G230-D234 WeakPolarHBondContact O-CB 3.34Å; G230-D234 PolarHBondContact O-N 2.75Å
231	V	86.1	Confident	93.1	Very high	95 Å²	95	43.1 Å²	43.1	58%	0.576	22%	0.22	S	C	*	.	H	α-helix	trans	-63.1	-50.1	175.3	-179.9	0	0	0	0	110.7	T229 A233 D234 E235	T229-V231 PolarHBondContact O-N 2.87Å; V231-A233 VanDerWaalsContact C-N 3.29Å; V231-A233 PolarHBondContact O-N 2.82Å; V231-D234 PolarHBondContact O-N 3.48Å; V231-E235 HydrophobicContact CG1-CG 4.49Å; V231-E235 WeakPolarHBondContact O-CG 3.43Å; V231-E235 PolarHBondContact O-N 3.16Å
232	E	90.4	Very high	92.8	Very high	61 Å²	61	42.7 Å²	42.7	29%	0.285	22%	0.219	S	C	.	.	H	α-helix	trans	-60.2	-40.6	177.5	-74.6	174.4	-168.3	0	0	111.6	A227 K228 T229 E235 W236	A227-E232 HydrophobicContact CB-CB 3.65Å; K228-E232 VanDerWaalsContact CB-OE2 3.29Å; K228-E232 WeakPolarHBondContact CB-OE2 3.41Å; K228-E232 PolarHBondContact N-OE2 2.85Å; T229-E232 PolarHBondContact O-N 2.76Å; T229-E232 WeakPolarHBondContact OG1-CG 3.28Å; T229-E232 PolarHBondContact OG1-N 3.21Å; T229-E232 VanDerWaalsContact OG1-N 3.08Å; E232-E235 PolarHBondContact O-N 3.06Å; E232-W236 PolarHBondContact O-N 3.2Å
233	A	92.8	Very high	92.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.1	-47.5	177.1	0	0	0	0	0	111.6	N212 F214 A227 T229 G230 V231 E235 W236 I237	N212-A233 HydrophobicContact CB-CB 3.95Å; F214-A233 HydrophobicContact CD1-CB 4.46Å; A227-A233 HydrophobicContact CB-CB 3.82Å; T229-A233 PolarHBondContact O-N 2.78Å; T229-A233 VanDerWaalsContact O-N 3.12Å; G230-A233 PolarHBondContact O-N 3.5Å; V231-A233 VanDerWaalsContact C-N 3.29Å; V231-A233 PolarHBondContact O-N 2.82Å; A233-E235 PolarHBondContact O-N 3.06Å; A233-W236 PolarHBondContact O-N 2.79Å; A233-I237 WeakPolarHBondContact O-CD1 3.46Å; A233-I237 VanDerWaalsContact O-CG1 3.23Å; A233-I237 WeakPolarHBondContact O-CG1 3.44Å; A233-I237 PolarHBondContact O-N 3.38Å
234	D	89.2	Confident	92.2	Very high	54 Å²	54	40.9 Å²	40.9	29%	0.289	21%	0.207	S	C	.	.	H	α-helix	trans	-60.2	-44.3	177.4	-180	65.3	0	0	0	111.8	G230 V231 W236 I237 K238	G230-D234 WeakPolarHBondContact O-CB 3.34Å; G230-D234 PolarHBondContact O-N 2.75Å; V231-D234 PolarHBondContact O-N 3.48Å; D234-W236 PolarHBondContact O-N 2.8Å; D234-I237 PolarHBondContact O-N 2.98Å; D234-K238 WeakPolarHBondContact O-CB 3.44Å; D234-K238 VanDerWaalsContact O-CG 3.31Å; D234-K238 WeakPolarHBondContact O-CG 3.49Å; D234-K238 PolarHBondContact O-N 3.27Å; D234-K238 WeakPolarHBondContact OD1-CE 3.33Å; D234-K238 IonicContact OD1-NZ 3.75Å; D234-K238 WeakPolarHBondContact OD2-CD 3.34Å; D234-K238 WeakPolarHBondContact OD2-CE 3.27Å; D234-K238 IonicContact OD2-NZ 2.64Å; D234-K238 PolarHBondContact OD2-NZ 3.06Å
