A0A077YVV8_TRITR Loading...

StAR-related lipid transfer protein 5

May be involved in the intracellular transport of sterols or other lipids. May bind cholesterol or other sterols.

AlphaFold DB , UniProt , Accession A0A077YVV8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 247 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	35.8	Very low	72.5	Confident	221 Å²	221	86.4 Å²	86.4	100%	1.089	53%	0.526	S	S	*	.				0	122.8	0	-62.3	173.6	-163.5	0	0	104.2
2	G	48.7	Very low	74.4	Confident	58 Å²	58	80.5 Å²	80.5	60%	0.598	49%	0.49	S	S	*	.			cis	152.4	90.5	0.4	0	0	0	0	0	105.7	G4	G2-G4 PolarHBondContact O-N 3.09Å
3	I	49.4	Very low	76	Confident	85 Å²	85	83.9 Å²	83.9	44%	0.436	50%	0.498	S	S	.	.			trans	-55.1	13.9	176.4	20	170.3	0	0	0	114.9	E5 I6 L115	I3-E5 PolarHBondContact O-N 3.33Å; I3-I6 PolarHBondContact O-N 3.36Å; I3-L115 HydrophobicContact CG2-CD2 4.15Å
4	G	53.7	Low	77.3	Confident	85 Å²	85	84.9 Å²	84.9	88%	0.876	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-0.9	-176.3	0	0	0	0	0	115.7	G2	G2-G4 PolarHBondContact O-N 3.09Å
5	E	71.4	Confident	78.6	Confident	146 Å²	146	79.3 Å²	79.3	68%	0.682	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.5	-14.1	-179.9	-143.9	175.9	-178.5	0	0	113.9	I3	I3-E5 PolarHBondContact O-N 3.33Å
6	I	78.7	Confident	79.7	Confident	22 Å²	22	78.6 Å²	78.6	11%	0.113	46%	0.455	C	S	.	.			trans	-108.7	107.9	-177.1	-57.6	173.6	0	0	0	109.1	I3 V8 I142 V159 Y161	I3-I6 PolarHBondContact O-N 3.36Å; I6-V8 VanDerWaalsContact C-N 3.33Å; I6-V8 HydrophobicContact CG2-CG2 4.09Å; I6-V8 PolarHBondContact O-N 3.4Å; I6-I142 HydrophobicContact CG2-CD1 3.89Å; I6-V159 HydrophobicContact CD1-CB 4.09Å; I6-V159 HydrophobicContact CD1-CG2 3.85Å; I6-V159 HydrophobicContact CG1-CB 4.49Å; I6-V159 HydrophobicContact CG2-CG1 4.23Å; I6-Y161 HydrophobicContact CD1-CD2 3.87Å
7	D	89.3	Confident	80.6	Confident	102 Å²	102	78.2 Å²	78.2	55%	0.545	45%	0.454	S	S	.	.			trans	-72.5	91.4	164.8	-172.9	-20.7	0	0	0	108.8	D9 A10 S11	D7-D9 PolarHBondContact OD1-N 3.15Å; D7-A10 HydrophobicContact CB-CB 4.05Å; D7-A10 WeakPolarHBondContact OD1-CB 3.21Å; D7-A10 PolarHBondContact OD1-N 2.97Å; D7-A10 WeakPolarHBondContact OD2-CB 3.43Å; D7-S11 VanDerWaalsContact O-CB 3.28Å; D7-S11 WeakPolarHBondContact O-CB 3.32Å; D7-S11 PolarHBondContact O-N 3.31Å; D7-S11 PolarHBondContact O-OG 3.36Å
