A0A024RA28_HUMAN Loading...

Heterogeneous nuclear ribonucleoprotein A2/B1

AlphaFold DB , UniProt , Accession A0A024RA28, Species HUMAN (Homo sapiens, Human), Gene HNRNPA2B1, Length 301 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	81.3	Confident	89.4	Confident	112 Å²	112	113.5 Å²	113.5	55%	0.552	61%	0.605	S	S	*	*				0	142.3	0	-94.1	-177.7	176.9	0	0	109.9	R10 F12 F14	M1-R10 WeakPolarHBondContact O-CB 3.39Å; M1-R10 PolarHBondContact O-N 3.24Å; M1-F12 HydrophobicContact CB-CE2 3.99Å; M1-F12 HydrophobicContact CB-CZ 4.01Å; M1-F12 HydrophobicContact CG-CE2 4.16Å; M1-F12 HydrophobicContact CG-CZ 4.43Å; M1-F12 PolarHBondContact N-O 2.85Å; M1-F12 HydrophobicContact SD-CE2 3.51Å; M1-F12 VanDerWaalsContact SD-CE2 3.51Å; M1-F12 HydrophobicContact SD-CZ 3.66Å; M1-F14 HydrophobicContact CE-CE2 4.29Å; M1-F14 HydrophobicContact SD-CE2 4.46Å
2	R	88.3	Confident	89.5	Confident	178 Å²	178	111.3 Å²	111.3	67%	0.672	59%	0.586	S	S	*	*	B	Isolated β-bridge	trans	-120.1	151.1	178.5	-68.8	175.5	-176.7	-168.3	4.9	109.6	K7 R8	R2-K7 WeakPolarHBondContact CD-O 3.21Å; R2-R8 CarbonylContact C-O 3.44Å; R2-R8 VanDerWaalsContact CA-O 3.24Å; R2-R8 WeakPolarHBondContact CA-O 3.39Å
3	D	87.7	Confident	89.7	Confident	62 Å²	62	106.7 Å²	106.7	33%	0.332	58%	0.582	S	S	.	*			trans	-60.9	129	170.8	178	-109.4	0	0	0	109.6	A5 S6 K7 R8	D3-A5 VanDerWaalsContact C-N 3.26Å; D3-A5 PolarHBondContact O-N 3.24Å; D3-A5 PolarHBondContact OD1-N 3.11Å; D3-S6 VanDerWaalsContact CB-OG 3.25Å; D3-S6 WeakPolarHBondContact CB-OG 3.24Å; D3-S6 VanDerWaalsContact CG-OG 3.29Å; D3-S6 WeakPolarHBondContact OD1-CB 3.45Å; D3-S6 PolarHBondContact OD1-N 3.48Å; D3-S6 PolarHBondContact OD1-OG 3.05Å; D3-K7 WeakPolarHBondContact O-CA 3.24Å; D3-K7 PolarHBondContact O-N 3.25Å; D3-R8 PolarHBondContact N-O 3.46Å
4	P	89.4	Confident	90	Very high	103 Å²	103	109 Å²	109	67%	0.669	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	-33.9	-174.3	-26.2	35.2	0	0	0	113.9	K7	P4-K7 WeakPolarHBondContact O-CE 3.47Å; P4-K7 PolarHBondContact O-NZ 2.78Å
5	A	91.2	Very high	90.3	Very high	88 Å²	88	109.5 Å²	109.5	73%	0.727	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-60.2	-176.6	0	0	0	0	0	111.8	D3 K7	D3-A5 VanDerWaalsContact C-N 3.26Å; D3-A5 PolarHBondContact O-N 3.24Å; D3-A5 PolarHBondContact OD1-N 3.11Å; A5-K7 VanDerWaalsContact C-N 3.31Å; A5-K7 PolarHBondContact O-N 3.27Å
6	S	91.6	Very high	90.5	Very high	77 Å²	77	111.3 Å²	111.3	54%	0.538	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-10.1	-175.2	64.8	0	0	0	0	114.3	D3 R8	D3-S6 VanDerWaalsContact CB-OG 3.25Å; D3-S6 WeakPolarHBondContact CB-OG 3.24Å; D3-S6 VanDerWaalsContact CG-OG 3.29Å; D3-S6 WeakPolarHBondContact OD1-CB 3.45Å; D3-S6 PolarHBondContact OD1-N 3.48Å; D3-S6 PolarHBondContact OD1-OG 3.05Å; S6-R8 PolarHBondContact O-N 3.45Å; S6-R8 WeakPolarHBondContact OG-CB 3.22Å; S6-R8 PolarHBondContact OG-N 2.98Å
7	K	92.7	Very high	90.8	Very high	139 Å²	139	109.9 Å²	109.9	60%	0.604	60%	0.595	S	S	*	*			trans	55.1	8.5	-171.6	-53.7	-54.8	-174.1	-161.4	0	114.5	R2 D3 P4 A5	R2-K7 WeakPolarHBondContact CD-O 3.21Å; D3-K7 WeakPolarHBondContact O-CA 3.24Å; D3-K7 PolarHBondContact O-N 3.25Å; P4-K7 WeakPolarHBondContact O-CE 3.47Å; P4-K7 PolarHBondContact O-NZ 2.78Å; A5-K7 VanDerWaalsContact C-N 3.31Å; A5-K7 PolarHBondContact O-N 3.27Å
8	R	90.3	Very high	91.1	Very high	197 Å²	197	109.6 Å²	109.6	74%	0.743	60%	0.603	S	S	*	*			trans	-67.9	141.9	178.4	-168	178.8	-178.4	-139.3	0.8	110.1	R2 D3 S6 R10	R2-R8 CarbonylContact C-O 3.44Å; R2-R8 VanDerWaalsContact CA-O 3.24Å; R2-R8 WeakPolarHBondContact CA-O 3.39Å; D3-R8 PolarHBondContact N-O 3.46Å; S6-R8 PolarHBondContact O-N 3.45Å; S6-R8 WeakPolarHBondContact OG-CB 3.22Å; S6-R8 PolarHBondContact OG-N 2.98Å; R8-R10 PolarHBondContact O-N 3.29Å
9	S	91.3	Very high	91.3	Very high	80 Å²	80	106.5 Å²	106.5	56%	0.559	59%	0.59	S	S	*	*	B	Isolated β-bridge	trans	-61.1	135.6	174.3	-176.7	0	0	0	0	110.8	G11	S9-G11 PolarHBondContact O-N 3.34Å; S9-G11 PolarHBondContact OG-N 3.26Å
10	R	90	Very high	91.3	Very high	142 Å²	142	107.2 Å²	107.2	54%	0.536	59%	0.59	S	S	.	*			trans	-82.3	2.8	173.5	-66.1	176	59.6	-163.8	-0.3	112.8	M1 R8 F12	M1-R10 WeakPolarHBondContact O-CB 3.39Å; M1-R10 PolarHBondContact O-N 3.24Å; R8-R10 PolarHBondContact O-N 3.29Å; R10-F12 VanDerWaalsContact C-N 3.31Å; R10-F12 HydrophobicContact CB-CD1 3.92Å; R10-F12 HydrophobicContact CB-CE1 3.57Å; R10-F12 HydrophobicContact CB-CZ 4.42Å; R10-F12 WeakPolarHBondContact O-CD1 3.21Å; R10-F12 PolarHBondContact O-N 3.42Å
11	G	89.8	Confident	91.4	Very high	70 Å²	70	105.4 Å²	105.4	72%	0.722	59%	0.589	S	S	*	*	S	Bend	trans	80.3	6.8	177.2	0	0	0	0	0	115.1	S9	S9-G11 PolarHBondContact O-N 3.34Å; S9-G11 PolarHBondContact OG-N 3.26Å
12	F	91.1	Very high	92.1	Very high	87 Å²	87	103.9 Å²	103.9	38%	0.382	58%	0.581	S	S	.	*			trans	-144.9	162.3	175.3	70.2	-86.4	0	0	0	111.5	M1 R10 F14	M1-F12 HydrophobicContact CB-CE2 3.99Å; M1-F12 HydrophobicContact CB-CZ 4.01Å; M1-F12 HydrophobicContact CG-CE2 4.16Å; M1-F12 HydrophobicContact CG-CZ 4.43Å; M1-F12 PolarHBondContact N-O 2.85Å; M1-F12 HydrophobicContact SD-CE2 3.51Å; M1-F12 VanDerWaalsContact SD-CE2 3.51Å; M1-F12 HydrophobicContact SD-CZ 3.66Å; R10-F12 VanDerWaalsContact C-N 3.31Å; R10-F12 HydrophobicContact CB-CD1 3.92Å; R10-F12 HydrophobicContact CB-CE1 3.57Å; R10-F12 HydrophobicContact CB-CZ 4.42Å; R10-F12 WeakPolarHBondContact O-CD1 3.21Å; R10-F12 PolarHBondContact O-N 3.42Å; F12-F14 HydrophobicContact CD2-CE2 4.26Å; F12-F14 HydrophobicContact CE2-CE2 4.05Å
13	G	92	Very high	92.5	Very high	52 Å²	52	97.2 Å²	97.2	54%	0.536	56%	0.56	S	S	.	*			trans	-154	178.5	177.8	0	0	0	0	0	111.3
14	F	93.5	Very high	92.7	Very high	139 Å²	139	96.5 Å²	96.5	61%	0.61	56%	0.556	S	S	*	*			trans	-126	142.4	173.7	-62.3	-85.7	0	0	0	107.8	M1 F12 A44	M1-F14 HydrophobicContact CE-CE2 4.29Å; M1-F14 HydrophobicContact SD-CE2 4.46Å; F12-F14 HydrophobicContact CD2-CE2 4.26Å; F12-F14 HydrophobicContact CE2-CE2 4.05Å; F14-A44 HydrophobicContact CD1-CB 4.31Å; F14-A44 HydrophobicContact CE1-CB 4.45Å
15	V	94.6	Very high	93	Very high	116 Å²	116	94.5 Å²	94.5	70%	0.703	55%	0.548	S	S	*	.			trans	-121.1	131.7	172	-179.7	0	0	0	0	106.3	F17	V15-F17 HydrophobicContact CB-CE2 4.41Å; V15-F17 HydrophobicContact CG1-CD2 4.29Å; V15-F17 HydrophobicContact CG1-CE2 3.9Å; V15-F17 HydrophobicContact CG1-CZ 4.14Å
16	T	94.2	Very high	93.2	Very high	138 Å²	138	91.5 Å²	91.5	85%	0.847	52%	0.523	S	S	*	.			trans	-109.7	119	176.4	-54.2	0	0	0	0	107.7
17	F	95.3	Very high	93.4	Very high	88 Å²	88	88.2 Å²	88.2	39%	0.386	50%	0.499	S	S	.	.			trans	-86.8	165.2	174.7	-70.2	-88.8	0	0	0	110.8	V15 E22 V23 A26	V15-F17 HydrophobicContact CB-CE2 4.41Å; V15-F17 HydrophobicContact CG1-CD2 4.29Å; V15-F17 HydrophobicContact CG1-CE2 3.9Å; V15-F17 HydrophobicContact CG1-CZ 4.14Å; F17-E22 HydrophobicContact CB-CB 3.94Å; F17-E22 HydrophobicContact CD1-CB 3.63Å; F17-E22 HydrophobicContact CE1-CB 4.44Å; F17-E22 HydrophobicContact CG-CB 4.03Å; F17-V23 HydrophobicContact CB-CG2 3.83Å; F17-V23 HydrophobicContact CD2-CG2 3.72Å; F17-V23 HydrophobicContact CG-CG2 4.04Å; F17-A26 HydrophobicContact CE1-CB 4.3Å; F17-A26 HydrophobicContact CE2-CB 4.16Å; F17-A26 HydrophobicContact CZ-CB 3.66Å
18	S	95.9	Very high	93.4	Very high	105 Å²	105	85.6 Å²	85.6	73%	0.734	50%	0.504	S	S	*	.	S	Bend	trans	-78.7	-27.8	178.9	74.6	0	0	0	0	112.2	E22	S18-E22 WeakPolarHBondContact CB-OE2 3.38Å; S18-E22 PolarHBondContact N-OE2 3.26Å; S18-E22 PolarHBondContact OG-OE1 2.84Å; S18-E22 PolarHBondContact OG-OE2 2.82Å
19	S	94.6	Very high	93.7	Very high	50 Å²	50	79.1 Å²	79.1	35%	0.35	49%	0.492	S	S	.	.	S	Bend	trans	-139.7	158.6	-179.3	72.4	0	0	0	0	112.6	A21 E22 V23	S19-A21 VanDerWaalsContact C-N 3.27Å; S19-A21 PolarHBondContact O-N 3.19Å; S19-E22 PolarHBondContact N-OE2 3.19Å; S19-E22 PolarHBondContact O-N 3.34Å; S19-E22 WeakPolarHBondContact OG-CG 3.27Å; S19-E22 PolarHBondContact OG-N 3.13Å; S19-V23 PolarHBondContact O-N 2.88Å
20	M	91.5	Very high	93.8	Very high	120 Å²	120	78.4 Å²	78.4	59%	0.591	48%	0.478	S	S	*	.	H	α-helix	trans	-65.8	-31.1	175	-169.5	177.9	-64.8	0	0	112.1	E22 V23 D24	M20-E22 VanDerWaalsContact C-N 3.31Å; M20-E22 PolarHBondContact O-N 3.4Å; M20-V23 WeakPolarHBondContact O-CB 3.28Å; M20-V23 PolarHBondContact O-N 3.41Å; M20-V23 VanDerWaalsContact O-N 3.16Å; M20-D24 PolarHBondContact O-N 3.41Å
21	A	94.1	Very high	94	Very high	70 Å²	70	77.1 Å²	77.1	58%	0.579	49%	0.487	S	S	*	.	H	α-helix	trans	-63.2	-37.3	177.2	0	0	0	0	0	112.2	S19 D24 A25	S19-A21 VanDerWaalsContact C-N 3.27Å; S19-A21 PolarHBondContact O-N 3.19Å; A21-D24 PolarHBondContact O-N 3.07Å; A21-A25 WeakPolarHBondContact O-CB 3.38Å; A21-A25 PolarHBondContact O-N 2.86Å
22	E	96.1	Very high	94.3	Very high	80 Å²	80	76.4 Å²	76.4	37%	0.374	47%	0.465	S	S	.	.	H	α-helix	trans	-66.8	-37.3	174.1	-70.6	171.2	168	0	0	112.1	F17 S18 S19 M20 A25 A26	F17-E22 HydrophobicContact CB-CB 3.94Å; F17-E22 HydrophobicContact CD1-CB 3.63Å; F17-E22 HydrophobicContact CE1-CB 4.44Å; F17-E22 HydrophobicContact CG-CB 4.03Å; S18-E22 WeakPolarHBondContact CB-OE2 3.38Å; S18-E22 PolarHBondContact N-OE2 3.26Å; S18-E22 PolarHBondContact OG-OE1 2.84Å; S18-E22 PolarHBondContact OG-OE2 2.82Å; S19-E22 PolarHBondContact N-OE2 3.19Å; S19-E22 PolarHBondContact O-N 3.34Å; S19-E22 WeakPolarHBondContact OG-CG 3.27Å; S19-E22 PolarHBondContact OG-N 3.13Å; M20-E22 VanDerWaalsContact C-N 3.31Å; M20-E22 PolarHBondContact O-N 3.4Å; E22-A25 PolarHBondContact O-N 3.19Å; E22-A26 WeakPolarHBondContact O-CB 3.32Å; E22-A26 PolarHBondContact O-N 3.42Å
23	V	95.4	Very high	94.5	Very high	39 Å²	39	76.1 Å²	76.1	24%	0.236	47%	0.474	C	S	.	.	H	α-helix	trans	-61.9	-48.1	173.5	-179	0	0	0	0	110	F17 S19 M20 A25 A26 M27	F17-V23 HydrophobicContact CB-CG2 3.83Å; F17-V23 HydrophobicContact CD2-CG2 3.72Å; F17-V23 HydrophobicContact CG-CG2 4.04Å; S19-V23 PolarHBondContact O-N 2.88Å; M20-V23 WeakPolarHBondContact O-CB 3.28Å; M20-V23 PolarHBondContact O-N 3.41Å; M20-V23 VanDerWaalsContact O-N 3.16Å; V23-A25 VanDerWaalsContact C-N 3.34Å; V23-A25 PolarHBondContact O-N 2.89Å; V23-A26 PolarHBondContact O-N 3.06Å; V23-M27 HydrophobicContact CG1-CG 4.38Å; V23-M27 WeakPolarHBondContact O-CG 3.32Å; V23-M27 PolarHBondContact O-N 3.03Å
24	D	93.4	Very high	94.6	Very high	46 Å²	46	78.3 Å²	78.3	25%	0.246	47%	0.472	C	S	.	.	H	α-helix	trans	-61.1	-43.4	179.7	-68.5	-12.7	0	0	0	110.8	M20 A21 A26 M27 A28 R43 K116	M20-D24 PolarHBondContact O-N 3.41Å; A21-D24 PolarHBondContact O-N 3.07Å; D24-A26 PolarHBondContact O-N 2.78Å; D24-M27 PolarHBondContact O-N 2.77Å; D24-A28 WeakPolarHBondContact O-CB 3.07Å; D24-A28 PolarHBondContact O-N 3.18Å; D24-R43 IonicContact OD1-CZ 3.21Å; D24-R43 IonicContact OD1-NH1 2.92Å; D24-R43 PolarHBondContact OD1-NH1 3.5Å; D24-R43 VanDerWaalsContact OD1-NH1 3.09Å; D24-R43 IonicContact OD1-NH2 2.63Å; D24-R43 PolarHBondContact OD1-NH2 3.47Å; D24-K116 IonicContact OD1-NZ 3.07Å; D24-K116 PolarHBondContact OD1-NZ 3.14Å; D24-K116 IonicContact OD2-NZ 3.98Å; D24-K116 PolarHBondContact OD2-NZ 2.92Å
25	A	95.2	Very high	94.6	Very high	62 Å²	62	79.2 Å²	79.2	51%	0.512	48%	0.483	S	S	.	.	H	α-helix	trans	-62.2	-42.2	174.7	0	0	0	0	0	112.4	A21 E22 V23 A28 A29	A21-A25 WeakPolarHBondContact O-CB 3.38Å; A21-A25 PolarHBondContact O-N 2.86Å; E22-A25 PolarHBondContact O-N 3.19Å; V23-A25 VanDerWaalsContact C-N 3.34Å; V23-A25 PolarHBondContact O-N 2.89Å; A25-A28 PolarHBondContact O-N 3.47Å; A25-A29 WeakPolarHBondContact O-CB 3.16Å; A25-A29 PolarHBondContact O-N 3.29Å; A25-A29 VanDerWaalsContact O-N 3.1Å
26	A	95.3	Very high	94.5	Very high	24 Å²	24	77.1 Å²	77.1	20%	0.198	49%	0.486	C	S	.	.	H	α-helix	trans	-64.2	-40.6	175.2	0	0	0	0	0	111.6	F17 E22 V23 D24 A29 H32	F17-A26 HydrophobicContact CE1-CB 4.3Å; F17-A26 HydrophobicContact CE2-CB 4.16Å; F17-A26 HydrophobicContact CZ-CB 3.66Å; E22-A26 WeakPolarHBondContact O-CB 3.32Å; E22-A26 PolarHBondContact O-N 3.42Å; V23-A26 PolarHBondContact O-N 3.06Å; D24-A26 PolarHBondContact O-N 2.78Å; A26-A29 PolarHBondContact O-N 2.83Å; A26-H32 PolarHBondContact O-CE1 3.21Å; A26-H32 PolarHBondContact O-NE2 3.37Å
27	M	94.9	Very high	94.4	Very high	8 Å²	8	79.7 Å²	79.7	4%	0.039	48%	0.48	C	S	.	.	H	α-helix	trans	-69.4	-33.7	177.4	-69.1	-58.2	-74.5	0	0	112.3	V23 D24 A29 R30 P41 D112	V23-M27 HydrophobicContact CG1-CG 4.38Å; V23-M27 WeakPolarHBondContact O-CG 3.32Å; V23-M27 PolarHBondContact O-N 3.03Å; D24-M27 PolarHBondContact O-N 2.77Å; M27-A29 VanDerWaalsContact C-N 3.32Å; M27-R30 PolarHBondContact O-NE 2.81Å; M27-R30 PolarHBondContact O-NH2 2.8Å; M27-R30 VanDerWaalsContact O-NH2 3.11Å; M27-P41 HydrophobicContact CE-CG 4.47Å; M27-P41 WeakPolarHBondContact CE-O 3.39Å; M27-P41 HydrophobicContact SD-CB 3.79Å; M27-P41 HydrophobicContact SD-CG 3.89Å; M27-D112 HydrophobicContact CE-CB 3.78Å; M27-D112 WeakPolarHBondContact CE-OD1 3.48Å; M27-D112 WeakPolarHBondContact CG-OD1 3.3Å
28	A	93.5	Very high	94.3	Very high	85 Å²	85	81.1 Å²	81.1	70%	0.702	50%	0.495	S	S	*	.	H	α-helix	trans	-69.7	-28.1	175.1	0	0	0	0	0	113.1	D24 A25 R30	D24-A28 WeakPolarHBondContact O-CB 3.07Å; D24-A28 PolarHBondContact O-N 3.18Å; A25-A28 PolarHBondContact O-N 3.47Å; A28-R30 VanDerWaalsContact C-N 3.25Å; A28-R30 PolarHBondContact O-N 3.36Å