235	E	89.4	Confident	91.7	Very high	57 Å²	57	40.1 Å²	40.1	27%	0.266	21%	0.211	S	C	.	.	H	α-helix	trans	-60.5	-44.6	175.3	-71.3	175.1	171.6	0	0	112.7	K153 V231 E232 A233 I239	K153-E235 IonicContact NZ-OE2 3.09Å; K153-E235 PolarHBondContact NZ-OE2 3.09Å; V231-E235 HydrophobicContact CG1-CG 4.49Å; V231-E235 WeakPolarHBondContact O-CG 3.43Å; V231-E235 PolarHBondContact O-N 3.16Å; E232-E235 PolarHBondContact O-N 3.06Å; A233-E235 PolarHBondContact O-N 3.06Å; E235-I239 WeakPolarHBondContact O-CG2 3.41Å; E235-I239 PolarHBondContact O-N 3.45Å
236	W	95.7	Very high	90.9	Very high	4 Å²	4	43 Å²	43	2%	0.015	22%	0.224	C	C	.	.	H	α-helix	trans	-62.4	-42.9	176.2	-86.6	109.8	0	0	0	111.7	K153 L157 F172 L174 L179 F214 E232 A233 D234 I239 L240	K153-W236 HydrophobicContact CB-CH2 4.23Å; K153-W236 HydrophobicContact CB-CZ3 4.15Å; K153-W236 HydrophobicContact CD-CD2 3.74Å; K153-W236 HydrophobicContact CD-CE3 3.99Å; K153-W236 HydrophobicContact CD-CG 4.09Å; K153-W236 HydrophobicContact CD-CZ2 4.37Å; K153-W236 HydrophobicContact CD-CZ3 4.39Å; K153-W236 HydrophobicContact CG-CD2 4.29Å; K153-W236 HydrophobicContact CG-CE3 4.36Å; K153-W236 HydrophobicContact CG-CH2 4.11Å; K153-W236 HydrophobicContact CG-CZ2 4.04Å; K153-W236 HydrophobicContact CG-CZ3 4.26Å; L157-W236 HydrophobicContact CD1-CD2 3.97Å; L157-W236 HydrophobicContact CD1-CE3 4.47Å; L157-W236 HydrophobicContact CD1-CG 4.24Å; L157-W236 HydrophobicContact CD1-CZ2 4.23Å; L157-W236 HydrophobicContact CD2-CG 4.3Å; L157-W236 HydrophobicContact CG-CZ2 4.48Å; F172-W236 HydrophobicContact CB-CH2 3.74Å; F172-W236 HydrophobicContact CB-CZ2 4Å; L174-W236 HydrophobicContact CB-CZ3 4.13Å; L179-W236 HydrophobicContact CD1-CH2 4.4Å; L179-W236 HydrophobicContact CD1-CZ3 3.84Å; F214-W236 HydrophobicContact CE1-CB 4.11Å; F214-W236 HydrophobicContact CE2-CB 4.42Å; F214-W236 HydrophobicContact CZ-CB 3.71Å; F214-W236 HydrophobicContact CZ-CG 4.22Å; E232-W236 PolarHBondContact O-N 3.2Å; A233-W236 PolarHBondContact O-N 2.79Å; D234-W236 PolarHBondContact O-N 2.8Å; W236-I239 HydrophobicContact CE3-CG2 4.47Å; W236-I239 WeakPolarHBondContact O-CG2 3.34Å; W236-L240 HydrophobicContact CE3-CD1 4.42Å; W236-L240 WeakPolarHBondContact O-CB 3.43Å; W236-L240 VanDerWaalsContact O-CD1 3.28Å; W236-L240 WeakPolarHBondContact O-CD1 3.05Å; W236-L240 WeakPolarHBondContact O-CG 3.35Å; W236-L240 PolarHBondContact O-N 3.31Å; W236-L240 VanDerWaalsContact O-N 3.11Å