8	V	92	Very high	81.4	Confident	25 Å²	25	75.8 Å²	75.8	15%	0.152	44%	0.438	C	S	.	.	H	α-helix	trans	-61.7	-45	-176.9	179	0	0	0	0	110.4	I6 S11 V12 L115 V119	I6-V8 VanDerWaalsContact C-N 3.33Å; I6-V8 HydrophobicContact CG2-CG2 4.09Å; I6-V8 PolarHBondContact O-N 3.4Å; V8-S11 PolarHBondContact O-N 3.49Å; V8-V12 HydrophobicContact CG1-CG2 4.16Å; V8-V12 WeakPolarHBondContact O-CB 3.4Å; V8-V12 VanDerWaalsContact O-CG2 3.22Å; V8-V12 WeakPolarHBondContact O-CG2 3.38Å; V8-V12 PolarHBondContact O-N 2.94Å; V8-L115 HydrophobicContact CG1-CB 4.1Å; V8-L115 HydrophobicContact CG1-CD1 4.37Å; V8-L115 HydrophobicContact CG2-CB 4.35Å; V8-L115 HydrophobicContact CG2-CD1 4.19Å; V8-L115 HydrophobicContact CG2-CD2 4.44Å; V8-V119 HydrophobicContact CG1-CG1 4.23Å
9	D	93.1	Very high	82.1	Confident	126 Å²	126	71.8 Å²	71.8	67%	0.674	42%	0.415	S	S	*	.	H	α-helix	trans	-64.6	-46.8	-176.6	-74.5	-24.7	0	0	0	111.4	D7 S11 V12 Q13	D7-D9 PolarHBondContact OD1-N 3.15Å; D9-S11 VanDerWaalsContact C-N 3.34Å; D9-S11 PolarHBondContact O-N 2.92Å; D9-V12 PolarHBondContact O-N 2.87Å; D9-Q13 WeakPolarHBondContact O-CB 3.39Å; D9-Q13 VanDerWaalsContact O-CG 3.3Å; D9-Q13 WeakPolarHBondContact O-CG 3.08Å; D9-Q13 PolarHBondContact O-N 3.35Å
10	A	92.6	Very high	82.7	Confident	50 Å²	50	71.5 Å²	71.5	41%	0.413	41%	0.409	S	S	.	.	H	α-helix	trans	-63.7	-41	176.3	0	0	0	0	0	111.8	D7 Q13 L14	D7-A10 HydrophobicContact CB-CB 4.05Å; D7-A10 WeakPolarHBondContact OD1-CB 3.21Å; D7-A10 PolarHBondContact OD1-N 2.97Å; D7-A10 WeakPolarHBondContact OD2-CB 3.43Å; A10-Q13 PolarHBondContact O-N 3.18Å; A10-L14 WeakPolarHBondContact O-CB 3.1Å; A10-L14 PolarHBondContact O-N 3.05Å
11	S	92.7	Very high	83.2	Confident	30 Å²	30	72.7 Å²	72.7	21%	0.21	42%	0.415	C	S	.	.	H	α-helix	trans	-63.1	-43.5	178.2	-60.2	0	0	0	0	111.6	D7 V8 D9 L15	D7-S11 VanDerWaalsContact O-CB 3.28Å; D7-S11 WeakPolarHBondContact O-CB 3.32Å; D7-S11 PolarHBondContact O-N 3.31Å; D7-S11 PolarHBondContact O-OG 3.36Å; V8-S11 PolarHBondContact O-N 3.49Å; D9-S11 VanDerWaalsContact C-N 3.34Å; D9-S11 PolarHBondContact O-N 2.92Å; S11-L15 WeakPolarHBondContact O-CB 3.3Å; S11-L15 PolarHBondContact O-N 2.64Å