29	A	95.3	Very high	94.3	Very high	60 Å²	60	78.6 Å²	78.6	50%	0.496	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	11.2	179.6	0	0	0	0	0	114.5	A25 A26 M27 H32	A25-A29 WeakPolarHBondContact O-CB 3.16Å; A25-A29 PolarHBondContact O-N 3.29Å; A25-A29 VanDerWaalsContact O-N 3.1Å; A26-A29 PolarHBondContact O-N 2.83Å; M27-A29 VanDerWaalsContact C-N 3.32Å; A29-H32 PolarHBondContact O-CE1 2.77Å
30	R	94.4	Very high	94.1	Very high	66 Å²	66	82.1 Å²	82.1	25%	0.249	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-62.8	151.4	173.9	-85.9	179.4	-76.2	153.4	16.3	111.4	M27 A28 P41 D110 H111	M27-R30 PolarHBondContact O-NE 2.81Å; M27-R30 PolarHBondContact O-NH2 2.8Å; M27-R30 VanDerWaalsContact O-NH2 3.11Å; A28-R30 VanDerWaalsContact C-N 3.25Å; A28-R30 PolarHBondContact O-N 3.36Å; R30-P41 HydrophobicContact CG-CG 3.48Å; R30-P41 VanDerWaalsContact CG-CG 3.48Å; R30-D110 IonicContact CZ-OD1 2.79Å; R30-D110 IonicContact CZ-OD2 3.79Å; R30-D110 IonicContact NH1-OD1 3.5Å; R30-D110 PolarHBondContact NH1-OD1 2.97Å; R30-D110 IonicContact NH1-OD2 2.66Å; R30-D110 PolarHBondContact NH1-OD2 2.72Å; R30-D110 IonicContact NH2-OD2 2.97Å; R30-D110 PolarHBondContact NH2-OD2 2.68Å; R30-H111 PolarHBondContact NH1-NE2 3.41Å
31	P	95.1	Very high	94.2	Very high	114 Å²	114	78 Å²	78	74%	0.74	47%	0.469	S	S	*	.	S	Bend	cis	-79.2	148.7	0.3	32.2	-35.3	0	0	0	113.3
32	H	95.8	Very high	94.2	Very high	55 Å²	55	78.8 Å²	78.8	26%	0.255	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	145	177	-70	-50.2	0	0	0	112.3	A26 A29 V38 V39	A26-H32 PolarHBondContact O-CE1 3.21Å; A26-H32 PolarHBondContact O-NE2 3.37Å; A29-H32 PolarHBondContact O-CE1 2.77Å; H32-V38 CarbonylContact O-C 3.52Å; H32-V38 WeakPolarHBondContact O-CA 3.28Å; H32-V39 HydrophobicContact CB-CG2 3.6Å; H32-V39 PolarHBondContact O-N 2.85Å
33	S	95.3	Very high	94	Very high	81 Å²	81	76 Å²	76	57%	0.566	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	126.4	171.6	-175.7	0	0	0	0	110	R37	S33-R37 CarbonylContact C-O 3.43Å; S33-R37 WeakPolarHBondContact CA-O 3.45Å
34	I	93.3	Very high	93.8	Very high	99 Å²	99	77.1 Å²	77.1	51%	0.508	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	126.4	178.9	-55.7	178.3	0	0	0	107.4	G36 R37 V39	I34-G36 PolarHBondContact O-N 3.05Å; I34-R37 PolarHBondContact N-O 3.1Å; I34-R37 PolarHBondContact O-N 3.3Å; I34-V39 HydrophobicContact CB-CG1 4.21Å; I34-V39 HydrophobicContact CD1-CG1 4.29Å; I34-V39 HydrophobicContact CD1-CG2 3.86Å; I34-V39 HydrophobicContact CG1-CG1 4.3Å; I34-V39 HydrophobicContact CG1-CG2 4Å
35	D	93	Very high	93.4	Very high	157 Å²	157	76.5 Å²	76.5	84%	0.84	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	37.8	-178	-54.8	-35	0	0	0	113.5	R37	D35-R37 VanDerWaalsContact C-N 3.25Å; D35-R37 PolarHBondContact O-N 2.96Å
36	G	92.4	Very high	92.8	Very high	73 Å²	73	76.3 Å²	76.3	75%	0.753	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	10.1	-178.4	0	0	0	0	0	114.7	I34	I34-G36 PolarHBondContact O-N 3.05Å
37	R	92.8	Very high	92.3	Very high	191 Å²	191	86.5 Å²	86.5	72%	0.721	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.6	175.7	-63.4	-178.1	-179.8	179.3	0.3	110.4	S33 I34 D35 V39	S33-R37 CarbonylContact C-O 3.43Å; S33-R37 WeakPolarHBondContact CA-O 3.45Å; I34-R37 PolarHBondContact N-O 3.1Å; I34-R37 PolarHBondContact O-N 3.3Å; D35-R37 VanDerWaalsContact C-N 3.25Å; D35-R37 PolarHBondContact O-N 2.96Å; R37-V39 PolarHBondContact O-N 2.82Å
38	V	93.9	Very high	91.7	Very high	118 Å²	118	94.9 Å²	94.9	72%	0.715	53%	0.528	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	125.2	169.6	-178	0	0	0	0	108.4	H32	H32-V38 CarbonylContact O-C 3.52Å; H32-V38 WeakPolarHBondContact O-CA 3.28Å
39	V	94.2	Very high	91	Very high	53 Å²	53	93.1 Å²	93.1	32%	0.321	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	151.9	179.3	-60.9	0	0	0	0	110.4	H32 I34 R37 P41	H32-V39 HydrophobicContact CB-CG2 3.6Å; H32-V39 PolarHBondContact O-N 2.85Å; I34-V39 HydrophobicContact CB-CG1 4.21Å; I34-V39 HydrophobicContact CD1-CG1 4.29Å; I34-V39 HydrophobicContact CD1-CG2 3.86Å; I34-V39 HydrophobicContact CG1-CG1 4.3Å; I34-V39 HydrophobicContact CG1-CG2 4Å; R37-V39 PolarHBondContact O-N 2.82Å; V39-P41 VanDerWaalsContact O-CD 3.31Å; V39-P41 WeakPolarHBondContact O-CD 3.33Å
40	E	91.6	Very high	90.3	Very high	124 Å²	124	92.1 Å²	92.1	58%	0.579	49%	0.494	S	S	*	.			trans	-106.7	94.7	178.5	-165.6	-173	-177	0	0	109	K42	E40-K42 WeakPolarHBondContact OE1-CE 3.49Å; E40-K42 IonicContact OE1-NZ 3.4Å; E40-K42 PolarHBondContact OE1-NZ 2.91Å; E40-K42 VanDerWaalsContact OE2-CE 3.24Å; E40-K42 WeakPolarHBondContact OE2-CE 3.45Å; E40-K42 IonicContact OE2-NZ 2.86Å; E40-K42 PolarHBondContact OE2-NZ 3.49Å
41	P	93.9	Very high	89.5	Confident	34 Å²	34	92.3 Å²	92.3	22%	0.221	52%	0.517	C	S	.	.			trans	-70.6	139.7	175.3	36.9	-41	0	0	0	109.2	M27 R30 V39	M27-P41 HydrophobicContact CE-CG 4.47Å; M27-P41 WeakPolarHBondContact CE-O 3.39Å; M27-P41 HydrophobicContact SD-CB 3.79Å; M27-P41 HydrophobicContact SD-CG 3.89Å; R30-P41 HydrophobicContact CG-CG 3.48Å; R30-P41 VanDerWaalsContact CG-CG 3.48Å; V39-P41 VanDerWaalsContact O-CD 3.31Å; V39-P41 WeakPolarHBondContact O-CD 3.33Å
42	K	92.4	Very high	88.8	Confident	86 Å²	86	90.6 Å²	90.6	37%	0.374	50%	0.498	S	S	.	.			trans	-139.4	149.4	175.3	-65.5	-178.4	-173.8	173.5	0	108.7	E40 A44 T58	E40-K42 WeakPolarHBondContact OE1-CE 3.49Å; E40-K42 IonicContact OE1-NZ 3.4Å; E40-K42 PolarHBondContact OE1-NZ 2.91Å; E40-K42 VanDerWaalsContact OE2-CE 3.24Å; E40-K42 WeakPolarHBondContact OE2-CE 3.45Å; E40-K42 IonicContact OE2-NZ 2.86Å; E40-K42 PolarHBondContact OE2-NZ 3.49Å; K42-A44 PolarHBondContact O-N 2.76Å; K42-T58 WeakPolarHBondContact CE-OG1 3.47Å; K42-T58 PolarHBondContact NZ-OG1 3.26Å
43	R	92.8	Very high	87.9	Confident	21 Å²	21	90.8 Å²	90.8	8%	0.079	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-64.7	139	171.7	-57.1	-170.7	-178.3	-117.7	-7.7	109.4	D24 V45 D112 D115	D24-R43 IonicContact OD1-CZ 3.21Å; D24-R43 IonicContact OD1-NH1 2.92Å; D24-R43 PolarHBondContact OD1-NH1 3.5Å; D24-R43 VanDerWaalsContact OD1-NH1 3.09Å; D24-R43 IonicContact OD1-NH2 2.63Å; D24-R43 PolarHBondContact OD1-NH2 3.47Å; R43-V45 PolarHBondContact O-N 2.78Å; R43-D112 IonicContact CZ-OD1 2.78Å; R43-D112 IonicContact CZ-OD2 3.09Å; R43-D112 IonicContact NE-OD1 2.77Å; R43-D112 PolarHBondContact NE-OD1 3.23Å; R43-D112 IonicContact NE-OD2 2.68Å; R43-D112 IonicContact NH2-OD1 3.45Å; R43-D112 PolarHBondContact NH2-OD1 2.84Å; R43-D112 IonicContact NH2-OD2 3.52Å; R43-D112 PolarHBondContact NH2-OD2 3.49Å; R43-D115 HydrophobicContact CB-CB 4.07Å; R43-D115 HydrophobicContact CG-CB 4.08Å
44	A	90.3	Very high	87.1	Confident	62 Å²	62	87.7 Å²	87.7	51%	0.512	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-68.4	127.1	-179.7	0	0	0	0	0	109.8	F14 K42	F14-A44 HydrophobicContact CD1-CB 4.31Å; F14-A44 HydrophobicContact CE1-CB 4.45Å; K42-A44 PolarHBondContact O-N 2.76Å
45	V	85.9	Confident	86.5	Confident	33 Å²	33	83.4 Å²	83.4	20%	0.2	46%	0.464	C	S	.	.	P	Polyproline II helix	trans	-83.9	134.2	173.4	-178.3	0	0	0	0	108.7	R43 E49 A55	R43-V45 PolarHBondContact O-N 2.78Å; V45-E49 HydrophobicContact CG1-CB 3.73Å; V45-E49 HydrophobicContact CG1-CG 3.73Å; V45-A55 HydrophobicContact CG1-CB 4.22Å; V45-A55 WeakPolarHBondContact CG2-O 3.48Å
46	A	83.6	Confident	86	Confident	59 Å²	59	81.8 Å²	81.8	49%	0.488	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-56.6	146.6	176.3	0	0	0	0	0	110.9	E48 E49 S50	A46-E48 PolarHBondContact O-N 3.27Å; A46-E49 PolarHBondContact O-N 3Å; A46-S50 PolarHBondContact O-N 2.8Å; A46-S50 PolarHBondContact O-OG 3.25Å
47	R	82.9	Confident	85.7	Confident	237 Å²	237	80.6 Å²	80.6	89%	0.894	43%	0.429	S	S	*	.	H	α-helix	trans	-59.9	-35.4	-175.5	-169.7	175.4	-179.7	-168.8	-1.1	112.8	E49 S50	R47-E49 VanDerWaalsContact C-N 3.31Å; R47-S50 WeakPolarHBondContact O-CB 2.98Å; R47-S50 PolarHBondContact O-N 2.8Å
48	E	82.4	Confident	85.5	Confident	185 Å²	185	73.8 Å²	73.8	86%	0.864	41%	0.409	S	S	*	.	H	α-helix	trans	-66.1	-34.8	176.6	-60.6	176.4	-167.5	0	0	112.3	A46	A46-E48 PolarHBondContact O-N 3.27Å
49	E	79.1	Confident	85.5	Confident	47 Å²	47	69.3 Å²	69.3	22%	0.22	38%	0.382	C	S	.	.	H	α-helix	trans	-82.2	-26.7	178.2	-175.7	141.7	-118	0	0	112.5	V45 A46 R47 G51 K52 A55	V45-E49 HydrophobicContact CG1-CB 3.73Å; V45-E49 HydrophobicContact CG1-CG 3.73Å; A46-E49 PolarHBondContact O-N 3Å; R47-E49 VanDerWaalsContact C-N 3.31Å; E49-G51 PolarHBondContact O-N 2.77Å; E49-G51 VanDerWaalsContact O-N 3.07Å; E49-K52 HydrophobicContact CG-CD 4.15Å; E49-K52 VanDerWaalsContact O-CB 3.32Å; E49-K52 WeakPolarHBondContact O-CB 3.17Å; E49-K52 PolarHBondContact O-N 2.86Å; E49-K52 IonicContact OE1-NZ 3.42Å; E49-K52 PolarHBondContact OE1-NZ 3.43Å; E49-A55 HydrophobicContact CG-CB 4.4Å; E49-A55 WeakPolarHBondContact O-CB 3.34Å
50	S	80.4	Confident	85.5	Confident	39 Å²	39	71.9 Å²	71.9	27%	0.273	39%	0.389	S	S	.	.	H	α-helix	trans	-57.1	-26	178.8	-59.7	0	0	0	0	113.6	A46 R47 K52 H56	A46-S50 PolarHBondContact O-N 2.8Å; A46-S50 PolarHBondContact O-OG 3.25Å; R47-S50 WeakPolarHBondContact O-CB 2.98Å; R47-S50 PolarHBondContact O-N 2.8Å; S50-K52 VanDerWaalsContact C-N 3.35Å; S50-H56 VanDerWaalsContact CB-NE2 3.35Å; S50-H56 WeakPolarHBondContact CB-NE2 3.4Å; S50-H56 PolarHBondContact OG-CE1 2.89Å
51	G	78.1	Confident	85.7	Confident	71 Å²	71	68.9 Å²	68.9	73%	0.732	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-11.3	175.5	0	0	0	0	0	114.6	E49	E49-G51 PolarHBondContact O-N 2.77Å; E49-G51 VanDerWaalsContact O-N 3.07Å
52	K	80.3	Confident	85.9	Confident	77 Å²	77	67.3 Å²	67.3	34%	0.335	36%	0.363	S	S	.	.	S	Bend	trans	-77.2	140.5	176.9	-60.8	-178.2	-162.4	159.8	0	109.5	E49 S50 G54 A55	E49-K52 HydrophobicContact CG-CD 4.15Å; E49-K52 VanDerWaalsContact O-CB 3.32Å; E49-K52 WeakPolarHBondContact O-CB 3.17Å; E49-K52 PolarHBondContact O-N 2.86Å; E49-K52 IonicContact OE1-NZ 3.42Å; E49-K52 PolarHBondContact OE1-NZ 3.43Å; S50-K52 VanDerWaalsContact C-N 3.35Å; K52-G54 PolarHBondContact O-N 3.32Å; K52-A55 WeakPolarHBondContact O-CB 3.34Å; K52-A55 PolarHBondContact O-N 3.38Å
53	P	78.1	Confident	86	Confident	59 Å²	59	65.4 Å²	65.4	38%	0.383	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	135.2	172.5	27.1	-32.9	0	0	0	109.4	V144	P53-V144 HydrophobicContact CB-CB 4.46Å; P53-V144 HydrophobicContact CB-CG1 4.42Å; P53-V144 HydrophobicContact CB-CG2 3.25Å; P53-V144 HydrophobicContact CG-CB 4.03Å; P53-V144 HydrophobicContact CG-CG1 3.48Å; P53-V144 VanDerWaalsContact CG-CG1 3.48Å; P53-V144 HydrophobicContact CG-CG2 3.29Å
54	G	78.1	Confident	86.2	Confident	16 Å²	16	64.4 Å²	64.4	17%	0.165	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	91	-8.5	-175.8	0	0	0	0	0	115.9	K52 H56 V57 K134	K52-G54 PolarHBondContact O-N 3.32Å; G54-H56 PolarHBondContact O-N 3.03Å; G54-V57 PolarHBondContact O-N 3.4Å; G54-V57 VanDerWaalsContact O-N 3.14Å; G54-K134 WeakPolarHBondContact O-CD 3.33Å
55	A	80.9	Confident	86.4	Confident	10 Å²	10	61.8 Å²	61.8	8%	0.083	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-46	-170.9	0	0	0	0	0	113.4	V45 E49 K52 K134	V45-A55 HydrophobicContact CG1-CB 4.22Å; V45-A55 WeakPolarHBondContact CG2-O 3.48Å; E49-A55 HydrophobicContact CG-CB 4.4Å; E49-A55 WeakPolarHBondContact O-CB 3.34Å; K52-A55 WeakPolarHBondContact O-CB 3.34Å; K52-A55 PolarHBondContact O-N 3.38Å; A55-K134 PolarHBondContact O-NZ 3.48Å
56	H	81.1	Confident	86.7	Confident	122 Å²	122	62.6 Å²	62.6	57%	0.565	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	6.3	179.7	-60.2	-64.5	0	0	0	113.9	S50 G54	S50-H56 VanDerWaalsContact CB-NE2 3.35Å; S50-H56 WeakPolarHBondContact CB-NE2 3.4Å; S50-H56 PolarHBondContact OG-CE1 2.89Å; G54-H56 PolarHBondContact O-N 3.03Å
57	V	86.8	Confident	87.2	Confident	48 Å²	48	60.1 Å²	60.1	29%	0.291	32%	0.324	S	S	.	.			trans	-75	137.5	179.1	-172.3	0	0	0	0	108.6	G54 V59 K134	G54-V57 PolarHBondContact O-N 3.4Å; G54-V57 VanDerWaalsContact O-N 3.14Å; V57-V59 HydrophobicContact CB-CG1 4.27Å; V57-V59 HydrophobicContact CG1-CG1 3.54Å; V57-K134 WeakPolarHBondContact O-CD 3.47Å; V57-K134 PolarHBondContact O-NZ 3.18Å
58	T	89.4	Confident	87.6	Confident	49 Å²	49	54.8 Å²	54.8	30%	0.301	31%	0.307	S	S	.	.			trans	-92.9	105	175.3	-61.3	0	0	0	0	108	K42 H111	K42-T58 WeakPolarHBondContact CE-OG1 3.47Å; K42-T58 PolarHBondContact NZ-OG1 3.26Å; T58-H111 HydrophobicContact CG2-CB 3.55Å; T58-H111 VanDerWaalsContact CG2-CG 3.4Å
59	V	93.1	Very high	88	Confident	23 Å²	23	51.6 Å²	51.6	14%	0.139	29%	0.292	C	S	.	.			trans	-127.7	144.9	-178.9	-58.7	0	0	0	0	109.5	V57 K61 V114 K134	V57-V59 HydrophobicContact CB-CG1 4.27Å; V57-V59 HydrophobicContact CG1-CG1 3.54Å; V59-K61 WeakPolarHBondContact CG2-O 3.43Å; V59-V114 HydrophobicContact CG2-CG1 4.08Å; V59-K134 HydrophobicContact CG2-CB 3.75Å; V59-K134 HydrophobicContact CG2-CD 4.33Å; V59-K134 HydrophobicContact CG2-CG 4.06Å
60	K	95.5	Very high	88.6	Confident	107 Å²	107	53.1 Å²	53.1	47%	0.465	30%	0.302	S	S	.	.	S	Bend	trans	-91.7	-7.9	171.4	-56.4	-172.1	177.9	-167.9	0	112.8	T107 F108 D109	K60-T107 WeakPolarHBondContact O-CA 3.34Å; K60-F108 WeakPolarHBondContact CB-O 3.37Å; K60-F108 PolarHBondContact O-N 2.87Å; K60-D109 WeakPolarHBondContact CD-O 3.38Å; K60-D109 WeakPolarHBondContact CE-O 3.32Å; K60-D109 PolarHBondContact NZ-O 3.36Å