237	I	95.3	Very high	90.3	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-66.1	-47.4	178.9	-68	161.8	0	0	0	110.5	V202 F204 F214 A233 D234 I239 L240 H241	V202-I237 HydrophobicContact CG1-CB 4.48Å; V202-I237 HydrophobicContact CG1-CG1 4.21Å; V202-I237 HydrophobicContact CG1-CG2 4.28Å; F204-I237 HydrophobicContact CD1-CD1 3.5Å; F204-I237 VanDerWaalsContact CD1-CD1 3.5Å; F204-I237 HydrophobicContact CD2-CD1 3.89Å; F204-I237 HydrophobicContact CE1-CD1 3.21Å; F204-I237 HydrophobicContact CE2-CD1 3.61Å; F204-I237 HydrophobicContact CG-CD1 3.84Å; F204-I237 HydrophobicContact CZ-CD1 3.27Å; F214-I237 HydrophobicContact CB-CD1 3.73Å; F214-I237 HydrophobicContact CB-CG1 3.84Å; F214-I237 HydrophobicContact CD1-CD1 4.34Å; F214-I237 HydrophobicContact CD1-CG1 4.22Å; F214-I237 HydrophobicContact CD2-CG1 4.1Å; F214-I237 HydrophobicContact CG-CD1 4.1Å; F214-I237 HydrophobicContact CG-CG1 3.81Å; A233-I237 WeakPolarHBondContact O-CD1 3.46Å; A233-I237 VanDerWaalsContact O-CG1 3.23Å; A233-I237 WeakPolarHBondContact O-CG1 3.44Å; A233-I237 PolarHBondContact O-N 3.38Å; D234-I237 PolarHBondContact O-N 2.98Å; I237-I239 PolarHBondContact O-N 3.35Å; I237-L240 PolarHBondContact O-N 3.29Å; I237-H241 VanDerWaalsContact CG2-CE1 3.42Å; I237-H241 WeakPolarHBondContact CG2-CE1 3.29Å; I237-H241 WeakPolarHBondContact O-CB 3.46Å; I237-H241 PolarHBondContact O-N 3.25Å
238	K	92.3	Very high	89.6	Confident	87 Å²	87	50.7 Å²	50.7	38%	0.378	25%	0.252	S	S	.	.	H	α-helix	trans	-57.4	-48.6	179.1	-78.6	173.4	174.4	168	0	112.2	I124 D234 L240 H241 W242	I124-K238 HydrophobicContact CG2-CD 4.12Å; D234-K238 WeakPolarHBondContact O-CB 3.44Å; D234-K238 VanDerWaalsContact O-CG 3.31Å; D234-K238 WeakPolarHBondContact O-CG 3.49Å; D234-K238 PolarHBondContact O-N 3.27Å; D234-K238 WeakPolarHBondContact OD1-CE 3.33Å; D234-K238 IonicContact OD1-NZ 3.75Å; D234-K238 WeakPolarHBondContact OD2-CD 3.34Å; D234-K238 WeakPolarHBondContact OD2-CE 3.27Å; D234-K238 IonicContact OD2-NZ 2.64Å; D234-K238 PolarHBondContact OD2-NZ 3.06Å; K238-L240 PolarHBondContact O-N 3.4Å; K238-H241 PolarHBondContact O-N 3.47Å; K238-W242 WeakPolarHBondContact O-CB 3.35Å; K238-W242 PolarHBondContact O-N 3.12Å
239	I	92.9	Very high	88.6	Confident	8 Å²	8	50 Å²	50	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-67.9	-37.1	-179.2	-161.9	171.5	0	0	0	112	T152 K153 L174 E235 W236 I237 W242 K243	T152-I239 VanDerWaalsContact O-CD1 3.3Å; T152-I239 WeakPolarHBondContact O-CD1 3.35Å; K153-I239 HydrophobicContact CB-CD1 3.73Å; K153-I239 HydrophobicContact CB-CG2 4.21Å; K153-I239 HydrophobicContact CD-CG2 3.91Å; L174-I239 HydrophobicContact CD2-CB 4.49Å; L174-I239 HydrophobicContact CD2-CD1 4.04Å; L174-I239 HydrophobicContact CD2-CG1 3.96Å; L174-I239 HydrophobicContact CD2-CG2 3.85Å; E235-I239 WeakPolarHBondContact O-CG2 3.41Å; E235-I239 PolarHBondContact O-N 3.45Å; W236-I239 HydrophobicContact CE3-CG2 4.47Å; W236-I239 WeakPolarHBondContact O-CG2 3.34Å; I237-I239 PolarHBondContact O-N 3.35Å; I239-W242 PolarHBondContact O-N 3.33Å; I239-K243 WeakPolarHBondContact O-CG 3.32Å; I239-K243 PolarHBondContact O-N 3.21Å