12	V	95.2	Very high	85.9	Confident	16 Å²	16	62.3 Å²	62.3	10%	0.097	36%	0.364	C	S	.	.	H	α-helix	trans	-67.1	-43.2	178.3	169.2	0	0	0	0	111.3	V8 D9 L15 K16 V119 I142 V144	V8-V12 HydrophobicContact CG1-CG2 4.16Å; V8-V12 WeakPolarHBondContact O-CB 3.4Å; V8-V12 VanDerWaalsContact O-CG2 3.22Å; V8-V12 WeakPolarHBondContact O-CG2 3.38Å; V8-V12 PolarHBondContact O-N 2.94Å; D9-V12 PolarHBondContact O-N 2.87Å; V12-L15 PolarHBondContact O-N 3.3Å; V12-K16 HydrophobicContact CG1-CD 4.02Å; V12-K16 HydrophobicContact CG1-CG 4.45Å; V12-K16 WeakPolarHBondContact O-CB 3.49Å; V12-K16 VanDerWaalsContact O-CG 3.3Å; V12-K16 WeakPolarHBondContact O-CG 3.37Å; V12-K16 PolarHBondContact O-N 2.83Å; V12-V119 HydrophobicContact CG2-CG1 3.92Å; V12-V119 HydrophobicContact CG2-CG2 4.27Å; V12-I142 HydrophobicContact CG2-CG2 4.41Å; V12-V144 HydrophobicContact CB-CG2 4.46Å; V12-V144 HydrophobicContact CG1-CG2 4.1Å; V12-V144 HydrophobicContact CG2-CG2 3.83Å
13	Q	95.6	Very high	87.9	Confident	125 Å²	125	59.8 Å²	59.8	58%	0.584	34%	0.337	S	S	*	.	H	α-helix	trans	-62.9	-45.7	177.9	-74.9	-68	-13.3	0	0	112.2	D9 A10 K16 T17	D9-Q13 WeakPolarHBondContact O-CB 3.39Å; D9-Q13 VanDerWaalsContact O-CG 3.3Å; D9-Q13 WeakPolarHBondContact O-CG 3.08Å; D9-Q13 PolarHBondContact O-N 3.35Å; A10-Q13 PolarHBondContact O-N 3.18Å; Q13-K16 PolarHBondContact O-N 3Å; Q13-T17 WeakPolarHBondContact O-CB 3.41Å; Q13-T17 PolarHBondContact O-N 3.18Å; Q13-T17 PolarHBondContact O-OG1 3.39Å
14	L	93.7	Very high	89.7	Confident	98 Å²	98	60.6 Å²	60.6	51%	0.513	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-45.9	177	-178.9	62.9	0	0	0	111.2	A10 K16 T17 E18	A10-L14 WeakPolarHBondContact O-CB 3.1Å; A10-L14 PolarHBondContact O-N 3.05Å; L14-K16 PolarHBondContact O-N 3.04Å; L14-T17 PolarHBondContact O-N 2.92Å; L14-E18 HydrophobicContact CD1-CG 4.12Å; L14-E18 PolarHBondContact O-N 3.08Å
15	L	96.7	Very high	91.1	Very high	1 Å²	1	59.5 Å²	59.5	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-55.6	-51.9	177.1	170.6	56.9	0	0	0	111.6	S11 V12 T17 E18 F19 V144 M155 L156 T157 P177	S11-L15 WeakPolarHBondContact O-CB 3.3Å; S11-L15 PolarHBondContact O-N 2.64Å; V12-L15 PolarHBondContact O-N 3.3Å; L15-T17 PolarHBondContact O-N 2.98Å; L15-E18 PolarHBondContact O-N 3.42Å; L15-F19 WeakPolarHBondContact O-CB 3.3Å; L15-F19 PolarHBondContact O-N 3.27Å; L15-V144 HydrophobicContact CD2-CB 4.41Å; L15-V144 HydrophobicContact CD2-CG2 3.8Å; L15-M155 HydrophobicContact CD1-CB 3.91Å; L15-M155 HydrophobicContact CD2-CB 3.82Å; L15-M155 HydrophobicContact CG-CB 3.79Å; L15-L156 VanDerWaalsContact CD1-O 3.24Å; L15-L156 WeakPolarHBondContact CD1-O 3.43Å; L15-T157 HydrophobicContact CB-CG2 4.36Å; L15-T157 HydrophobicContact CD2-CG2 4.26Å; L15-P177 HydrophobicContact CD1-CB 3.86Å; L15-P177 HydrophobicContact CD1-CG 4.47Å