61	K	95.7	Very high	89.2	Confident	62 Å²	62	51.2 Å²	51.2	27%	0.27	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	125.9	-177.9	-166.4	166	-173.4	159.2	0	109.9	V59 E90 F105 V106 A135	V59-K61 WeakPolarHBondContact CG2-O 3.43Å; K61-E90 IonicContact NZ-OE1 3.33Å; K61-E90 PolarHBondContact NZ-OE1 3.21Å; K61-E90 IonicContact NZ-OE2 3.37Å; K61-E90 PolarHBondContact NZ-OE2 3.11Å; K61-F105 HydrophobicContact CD-CB 4.28Å; K61-F105 HydrophobicContact CD-CD1 4.32Å; K61-F105 HydrophobicContact CD-CG 4.45Å; K61-F105 HydrophobicContact CG-CB 4.11Å; K61-F105 HydrophobicContact CG-CD1 4.16Å; K61-F105 HydrophobicContact CG-CG 4.49Å; K61-V106 CarbonylContact C-O 3.48Å; K61-V106 WeakPolarHBondContact CA-O 3.48Å; K61-A135 HydrophobicContact CB-CB 3.86Å; K61-A135 HydrophobicContact CD-CB 4.41Å; K61-A135 HydrophobicContact CG-CB 3.73Å; K61-A135 WeakPolarHBondContact O-CB 3.26Å; K61-A135 PolarHBondContact O-N 3.49Å
62	L	96.4	Very high	90	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	134.3	176.5	-173.7	75.8	0	0	0	109	V64 F80 F105 V106 F108 V114 I117 V118 V132	L62-V64 HydrophobicContact CD2-CG2 3.84Å; L62-V64 HydrophobicContact CG-CG2 4.19Å; L62-F80 HydrophobicContact CD2-CD1 4.22Å; L62-F80 HydrophobicContact CD2-CE1 3.7Å; L62-F80 HydrophobicContact CD2-CE2 4.41Å; L62-F80 HydrophobicContact CD2-CZ 3.81Å; L62-F105 CarbonylContact O-C 3.6Å; L62-F105 WeakPolarHBondContact O-CA 3.49Å; L62-V106 HydrophobicContact CB-CB 4.39Å; L62-V106 PolarHBondContact N-O 3.26Å; L62-V106 PolarHBondContact O-N 3.34Å; L62-F108 HydrophobicContact CB-CE2 4.21Å; L62-F108 HydrophobicContact CD2-CE2 4.32Å; L62-V114 HydrophobicContact CB-CG2 4.37Å; L62-V114 HydrophobicContact CD1-CG1 3.95Å; L62-I117 HydrophobicContact CD1-CB 4.44Å; L62-I117 HydrophobicContact CD1-CG2 3.97Å; L62-I117 HydrophobicContact CD2-CD1 4Å; L62-I117 HydrophobicContact CD2-CG2 3.76Å; L62-V118 HydrophobicContact CD1-CG1 3.71Å; L62-V132 HydrophobicContact CD1-CB 4.24Å; L62-V132 HydrophobicContact CD2-CB 4.49Å; L62-V132 HydrophobicContact CD2-CG1 4.37Å
63	F	95.8	Very high	90.6	Very high	47 Å²	47	53.1 Å²	53.1	21%	0.206	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	132.6	166.1	169.3	-90.5	0	0	0	109	F103 F105 V132 R133 A135	F63-F103 HydrophobicContact CD2-CD2 4.26Å; F63-F103 HydrophobicContact CE2-CB 3.83Å; F63-F103 AromaticContact CE2-CD2 3.61Å; F63-F103 HydrophobicContact CE2-CD2 3.61Å; F63-F103 HydrophobicContact CE2-CE2 4.4Å; F63-F103 AromaticContact CE2-CG 3.91Å; F63-F103 HydrophobicContact CE2-CG 3.91Å; F63-F103 HydrophobicContact CZ-CB 3.97Å; F63-F103 HydrophobicContact CZ-CG 4.4Å; F63-F105 HydrophobicContact CB-CD1 4.19Å; F63-F105 HydrophobicContact CB-CE1 4.03Å; F63-F105 HydrophobicContact CD2-CD1 4.4Å; F63-F105 AromaticContact CD2-CE1 3.75Å; F63-F105 HydrophobicContact CD2-CE1 3.75Å; F63-F105 HydrophobicContact CD2-CZ 4.02Å; F63-F105 HydrophobicContact CG-CE1 4.4Å; F63-V132 VanDerWaalsContact O-CA 3.31Å; F63-V132 WeakPolarHBondContact O-CA 3.17Å; F63-R133 WeakPolarHBondContact CB-O 3.48Å; F63-R133 HydrophobicContact CD1-CB 4.25Å; F63-R133 PolarHBondContact N-O 2.84Å; F63-R133 PolarHBondContact O-N 2.88Å; F63-A135 HydrophobicContact CB-CB 4.38Å
64	V	96.3	Very high	91.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	109.1	176.9	-173	0	0	0	0	107.9	L62 I67 L76 F80 F103 G104 V106 I125 A130 V132	L62-V64 HydrophobicContact CD2-CG2 3.84Å; L62-V64 HydrophobicContact CG-CG2 4.19Å; V64-I67 HydrophobicContact CG1-CG2 3.98Å; V64-L76 HydrophobicContact CG1-CD2 4.11Å; V64-F80 HydrophobicContact CG1-CE2 4.3Å; V64-F80 HydrophobicContact CG1-CZ 4.38Å; V64-F80 HydrophobicContact CG2-CE2 3.7Å; V64-F80 HydrophobicContact CG2-CZ 3.82Å; V64-F103 CarbonylContact O-C 3.57Å; V64-F103 WeakPolarHBondContact O-CA 3.47Å; V64-F103 WeakPolarHBondContact O-CB 3.3Å; V64-G104 PolarHBondContact N-O 2.76Å; V64-G104 PolarHBondContact O-N 3.18Å; V64-V106 HydrophobicContact CG2-CG2 4.12Å; V64-I125 HydrophobicContact CG1-CD1 4.21Å; V64-A130 HydrophobicContact CG1-CB 3.98Å; V64-V132 HydrophobicContact CG2-CG1 4.44Å
65	G	95.3	Very high	92.3	Very high	6 Å²	6	55.8 Å²	55.8	6%	0.062	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	165	179.4	0	0	0	0	0	112.6	I67 A130 E131	G65-I67 VanDerWaalsContact C-N 3.29Å; G65-A130 CarbonylContact O-C 3.5Å; G65-A130 WeakPolarHBondContact O-CA 3.43Å; G65-A130 WeakPolarHBondContact O-CB 3.24Å; G65-E131 PolarHBondContact N-O 3.05Å; G65-E131 PolarHBondContact O-N 2.97Å
66	G	92.8	Very high	93	Very high	50 Å²	50	55.3 Å²	55.3	52%	0.515	28%	0.279	S	S	.	.	S	Bend	trans	78.8	14.3	178.2	0	0	0	0	0	114	G102	G66-G102 PolarHBondContact N-O 3.35Å
67	I	93.8	Very high	93.7	Very high	7 Å²	7	53.7 Å²	53.7	4%	0.036	27%	0.267	C	S	.	.			trans	-81.7	146.8	170	59.2	174.3	0	0	0	109.3	V64 G65 T71 L76 G102 A130	V64-I67 HydrophobicContact CG1-CG2 3.98Å; G65-I67 VanDerWaalsContact C-N 3.29Å; I67-T71 HydrophobicContact CB-CG2 3.99Å; I67-T71 HydrophobicContact CD1-CG2 4.28Å; I67-T71 HydrophobicContact CG2-CG2 4.12Å; I67-L76 HydrophobicContact CD1-CD1 4.5Å; I67-G102 VanDerWaalsContact CG1-C 3.5Å; I67-G102 WeakPolarHBondContact CG1-O 3.33Å; I67-G102 PolarHBondContact N-O 2.82Å; I67-G102 CarbonylContact O-C 3.4Å; I67-G102 WeakPolarHBondContact O-CA 3.4Å; I67-A130 HydrophobicContact CG2-CB 3.94Å
68	K	91.5	Very high	94.1	Very high	126 Å²	126	56 Å²	56	55%	0.548	28%	0.279	S	S	.	.			trans	-91.7	175.8	178.4	-70.1	-165.2	-163.6	166.4	0	111.8	D70 T71 H128	K68-D70 VanDerWaalsContact CB-OD1 3.24Å; K68-D70 WeakPolarHBondContact CB-OD1 3.38Å; K68-D70 PolarHBondContact O-N 3.36Å; K68-T71 WeakPolarHBondContact O-CB 3.45Å; K68-T71 PolarHBondContact O-N 3.46Å; K68-T71 PolarHBondContact O-OG1 2.74Å; K68-H128 WeakPolarHBondContact CD-CE1 3.31Å; K68-H128 VanDerWaalsContact CE-ND1 3.3Å; K68-H128 WeakPolarHBondContact CE-ND1 3.33Å
69	E	90.1	Very high	94.4	Very high	117 Å²	117	56 Å²	56	55%	0.547	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-19.7	179.9	-60.9	-174	174.7	0	0	113.4	T71 K100	E69-T71 VanDerWaalsContact C-N 3.28Å; E69-T71 PolarHBondContact O-N 2.78Å; E69-K100 HydrophobicContact CG-CB 4.33Å; E69-K100 VanDerWaalsContact O-CD 3.28Å; E69-K100 WeakPolarHBondContact O-CD 3.34Å; E69-K100 WeakPolarHBondContact O-CE 3.48Å; E69-K100 PolarHBondContact O-NZ 2.97Å
70	D	91.6	Very high	94.6	Very high	79 Å²	79	55 Å²	55	42%	0.422	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-14.7	173.9	60	4.5	0	0	0	113.3	K68 H128	K68-D70 VanDerWaalsContact CB-OD1 3.24Å; K68-D70 WeakPolarHBondContact CB-OD1 3.38Å; K68-D70 PolarHBondContact O-N 3.36Å; D70-H128 VanDerWaalsContact CG-NE2 3.26Å; D70-H128 IonicContact OD1-CD2 3.44Å; D70-H128 PolarHBondContact OD1-CD2 3.36Å; D70-H128 IonicContact OD1-NE2 2.74Å; D70-H128 PolarHBondContact OD1-NE2 3.42Å; D70-H128 IonicContact OD2-CD2 2.78Å; D70-H128 IonicContact OD2-CE1 2.84Å; D70-H128 PolarHBondContact OD2-CE1 2.92Å; D70-H128 IonicContact OD2-NE2 3.7Å; D70-H128 PolarHBondContact OD2-NE2 3.38Å
71	T	92.9	Very high	94.6	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.268	C	S	.	.			trans	-82.6	124.7	-176	-53.6	0	0	0	0	109.6	I67 K68 E69 H75 L76 K100	I67-T71 HydrophobicContact CB-CG2 3.99Å; I67-T71 HydrophobicContact CD1-CG2 4.28Å; I67-T71 HydrophobicContact CG2-CG2 4.12Å; K68-T71 WeakPolarHBondContact O-CB 3.45Å; K68-T71 PolarHBondContact O-N 3.46Å; K68-T71 PolarHBondContact O-OG1 2.74Å; E69-T71 VanDerWaalsContact C-N 3.28Å; E69-T71 PolarHBondContact O-N 2.78Å; T71-H75 HydrophobicContact CG2-CB 4.23Å; T71-L76 HydrophobicContact CG2-CD2 4.37Å; T71-L76 HydrophobicContact CG2-CG 4.39Å; T71-K100 PolarHBondContact O-NZ 3.46Å
72	E	93.8	Very high	94.5	Very high	96 Å²	96	58.3 Å²	58.3	45%	0.449	29%	0.285	S	S	.	.			trans	-115.2	172.6	-178.4	-60.6	-165.3	160.3	0	0	112.1	H74 H75 L76	E72-H74 VanDerWaalsContact C-N 3.3Å; E72-H74 PolarHBondContact O-N 2.94Å; E72-H74 IonicContact OE2-CE1 3.65Å; E72-H74 PolarHBondContact OE2-CE1 3.44Å; E72-H74 IonicContact OE2-ND1 3.24Å; E72-H74 PolarHBondContact OE2-ND1 3.34Å; E72-H75 PolarHBondContact N-ND1 2.92Å; E72-H75 PolarHBondContact O-N 3.25Å; E72-L76 PolarHBondContact O-N 2.8Å
73	E	94.3	Very high	94.4	Very high	92 Å²	92	60.6 Å²	60.6	43%	0.43	29%	0.294	S	S	.	.	H	α-helix	trans	-56.2	-43.4	-179.1	174.5	171.5	170.2	0	0	112.2	H75 L76 R77 I89	E73-H75 VanDerWaalsContact C-N 3.33Å; E73-H75 PolarHBondContact O-N 2.68Å; E73-L76 PolarHBondContact O-N 3.09Å; E73-L76 VanDerWaalsContact O-N 3.13Å; E73-R77 PolarHBondContact O-N 3.02Å; E73-R77 IonicContact OE1-NH2 3.11Å; E73-R77 PolarHBondContact OE1-NH2 3.06Å; E73-I89 HydrophobicContact CB-CG2 4.36Å; E73-I89 HydrophobicContact CG-CB 3.78Å; E73-I89 HydrophobicContact CG-CD1 3.75Å; E73-I89 HydrophobicContact CG-CG1 4.31Å; E73-I89 HydrophobicContact CG-CG2 3.88Å
74	H	95.6	Very high	94.3	Very high	85 Å²	85	59.3 Å²	59.3	39%	0.394	29%	0.294	S	S	.	.	H	α-helix	trans	-61.7	-40.6	-178.4	68.1	-94.5	0	0	0	111.9	E72 L76 R77 D78	E72-H74 VanDerWaalsContact C-N 3.3Å; E72-H74 PolarHBondContact O-N 2.94Å; E72-H74 IonicContact OE2-CE1 3.65Å; E72-H74 PolarHBondContact OE2-CE1 3.44Å; E72-H74 IonicContact OE2-ND1 3.24Å; E72-H74 PolarHBondContact OE2-ND1 3.34Å; H74-L76 VanDerWaalsContact C-N 3.27Å; H74-L76 PolarHBondContact O-N 3.37Å; H74-R77 WeakPolarHBondContact O-CB 3.4Å; H74-R77 PolarHBondContact O-N 2.74Å; H74-D78 WeakPolarHBondContact O-CB 3.49Å; H74-D78 PolarHBondContact O-N 2.99Å
75	H	95.2	Very high	94.3	Very high	46 Å²	46	65.9 Å²	65.9	21%	0.213	32%	0.323	C	S	.	.	H	α-helix	trans	-59.7	-37.4	175.8	-58	100	0	0	0	112.8	T71 E72 E73 Y79 I125 N126	T71-H75 HydrophobicContact CG2-CB 4.23Å; E72-H75 PolarHBondContact N-ND1 2.92Å; E72-H75 PolarHBondContact O-N 3.25Å; E73-H75 VanDerWaalsContact C-N 3.33Å; E73-H75 PolarHBondContact O-N 2.68Å; H75-Y79 WeakPolarHBondContact O-CB 3.29Å; H75-Y79 PolarHBondContact O-N 3.22Å; H75-I125 HydrophobicContact CB-CG2 4.48Å; H75-N126 HydrophobicContact CB-CB 4.37Å; H75-N126 PolarHBondContact NE2-OD1 2.9Å
76	L	95.5	Very high	94.4	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-73.5	-39.6	175.3	-64	174.6	0	0	0	110.7	V64 I67 T71 E72 E73 H74 F80 I89 I91 I125	V64-L76 HydrophobicContact CG1-CD2 4.11Å; I67-L76 HydrophobicContact CD1-CD1 4.5Å; T71-L76 HydrophobicContact CG2-CD2 4.37Å; T71-L76 HydrophobicContact CG2-CG 4.39Å; E72-L76 PolarHBondContact O-N 2.8Å; E73-L76 PolarHBondContact O-N 3.09Å; E73-L76 VanDerWaalsContact O-N 3.13Å; H74-L76 VanDerWaalsContact C-N 3.27Å; H74-L76 PolarHBondContact O-N 3.37Å; L76-F80 HydrophobicContact CB-CD2 4.24Å; L76-F80 HydrophobicContact CD2-CD2 4.37Å; L76-F80 HydrophobicContact CD2-CE2 3.9Å; L76-F80 VanDerWaalsContact O-CB 3.27Å; L76-F80 WeakPolarHBondContact O-CB 3.46Å; L76-F80 WeakPolarHBondContact O-CD2 3.17Å; L76-F80 PolarHBondContact O-N 2.93Å; L76-I89 HydrophobicContact CB-CD1 4.34Å; L76-I89 HydrophobicContact CB-CG2 4.23Å; L76-I89 HydrophobicContact CD1-CG2 3.76Å; L76-I91 HydrophobicContact CD1-CD1 4.04Å; L76-I91 HydrophobicContact CD1-CG1 3.89Å; L76-I125 HydrophobicContact CD2-CD1 4.08Å; L76-I125 HydrophobicContact CD2-CG2 4.14Å
77	R	96.3	Very high	94.6	Very high	87 Å²	87	68.1 Å²	68.1	33%	0.328	32%	0.321	S	S	.	.	H	α-helix	trans	-61.4	-55.8	178.2	-176.3	174.1	-72.4	-86.9	-0.5	111.1	E73 H74 Y79 F80 E81 I86 I89	E73-R77 PolarHBondContact O-N 3.02Å; E73-R77 IonicContact OE1-NH2 3.11Å; E73-R77 PolarHBondContact OE1-NH2 3.06Å; H74-R77 WeakPolarHBondContact O-CB 3.4Å; H74-R77 PolarHBondContact O-N 2.74Å; R77-Y79 PolarHBondContact O-N 3.44Å; R77-F80 PolarHBondContact O-N 3.33Å; R77-E81 WeakPolarHBondContact O-CB 3.16Å; R77-E81 VanDerWaalsContact O-CG 3.24Å; R77-E81 WeakPolarHBondContact O-CG 3.42Å; R77-E81 PolarHBondContact O-N 3.41Å; R77-I86 HydrophobicContact CG-CD1 4.33Å; R77-I89 HydrophobicContact CB-CD1 3.65Å; R77-I89 HydrophobicContact CG-CD1 4.41Å
78	D	95.9	Very high	94.6	Very high	98 Å²	98	70.7 Å²	70.7	52%	0.524	34%	0.337	S	S	.	.	H	α-helix	trans	-58.1	-34.5	-177.9	-59.7	-9.6	0	0	0	111.5	H74	H74-D78 WeakPolarHBondContact O-CB 3.49Å; H74-D78 PolarHBondContact O-N 2.99Å
79	Y	95.9	Very high	94.9	Very high	49 Å²	49	65.6 Å²	65.6	19%	0.192	32%	0.316	C	S	.	.	H	α-helix	trans	-78.6	-44.7	177.3	-172.6	-101.5	0	0	0	113.2	H75 R77 E82 Y83 H123 I125	H75-Y79 WeakPolarHBondContact O-CB 3.29Å; H75-Y79 PolarHBondContact O-N 3.22Å; R77-Y79 PolarHBondContact O-N 3.44Å; Y79-E82 WeakPolarHBondContact O-CG 3.4Å; Y79-Y83 HydrophobicContact CE1-CE2 4.13Å; Y79-H123 HydrophobicContact CE1-CB 3.77Å; Y79-H123 AromaticContact CE1-CG 3.88Å; Y79-H123 AromaticContact CE1-ND1 3.45Å; Y79-H123 WeakPolarHBondContact CE1-ND1 3.48Å; Y79-H123 AromaticContact CZ-ND1 3.53Å; Y79-H123 PolarHBondContact OH-ND1 3.41Å; Y79-I125 HydrophobicContact CD1-CD1 3.66Å; Y79-I125 HydrophobicContact CD1-CG1 3.68Å; Y79-I125 HydrophobicContact CD2-CG1 4.38Å; Y79-I125 HydrophobicContact CE1-CD1 4.07Å; Y79-I125 HydrophobicContact CE1-CG1 3.98Å; Y79-I125 HydrophobicContact CG-CD1 4.27Å; Y79-I125 HydrophobicContact CG-CG1 3.91Å