240	L	95.1	Very high	86.9	Confident	1 Å²	1	50 Å²	50	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-70	-41.8	177.3	-68.9	167.7	0	0	0	111.6	L174 L179 L196 V202 F214 L216 W236 I237 K238 K243 L244	L174-L240 HydrophobicContact CD1-CD2 4.36Å; L174-L240 HydrophobicContact CD2-CD2 4Å; L179-L240 HydrophobicContact CD2-CD2 4.41Å; L196-L240 HydrophobicContact CD1-CD2 3.87Å; L196-L240 HydrophobicContact CD2-CD2 4.18Å; V202-L240 HydrophobicContact CG1-CB 4.32Å; V202-L240 HydrophobicContact CG1-CD1 4.39Å; V202-L240 HydrophobicContact CG2-CB 3.81Å; F214-L240 HydrophobicContact CE2-CD1 3.99Å; L216-L240 HydrophobicContact CD2-CD1 3.75Å; W236-L240 HydrophobicContact CE3-CD1 4.42Å; W236-L240 WeakPolarHBondContact O-CB 3.43Å; W236-L240 VanDerWaalsContact O-CD1 3.28Å; W236-L240 WeakPolarHBondContact O-CD1 3.05Å; W236-L240 WeakPolarHBondContact O-CG 3.35Å; W236-L240 PolarHBondContact O-N 3.31Å; W236-L240 VanDerWaalsContact O-N 3.11Å; I237-L240 PolarHBondContact O-N 3.29Å; K238-L240 PolarHBondContact O-N 3.4Å; L240-K243 PolarHBondContact O-N 3.27Å; L240-L244 WeakPolarHBondContact O-CG 3.44Å; L240-L244 PolarHBondContact O-N 3Å
241	H	93.7	Very high	85.3	Confident	88 Å²	88	59.6 Å²	59.6	41%	0.407	29%	0.285	S	S	.	.	H	α-helix	trans	-58.4	-47.6	171.6	-79.6	172.8	0	0	0	111.9	V202 I237 K238 K243 L244 S245	V202-H241 PolarHBondContact O-NE2 3.31Å; I237-H241 VanDerWaalsContact CG2-CE1 3.42Å; I237-H241 WeakPolarHBondContact CG2-CE1 3.29Å; I237-H241 WeakPolarHBondContact O-CB 3.46Å; I237-H241 PolarHBondContact O-N 3.25Å; K238-H241 PolarHBondContact O-N 3.47Å; H241-K243 VanDerWaalsContact C-N 3.32Å; H241-K243 PolarHBondContact O-N 2.83Å; H241-L244 PolarHBondContact O-N 3Å; H241-S245 PolarHBondContact O-N 3.03Å
242	W	88.4	Confident	85.3	Confident	39 Å²	39	57.9 Å²	57.9	15%	0.148	27%	0.27	C	S	.	.	H	α-helix	trans	-57.2	-47.6	176.5	179.4	87.5	0	0	0	110.6	K238 I239 L244 S245 Q246	K238-W242 WeakPolarHBondContact O-CB 3.35Å; K238-W242 PolarHBondContact O-N 3.12Å; I239-W242 PolarHBondContact O-N 3.33Å; W242-L244 PolarHBondContact O-N 2.88Å; W242-S245 WeakPolarHBondContact O-CB 3.42Å; W242-S245 PolarHBondContact O-N 2.74Å; W242-S245 VanDerWaalsContact O-N 3.11Å; W242-S245 PolarHBondContact O-OG 2.99Å; W242-Q246 HydrophobicContact CD2-CG 4.15Å; W242-Q246 HydrophobicContact CE3-CG 4.42Å; W242-Q246 HydrophobicContact CH2-CG 4.21Å; W242-Q246 HydrophobicContact CZ2-CG 3.92Å; W242-Q246 HydrophobicContact CZ3-CG 4.46Å; W242-Q246 WeakPolarHBondContact O-CG 3.38Å; W242-Q246 PolarHBondContact O-N 2.95Å