16	K	96.1	Very high	91.4	Very high	67 Å²	67	60.6 Å²	60.6	29%	0.291	32%	0.315	S	S	.	.	H	α-helix	trans	-58.8	-47.9	179.5	-75.3	177.9	174.2	-165.9	0	111.7	V12 Q13 L14 F19 E20 E146 M155	V12-K16 HydrophobicContact CG1-CD 4.02Å; V12-K16 HydrophobicContact CG1-CG 4.45Å; V12-K16 WeakPolarHBondContact O-CB 3.49Å; V12-K16 VanDerWaalsContact O-CG 3.3Å; V12-K16 WeakPolarHBondContact O-CG 3.37Å; V12-K16 PolarHBondContact O-N 2.83Å; Q13-K16 PolarHBondContact O-N 3Å; L14-K16 PolarHBondContact O-N 3.04Å; K16-F19 PolarHBondContact O-N 2.8Å; K16-E20 WeakPolarHBondContact O-CB 3.35Å; K16-E20 PolarHBondContact O-N 3.02Å; K16-E146 WeakPolarHBondContact CE-OE1 3.4Å; K16-E146 IonicContact NZ-OE1 3.32Å; K16-E146 PolarHBondContact NZ-OE1 2.94Å; K16-M155 HydrophobicContact CG-CE 3.8Å; K16-M155 HydrophobicContact CG-SD 4.07Å
17	T	95.4	Very high	91.3	Very high	73 Å²	73	64.5 Å²	64.5	45%	0.448	35%	0.345	S	S	.	.	H	α-helix	trans	-61.6	-49.8	-178.7	-57.8	0	0	0	0	111.6	Q13 L14 L15 E20 N21	Q13-T17 WeakPolarHBondContact O-CB 3.41Å; Q13-T17 PolarHBondContact O-N 3.18Å; Q13-T17 PolarHBondContact O-OG1 3.39Å; L14-T17 PolarHBondContact O-N 2.92Å; L15-T17 PolarHBondContact O-N 2.98Å; T17-E20 PolarHBondContact O-N 2.98Å; T17-N21 WeakPolarHBondContact O-CB 3.25Å; T17-N21 VanDerWaalsContact O-CG 3.23Å; T17-N21 PolarHBondContact O-N 2.93Å; T17-N21 VanDerWaalsContact O-N 3.08Å; T17-N21 PolarHBondContact O-ND2 3.43Å
18	E	94.8	Very high	90.7	Very high	35 Å²	35	62.6 Å²	62.6	16%	0.164	33%	0.334	C	S	.	.	H	α-helix	trans	-69.3	-37.8	-179	-77.1	-160.9	-148.9	0	0	112.9	L14 L15 S22 H69 P177	L14-E18 HydrophobicContact CD1-CG 4.12Å; L14-E18 PolarHBondContact O-N 3.08Å; L15-E18 PolarHBondContact O-N 3.42Å; E18-S22 WeakPolarHBondContact O-CB 3.15Å; E18-S22 PolarHBondContact O-N 2.66Å; E18-S22 PolarHBondContact O-OG 2.99Å; E18-H69 IonicContact OE1-CE1 2.66Å; E18-H69 PolarHBondContact OE1-CE1 3.11Å; E18-H69 VanDerWaalsContact OE1-CE1 3.23Å; E18-H69 IonicContact OE1-NE2 3.51Å; E18-H69 PolarHBondContact OE1-NE2 3.39Å; E18-H69 IonicContact OE2-CD2 3.27Å; E18-H69 IonicContact OE2-CE1 3.06Å; E18-H69 IonicContact OE2-NE2 2.74Å; E18-H69 PolarHBondContact OE2-NE2 3.45Å; E18-P177 HydrophobicContact CB-CB 3.64Å; E18-P177 HydrophobicContact CB-CG 4.02Å; E18-P177 HydrophobicContact CG-CB 4.49Å; E18-P177 HydrophobicContact CG-CG 4.37Å