80	F	96.4	Very high	95.1	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-89.2	-17.4	-171.1	-75.4	-57.8	0	0	0	114.2	L62 V64 L76 R77 E82 Y83 I86 V106 F108 I117 I125 V132	L62-F80 HydrophobicContact CD2-CD1 4.22Å; L62-F80 HydrophobicContact CD2-CE1 3.7Å; L62-F80 HydrophobicContact CD2-CE2 4.41Å; L62-F80 HydrophobicContact CD2-CZ 3.81Å; V64-F80 HydrophobicContact CG1-CE2 4.3Å; V64-F80 HydrophobicContact CG1-CZ 4.38Å; V64-F80 HydrophobicContact CG2-CE2 3.7Å; V64-F80 HydrophobicContact CG2-CZ 3.82Å; L76-F80 HydrophobicContact CB-CD2 4.24Å; L76-F80 HydrophobicContact CD2-CD2 4.37Å; L76-F80 HydrophobicContact CD2-CE2 3.9Å; L76-F80 VanDerWaalsContact O-CB 3.27Å; L76-F80 WeakPolarHBondContact O-CB 3.46Å; L76-F80 WeakPolarHBondContact O-CD2 3.17Å; L76-F80 PolarHBondContact O-N 2.93Å; R77-F80 PolarHBondContact O-N 3.33Å; F80-E82 PolarHBondContact O-N 2.84Å; F80-Y83 HydrophobicContact CD1-CD2 4.22Å; F80-Y83 HydrophobicContact CD1-CE2 4.44Å; F80-Y83 PolarHBondContact O-N 2.97Å; F80-Y83 VanDerWaalsContact O-N 3.1Å; F80-I86 HydrophobicContact CB-CD1 3.78Å; F80-V106 HydrophobicContact CB-CG1 4.45Å; F80-V106 HydrophobicContact CD2-CG2 3.81Å; F80-V106 HydrophobicContact CE2-CG2 4.12Å; F80-F108 HydrophobicContact CB-CE1 4.3Å; F80-F108 HydrophobicContact CB-CZ 3.86Å; F80-F108 HydrophobicContact CD1-CZ 4.36Å; F80-F108 HydrophobicContact CG-CZ 4.29Å; F80-I117 HydrophobicContact CD1-CD1 3.59Å; F80-I117 HydrophobicContact CD1-CG1 4.28Å; F80-I117 HydrophobicContact CE1-CD1 3.97Å; F80-I117 HydrophobicContact CE1-CG1 4.37Å; F80-I117 HydrophobicContact CE1-CG2 3.91Å; F80-I125 HydrophobicContact CE2-CD1 3.57Å; F80-I125 HydrophobicContact CZ-CD1 3.56Å; F80-V132 HydrophobicContact CE1-CG1 4.44Å; F80-V132 HydrophobicContact CZ-CG1 4.05Å
81	E	95.6	Very high	95.2	Very high	107 Å²	107	62 Å²	62	50%	0.5	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.5	-179.8	69.6	-178.9	177.9	0	0	112.9	R77 Y83 G84 I86	R77-E81 WeakPolarHBondContact O-CB 3.16Å; R77-E81 VanDerWaalsContact O-CG 3.24Å; R77-E81 WeakPolarHBondContact O-CG 3.42Å; R77-E81 PolarHBondContact O-N 3.41Å; E81-Y83 PolarHBondContact O-N 3.03Å; E81-G84 PolarHBondContact O-N 3.4Å; E81-I86 HydrophobicContact CB-CD1 4.21Å
82	E	93.7	Very high	95.3	Very high	133 Å²	133	64 Å²	64	62%	0.621	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-24	174.8	77	-180	166.4	0	0	112.9	Y79 F80	Y79-E82 WeakPolarHBondContact O-CG 3.4Å; F80-E82 PolarHBondContact O-N 2.84Å
83	Y	94.3	Very high	95.3	Very high	47 Å²	47	62.9 Å²	62.9	18%	0.184	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-24.9	-178.8	-66.5	-90.7	0	0	0	112.7	Y79 F80 E81 K116 I117	Y79-Y83 HydrophobicContact CE1-CE2 4.13Å; F80-Y83 HydrophobicContact CD1-CD2 4.22Å; F80-Y83 HydrophobicContact CD1-CE2 4.44Å; F80-Y83 PolarHBondContact O-N 2.97Å; F80-Y83 VanDerWaalsContact O-N 3.1Å; E81-Y83 PolarHBondContact O-N 3.03Å; Y83-K116 HydrophobicContact CD1-CB 4.49Å; Y83-K116 HydrophobicContact CD1-CD 3.94Å; Y83-K116 HydrophobicContact CD1-CG 4.01Å; Y83-K116 HydrophobicContact CE1-CG 4.39Å; Y83-I117 HydrophobicContact CD1-CD1 4.29Å; Y83-I117 HydrophobicContact CD1-CG1 3.47Å; Y83-I117 VanDerWaalsContact CD1-CG1 3.47Å; Y83-I117 HydrophobicContact CD2-CD1 4.15Å; Y83-I117 HydrophobicContact CD2-CG1 3.94Å; Y83-I117 HydrophobicContact CE1-CG1 3.85Å; Y83-I117 HydrophobicContact CE2-CG1 4.27Å; Y83-I117 HydrophobicContact CG-CD1 3.86Å; Y83-I117 HydrophobicContact CG-CG1 3.52Å
84	G	93.8	Very high	95.1	Very high	20 Å²	20	61.2 Å²	61.2	21%	0.206	30%	0.302	C	S	.	.	S	Bend	trans	165.3	174.8	-177.4	0	0	0	0	0	112.8	E81 I86	E81-G84 PolarHBondContact O-N 3.4Å; G84-I86 PolarHBondContact O-N 3.37Å
85	K	96.1	Very high	94.8	Very high	139 Å²	139	69.1 Å²	69.1	60%	0.604	33%	0.328	S	S	*	.			trans	-73.1	123.6	-177.3	-178.3	-175	175.5	-167.7	0	110.8	F108 D109	K85-F108 WeakPolarHBondContact O-CA 3.42Å; K85-D109 HydrophobicContact CB-CB 4.47Å; K85-D109 HydrophobicContact CD-CB 4.43Å; K85-D109 PolarHBondContact O-N 3.35Å
86	I	97.2	Very high	94.5	Very high	16 Å²	16	76.1 Å²	76.1	8%	0.082	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	125.9	177.9	-58.8	171.4	0	0	0	109.8	R77 F80 E81 G84 I89 V106 F108	R77-I86 HydrophobicContact CG-CD1 4.33Å; F80-I86 HydrophobicContact CB-CD1 3.78Å; E81-I86 HydrophobicContact CB-CD1 4.21Å; G84-I86 PolarHBondContact O-N 3.37Å; I86-I89 HydrophobicContact CD1-CD1 4.28Å; I86-I89 HydrophobicContact CG2-CD1 4.02Å; I86-I89 HydrophobicContact CG2-CG1 3.63Å; I86-V106 HydrophobicContact CD1-CG1 4.25Å; I86-V106 HydrophobicContact CG1-CG1 4.13Å; I86-V106 HydrophobicContact CG2-CG1 3.91Å; I86-F108 HydrophobicContact CG1-CD1 4.03Å; I86-F108 HydrophobicContact CG1-CE1 3.73Å; I86-F108 HydrophobicContact CG1-CZ 4.45Å
87	D	96.4	Very high	94.3	Very high	86 Å²	86	79.4 Å²	79.4	46%	0.46	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-53	172.6	-80.7	-14	0	0	0	111	T107 D109	D87-T107 PolarHBondContact N-O 3.1Å; D87-D109 WeakPolarHBondContact OD2-CA 3.45Å
88	T	95.4	Very high	93.9	Very high	62 Å²	62	77.7 Å²	77.7	38%	0.38	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	149.4	-177.2	66.8	0	0	0	0	112.6	T107	T88-T107 PolarHBondContact N-O 3.07Å; T88-T107 PolarHBondContact O-N 2.73Å; T88-T107 VanDerWaalsContact OG1-CB 3.26Å; T88-T107 WeakPolarHBondContact OG1-CB 3.13Å; T88-T107 PolarHBondContact OG1-OG1 3.29Å
89	I	96.2	Very high	93.6	Very high	18 Å²	18	79.1 Å²	79.1	9%	0.092	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.2	172.5	-58.9	173	0	0	0	108	E73 L76 R77 I86 F105 V106	E73-I89 HydrophobicContact CB-CG2 4.36Å; E73-I89 HydrophobicContact CG-CB 3.78Å; E73-I89 HydrophobicContact CG-CD1 3.75Å; E73-I89 HydrophobicContact CG-CG1 4.31Å; E73-I89 HydrophobicContact CG-CG2 3.88Å; L76-I89 HydrophobicContact CB-CD1 4.34Å; L76-I89 HydrophobicContact CB-CG2 4.23Å; L76-I89 HydrophobicContact CD1-CG2 3.76Å; R77-I89 HydrophobicContact CB-CD1 3.65Å; R77-I89 HydrophobicContact CG-CD1 4.41Å; I86-I89 HydrophobicContact CD1-CD1 4.28Å; I86-I89 HydrophobicContact CG2-CD1 4.02Å; I86-I89 HydrophobicContact CG2-CG1 3.63Å; I89-F105 WeakPolarHBondContact CA-O 3.06Å; I89-V106 HydrophobicContact CG1-CG1 4.36Å; I89-V106 HydrophobicContact CG1-CG2 4.48Å
90	E	95	Very high	93.4	Very high	81 Å²	81	79.2 Å²	79.2	38%	0.379	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	102.7	-178.3	-70.2	171.3	-161.4	0	0	109.6	K61 I92 G104 F105	K61-E90 IonicContact NZ-OE1 3.33Å; K61-E90 PolarHBondContact NZ-OE1 3.21Å; K61-E90 IonicContact NZ-OE2 3.37Å; K61-E90 PolarHBondContact NZ-OE2 3.11Å; E90-I92 HydrophobicContact CB-CD1 4.43Å; E90-G104 CarbonylContact O-C 3.56Å; E90-G104 WeakPolarHBondContact O-CA 3.5Å; E90-F105 HydrophobicContact CB-CB 4.44Å; E90-F105 PolarHBondContact N-O 3.06Å; E90-F105 PolarHBondContact O-N 2.92Å
91	I	94.8	Very high	93.2	Very high	40 Å²	40	86.5 Å²	86.5	21%	0.205	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.3	170.6	-61.7	179.4	0	0	0	108.6	L76 T93 K100	L76-I91 HydrophobicContact CD1-CD1 4.04Å; L76-I91 HydrophobicContact CD1-CG1 3.89Å; I91-T93 PolarHBondContact O-N 2.86Å; I91-K100 HydrophobicContact CG2-CB 4.47Å; I91-K100 HydrophobicContact CG2-CD 4.01Å; I91-K100 HydrophobicContact CG2-CG 4.07Å
92	I	93.4	Very high	93.1	Very high	43 Å²	43	82.3 Å²	82.3	22%	0.221	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	120.5	-174.8	-53.5	-54.2	0	0	0	109.8	E90 R101 F103 F105	E90-I92 HydrophobicContact CB-CD1 4.43Å; I92-R101 HydrophobicContact CG2-CG 4.49Å; I92-R101 WeakPolarHBondContact O-CB 3.46Å; I92-R101 PolarHBondContact O-N 3.44Å; I92-F103 HydrophobicContact CB-CD2 4.18Å; I92-F103 HydrophobicContact CB-CE1 4.4Å; I92-F103 HydrophobicContact CB-CE2 3.73Å; I92-F103 HydrophobicContact CB-CZ 3.84Å; I92-F103 HydrophobicContact CG1-CD2 3.91Å; I92-F103 HydrophobicContact CG1-CE2 3.48Å; I92-F103 VanDerWaalsContact CG1-CE2 3.48Å; I92-F103 HydrophobicContact CG1-CZ 4.08Å; I92-F103 HydrophobicContact CG2-CE1 4.43Å; I92-F103 HydrophobicContact CG2-CE2 4.09Å; I92-F103 HydrophobicContact CG2-CZ 3.78Å; I92-F103 PolarHBondContact N-O 2.82Å; I92-F105 HydrophobicContact CD1-CD2 4Å; I92-F105 HydrophobicContact CD1-CE2 4.1Å; I92-F105 HydrophobicContact CG1-CD2 3.96Å; I92-F105 HydrophobicContact CG1-CE2 3.83Å
93	T	93.6	Very high	93.1	Very high	72 Å²	72	77.8 Å²	77.8	44%	0.442	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	155.1	171.6	55.3	0	0	0	0	111.2	I91 K99 K100	I91-T93 PolarHBondContact O-N 2.86Å; T93-K99 CarbonylContact C-O 3.58Å; T93-K99 VanDerWaalsContact CA-O 3.28Å; T93-K99 WeakPolarHBondContact CA-O 3.31Å; T93-K100 HydrophobicContact CG2-CG 3.92Å
94	D	90.8	Very high	93.2	Very high	57 Å²	57	75.6 Å²	75.6	31%	0.305	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-72.9	127.6	169.7	179.5	-84.9	0	0	0	109.3	Q96 S97 G98 K99 R101	D94-Q96 VanDerWaalsContact C-N 3.26Å; D94-Q96 PolarHBondContact O-N 2.72Å; D94-Q96 PolarHBondContact OD1-N 3.42Å; D94-S97 WeakPolarHBondContact CB-OG 3.37Å; D94-S97 PolarHBondContact OD1-N 2.63Å; D94-S97 PolarHBondContact OD1-OG 2.92Å; D94-G98 VanDerWaalsContact O-CA 3.22Å; D94-G98 WeakPolarHBondContact O-CA 3.18Å; D94-G98 PolarHBondContact O-N 3.25Å; D94-K99 PolarHBondContact N-O 3.23Å; D94-R101 HydrophobicContact CB-CG 4.2Å
95	R	89.3	Confident	93.3	Very high	250 Å²	250	76.1 Å²	76.1	94%	0.943	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-23.7	-172.5	-171.4	175.8	178.5	-171.2	0.3	113.2
96	Q	90.1	Very high	93.4	Very high	193 Å²	193	69.5 Å²	69.5	90%	0.902	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-44.6	-177	-63.3	-178.6	-2.6	0	0	111.3	D94	D94-Q96 VanDerWaalsContact C-N 3.26Å; D94-Q96 PolarHBondContact O-N 2.72Å; D94-Q96 PolarHBondContact OD1-N 3.42Å
97	S	89.8	Confident	93.4	Very high	69 Å²	69	70 Å²	70	48%	0.483	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-14.9	-175.2	62.4	0	0	0	0	114.1	D94 K99	D94-S97 WeakPolarHBondContact CB-OG 3.37Å; D94-S97 PolarHBondContact OD1-N 2.63Å; D94-S97 PolarHBondContact OD1-OG 2.92Å; S97-K99 PolarHBondContact O-N 2.97Å; S97-K99 VanDerWaalsContact O-N 3.14Å; S97-K99 PolarHBondContact OG-N 2.99Å
98	G	88.6	Confident	93.4	Very high	52 Å²	52	66 Å²	66	54%	0.536	33%	0.329	S	S	.	.			trans	70.6	-3.3	-173.4	0	0	0	0	0	114.3	D94	D94-G98 VanDerWaalsContact O-CA 3.22Å; D94-G98 WeakPolarHBondContact O-CA 3.18Å; D94-G98 PolarHBondContact O-N 3.25Å
99	K	89.9	Confident	93.4	Very high	128 Å²	128	66 Å²	66	56%	0.557	33%	0.327	S	S	*	.			trans	-72.3	143.7	-177.3	-64.9	-171.6	177.3	-170.1	0	111.5	T93 D94 S97 R101	T93-K99 CarbonylContact C-O 3.58Å; T93-K99 VanDerWaalsContact CA-O 3.28Å; T93-K99 WeakPolarHBondContact CA-O 3.31Å; D94-K99 PolarHBondContact N-O 3.23Å; S97-K99 PolarHBondContact O-N 2.97Å; S97-K99 VanDerWaalsContact O-N 3.14Å; S97-K99 PolarHBondContact OG-N 2.99Å; K99-R101 PolarHBondContact O-N 3.16Å
100	K	92.1	Very high	93.4	Very high	51 Å²	51	66.9 Å²	66.9	22%	0.222	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.6	176.4	-64.3	177.1	-170.2	166.1	0	109.4	E69 T71 I91 T93 G102	E69-K100 HydrophobicContact CG-CB 4.33Å; E69-K100 VanDerWaalsContact O-CD 3.28Å; E69-K100 WeakPolarHBondContact O-CD 3.34Å; E69-K100 WeakPolarHBondContact O-CE 3.48Å; E69-K100 PolarHBondContact O-NZ 2.97Å; T71-K100 PolarHBondContact O-NZ 3.46Å; I91-K100 HydrophobicContact CG2-CB 4.47Å; I91-K100 HydrophobicContact CG2-CD 4.01Å; I91-K100 HydrophobicContact CG2-CG 4.07Å; T93-K100 HydrophobicContact CG2-CG 3.92Å; K100-G102 PolarHBondContact O-N 2.79Å
101	R	91.7	Very high	93.3	Very high	152 Å²	152	63.8 Å²	63.8	57%	0.574	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	3.7	-178.5	-64.5	-176.5	64.1	-164.7	-3.8	113.7	I92 D94 K99 F103	I92-R101 HydrophobicContact CG2-CG 4.49Å; I92-R101 WeakPolarHBondContact O-CB 3.46Å; I92-R101 PolarHBondContact O-N 3.44Å; D94-R101 HydrophobicContact CB-CG 4.2Å; K99-R101 PolarHBondContact O-N 3.16Å; R101-F103 VanDerWaalsContact C-N 3.35Å; R101-F103 HydrophobicContact CB-CD1 3.76Å; R101-F103 HydrophobicContact CB-CE1 3.47Å; R101-F103 VanDerWaalsContact CB-CE1 3.47Å; R101-F103 HydrophobicContact CB-CZ 4.43Å; R101-F103 HydrophobicContact CG-CE1 4.39Å
102	G	92.4	Very high	93.3	Very high	19 Å²	19	62.7 Å²	62.7	20%	0.196	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.2	22.4	-179.2	0	0	0	0	0	114.9	G66 I67 K100	G66-G102 PolarHBondContact N-O 3.35Å; I67-G102 VanDerWaalsContact CG1-C 3.5Å; I67-G102 WeakPolarHBondContact CG1-O 3.33Å; I67-G102 PolarHBondContact N-O 2.82Å; I67-G102 CarbonylContact O-C 3.4Å; I67-G102 WeakPolarHBondContact O-CA 3.4Å; K100-G102 PolarHBondContact O-N 2.79Å
103	F	95.1	Very high	93.4	Very high	39 Å²	39	60.9 Å²	60.9	17%	0.171	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	158.6	170.5	70.9	-85.9	0	0	0	111.4	F63 V64 I92 R101 F105	F63-F103 HydrophobicContact CD2-CD2 4.26Å; F63-F103 HydrophobicContact CE2-CB 3.83Å; F63-F103 AromaticContact CE2-CD2 3.61Å; F63-F103 HydrophobicContact CE2-CD2 3.61Å; F63-F103 HydrophobicContact CE2-CE2 4.4Å; F63-F103 AromaticContact CE2-CG 3.91Å; F63-F103 HydrophobicContact CE2-CG 3.91Å; F63-F103 HydrophobicContact CZ-CB 3.97Å; F63-F103 HydrophobicContact CZ-CG 4.4Å; V64-F103 CarbonylContact O-C 3.57Å; V64-F103 WeakPolarHBondContact O-CA 3.47Å; V64-F103 WeakPolarHBondContact O-CB 3.3Å; I92-F103 HydrophobicContact CB-CD2 4.18Å; I92-F103 HydrophobicContact CB-CE1 4.4Å; I92-F103 HydrophobicContact CB-CE2 3.73Å; I92-F103 HydrophobicContact CB-CZ 3.84Å; I92-F103 HydrophobicContact CG1-CD2 3.91Å; I92-F103 HydrophobicContact CG1-CE2 3.48Å; I92-F103 VanDerWaalsContact CG1-CE2 3.48Å; I92-F103 HydrophobicContact CG1-CZ 4.08Å; I92-F103 HydrophobicContact CG2-CE1 4.43Å; I92-F103 HydrophobicContact CG2-CE2 4.09Å; I92-F103 HydrophobicContact CG2-CZ 3.78Å; I92-F103 PolarHBondContact N-O 2.82Å; R101-F103 VanDerWaalsContact C-N 3.35Å; R101-F103 HydrophobicContact CB-CD1 3.76Å; R101-F103 HydrophobicContact CB-CE1 3.47Å; R101-F103 VanDerWaalsContact CB-CE1 3.47Å; R101-F103 HydrophobicContact CB-CZ 4.43Å; R101-F103 HydrophobicContact CG-CE1 4.39Å; F103-F105 HydrophobicContact CD2-CE2 4.18Å; F103-F105 HydrophobicContact CD2-CZ 4.49Å; F103-F105 AromaticContact CE2-CE2 3.91Å; F103-F105 HydrophobicContact CE2-CE2 3.91Å; F103-F105 HydrophobicContact CE2-CZ 4.28Å