243	K	89.1	Confident	85	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-58.1	-46.7	175.2	-76.9	-64.9	-175.3	-176.8	0	113	G151 L174 R176 L196 I239 L240 H241 S245 Q246 I247	G151-K243 WeakPolarHBondContact O-CE 3.3Å; L174-K243 HydrophobicContact CD2-CG 4.21Å; R176-K243 WeakPolarHBondContact O-CD 3.46Å; R176-K243 WeakPolarHBondContact O-CE 3.35Å; R176-K243 PolarHBondContact O-NZ 2.92Å; R176-K243 VanDerWaalsContact O-NZ 3.13Å; L196-K243 HydrophobicContact CD1-CB 4.25Å; I239-K243 WeakPolarHBondContact O-CG 3.32Å; I239-K243 PolarHBondContact O-N 3.21Å; L240-K243 PolarHBondContact O-N 3.27Å; H241-K243 VanDerWaalsContact C-N 3.32Å; H241-K243 PolarHBondContact O-N 2.83Å; K243-S245 VanDerWaalsContact C-N 3.26Å; K243-S245 PolarHBondContact O-N 3.09Å; K243-Q246 PolarHBondContact O-N 3.18Å; K243-I247 VanDerWaalsContact O-CG1 3.31Å; K243-I247 WeakPolarHBondContact O-CG1 3.43Å; K243-I247 PolarHBondContact O-N 2.81Å
244	L	91.1	Very high	84.6	Confident	10 Å²	10	60.9 Å²	60.9	5%	0.052	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-36.3	176.4	-66.7	-173.8	0	0	0	112.1	L196 C199 V202 L240 H241 W242 I247 R248	L196-L244 HydrophobicContact CB-CD2 4.36Å; L196-L244 WeakPolarHBondContact O-CD2 3.3Å; C199-L244 HydrophobicContact CB-CD2 3.91Å; V202-L244 HydrophobicContact CG2-CD1 3.76Å; L240-L244 WeakPolarHBondContact O-CG 3.44Å; L240-L244 PolarHBondContact O-N 3Å; H241-L244 PolarHBondContact O-N 3Å; W242-L244 PolarHBondContact O-N 2.88Å; L244-I247 HydrophobicContact CD2-CD1 4.47Å; L244-R248 VanDerWaalsContact O-CG 3.28Å; L244-R248 WeakPolarHBondContact O-CG 3.36Å; L244-R248 PolarHBondContact O-N 2.77Å; L244-R248 VanDerWaalsContact O-N 3.12Å
245	S	86.1	Confident	84.3	Confident	43 Å²	43	61.3 Å²	61.3	30%	0.301	28%	0.284	S	S	.	.	H	α-helix	trans	-65.3	-41.6	176.9	82.1	0	0	0	0	112.1	H241 W242 K243 R248 K249	H241-S245 PolarHBondContact O-N 3.03Å; W242-S245 WeakPolarHBondContact O-CB 3.42Å; W242-S245 PolarHBondContact O-N 2.74Å; W242-S245 VanDerWaalsContact O-N 3.11Å; W242-S245 PolarHBondContact O-OG 2.99Å; K243-S245 VanDerWaalsContact C-N 3.26Å; K243-S245 PolarHBondContact O-N 3.09Å; S245-R248 PolarHBondContact O-N 3.36Å; S245-K249 WeakPolarHBondContact O-CG 3.39Å; S245-K249 PolarHBondContact O-N 2.92Å; S245-K249 VanDerWaalsContact O-N 3.11Å