104	G	95.3	Very high	93.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	-179.7	175.9	0	0	0	0	0	111.7	V64 E90	V64-G104 PolarHBondContact N-O 2.76Å; V64-G104 PolarHBondContact O-N 3.18Å; E90-G104 CarbonylContact O-C 3.56Å; E90-G104 WeakPolarHBondContact O-CA 3.5Å
105	F	96.7	Very high	93.6	Very high	32 Å²	32	55 Å²	55	14%	0.14	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	144.1	173.7	-60	-88.2	0	0	0	110.8	K61 L62 F63 I89 E90 I92 F103 A135	K61-F105 HydrophobicContact CD-CB 4.28Å; K61-F105 HydrophobicContact CD-CD1 4.32Å; K61-F105 HydrophobicContact CD-CG 4.45Å; K61-F105 HydrophobicContact CG-CB 4.11Å; K61-F105 HydrophobicContact CG-CD1 4.16Å; K61-F105 HydrophobicContact CG-CG 4.49Å; L62-F105 CarbonylContact O-C 3.6Å; L62-F105 WeakPolarHBondContact O-CA 3.49Å; F63-F105 HydrophobicContact CB-CD1 4.19Å; F63-F105 HydrophobicContact CB-CE1 4.03Å; F63-F105 HydrophobicContact CD2-CD1 4.4Å; F63-F105 AromaticContact CD2-CE1 3.75Å; F63-F105 HydrophobicContact CD2-CE1 3.75Å; F63-F105 HydrophobicContact CD2-CZ 4.02Å; F63-F105 HydrophobicContact CG-CE1 4.4Å; I89-F105 WeakPolarHBondContact CA-O 3.06Å; E90-F105 HydrophobicContact CB-CB 4.44Å; E90-F105 PolarHBondContact N-O 3.06Å; E90-F105 PolarHBondContact O-N 2.92Å; I92-F105 HydrophobicContact CD1-CD2 4Å; I92-F105 HydrophobicContact CD1-CE2 4.1Å; I92-F105 HydrophobicContact CG1-CD2 3.96Å; I92-F105 HydrophobicContact CG1-CE2 3.83Å; F103-F105 HydrophobicContact CD2-CE2 4.18Å; F103-F105 HydrophobicContact CD2-CZ 4.49Å; F103-F105 AromaticContact CE2-CE2 3.91Å; F103-F105 HydrophobicContact CE2-CE2 3.91Å; F103-F105 HydrophobicContact CE2-CZ 4.28Å; F105-A135 HydrophobicContact CD1-CB 3.86Å; F105-A135 HydrophobicContact CE1-CB 3.95Å
106	V	97.3	Very high	93.8	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.3	173	-178	0	0	0	0	107.3	K61 L62 V64 F80 I86 I89 F108	K61-V106 CarbonylContact C-O 3.48Å; K61-V106 WeakPolarHBondContact CA-O 3.48Å; L62-V106 HydrophobicContact CB-CB 4.39Å; L62-V106 PolarHBondContact N-O 3.26Å; L62-V106 PolarHBondContact O-N 3.34Å; V64-V106 HydrophobicContact CG2-CG2 4.12Å; F80-V106 HydrophobicContact CB-CG1 4.45Å; F80-V106 HydrophobicContact CD2-CG2 3.81Å; F80-V106 HydrophobicContact CE2-CG2 4.12Å; I86-V106 HydrophobicContact CD1-CG1 4.25Å; I86-V106 HydrophobicContact CG1-CG1 4.13Å; I86-V106 HydrophobicContact CG2-CG1 3.91Å; I89-V106 HydrophobicContact CG1-CG1 4.36Å; I89-V106 HydrophobicContact CG1-CG2 4.48Å; V106-F108 HydrophobicContact CB-CE2 4.18Å; V106-F108 HydrophobicContact CG1-CD2 4.17Å; V106-F108 HydrophobicContact CG1-CE1 4.39Å; V106-F108 HydrophobicContact CG1-CE2 3.63Å; V106-F108 HydrophobicContact CG1-CZ 3.77Å
107	T	96.8	Very high	94.1	Very high	27 Å²	27	36.3 Å²	36.3	17%	0.166	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.3	175.7	-46.6	0	0	0	0	108.4	K60 D87 T88	K60-T107 WeakPolarHBondContact O-CA 3.34Å; D87-T107 PolarHBondContact N-O 3.1Å; T88-T107 PolarHBondContact N-O 3.07Å; T88-T107 PolarHBondContact O-N 2.73Å; T88-T107 VanDerWaalsContact OG1-CB 3.26Å; T88-T107 WeakPolarHBondContact OG1-CB 3.13Å; T88-T107 PolarHBondContact OG1-OG1 3.29Å
108	F	97.3	Very high	94.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	163.8	175.4	-65.8	-91.3	0	0	0	111	K60 L62 F80 K85 I86 V106 D110 P113 V114 I117	K60-F108 WeakPolarHBondContact CB-O 3.37Å; K60-F108 PolarHBondContact O-N 2.87Å; L62-F108 HydrophobicContact CB-CE2 4.21Å; L62-F108 HydrophobicContact CD2-CE2 4.32Å; F80-F108 HydrophobicContact CB-CE1 4.3Å; F80-F108 HydrophobicContact CB-CZ 3.86Å; F80-F108 HydrophobicContact CD1-CZ 4.36Å; F80-F108 HydrophobicContact CG-CZ 4.29Å; K85-F108 WeakPolarHBondContact O-CA 3.42Å; I86-F108 HydrophobicContact CG1-CD1 4.03Å; I86-F108 HydrophobicContact CG1-CE1 3.73Å; I86-F108 HydrophobicContact CG1-CZ 4.45Å; V106-F108 HydrophobicContact CB-CE2 4.18Å; V106-F108 HydrophobicContact CG1-CD2 4.17Å; V106-F108 HydrophobicContact CG1-CE1 4.39Å; V106-F108 HydrophobicContact CG1-CE2 3.63Å; V106-F108 HydrophobicContact CG1-CZ 3.77Å; F108-D110 WeakPolarHBondContact CB-O 3.38Å; F108-D110 PolarHBondContact O-N 2.84Å; F108-P113 HydrophobicContact CB-CB 4.33Å; F108-P113 HydrophobicContact CB-CG 4.32Å; F108-P113 HydrophobicContact CD1-CB 3.63Å; F108-P113 HydrophobicContact CD1-CG 4.08Å; F108-P113 HydrophobicContact CD2-CB 4.28Å; F108-P113 HydrophobicContact CE1-CB 3.88Å; F108-P113 HydrophobicContact CE2-CB 4.49Å; F108-P113 HydrophobicContact CG-CB 3.83Å; F108-P113 HydrophobicContact CG-CG 4.29Å; F108-P113 HydrophobicContact CZ-CB 4.29Å; F108-V114 HydrophobicContact CD2-CG2 3.7Å; F108-V114 HydrophobicContact CE2-CG2 4.25Å; F108-I117 HydrophobicContact CE1-CD1 4.39Å; F108-I117 HydrophobicContact CE2-CD1 3.8Å; F108-I117 HydrophobicContact CZ-CD1 3.46Å; F108-I117 VanDerWaalsContact CZ-CD1 3.46Å
109	D	95.8	Very high	94.3	Very high	63 Å²	63	35.6 Å²	35.6	34%	0.337	17%	0.17	S	C	.	.	S	Bend	trans	-69.4	-22.6	172.4	70.7	-19.6	0	0	0	112.7	K60 K85 D87	K60-D109 WeakPolarHBondContact CD-O 3.38Å; K60-D109 WeakPolarHBondContact CE-O 3.32Å; K60-D109 PolarHBondContact NZ-O 3.36Å; K85-D109 HydrophobicContact CB-CB 4.47Å; K85-D109 HydrophobicContact CD-CB 4.43Å; K85-D109 PolarHBondContact O-N 3.35Å; D87-D109 WeakPolarHBondContact OD2-CA 3.45Å
110	D	94.8	Very high	94.4	Very high	37 Å²	37	34.4 Å²	34.4	20%	0.198	17%	0.167	C	C	.	.	S	Bend	trans	-134.5	164.6	-177.4	-172.7	35.5	0	0	0	113.2	R30 F108 D112	R30-D110 IonicContact CZ-OD1 2.79Å; R30-D110 IonicContact CZ-OD2 3.79Å; R30-D110 IonicContact NH1-OD1 3.5Å; R30-D110 PolarHBondContact NH1-OD1 2.97Å; R30-D110 IonicContact NH1-OD2 2.66Å; R30-D110 PolarHBondContact NH1-OD2 2.72Å; R30-D110 IonicContact NH2-OD2 2.97Å; R30-D110 PolarHBondContact NH2-OD2 2.68Å; F108-D110 WeakPolarHBondContact CB-O 3.38Å; F108-D110 PolarHBondContact O-N 2.84Å; D110-D112 VanDerWaalsContact OD2-CB 3.3Å; D110-D112 WeakPolarHBondContact OD2-CB 3.48Å; D110-D112 PolarHBondContact OD2-N 2.82Å
111	H	94.4	Very high	94.3	Very high	16 Å²	16	36 Å²	36	7%	0.074	17%	0.173	C	C	.	.	S	Bend	trans	-85.4	-22.7	177.7	72.6	85.5	0	0	0	113.5	R30 T58 V114 D115	R30-H111 PolarHBondContact NH1-NE2 3.41Å; T58-H111 HydrophobicContact CG2-CB 3.55Å; T58-H111 VanDerWaalsContact CG2-CG 3.4Å; H111-V114 WeakPolarHBondContact O-CB 3.37Å; H111-V114 PolarHBondContact O-N 3.21Å; H111-D115 IonicContact CE1-OD2 3.93Å; H111-D115 IonicContact ND1-OD2 2.98Å; H111-D115 PolarHBondContact ND1-OD2 2.87Å; H111-D115 PolarHBondContact O-N 3.25Å
112	D	94.9	Very high	94.4	Very high	16 Å²	16	33.8 Å²	33.8	9%	0.086	17%	0.166	C	C	.	.	H	α-helix	trans	-61.1	-41.5	-178.5	-174.5	58.8	0	0	0	113.5	M27 R43 D110 V114 D115 K116	M27-D112 HydrophobicContact CE-CB 3.78Å; M27-D112 WeakPolarHBondContact CE-OD1 3.48Å; M27-D112 WeakPolarHBondContact CG-OD1 3.3Å; R43-D112 IonicContact CZ-OD1 2.78Å; R43-D112 IonicContact CZ-OD2 3.09Å; R43-D112 IonicContact NE-OD1 2.77Å; R43-D112 PolarHBondContact NE-OD1 3.23Å; R43-D112 IonicContact NE-OD2 2.68Å; R43-D112 IonicContact NH2-OD1 3.45Å; R43-D112 PolarHBondContact NH2-OD1 2.84Å; R43-D112 IonicContact NH2-OD2 3.52Å; R43-D112 PolarHBondContact NH2-OD2 3.49Å; D110-D112 VanDerWaalsContact OD2-CB 3.3Å; D110-D112 WeakPolarHBondContact OD2-CB 3.48Å; D110-D112 PolarHBondContact OD2-N 2.82Å; D112-V114 VanDerWaalsContact C-N 3.28Å; D112-V114 PolarHBondContact O-N 2.86Å; D112-D115 PolarHBondContact O-N 3.31Å; D112-K116 WeakPolarHBondContact O-CB 3.06Å; D112-K116 PolarHBondContact O-N 3.02Å
113	P	95.8	Very high	94.5	Very high	6 Å²	6	32.9 Å²	32.9	4%	0.039	16%	0.157	C	C	.	.	H	α-helix	trans	-57.3	-43.2	175.2	-25.9	35.6	0	0	0	111.9	F108 K116 I117	F108-P113 HydrophobicContact CB-CB 4.33Å; F108-P113 HydrophobicContact CB-CG 4.32Å; F108-P113 HydrophobicContact CD1-CB 3.63Å; F108-P113 HydrophobicContact CD1-CG 4.08Å; F108-P113 HydrophobicContact CD2-CB 4.28Å; F108-P113 HydrophobicContact CE1-CB 3.88Å; F108-P113 HydrophobicContact CE2-CB 4.49Å; F108-P113 HydrophobicContact CG-CB 3.83Å; F108-P113 HydrophobicContact CG-CG 4.29Å; F108-P113 HydrophobicContact CZ-CB 4.29Å; P113-K116 WeakPolarHBondContact O-CB 3.24Å; P113-K116 PolarHBondContact O-N 2.66Å; P113-I117 WeakPolarHBondContact O-CB 3.43Å; P113-I117 VanDerWaalsContact O-CD1 3.29Å; P113-I117 WeakPolarHBondContact O-CD1 2.96Å; P113-I117 WeakPolarHBondContact O-CG1 3.41Å; P113-I117 PolarHBondContact O-N 3.01Å
114	V	95.3	Very high	94.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.1	-48.5	176.7	179.9	0	0	0	0	110.7	V59 L62 F108 H111 D112 K116 I117 V118 K134	V59-V114 HydrophobicContact CG2-CG1 4.08Å; L62-V114 HydrophobicContact CB-CG2 4.37Å; L62-V114 HydrophobicContact CD1-CG1 3.95Å; F108-V114 HydrophobicContact CD2-CG2 3.7Å; F108-V114 HydrophobicContact CE2-CG2 4.25Å; H111-V114 WeakPolarHBondContact O-CB 3.37Å; H111-V114 PolarHBondContact O-N 3.21Å; D112-V114 VanDerWaalsContact C-N 3.28Å; D112-V114 PolarHBondContact O-N 2.86Å; V114-K116 VanDerWaalsContact C-N 3.25Å; V114-K116 PolarHBondContact O-N 3.36Å; V114-I117 PolarHBondContact O-N 3.14Å; V114-V118 HydrophobicContact CG1-CG1 4.37Å; V114-V118 WeakPolarHBondContact O-CG1 3.48Å; V114-V118 VanDerWaalsContact O-CG2 3.32Å; V114-V118 WeakPolarHBondContact O-CG2 3.43Å; V114-V118 PolarHBondContact O-N 3.35Å; V114-K134 HydrophobicContact CG1-CG 4.05Å
115	D	93.1	Very high	94.4	Very high	5 Å²	5	35.7 Å²	35.7	3%	0.027	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-34.6	178.2	-73.7	-31.8	0	0	0	112	R43 H111 D112 L119 K134	R43-D115 HydrophobicContact CB-CB 4.07Å; R43-D115 HydrophobicContact CG-CB 4.08Å; H111-D115 IonicContact CE1-OD2 3.93Å; H111-D115 IonicContact ND1-OD2 2.98Å; H111-D115 PolarHBondContact ND1-OD2 2.87Å; H111-D115 PolarHBondContact O-N 3.25Å; D112-D115 PolarHBondContact O-N 3.31Å; D115-L119 WeakPolarHBondContact O-CG 3.38Å; D115-K134 WeakPolarHBondContact OD1-CE 2.99Å; D115-K134 IonicContact OD1-NZ 3.46Å; D115-K134 PolarHBondContact OD1-NZ 3.37Å
116	K	93.6	Very high	94.2	Very high	49 Å²	49	37.2 Å²	37.2	21%	0.213	19%	0.187	C	C	.	.	H	α-helix	trans	-69.5	-48	177	-173.3	171.2	-178.8	169.2	0	111.5	D24 Y83 D112 P113 V114 L119	D24-K116 IonicContact OD1-NZ 3.07Å; D24-K116 PolarHBondContact OD1-NZ 3.14Å; D24-K116 IonicContact OD2-NZ 3.98Å; D24-K116 PolarHBondContact OD2-NZ 2.92Å; Y83-K116 HydrophobicContact CD1-CB 4.49Å; Y83-K116 HydrophobicContact CD1-CD 3.94Å; Y83-K116 HydrophobicContact CD1-CG 4.01Å; Y83-K116 HydrophobicContact CE1-CG 4.39Å; D112-K116 WeakPolarHBondContact O-CB 3.06Å; D112-K116 PolarHBondContact O-N 3.02Å; P113-K116 WeakPolarHBondContact O-CB 3.24Å; P113-K116 PolarHBondContact O-N 2.66Å; V114-K116 VanDerWaalsContact C-N 3.25Å; V114-K116 PolarHBondContact O-N 3.36Å; K116-L119 WeakPolarHBondContact O-CB 3.22Å; K116-L119 PolarHBondContact O-N 2.9Å
117	I	94.9	Very high	93.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-48.4	-177.2	-70.8	160.8	0	0	0	110.1	L62 F80 Y83 F108 P113 V114 L119 Q120 H123 V132	L62-I117 HydrophobicContact CD1-CB 4.44Å; L62-I117 HydrophobicContact CD1-CG2 3.97Å; L62-I117 HydrophobicContact CD2-CD1 4Å; L62-I117 HydrophobicContact CD2-CG2 3.76Å; F80-I117 HydrophobicContact CD1-CD1 3.59Å; F80-I117 HydrophobicContact CD1-CG1 4.28Å; F80-I117 HydrophobicContact CE1-CD1 3.97Å; F80-I117 HydrophobicContact CE1-CG1 4.37Å; F80-I117 HydrophobicContact CE1-CG2 3.91Å; Y83-I117 HydrophobicContact CD1-CD1 4.29Å; Y83-I117 HydrophobicContact CD1-CG1 3.47Å; Y83-I117 VanDerWaalsContact CD1-CG1 3.47Å; Y83-I117 HydrophobicContact CD2-CD1 4.15Å; Y83-I117 HydrophobicContact CD2-CG1 3.94Å; Y83-I117 HydrophobicContact CE1-CG1 3.85Å; Y83-I117 HydrophobicContact CE2-CG1 4.27Å; Y83-I117 HydrophobicContact CG-CD1 3.86Å; Y83-I117 HydrophobicContact CG-CG1 3.52Å; F108-I117 HydrophobicContact CE1-CD1 4.39Å; F108-I117 HydrophobicContact CE2-CD1 3.8Å; F108-I117 HydrophobicContact CZ-CD1 3.46Å; F108-I117 VanDerWaalsContact CZ-CD1 3.46Å; P113-I117 WeakPolarHBondContact O-CB 3.43Å; P113-I117 VanDerWaalsContact O-CD1 3.29Å; P113-I117 WeakPolarHBondContact O-CD1 2.96Å; P113-I117 WeakPolarHBondContact O-CG1 3.41Å; P113-I117 PolarHBondContact O-N 3.01Å; V114-I117 PolarHBondContact O-N 3.14Å; I117-L119 PolarHBondContact O-N 3.22Å; I117-Q120 PolarHBondContact O-N 2.91Å; I117-H123 PolarHBondContact O-NE2 3Å; I117-V132 HydrophobicContact CG2-CB 4.02Å; I117-V132 HydrophobicContact CG2-CG1 4.14Å; I117-V132 HydrophobicContact CG2-CG2 3.71Å