246	Q	80.7	Confident	84	Confident	62 Å²	62	61.6 Å²	61.6	29%	0.29	29%	0.285	S	S	.	.	H	α-helix	trans	-67.4	-41.5	177.7	-59.2	-50.7	-36.4	0	0	111.5	W242 K243 R248 K249 G250	W242-Q246 HydrophobicContact CD2-CG 4.15Å; W242-Q246 HydrophobicContact CE3-CG 4.42Å; W242-Q246 HydrophobicContact CH2-CG 4.21Å; W242-Q246 HydrophobicContact CZ2-CG 3.92Å; W242-Q246 HydrophobicContact CZ3-CG 4.46Å; W242-Q246 WeakPolarHBondContact O-CG 3.38Å; W242-Q246 PolarHBondContact O-N 2.95Å; K243-Q246 PolarHBondContact O-N 3.18Å; Q246-R248 VanDerWaalsContact C-N 3.27Å; Q246-R248 PolarHBondContact O-N 3.2Å; Q246-K249 PolarHBondContact O-N 3.19Å; Q246-G250 PolarHBondContact O-N 3.18Å; Q246-G250 VanDerWaalsContact O-N 3.15Å
247	I	83.6	Confident	83.2	Confident	22 Å²	22	65.4 Å²	65.4	11%	0.113	30%	0.303	C	S	.	.	H	α-helix	trans	-59	-39.9	176	-68.6	166.5	0	0	0	111.1	N177 L196 T197 K243 L244 G250	N177-I247 HydrophobicContact CB-CD1 4.23Å; L196-I247 HydrophobicContact CB-CD1 3.96Å; T197-I247 HydrophobicContact CG2-CD1 4.43Å; T197-I247 HydrophobicContact CG2-CG2 4.35Å; K243-I247 VanDerWaalsContact O-CG1 3.31Å; K243-I247 WeakPolarHBondContact O-CG1 3.43Å; K243-I247 PolarHBondContact O-N 2.81Å; L244-I247 HydrophobicContact CD2-CD1 4.47Å; I247-G250 PolarHBondContact O-N 2.81Å
248	R	81.7	Confident	82.4	Confident	155 Å²	155	69.8 Å²	69.8	59%	0.585	32%	0.324	S	S	*	.	H	α-helix	trans	-71.3	-35.2	179.3	-71.4	170.7	-176	-175.1	1	113	S200 L244 S245 Q246 G250	S200-R248 PolarHBondContact O-NH2 3.28Å; L244-R248 VanDerWaalsContact O-CG 3.28Å; L244-R248 WeakPolarHBondContact O-CG 3.36Å; L244-R248 PolarHBondContact O-N 2.77Å; L244-R248 VanDerWaalsContact O-N 3.12Å; S245-R248 PolarHBondContact O-N 3.36Å; Q246-R248 VanDerWaalsContact C-N 3.27Å; Q246-R248 PolarHBondContact O-N 3.2Å; R248-G250 VanDerWaalsContact C-N 3.28Å
249	K	70.7	Confident	81.6	Confident	161 Å²	161	68.5 Å²	68.5	70%	0.7	32%	0.319	S	S	*	.	H	α-helix	trans	-70	-24.5	176	-72.4	179.2	179.7	-176.8	0	113.1	S245 Q246	S245-K249 WeakPolarHBondContact O-CG 3.39Å; S245-K249 PolarHBondContact O-N 2.92Å; S245-K249 VanDerWaalsContact O-N 3.11Å; Q246-K249 PolarHBondContact O-N 3.19Å
250	G	55.1	Low	80.7	Confident	57 Å²	57	73.5 Å²	73.5	59%	0.588	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	4.5	179.3	0	0	0	0	0	115.6	Q246 I247 R248	Q246-G250 PolarHBondContact O-N 3.18Å; Q246-G250 VanDerWaalsContact O-N 3.15Å; I247-G250 PolarHBondContact O-N 2.81Å; R248-G250 VanDerWaalsContact C-N 3.28Å
251	R	52.8	Low	79.4	Confident	240 Å²	240	80.1 Å²	80.1	91%	0.906	37%	0.373	S	S	*	.			trans	-96.1	0	170	-76	-173.1	179.9	174.2	3.6	109.9	T197	T197-R251 PolarHBondContact O-NH2 3.27Å

Retrieved 251 of 251 residues in 524.6 ms (Link to these results)

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