118	V	92.9	Very high	93.6	Very high	13 Å²	13	40.4 Å²	40.4	8%	0.079	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-10.1	-174.8	-59.8	0	0	0	0	114.7	L62 V114 Q120 K134	L62-V118 HydrophobicContact CD1-CG1 3.71Å; V114-V118 HydrophobicContact CG1-CG1 4.37Å; V114-V118 WeakPolarHBondContact O-CG1 3.48Å; V114-V118 VanDerWaalsContact O-CG2 3.32Å; V114-V118 WeakPolarHBondContact O-CG2 3.43Å; V114-V118 PolarHBondContact O-N 3.35Å; V118-Q120 PolarHBondContact O-N 2.77Å; V118-K134 HydrophobicContact CG1-CG 4.06Å; V118-K134 HydrophobicContact CG2-CG 4.34Å
119	L	90.1	Very high	93.5	Very high	93 Å²	93	45 Å²	45	49%	0.487	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.2	169	-64	175.8	0	0	0	111.3	D115 K116 I117	D115-L119 WeakPolarHBondContact O-CG 3.38Å; K116-L119 WeakPolarHBondContact O-CB 3.22Å; K116-L119 PolarHBondContact O-N 2.9Å; I117-L119 PolarHBondContact O-N 3.22Å
120	Q	91.3	Very high	93.5	Very high	104 Å²	104	42 Å²	42	49%	0.486	23%	0.226	S	C	.	.	S	Bend	trans	-102.6	116.4	171.2	-176	175.2	-56.2	0	0	108.6	I117 V118 Y122 H123 V132	I117-Q120 PolarHBondContact O-N 2.91Å; V118-Q120 PolarHBondContact O-N 2.77Å; Q120-Y122 VanDerWaalsContact C-N 3.32Å; Q120-Y122 WeakPolarHBondContact CG-O 3.44Å; Q120-Y122 PolarHBondContact NE2-O 3.01Å; Q120-Y122 PolarHBondContact O-N 3.27Å; Q120-H123 PolarHBondContact O-CD2 2.91Å; Q120-H123 PolarHBondContact O-NE2 2.86Å; Q120-V132 WeakPolarHBondContact O-CG2 3.45Å
121	K	90.1	Very high	93.5	Very high	83 Å²	83	43.1 Å²	43.1	36%	0.361	23%	0.23	S	C	.	.	S	Bend	trans	-69	-32	-175.9	-173.6	-179.9	176.8	-155.7	0	113.3	E131 V132	K121-E131 VanDerWaalsContact CE-CD 3.44Å; K121-E131 WeakPolarHBondContact CE-OE1 3.48Å; K121-E131 HydrophobicContact CG-CG 4.28Å; K121-E131 IonicContact NZ-OE1 2.86Å; K121-E131 WeakPolarHBondContact O-CA 3.46Å; K121-V132 PolarHBondContact O-N 2.98Å
122	Y	94.6	Very high	93.5	Very high	106 Å²	106	42.5 Å²	42.5	42%	0.416	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.9	-168	-69.5	-64.3	0	0	0	110.7	Q120 N129 A130 E131	Q120-Y122 VanDerWaalsContact C-N 3.32Å; Q120-Y122 WeakPolarHBondContact CG-O 3.44Å; Q120-Y122 PolarHBondContact NE2-O 3.01Å; Q120-Y122 PolarHBondContact O-N 3.27Å; Y122-N129 WeakPolarHBondContact CB-OD1 3.33Å; Y122-A130 CarbonylContact C-O 3.57Å; Y122-A130 WeakPolarHBondContact CA-O 2.89Å; Y122-E131 HydrophobicContact CD1-CB 4.32Å; Y122-E131 HydrophobicContact CE1-CB 4.14Å; Y122-E131 HydrophobicContact CE1-CG 4.33Å
123	H	95.4	Very high	93.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	136.1	-178.7	-69	-101.4	0	0	0	109.8	Y79 I117 Q120 I125 A130 V132	Y79-H123 HydrophobicContact CE1-CB 3.77Å; Y79-H123 AromaticContact CE1-CG 3.88Å; Y79-H123 AromaticContact CE1-ND1 3.45Å; Y79-H123 WeakPolarHBondContact CE1-ND1 3.48Å; Y79-H123 AromaticContact CZ-ND1 3.53Å; Y79-H123 PolarHBondContact OH-ND1 3.41Å; I117-H123 PolarHBondContact O-NE2 3Å; Q120-H123 PolarHBondContact O-CD2 2.91Å; Q120-H123 PolarHBondContact O-NE2 2.86Å; H123-I125 HydrophobicContact CB-CD1 4.35Å; H123-I125 HydrophobicContact CB-CG1 4.24Å; H123-I125 PolarHBondContact O-N 2.86Å; H123-A130 PolarHBondContact N-O 2.88Å; H123-A130 PolarHBondContact O-N 3.34Å; H123-V132 WeakPolarHBondContact CD2-CG2 3.37Å; H123-V132 WeakPolarHBondContact NE2-CG2 3.46Å
124	T	94.8	Very high	93.3	Very high	95 Å²	95	46.6 Å²	46.6	58%	0.583	24%	0.242	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	109.7	175.7	-58.6	0	0	0	0	109	H128	T124-H128 CarbonylContact C-O 3.56Å; T124-H128 WeakPolarHBondContact CA-O 3.32Å
125	I	93.6	Very high	93.2	Very high	3 Å²	3	47 Å²	47	2%	0.015	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.3	-178.3	-53.6	177.1	0	0	0	107.9	V64 H75 L76 Y79 F80 H123 G127 H128 A130	V64-I125 HydrophobicContact CG1-CD1 4.21Å; H75-I125 HydrophobicContact CB-CG2 4.48Å; L76-I125 HydrophobicContact CD2-CD1 4.08Å; L76-I125 HydrophobicContact CD2-CG2 4.14Å; Y79-I125 HydrophobicContact CD1-CD1 3.66Å; Y79-I125 HydrophobicContact CD1-CG1 3.68Å; Y79-I125 HydrophobicContact CD2-CG1 4.38Å; Y79-I125 HydrophobicContact CE1-CD1 4.07Å; Y79-I125 HydrophobicContact CE1-CG1 3.98Å; Y79-I125 HydrophobicContact CG-CD1 4.27Å; Y79-I125 HydrophobicContact CG-CG1 3.91Å; F80-I125 HydrophobicContact CE2-CD1 3.57Å; F80-I125 HydrophobicContact CZ-CD1 3.56Å; H123-I125 HydrophobicContact CB-CD1 4.35Å; H123-I125 HydrophobicContact CB-CG1 4.24Å; H123-I125 PolarHBondContact O-N 2.86Å; I125-G127 PolarHBondContact O-N 3.38Å; I125-H128 PolarHBondContact N-O 2.94Å; I125-H128 PolarHBondContact O-N 3.45Å; I125-A130 HydrophobicContact CD1-CB 4.06Å; I125-A130 HydrophobicContact CG1-CB 4.37Å
126	N	91.3	Very high	92.9	Very high	64 Å²	64	48 Å²	48	34%	0.342	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	36.2	-177	-164.7	29	0	0	0	113.5	H75 H128	H75-N126 HydrophobicContact CB-CB 4.37Å; H75-N126 PolarHBondContact NE2-OD1 2.9Å; N126-H128 PolarHBondContact O-CD2 3.2Å; N126-H128 VanDerWaalsContact O-CD2 3.26Å; N126-H128 PolarHBondContact O-N 2.95Å; N126-H128 PolarHBondContact O-NE2 2.92Å
127	G	90.4	Very high	92.3	Very high	68 Å²	68	48.2 Å²	48.2	70%	0.701	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	3.4	-176.9	0	0	0	0	0	115.4	I125	I125-G127 PolarHBondContact O-N 3.38Å
128	H	92.1	Very high	91.6	Very high	26 Å²	26	59.2 Å²	59.2	12%	0.12	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	144.4	176.7	-54.3	-58.3	0	0	0	111.5	K68 D70 T124 I125 N126 A130	K68-H128 WeakPolarHBondContact CD-CE1 3.31Å; K68-H128 VanDerWaalsContact CE-ND1 3.3Å; K68-H128 WeakPolarHBondContact CE-ND1 3.33Å; D70-H128 VanDerWaalsContact CG-NE2 3.26Å; D70-H128 IonicContact OD1-CD2 3.44Å; D70-H128 PolarHBondContact OD1-CD2 3.36Å; D70-H128 IonicContact OD1-NE2 2.74Å; D70-H128 PolarHBondContact OD1-NE2 3.42Å; D70-H128 IonicContact OD2-CD2 2.78Å; D70-H128 IonicContact OD2-CE1 2.84Å; D70-H128 PolarHBondContact OD2-CE1 2.92Å; D70-H128 IonicContact OD2-NE2 3.7Å; D70-H128 PolarHBondContact OD2-NE2 3.38Å; T124-H128 CarbonylContact C-O 3.56Å; T124-H128 WeakPolarHBondContact CA-O 3.32Å; I125-H128 PolarHBondContact N-O 2.94Å; I125-H128 PolarHBondContact O-N 3.45Å; N126-H128 PolarHBondContact O-CD2 3.2Å; N126-H128 VanDerWaalsContact O-CD2 3.26Å; N126-H128 PolarHBondContact O-N 2.95Å; N126-H128 PolarHBondContact O-NE2 2.92Å; H128-A130 PolarHBondContact O-N 3.33Å
129	N	94.1	Very high	90.9	Very high	96 Å²	96	64.9 Å²	64.9	51%	0.513	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	92.4	175.9	-170.2	30.8	0	0	0	110.4	Y122	Y122-N129 WeakPolarHBondContact CB-OD1 3.33Å
130	A	95.8	Very high	90.4	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	139.1	179	0	0	0	0	0	111.4	V64 G65 I67 Y122 H123 I125 H128	V64-A130 HydrophobicContact CG1-CB 3.98Å; G65-A130 CarbonylContact O-C 3.5Å; G65-A130 WeakPolarHBondContact O-CA 3.43Å; G65-A130 WeakPolarHBondContact O-CB 3.24Å; I67-A130 HydrophobicContact CG2-CB 3.94Å; Y122-A130 CarbonylContact C-O 3.57Å; Y122-A130 WeakPolarHBondContact CA-O 2.89Å; H123-A130 PolarHBondContact N-O 2.88Å; H123-A130 PolarHBondContact O-N 3.34Å; I125-A130 HydrophobicContact CD1-CB 4.06Å; I125-A130 HydrophobicContact CG1-CB 4.37Å; H128-A130 PolarHBondContact O-N 3.33Å
131	E	94.8	Very high	89.7	Confident	60 Å²	60	62.1 Å²	62.1	28%	0.28	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.1	170.6	-179.3	173.3	170.9	0	0	109.8	G65 K121 Y122 R133	G65-E131 PolarHBondContact N-O 3.05Å; G65-E131 PolarHBondContact O-N 2.97Å; K121-E131 VanDerWaalsContact CE-CD 3.44Å; K121-E131 WeakPolarHBondContact CE-OE1 3.48Å; K121-E131 HydrophobicContact CG-CG 4.28Å; K121-E131 IonicContact NZ-OE1 2.86Å; K121-E131 WeakPolarHBondContact O-CA 3.46Å; Y122-E131 HydrophobicContact CD1-CB 4.32Å; Y122-E131 HydrophobicContact CE1-CB 4.14Å; Y122-E131 HydrophobicContact CE1-CG 4.33Å; E131-R133 HydrophobicContact CG-CG 4.42Å
132	V	95	Very high	89.2	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.024	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	140.3	179.3	-58.9	0	0	0	0	111.4	L62 F63 V64 F80 I117 Q120 K121 H123	L62-V132 HydrophobicContact CD1-CB 4.24Å; L62-V132 HydrophobicContact CD2-CB 4.49Å; L62-V132 HydrophobicContact CD2-CG1 4.37Å; F63-V132 VanDerWaalsContact O-CA 3.31Å; F63-V132 WeakPolarHBondContact O-CA 3.17Å; V64-V132 HydrophobicContact CG2-CG1 4.44Å; F80-V132 HydrophobicContact CE1-CG1 4.44Å; F80-V132 HydrophobicContact CZ-CG1 4.05Å; I117-V132 HydrophobicContact CG2-CB 4.02Å; I117-V132 HydrophobicContact CG2-CG1 4.14Å; I117-V132 HydrophobicContact CG2-CG2 3.71Å; Q120-V132 WeakPolarHBondContact O-CG2 3.45Å; K121-V132 PolarHBondContact O-N 2.98Å; H123-V132 WeakPolarHBondContact CD2-CG2 3.37Å; H123-V132 WeakPolarHBondContact NE2-CG2 3.46Å
133	R	92.8	Very high	88.3	Confident	78 Å²	78	64.6 Å²	64.6	29%	0.294	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	155.9	177.8	-62.6	180	63	-174.9	-7.2	110.2	F63 E131 A135	F63-R133 WeakPolarHBondContact CB-O 3.48Å; F63-R133 HydrophobicContact CD1-CB 4.25Å; F63-R133 PolarHBondContact N-O 2.84Å; F63-R133 PolarHBondContact O-N 2.88Å; E131-R133 HydrophobicContact CG-CG 4.42Å; R133-A135 PolarHBondContact O-N 3.06Å
134	K	93.8	Very high	87.1	Confident	29 Å²	29	65.4 Å²	65.4	13%	0.126	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	126.7	166.1	-67.7	-172	172.7	-171.5	0	109.2	G54 A55 V57 V59 V114 D115 V118 L136	G54-K134 WeakPolarHBondContact O-CD 3.33Å; A55-K134 PolarHBondContact O-NZ 3.48Å; V57-K134 WeakPolarHBondContact O-CD 3.47Å; V57-K134 PolarHBondContact O-NZ 3.18Å; V59-K134 HydrophobicContact CG2-CB 3.75Å; V59-K134 HydrophobicContact CG2-CD 4.33Å; V59-K134 HydrophobicContact CG2-CG 4.06Å; V114-K134 HydrophobicContact CG1-CG 4.05Å; D115-K134 WeakPolarHBondContact OD1-CE 2.99Å; D115-K134 IonicContact OD1-NZ 3.46Å; D115-K134 PolarHBondContact OD1-NZ 3.37Å; V118-K134 HydrophobicContact CG1-CG 4.06Å; V118-K134 HydrophobicContact CG2-CG 4.34Å; K134-L136 PolarHBondContact O-N 3.39Å
135	A	91.9	Very high	85.8	Confident	9 Å²	9	66.6 Å²	66.6	7%	0.074	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-71.2	122	178.6	0	0	0	0	0	109.2	K61 F63 F105 R133	K61-A135 HydrophobicContact CB-CB 3.86Å; K61-A135 HydrophobicContact CD-CB 4.41Å; K61-A135 HydrophobicContact CG-CB 3.73Å; K61-A135 WeakPolarHBondContact O-CB 3.26Å; K61-A135 PolarHBondContact O-N 3.49Å; F63-A135 HydrophobicContact CB-CB 4.38Å; F105-A135 HydrophobicContact CD1-CB 3.86Å; F105-A135 HydrophobicContact CE1-CB 3.95Å; R133-A135 PolarHBondContact O-N 3.06Å
136	L	87.3	Confident	84.5	Confident	25 Å²	25	69.7 Å²	69.7	13%	0.131	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-86.1	147.4	169.8	-67.5	179.4	0	0	0	109.3	K134 E140 M141 V144	K134-L136 PolarHBondContact O-N 3.39Å; L136-E140 HydrophobicContact CB-CB 4.01Å; L136-E140 HydrophobicContact CD2-CB 4.25Å; L136-M141 HydrophobicContact CB-CB 4.47Å; L136-V144 HydrophobicContact CD1-CG2 4.04Å
137	S	81.4	Confident	83	Confident	55 Å²	55	70.3 Å²	70.3	39%	0.385	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-58.8	159.1	167.3	67.7	0	0	0	0	110.3	Q139 E140 M141	S137-Q139 PolarHBondContact O-N 3.4Å; S137-E140 VanDerWaalsContact CB-OE2 3.24Å; S137-E140 WeakPolarHBondContact CB-OE2 3.39Å; S137-E140 PolarHBondContact N-OE2 3.4Å; S137-E140 PolarHBondContact O-N 2.76Å; S137-E140 WeakPolarHBondContact OG-CB 3.22Å; S137-E140 VanDerWaalsContact OG-CD 3.29Å; S137-E140 VanDerWaalsContact OG-CG 3.22Å; S137-E140 WeakPolarHBondContact OG-CG 3.06Å; S137-E140 PolarHBondContact OG-N 3.01Å; S137-E140 PolarHBondContact OG-OE2 2.86Å; S137-M141 WeakPolarHBondContact O-CB 3.35Å; S137-M141 PolarHBondContact O-N 3.04Å
138	R	79.3	Confident	81.3	Confident	232 Å²	232	75.3 Å²	75.3	88%	0.875	36%	0.36	S	S	*	.	H	α-helix	trans	-56.3	-37.7	177.9	-69.6	-174.6	179.8	-166.8	1.5	112	Q142	R138-Q142 WeakPolarHBondContact O-CB 3.43Å; R138-Q142 PolarHBondContact O-N 3.5Å
139	Q	78.2	Confident	79.5	Confident	131 Å²	131	78.9 Å²	78.9	61%	0.612	39%	0.388	S	S	*	.	H	α-helix	trans	-67.4	-50.6	178.3	-176.6	178.2	-13.6	0	0	111.4	S137 M141 Q142 E143	S137-Q139 PolarHBondContact O-N 3.4Å; Q139-M141 VanDerWaalsContact C-N 3.25Å; Q139-M141 PolarHBondContact O-N 3.07Å; Q139-Q142 WeakPolarHBondContact O-CB 3.48Å; Q139-Q142 PolarHBondContact O-N 3.35Å; Q139-E143 WeakPolarHBondContact CG-OE1 3.37Å; Q139-E143 PolarHBondContact NE2-OE1 3.5Å; Q139-E143 VanDerWaalsContact NE2-OE1 3.14Å; Q139-E143 WeakPolarHBondContact O-CG 3.36Å; Q139-E143 PolarHBondContact O-N 2.74Å
140	E	79.6	Confident	77.3	Confident	66 Å²	66	77.5 Å²	77.5	31%	0.308	40%	0.397	S	S	.	.	H	α-helix	trans	-59.1	-39.4	176.3	-71.1	165.1	129.2	0	0	111.1	L136 S137 Q142 E143 V144	L136-E140 HydrophobicContact CB-CB 4.01Å; L136-E140 HydrophobicContact CD2-CB 4.25Å; S137-E140 VanDerWaalsContact CB-OE2 3.24Å; S137-E140 WeakPolarHBondContact CB-OE2 3.39Å; S137-E140 PolarHBondContact N-OE2 3.4Å; S137-E140 PolarHBondContact O-N 2.76Å; S137-E140 WeakPolarHBondContact OG-CB 3.22Å; S137-E140 VanDerWaalsContact OG-CD 3.29Å; S137-E140 VanDerWaalsContact OG-CG 3.22Å; S137-E140 WeakPolarHBondContact OG-CG 3.06Å; S137-E140 PolarHBondContact OG-N 3.01Å; S137-E140 PolarHBondContact OG-OE2 2.86Å; E140-Q142 VanDerWaalsContact C-N 3.33Å; E140-Q142 PolarHBondContact O-N 3.31Å; E140-E143 PolarHBondContact O-N 3.23Å; E140-V144 WeakPolarHBondContact O-CB 3.33Å; E140-V144 WeakPolarHBondContact O-CG2 3.43Å; E140-V144 PolarHBondContact O-N 3.39Å
141	M	78.4	Confident	75.1	Confident	73 Å²	73	88.2 Å²	88.2	36%	0.36	44%	0.438	S	S	.	.	H	α-helix	trans	-63.4	-39.3	176	-172.1	176	-69	0	0	112.1	L136 S137 Q139 V144 Q145	L136-M141 HydrophobicContact CB-CB 4.47Å; S137-M141 WeakPolarHBondContact O-CB 3.35Å; S137-M141 PolarHBondContact O-N 3.04Å; Q139-M141 VanDerWaalsContact C-N 3.25Å; Q139-M141 PolarHBondContact O-N 3.07Å; M141-V144 PolarHBondContact O-N 2.76Å; M141-Q145 WeakPolarHBondContact O-CG 3.37Å; M141-Q145 PolarHBondContact O-N 3.26Å
142	Q	78.5	Confident	72.9	Confident	138 Å²	138	89.8 Å²	89.8	65%	0.645	47%	0.47	S	S	*	.	H	α-helix	trans	-68.9	-38.2	178.2	-164.2	166.8	26.4	0	0	111.8	R138 Q139 E140 Q145 S146	R138-Q142 WeakPolarHBondContact O-CB 3.43Å; R138-Q142 PolarHBondContact O-N 3.5Å; Q139-Q142 WeakPolarHBondContact O-CB 3.48Å; Q139-Q142 PolarHBondContact O-N 3.35Å; E140-Q142 VanDerWaalsContact C-N 3.33Å; E140-Q142 PolarHBondContact O-N 3.31Å; Q142-Q145 PolarHBondContact O-N 2.94Å; Q142-S146 WeakPolarHBondContact O-CB 3.32Å; Q142-S146 PolarHBondContact O-N 3.2Å; Q142-S146 PolarHBondContact O-OG 3.14Å
143	E	75.1	Confident	70.3	Confident	103 Å²	103	91.8 Å²	91.8	48%	0.481	49%	0.491	S	S	.	.	H	α-helix	trans	-66.5	-36	173.3	-69.9	173.2	-165.3	0	0	112.4	Q139 E140 S146 S147	Q139-E143 WeakPolarHBondContact CG-OE1 3.37Å; Q139-E143 PolarHBondContact NE2-OE1 3.5Å; Q139-E143 VanDerWaalsContact NE2-OE1 3.14Å; Q139-E143 WeakPolarHBondContact O-CG 3.36Å; Q139-E143 PolarHBondContact O-N 2.74Å; E140-E143 PolarHBondContact O-N 3.23Å; E143-S146 WeakPolarHBondContact CA-OG 3.24Å; E143-S146 PolarHBondContact O-OG 3.45Å; E143-S147 WeakPolarHBondContact O-CB 3.46Å; E143-S147 PolarHBondContact O-N 3.41Å; E143-S147 PolarHBondContact O-OG 3.32Å
144	V	71.1	Confident	68.1	Low	19 Å²	19	95.8 Å²	95.8	12%	0.115	52%	0.519	C	S	.	.	H	α-helix	trans	-69.5	-34.8	173.9	170.5	0	0	0	0	112.3	P53 L136 E140 M141 S147 R148	P53-V144 HydrophobicContact CB-CB 4.46Å; P53-V144 HydrophobicContact CB-CG1 4.42Å; P53-V144 HydrophobicContact CB-CG2 3.25Å; P53-V144 HydrophobicContact CG-CB 4.03Å; P53-V144 HydrophobicContact CG-CG1 3.48Å; P53-V144 VanDerWaalsContact CG-CG1 3.48Å; P53-V144 HydrophobicContact CG-CG2 3.29Å; L136-V144 HydrophobicContact CD1-CG2 4.04Å; E140-V144 WeakPolarHBondContact O-CB 3.33Å; E140-V144 WeakPolarHBondContact O-CG2 3.43Å; E140-V144 PolarHBondContact O-N 3.39Å; M141-V144 PolarHBondContact O-N 2.76Å; V144-S147 WeakPolarHBondContact CA-OG 3.2Å; V144-S147 PolarHBondContact O-OG 2.77Å; V144-S147 VanDerWaalsContact O-OG 3.06Å; V144-R148 WeakPolarHBondContact O-CG 3.35Å; V144-R148 PolarHBondContact O-N 3.16Å
145	Q	68.1	Low	65.5	Low	120 Å²	120	102.9 Å²	102.9	56%	0.561	55%	0.55	S	S	*	.	H	α-helix	trans	-73.2	-40.8	175.8	-74.7	175.9	-3.6	0	0	111.5	M141 Q142 S147 R148 S149	M141-Q145 WeakPolarHBondContact O-CG 3.37Å; M141-Q145 PolarHBondContact O-N 3.26Å; Q142-Q145 PolarHBondContact O-N 2.94Å; Q145-S147 PolarHBondContact O-N 3.06Å; Q145-R148 PolarHBondContact O-N 3.22Å; Q145-S149 PolarHBondContact O-N 3.45Å; Q145-S149 PolarHBondContact O-OG 2.94Å
146	S	64.9	Low	62.9	Low	67 Å²	67	105.2 Å²	105.2	47%	0.469	58%	0.575	S	S	.	*	H	α-helix	trans	-68.9	-33	178.7	63.5	0	0	0	0	113.1	Q142 E143 R148 S149 G150	Q142-S146 WeakPolarHBondContact O-CB 3.32Å; Q142-S146 PolarHBondContact O-N 3.2Å; Q142-S146 PolarHBondContact O-OG 3.14Å; E143-S146 WeakPolarHBondContact CA-OG 3.24Å; E143-S146 PolarHBondContact O-OG 3.45Å; S146-R148 VanDerWaalsContact C-N 3.32Å; S146-R148 PolarHBondContact O-N 3.46Å; S146-S149 WeakPolarHBondContact CA-OG 3.49Å; S146-S149 PolarHBondContact O-N 3.15Å; S146-S149 PolarHBondContact O-OG 2.91Å; S146-G150 PolarHBondContact O-N 3.45Å
147	S	59.9	Low	60.7	Low	78 Å²	78	113.6 Å²	113.6	55%	0.545	61%	0.611	S	S	.	*	H	α-helix	trans	-72.5	-21.1	173.4	51.9	0	0	0	0	113.9	E143 V144 Q145	E143-S147 WeakPolarHBondContact O-CB 3.46Å; E143-S147 PolarHBondContact O-N 3.41Å; E143-S147 PolarHBondContact O-OG 3.32Å; V144-S147 WeakPolarHBondContact CA-OG 3.2Å; V144-S147 PolarHBondContact O-OG 2.77Å; V144-S147 VanDerWaalsContact O-OG 3.06Å; Q145-S147 PolarHBondContact O-N 3.06Å
148	R	55.9	Low	58.6	Low	172 Å²	172	113.8 Å²	113.8	65%	0.649	62%	0.622	S	S	*	*	H	α-helix	trans	-79.3	-25.5	170.2	-75.2	176.8	177.6	-169.9	-3.8	113.3	V144 Q145 S146	V144-R148 WeakPolarHBondContact O-CG 3.35Å; V144-R148 PolarHBondContact O-N 3.16Å; Q145-R148 PolarHBondContact O-N 3.22Å; S146-R148 VanDerWaalsContact C-N 3.32Å; S146-R148 PolarHBondContact O-N 3.46Å
149	S	52.7	Low	56.5	Low	101 Å²	101	109.9 Å²	109.9	71%	0.706	62%	0.618	S	S	*	*	H	α-helix	trans	-82.1	-9.8	174	43.6	0	0	0	0	114.4	Q145 S146	Q145-S149 PolarHBondContact O-N 3.45Å; Q145-S149 PolarHBondContact O-OG 2.94Å; S146-S149 WeakPolarHBondContact CA-OG 3.49Å; S146-S149 PolarHBondContact O-N 3.15Å; S146-S149 PolarHBondContact O-OG 2.91Å
150	G	49.3	Very low	55.2	Low	68 Å²	68	109.9 Å²	109.9	70%	0.701	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-2.3	-179.3	0	0	0	0	0	115.6	S146	S146-G150 PolarHBondContact O-N 3.45Å
151	R	49.8	Very low	53.4	Low	224 Å²	224	117.6 Å²	117.6	85%	0.845	66%	0.659	S	S	*	*	S	Bend	trans	-121	101.1	177.9	-125.6	178.6	-175.6	-179.8	1.1	108.9	G153	R151-G153 PolarHBondContact O-N 2.84Å; R151-G153 VanDerWaalsContact O-N 3.16Å
152	G	48.4	Very low	51.5	Low	93 Å²	93	118.2 Å²	118.2	96%	0.959	68%	0.684	S	S	*	*			trans	-40.1	117.1	-179.5	0	0	0	0	0	112.8
153	G	40.9	Very low	49.6	Very low	46 Å²	46	115.6 Å²	115.6	47%	0.474	69%	0.694	S	S	.	*			trans	-163.1	85.5	175.5	0	0	0	0	0	106.3	R151 F155	R151-G153 PolarHBondContact O-N 2.84Å; R151-G153 VanDerWaalsContact O-N 3.16Å; G153-F155 WeakPolarHBondContact O-CD2 3.25Å; G153-F155 PolarHBondContact O-N 3.41Å
154	N	45.7	Very low	47.8	Very low	162 Å²	162	114.2 Å²	114.2	87%	0.866	71%	0.708	S	S	*	*			trans	-58.3	79.8	170.6	-177	67.5	0	0	0	109.5	G156	N154-G156 VanDerWaalsContact C-N 3.27Å; N154-G156 PolarHBondContact O-N 2.97Å
155	F	38.4	Very low	46.3	Very low	178 Å²	178	116.9 Å²	116.9	78%	0.781	74%	0.738	S	S	*	*			trans	-87.2	79.1	163.2	-67.4	-74.3	0	0	0	106.9	G153 F157	G153-F155 WeakPolarHBondContact O-CD2 3.25Å; G153-F155 PolarHBondContact O-N 3.41Å; F155-F157 PolarHBondContact O-N 2.75Å
156	G	39	Very low	44.9	Very low	59 Å²	59	118.6 Å²	118.6	61%	0.608	75%	0.752	S	S	*	*			trans	-60.6	102.2	172.1	0	0	0	0	0	110.3	N154	N154-G156 VanDerWaalsContact C-N 3.27Å; N154-G156 PolarHBondContact O-N 2.97Å
157	F	41.1	Very low	43.7	Very low	200 Å²	200	124.8 Å²	124.8	88%	0.877	77%	0.77	S	S	*	*			trans	-112.6	113.5	156.1	-76.8	-86	0	0	0	106.8	F155	F155-F157 PolarHBondContact O-N 2.75Å
158	G	35.8	Very low	42.5	Very low	60 Å²	60	124 Å²	124	62%	0.619	77%	0.774	S	S	*	*			trans	102.4	122.8	-175.7	0	0	0	0	0	111.2
159	D	36.3	Very low	42	Very low	149 Å²	149	122.3 Å²	122.3	80%	0.797	79%	0.785	S	S	*	*			cis	-158.1	136.8	10.3	-89.1	-83.3	0	0	0	107.5	R161	D159-R161 PolarHBondContact O-N 3.32Å
160	S	49.7	Very low	41	Very low	131 Å²	131	120.6 Å²	120.6	92%	0.916	78%	0.784	S	S	*	*			trans	-68.1	75.3	161	-61.8	0	0	0	0	109.6
161	R	41.5	Very low	40.5	Very low	229 Å²	229	124 Å²	124	86%	0.864	79%	0.794	S	S	*	*			trans	-147.9	88.9	164.5	-73.1	-163.4	-179.7	-174.7	0.9	111.2	D159	D159-R161 PolarHBondContact O-N 3.32Å
162	G	39.9	Very low	39.8	Very low	86 Å²	86	116.5 Å²	116.5	89%	0.887	79%	0.786	S	S	*	*			trans	76.4	127.2	134.8	0	0	0	0	0	117.7
163	G	37.8	Very low	39.4	Very low	82 Å²	82	117.7 Å²	117.7	85%	0.845	78%	0.78	S	S	*	*			trans	122.2	113.5	137.8	0	0	0	0	0	115.2
164	G	37.9	Very low	39.2	Very low	75 Å²	75	122.8 Å²	122.8	77%	0.773	80%	0.796	S	S	*	*			trans	89	83.7	142.8	0	0	0	0	0	115	N166	G164-N166 PolarHBondContact O-N 3.28Å
165	G	39.2	Very low	38.8	Very low	74 Å²	74	124 Å²	124	76%	0.763	79%	0.794	S	S	*	*			trans	-54.1	124.3	156.1	0	0	0	0	0	109.8
166	N	39.6	Very low	38.8	Very low	157 Å²	157	126.5 Å²	126.5	84%	0.84	80%	0.798	S	S	*	*			trans	-117.8	86.1	166.6	-163.3	46.9	0	0	0	106.8	G164 G168	G164-N166 PolarHBondContact O-N 3.28Å; N166-G168 PolarHBondContact O-N 2.84Å
167	F	39.3	Very low	38.5	Very low	197 Å²	197	127.8 Å²	127.8	86%	0.864	81%	0.812	S	S	*	*			trans	-63.5	104.5	169.9	-74.9	-88.5	0	0	0	108.1
168	G	34.8	Very low	38.1	Very low	60 Å²	60	121.7 Å²	121.7	62%	0.619	81%	0.805	S	S	*	*			trans	-62.9	133.9	163.7	0	0	0	0	0	109.4	N166 G170	N166-G168 PolarHBondContact O-N 2.84Å; G168-G170 PolarHBondContact O-N 2.66Å; G168-G170 VanDerWaalsContact O-N 3.15Å
169	P	44.4	Very low	38	Very low	137 Å²	137	124 Å²	124	89%	0.89	81%	0.812	S	S	*	*			trans	-75.5	109.3	-175.4	28.1	-30.8	0	0	0	110.2
170	G	32.1	Very low	38.1	Very low	66 Å²	66	123.9 Å²	123.9	68%	0.68	81%	0.811	S	S	*	*			trans	-74.9	152.5	164.4	0	0	0	0	0	111.4	G168	G168-G170 PolarHBondContact O-N 2.66Å; G168-G170 VanDerWaalsContact O-N 3.15Å
171	P	39.7	Very low	37.2	Very low	139 Å²	139	121 Å²	121	90%	0.903	80%	0.802	S	S	*	*			trans	-85.2	129.8	-172.5	32.9	-31.2	0	0	0	111.2
172	G	35.2	Very low	36.9	Very low	66 Å²	66	121 Å²	121	68%	0.68	80%	0.804	S	S	*	*			trans	163.4	115.6	166.5	0	0	0	0	0	117.2
173	S	39.1	Very low	36.6	Very low	119 Å²	119	120.6 Å²	120.6	83%	0.832	80%	0.8	S	S	*	*			trans	70.4	99.7	141.6	41.3	0	0	0	0	120.4
174	N	36	Very low	36.6	Very low	152 Å²	152	122.9 Å²	122.9	81%	0.813	80%	0.803	S	S	*	*			trans	-26.9	129	149.7	-57.4	-9	0	0	0	114.7
175	F	37.5	Very low	36.3	Very low	189 Å²	189	122.1 Å²	122.1	83%	0.829	80%	0.795	S	S	*	*			trans	-164	124.9	139.7	-95.7	-71.3	0	0	0	111.4
176	R	38.8	Very low	36.1	Very low	230 Å²	230	129.6 Å²	129.6	87%	0.868	80%	0.8	S	S	*	*			trans	63.9	109.8	155.4	-65.8	174.5	176.1	-152.1	-2.1	116.5
177	G	33.4	Very low	35.7	Very low	86 Å²	86	125.3 Å²	125.3	89%	0.887	79%	0.793	S	S	*	*				79.5	124	69.9	0	0	0	0	0	108.8
178	G	31.5	Very low	35.5	Very low	72 Å²	72	124.8 Å²	124.8	74%	0.742	79%	0.791	S	S	*	*			cis	175.7	176.4	8.1	0	0	0	0	0	106
179	S	34.4	Very low	35.5	Very low	108 Å²	108	125.5 Å²	125.5	76%	0.755	80%	0.798	S	S	*	*			trans	72.9	128.8	-178.1	-108	0	0	0	0	114
180	D	38.9	Very low	34.8	Very low	146 Å²	146	124.7 Å²	124.7	78%	0.781	79%	0.786	S	S	*	*			cis	-151.5	145.6	15.2	-64.5	-64.5	0	0	0	105.9
181	G	29.9	Very low	34.7	Very low	71 Å²	71	125 Å²	125	73%	0.732	79%	0.79	S	S	*	*			cis	110.8	56.6	35.7	0	0	0	0	0	111.6
182	Y	36.2	Very low	34.2	Very low	229 Å²	229	127.1 Å²	127.1	90%	0.898	78%	0.781	S	S	*	*			trans	-165.3	89.1	145.9	55.1	-86.6	0	0	0	110.8
183	G	33.6	Very low	34.2	Very low	78 Å²	78	131.4 Å²	131.4	80%	0.804	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-103.1	119.6	165	0	0	0	0	0	109.3	G185	G183-G185 PolarHBondContact O-N 3.48Å
184	S	37.5	Very low	33.8	Very low	130 Å²	130	128.5 Å²	128.5	91%	0.909	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-69.1	124	163.6	-65.7	0	0	0	0	108.9
185	G	32	Very low	33.6	Very low	59 Å²	59	131.9 Å²	131.9	61%	0.608	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-60.4	148.2	-176.6	0	0	0	0	0	114	G183	G183-G185 PolarHBondContact O-N 3.48Å
186	R	34.4	Very low	33.3	Very low	231 Å²	231	126.8 Å²	126.8	87%	0.872	78%	0.78	S	S	*	*				84.7	108.6	92.7	-70.5	179.8	-162.3	-139.7	5.5	109.5	F188	R186-F188 HydrophobicContact CB-CE2 4.42Å
187	G	30.7	Very low	33	Very low	66 Å²	66	119.7 Å²	119.7	68%	0.68	78%	0.779	S	S	*	*				112.9	151.6	76.9	0	0	0	0	0	105.6
188	F	34.8	Very low	32.8	Very low	187 Å²	187	119.4 Å²	119.4	82%	0.82	78%	0.776	S	S	*	*			cis	-162.9	160	26.7	-75.6	-96	0	0	0	106.8	R186	R186-F188 HydrophobicContact CB-CE2 4.42Å
189	G	34.8	Very low	33.6	Very low	75 Å²	75	122.2 Å²	122.2	77%	0.773	78%	0.781	S	S	*	*			trans	162.7	57.2	169.6	0	0	0	0	0	115.3
190	D	31.2	Very low	33.5	Very low	119 Å²	119	121.2 Å²	121.2	64%	0.636	79%	0.788	S	S	*	*			trans	-44.5	147.4	167.5	-64	-90.9	0	0	0	114.9	Y192	D190-Y192 HydrophobicContact CB-CE2 3.89Å; D190-Y192 PolarHBondContact OD1-OH 2.63Å
191	G	29.5	Very low	33.1	Very low	74 Å²	74	118 Å²	118	76%	0.763	79%	0.789	S	S	*	*			trans	175.1	61.4	172.6	0	0	0	0	0	115.9
192	Y	29.5	Very low	33.5	Very low	182 Å²	182	118.5 Å²	118.5	71%	0.714	80%	0.795	S	S	*	*			trans	-58	128.5	172.4	-36.3	-93.5	0	0	0	112.4	D190	D190-Y192 HydrophobicContact CB-CE2 3.89Å; D190-Y192 PolarHBondContact OD1-OH 2.63Å
193	N	33.9	Very low	33.3	Very low	156 Å²	156	115 Å²	115	83%	0.834	79%	0.792	S	S	*	*				168.5	130.7	124.2	-92	-15.6	0	0	0	111.7
194	G	30.9	Very low	33.5	Very low	58 Å²	58	120.5 Å²	120.5	60%	0.598	79%	0.793	S	S	*	*			trans	145.7	94	138	0	0	0	0	0	116.9
195	Y	32.4	Very low	33.2	Very low	224 Å²	224	118.3 Å²	118.3	88%	0.878	79%	0.791	S	S	*	*			trans	35.6	110.6	139.4	-47.1	-84.1	0	0	0	116.9
196	G	31.2	Very low	33.1	Very low	81 Å²	81	119.4 Å²	119.4	84%	0.835	80%	0.803	S	S	*	*				106.6	128.4	63.1	0	0	0	0	0	110.3
197	G	31.8	Very low	33.1	Very low	82 Å²	82	114.1 Å²	114.1	85%	0.845	80%	0.802	S	S	*	*			trans	93.4	119.6	157.2	0	0	0	0	0	118
198	G	29.9	Very low	34.1	Very low	79 Å²	79	116.3 Å²	116.3	81%	0.814	80%	0.804	S	S	*	*			trans	-74.8	-139.4	160.2	0	0	0	0	0	111.5
199	P	48	Very low	33.8	Very low	132 Å²	132	109.8 Å²	109.8	86%	0.857	79%	0.789	S	S	*	*			cis	-132.2	175.5	-34.7	39.1	-23.5	0	0	0	112.4
200	G	31.3	Very low	33.7	Very low	87 Å²	87	117.2 Å²	117.2	90%	0.897	80%	0.795	S	S	*	*			trans	72.5	162.1	157.8	0	0	0	0	0	115.7
201	G	32.4	Very low	33.8	Very low	78 Å²	78	115.4 Å²	115.4	80%	0.804	81%	0.805	S	S	*	*			cis	-177.4	160.7	7.1	0	0	0	0	0	106.5
202	G	37.8	Very low	33.9	Very low	82 Å²	82	116 Å²	116	85%	0.845	81%	0.812	S	S	*	*			trans	-68.3	172.8	-166.5	0	0	0	0	0	116.8
203	N	31.5	Very low	34.1	Very low	156 Å²	156	111.5 Å²	111.5	83%	0.834	82%	0.82	S	S	*	*			trans	-156	157.2	161.5	-154.2	26.3	0	0	0	113.8
204	F	36.9	Very low	34.2	Very low	192 Å²	192	116.6 Å²	116.6	84%	0.842	83%	0.828	S	S	*	*			trans	-76.6	153.9	-164.3	-73.1	-113.3	0	0	0	116.9
205	G	31.5	Very low	34.3	Very low	84 Å²	84	117.5 Å²	117.5	87%	0.866	84%	0.837	S	S	*	*				61.6	132.2	118	0	0	0	0	0	122.5
206	G	31.2	Very low	34.3	Very low	83 Å²	83	109.8 Å²	109.8	86%	0.856	83%	0.826	S	S	*	*			trans	145.5	105.3	154	0	0	0	0	0	115.9
207	S	34.3	Very low	34.5	Very low	120 Å²	120	116.8 Å²	116.8	84%	0.839	83%	0.829	S	S	*	*			trans	-80.9	-169.9	171.6	-41.2	0	0	0	0	112.3
208	P	51.5	Low	34.5	Very low	112 Å²	112	116.5 Å²	116.5	73%	0.727	83%	0.826	S	S	*	*			cis	-137.1	173.7	-14.4	33.1	-12.6	0	0	0	114.6
209	G	28.2	Very low	34.7	Very low	50 Å²	50	116.7 Å²	116.7	52%	0.515	83%	0.828	S	S	.	*			trans	160	109	153.5	0	0	0	0	0	120.8
210	Y	32.9	Very low	34	Very low	230 Å²	230	114.4 Å²	114.4	90%	0.902	83%	0.828	S	S	*	*			trans	61.6	132.1	139.6	-2.6	-86.2	0	0	0	122.6
211	G	33.5	Very low	34.3	Very low	82 Å²	82	114.1 Å²	114.1	85%	0.845	83%	0.825	S	S	*	*			trans	123	108.2	163.7	0	0	0	0	0	110.5
212	G	30.9	Very low	34.9	Very low	87 Å²	87	116.7 Å²	116.7	90%	0.897	83%	0.828	S	S	*	*			cis	116.6	114.4	34.9	0	0	0	0	0	106.8
213	G	34.7	Very low	34.7	Very low	87 Å²	87	116.6 Å²	116.6	90%	0.897	83%	0.827	S	S	*	*			trans	164.1	84.7	176.8	0	0	0	0	0	114.5
214	R	34.5	Very low	34.7	Very low	262 Å²	262	120.3 Å²	120.3	99%	0.989	83%	0.831	S	S	*	*			trans	-100.8	146	169.4	-123	-176.3	-175.7	-114	3.3	108.8
215	G	33.6	Very low	34.6	Very low	77 Å²	77	114.3 Å²	114.3	79%	0.794	82%	0.824	S	S	*	*			trans	136.2	105.5	164.9	0	0	0	0	0	110.6
216	G	32.3	Very low	34.7	Very low	63 Å²	63	118.3 Å²	118.3	65%	0.649	83%	0.825	S	S	*	*				85.4	132.2	89.7	0	0	0	0	0	108
217	Y	34.8	Very low	34.9	Very low	227 Å²	227	123.1 Å²	123.1	89%	0.89	83%	0.825	S	S	*	*			cis	-177.2	158.4	46.3	34.3	-95.6	0	0	0	109.7
218	G	32.6	Very low	34.7	Very low	76 Å²	76	121.4 Å²	121.4	78%	0.784	83%	0.827	S	S	*	*			trans	65.1	115.9	141.4	0	0	0	0	0	119
219	G	34.3	Very low	33.9	Very low	84 Å²	84	119.6 Å²	119.6	87%	0.866	83%	0.828	S	S	*	*				106.1	111.8	83.4	0	0	0	0	0	108.7
220	G	33.7	Very low	34.1	Very low	83 Å²	83	121 Å²	121	86%	0.856	84%	0.842	S	S	*	*				108.9	93.3	72.5	0	0	0	0	0	107.8
221	G	37.4	Very low	34.1	Very low	81 Å²	81	120.8 Å²	120.8	84%	0.835	84%	0.841	S	S	*	*			trans	-84	163.7	179.4	0	0	0	0	0	113.4
222	P	45.3	Very low	34	Very low	133 Å²	133	120.7 Å²	120.7	86%	0.864	84%	0.84	S	S	*	*			trans	-117.6	136.7	153.7	26.4	-10	0	0	0	109.4
223	G	32.3	Very low	34	Very low	80 Å²	80	120.4 Å²	120.4	83%	0.825	84%	0.838	S	S	*	*				104.5	96	55.2	0	0	0	0	0	107.7
224	Y	33.1	Very low	33.8	Very low	234 Å²	234	119.7 Å²	119.7	92%	0.918	83%	0.831	S	S	*	*			trans	-105.1	121	172.8	53.3	-96.3	0	0	0	110.1
225	G	33.5	Very low	33.7	Very low	66 Å²	66	118 Å²	118	68%	0.68	83%	0.826	S	S	*	*			trans	-158	119.7	164.6	0	0	0	0	0	107.7
226	N	33.3	Very low	33.9	Very low	167 Å²	167	121.6 Å²	121.6	89%	0.893	83%	0.827	S	S	*	*			trans	-165	134.4	140.7	-129.6	-47.9	0	0	0	112
227	Q	35.9	Very low	33.9	Very low	184 Å²	184	124.3 Å²	124.3	86%	0.86	83%	0.826	S	S	*	*			trans	-91.9	153.6	167	-79.5	157.8	-36.4	0	0	108.9
228	G	31.3	Very low	33.8	Very low	85 Å²	85	123.5 Å²	123.5	88%	0.876	82%	0.823	S	S	*	*			trans	111	138	149.3	0	0	0	0	0	116.2
229	G	34.4	Very low	33.7	Very low	73 Å²	73	123.7 Å²	123.7	75%	0.753	83%	0.826	S	S	*	*			trans	144.1	83.2	161.6	0	0	0	0	0	114.1
230	G	31	Very low	33.5	Very low	79 Å²	79	123.7 Å²	123.7	81%	0.814	83%	0.826	S	S	*	*			trans	-78.6	159	163.7	0	0	0	0	0	112.3
231	Y	34.7	Very low	33.4	Very low	226 Å²	226	123.2 Å²	123.2	89%	0.886	82%	0.82	S	S	*	*			trans	-156	131.6	154.7	49.9	-89.8	0	0	0	108.8
232	G	30.6	Very low	33.3	Very low	80 Å²	80	126.8 Å²	126.8	83%	0.825	82%	0.82	S	S	*	*			trans	-98.2	-176.9	170.7	0	0	0	0	0	112.6
233	G	31	Very low	32.8	Very low	82 Å²	82	131.2 Å²	131.2	85%	0.845	82%	0.821	S	S	*	*			trans	112.3	116.2	175	0	0	0	0	0	110.9
234	G	29.6	Very low	32.7	Very low	72 Å²	72	130.7 Å²	130.7	74%	0.742	82%	0.816	S	S	*	*			cis	104.5	99.6	21.1	0	0	0	0	0	109.9
235	Y	33.6	Very low	32.7	Very low	227 Å²	227	125.8 Å²	125.8	89%	0.89	82%	0.816	S	S	*	*			trans	-172.8	144.5	144.3	55.8	-95.9	0	0	0	112
236	D	37	Very low	32.4	Very low	151 Å²	151	126.6 Å²	126.6	81%	0.807	83%	0.825	S	S	*	*			trans	-87.5	160.7	-175.6	-54.8	-92	0	0	0	114.8
237	N	32.5	Very low	32.3	Very low	120 Å²	120	124.5 Å²	124.5	64%	0.642	81%	0.813	S	S	*	*			trans	89.8	136.4	130.8	-135.3	-24	0	0	0	123.7
238	Y	33.7	Very low	32.1	Very low	210 Å²	210	124.3 Å²	124.3	82%	0.824	81%	0.806	S	S	*	*			trans	102.9	120.2	148.1	-69.6	-71.4	0	0	0	122.2
239	G	29.8	Very low	32.2	Very low	81 Å²	81	127.1 Å²	127.1	84%	0.835	80%	0.801	S	S	*	*			trans	109.6	120.3	149.4	0	0	0	0	0	114.4
240	G	30.5	Very low	32.4	Very low	84 Å²	84	130.5 Å²	130.5	87%	0.866	80%	0.802	S	S	*	*			cis	114.3	112.9	17.3	0	0	0	0	0	111.3
241	G	30.2	Very low	32.3	Very low	72 Å²	72	136.3 Å²	136.3	74%	0.742	81%	0.805	S	S	*	*			trans	95	111.3	165.6	0	0	0	0	0	115.3
242	N	35.5	Very low	32.1	Very low	156 Å²	156	129 Å²	129	83%	0.834	80%	0.798	S	S	*	*				68.1	106.2	60.5	-168.2	32.4	0	0	0	115.8
243	Y	34.5	Very low	32.2	Very low	226 Å²	226	131.9 Å²	131.9	89%	0.886	80%	0.795	S	S	*	*			trans	-165.9	134.4	138.7	40.4	-100.4	0	0	0	113.8
244	G	31.2	Very low	32.2	Very low	70 Å²	70	138.2 Å²	138.2	72%	0.722	80%	0.795	S	S	*	*			trans	99	90.2	153.1	0	0	0	0	0	115.6
245	S	32.1	Very low	32.4	Very low	131 Å²	131	140.9 Å²	140.9	92%	0.916	79%	0.792	S	S	*	*				60.1	114.6	61.4	-168.1	0	0	0	0	115
246	G	28.9	Very low	32.4	Very low	83 Å²	83	138.2 Å²	138.2	86%	0.856	79%	0.788	S	S	*	*			trans	178.4	92.6	168.7	0	0	0	0	0	111.8
247	N	29.6	Very low	32.4	Very low	123 Å²	123	139.6 Å²	139.6	66%	0.658	79%	0.789	S	S	*	*			trans	-99	168.2	-169.7	-169.1	9.2	0	0	0	112.4
248	Y	31.4	Very low	33	Very low	179 Å²	179	139.3 Å²	139.3	70%	0.702	79%	0.794	S	S	*	*			trans	91.2	108.4	162.1	-62	-79.8	0	0	0	119.5
249	N	34.4	Very low	33.8	Very low	144 Å²	144	134.9 Å²	134.9	77%	0.77	79%	0.794	S	S	*	*				-173.5	115.4	92.4	-83	-45.3	0	0	0	111.7
250	D	37.8	Very low	33.9	Very low	145 Å²	145	137.4 Å²	137.4	78%	0.775	79%	0.788	S	S	*	*			trans	-88.2	123.9	160.4	172.6	15.3	0	0	0	107.7
251	F	29.1	Very low	34.1	Very low	200 Å²	200	143.7 Å²	143.7	88%	0.877	79%	0.787	S	S	*	*			trans	-164.6	122	157.2	-89.8	-69.6	0	0	0	111.5
252	G	30.4	Very low	34.2	Very low	73 Å²	73	143.5 Å²	143.5	75%	0.753	79%	0.785	S	S	*	*				102.6	90.6	125.7	0	0	0	0	0	119.2
253	N	33.7	Very low	34.9	Very low	141 Å²	141	141.3 Å²	141.3	75%	0.754	78%	0.779	S	S	*	*			trans	-59.3	131.8	150.5	176.1	9.5	0	0	0	111.4
254	Y	30.6	Very low	35	Very low	215 Å²	215	139.1 Å²	139.1	84%	0.843	78%	0.779	S	S	*	*			trans	-175.2	109.7	134.3	-102.9	-75.5	0	0	0	111.4
255	N	33.3	Very low	35.3	Very low	127 Å²	127	145.3 Å²	145.3	68%	0.679	79%	0.786	S	S	*	*			trans	29.8	137.9	130.1	-136.5	11.6	0	0	0	122
256	Q	33.2	Very low	35.2	Very low	171 Å²	171	145 Å²	145	80%	0.799	78%	0.784	S	S	*	*			trans	88.1	120.9	152.1	-47.5	-159.8	68.2	0	0	120
257	Q	38.3	Very low	35.4	Very low	181 Å²	181	144.3 Å²	144.3	85%	0.846	78%	0.777	S	S	*	*			trans	-42.2	158.9	158.2	-74.4	-158.6	-7.7	0	0	112.8
258	P	45	Very low	35.5	Very low	113 Å²	113	145.9 Å²	145.9	73%	0.734	79%	0.785	S	S	*	*			cis	-151.2	167.8	46	36.8	-13.4	0	0	0	118.6
259	S	49.5	Very low	36	Very low	117 Å²	117	147.3 Å²	147.3	82%	0.818	80%	0.796	S	S	*	*			trans	-62.5	130.7	161.3	-48.5	0	0	0	0	110.9
260	N	33.3	Very low	35.9	Very low	134 Å²	134	143.9 Å²	143.9	72%	0.717	79%	0.794	S	S	*	*			trans	-148.9	103.1	172.9	-152.5	37.7	0	0	0	110.4
261	Y	33.7	Very low	35.6	Very low	217 Å²	217	140.7 Å²	140.7	85%	0.851	80%	0.795	S	S	*	*				86	141.2	104.4	-99.1	-104.9	0	0	0	114.7
262	G	33	Very low	35.8	Very low	67 Å²	67	135.7 Å²	135.7	69%	0.691	79%	0.786	S	S	*	*			cis	176.7	-150	11.3	0	0	0	0	0	108.2
263	P	50.7	Low	36	Very low	111 Å²	111	143.4 Å²	143.4	72%	0.721	79%	0.792	S	S	*	*			cis	-135.5	-173.1	-14.7	39.6	-20	0	0	0	115
264	M	35.1	Very low	36	Very low	180 Å²	180	143.9 Å²	143.9	89%	0.887	79%	0.794	S	S	*	*			trans	97	126.8	168.6	-55.7	-171.7	167.5	0	0	115.8
265	K	38.6	Very low	36.1	Very low	200 Å²	200	142.3 Å²	142.3	87%	0.87	80%	0.797	S	S	*	*			cis	-161.6	134.3	7.3	-153.4	175.8	-176.4	-177.9	0	109.2
266	S	30.2	Very low	36.1	Very low	124 Å²	124	140 Å²	140	87%	0.867	80%	0.802	S	S	*	*			trans	-67.4	137.2	177.2	150.9	0	0	0	0	113.5
267	G	32.4	Very low	36	Very low	69 Å²	69	135.4 Å²	135.4	71%	0.711	80%	0.802	S	S	*	*				130.5	152.1	110	0	0	0	0	0	109.2
268	N	32.7	Very low	36.7	Very low	155 Å²	155	132.5 Å²	132.5	83%	0.829	80%	0.798	S	S	*	*			cis	-170.6	142.2	20.3	-177.2	54.5	0	0	0	108.3
269	F	41.5	Very low	36.2	Very low	210 Å²	210	138 Å²	138	92%	0.921	81%	0.806	S	S	*	*			trans	-90	139.9	164.6	-99.1	-94.4	0	0	0	109.8
270	G	30.9	Very low	35.4	Very low	71 Å²	71	136.1 Å²	136.1	73%	0.732	81%	0.805	S	S	*	*			trans	146.1	123.2	172.1	0	0	0	0	0	109.6
271	G	33	Very low	35.4	Very low	78 Å²	78	133.9 Å²	133.9	80%	0.804	81%	0.813	S	S	*	*			cis	96.7	74.2	25.6	0	0	0	0	0	111.1
272	S	31.8	Very low	35.4	Very low	96 Å²	96	127.2 Å²	127.2	67%	0.671	81%	0.811	S	S	*	*			trans	-173.5	117	148	-116.7	0	0	0	0	115.2
273	R	35.9	Very low	35.7	Very low	235 Å²	235	130.7 Å²	130.7	89%	0.887	81%	0.813	S	S	*	*				61.2	117.3	126.4	-57.6	173.5	-165	-172.9	3.3	121.1
274	N	32.8	Very low	35.1	Very low	150 Å²	150	136.1 Å²	136.1	80%	0.802	82%	0.821	S	S	*	*				-157.2	101.5	129	-138	11.7	0	0	0	108.4
275	M	34	Very low	35.2	Very low	183 Å²	183	130.7 Å²	130.7	90%	0.901	81%	0.811	S	S	*	*				87.8	118.9	98.8	-80.2	-68.1	-168.2	0	0	115
276	G	31.5	Very low	36	Very low	77 Å²	77	127.9 Å²	127.9	79%	0.794	81%	0.814	S	S	*	*			trans	131.9	86.6	153.5	0	0	0	0	0	117.8
277	G	32.7	Very low	36.3	Very low	76 Å²	76	125.8 Å²	125.8	78%	0.784	81%	0.812	S	S	*	*			trans	-90.7	-164.9	142	0	0	0	0	0	109.4
278	P	52.1	Low	36.5	Very low	119 Å²	119	126.5 Å²	126.5	77%	0.773	82%	0.819	S	S	*	*			cis	-145.7	146.1	-5.2	38.2	-19	0	0	0	115.7
279	Y	34.3	Very low	36.9	Very low	230 Å²	230	125 Å²	125	90%	0.902	82%	0.821	S	S	*	*			trans	-179.9	122.6	144.3	50.5	-98.4	0	0	0	109.4
280	G	32.2	Very low	36.6	Very low	76 Å²	76	118.8 Å²	118.8	78%	0.784	82%	0.816	S	S	*	*				83.5	99.3	96	0	0	0	0	0	110.2
281	G	34	Very low	36.8	Very low	87 Å²	87	119.1 Å²	119.1	90%	0.897	82%	0.819	S	S	*	*				100.8	129.8	73	0	0	0	0	0	109.3
282	G	33	Very low	37.3	Very low	78 Å²	78	121.2 Å²	121.2	80%	0.804	82%	0.821	S	S	*	*			trans	155.2	88.4	170.2	0	0	0	0	0	117.4
283	N	40.2	Very low	37.7	Very low	139 Å²	139	120.3 Å²	120.3	74%	0.743	83%	0.827	S	S	*	*			trans	-69.2	128.3	158.3	163	79.4	0	0	0	111.1
284	Y	39.2	Very low	37.7	Very low	225 Å²	225	112 Å²	112	88%	0.882	82%	0.815	S	S	*	*			trans	-155.9	128.3	146.7	-73.3	-68.5	0	0	0	110.9
285	G	35.7	Very low	38.2	Very low	66 Å²	66	115.5 Å²	115.5	68%	0.68	82%	0.818	S	S	*	*			trans	-81	-149.6	174.2	0	0	0	0	0	114.2
286	P	57	Low	38.6	Very low	141 Å²	141	110.6 Å²	110.6	92%	0.916	81%	0.814	S	S	*	*			trans	-96.3	152.7	-131.2	37.2	-35.5	0	0	0	114.9
287	G	35.7	Very low	39.2	Very low	80 Å²	80	110.5 Å²	110.5	83%	0.825	81%	0.813	S	S	*	*			trans	-151.2	131.8	162.4	0	0	0	0	0	108.2
288	G	35.8	Very low	39.9	Very low	84 Å²	84	117.9 Å²	117.9	87%	0.866	82%	0.818	S	S	*	*			cis	102.9	77	28	0	0	0	0	0	109.4
289	S	42	Very low	39.6	Very low	125 Å²	125	117.2 Å²	117.2	87%	0.874	82%	0.816	S	S	*	*			trans	-162.7	130.5	153.2	61.8	0	0	0	0	107.3
290	G	35.2	Very low	40.5	Very low	79 Å²	79	115 Å²	115	81%	0.814	81%	0.806	S	S	*	*			cis	133.8	108.9	9.6	0	0	0	0	0	108.9
291	G	35.8	Very low	41.5	Very low	77 Å²	77	124.6 Å²	124.6	79%	0.794	82%	0.821	S	S	*	*			trans	83.6	140.7	159.5	0	0	0	0	0	116
292	S	42.7	Very low	41.9	Very low	122 Å²	122	126.5 Å²	126.5	85%	0.853	82%	0.817	S	S	*	*			cis	-175.5	145.2	18.3	46.9	0	0	0	0	113
293	G	39.3	Very low	42.4	Very low	77 Å²	77	129.1 Å²	129.1	79%	0.794	82%	0.817	S	S	*	*			trans	77.4	117.9	150.3	0	0	0	0	0	116.8
294	G	37.1	Very low	42.5	Very low	61 Å²	61	128.5 Å²	128.5	63%	0.629	82%	0.822	S	S	*	*				87.9	131.6	64.8	0	0	0	0	0	107.6
295	Y	43.3	Very low	42.7	Very low	224 Å²	224	122.8 Å²	122.8	88%	0.878	82%	0.818	S	S	*	*			cis	-180	151	39.4	21.7	-100.1	0	0	0	108.7
296	G	41.2	Very low	43.1	Very low	79 Å²	79	126.4 Å²	126.4	81%	0.814	83%	0.827	S	S	*	*			trans	66.1	127.8	151	0	0	0	0	0	118.4
297	G	45.9	Very low	42.2	Very low	75 Å²	75	125.4 Å²	125.4	77%	0.773	82%	0.821	S	S	*	*			cis	78.7	81.6	32.2	0	0	0	0	0	112.1
298	R	46.9	Very low	42.6	Very low	231 Å²	231	128.6 Å²	128.6	87%	0.872	82%	0.82	S	S	*	*			trans	171.3	131.4	131.5	-101.6	176.9	177.5	-161.5	0.4	114.2
299	S	44.3	Very low	43.2	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	82%	0.817	S	S	*	*			trans	-48.6	140.3	149	173.5	0	0	0	0	112.3
300	R	53.7	Low	43.3	Very low	183 Å²	183	132.7 Å²	132.7	69%	0.691	81%	0.812	S	S	*	*				176.5	144	123.3	-97.6	-165	-138.8	-171.2	5.6	113.1
301	Y	53.9	Low	44	Very low	278 Å²	278	137.5 Å²	137.5	100%	1.09	81%	0.812	S	S	*	*			trans	70.7	0	167.2	-60.5	-69.5	0	0	0	118.3

Retrieved 301 of 301 residues in 195.6 ms (Link to these results)

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