19	F	95.7	Very high	90.1	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.9	-47.6	175.9	-178.2	-102	0	0	0	110.9	L15 K16 N21 S22 V23 M155 G179 R181 I196	L15-F19 WeakPolarHBondContact O-CB 3.3Å; L15-F19 PolarHBondContact O-N 3.27Å; K16-F19 PolarHBondContact O-N 2.8Å; F19-N21 PolarHBondContact O-N 3.38Å; F19-S22 WeakPolarHBondContact O-CA 3.45Å; F19-S22 VanDerWaalsContact O-CB 3.3Å; F19-S22 WeakPolarHBondContact O-CB 3.34Å; F19-S22 PolarHBondContact O-N 2.84Å; F19-V23 HydrophobicContact CD1-CG2 4.2Å; F19-V23 HydrophobicContact CE1-CG2 3.74Å; F19-V23 HydrophobicContact CE2-CG2 4.16Å; F19-V23 HydrophobicContact CZ-CG2 3.72Å; F19-V23 WeakPolarHBondContact O-CG2 3.27Å; F19-V23 PolarHBondContact O-N 3.36Å; F19-M155 HydrophobicContact CB-CG 4.18Å; F19-M155 HydrophobicContact CB-SD 4.04Å; F19-M155 HydrophobicContact CD1-CG 3.54Å; F19-M155 HydrophobicContact CD1-SD 3.57Å; F19-M155 VanDerWaalsContact CD1-SD 3.57Å; F19-M155 HydrophobicContact CD2-CG 4.26Å; F19-M155 HydrophobicContact CE1-CG 3.93Å; F19-M155 HydrophobicContact CE1-SD 4.32Å; F19-M155 HydrophobicContact CG-CG 3.71Å; F19-M155 HydrophobicContact CG-SD 3.98Å; F19-M155 HydrophobicContact CZ-CG 4.46Å; F19-G179 VanDerWaalsContact CE2-CA 3.41Å; F19-R181 HydrophobicContact CE1-CB 4.37Å; F19-R181 HydrophobicContact CZ-CB 4.26Å; F19-I196 HydrophobicContact CD2-CB 4.17Å; F19-I196 HydrophobicContact CD2-CG1 4.07Å; F19-I196 HydrophobicContact CE2-CB 3.94Å; F19-I196 HydrophobicContact CE2-CG1 3.69Å
20	E	93.9	Very high	89.2	Confident	64 Å²	64	60.6 Å²	60.6	30%	0.299	32%	0.323	S	S	.	.	H	α-helix	trans	-57.7	-49.4	178	-166.9	61.8	-124.3	0	0	111.6	K16 T17 S22 V23 E24 R181	K16-E20 WeakPolarHBondContact O-CB 3.35Å; K16-E20 PolarHBondContact O-N 3.02Å; T17-E20 PolarHBondContact O-N 2.98Å; E20-S22 PolarHBondContact O-N 3.4Å; E20-V23 PolarHBondContact O-N 3.32Å; E20-E24 HydrophobicContact CG-CG 4.47Å; E20-E24 PolarHBondContact O-N 3.12Å; E20-E24 VanDerWaalsContact OE1-CG 3.23Å; E20-E24 WeakPolarHBondContact OE1-CG 3.26Å; E20-R181 IonicContact OE1-CZ 3.59Å; E20-R181 IonicContact OE1-NH1 3.87Å; E20-R181 PolarHBondContact OE1-NH1 2.85Å; E20-R181 IonicContact OE1-NH2 3.82Å; E20-R181 PolarHBondContact OE1-NH2 3.15Å; E20-R181 IonicContact OE2-CZ 3.42Å; E20-R181 IonicContact OE2-NH1 2.98Å; E20-R181 IonicContact OE2-NH2 3.21Å; E20-R181 PolarHBondContact OE2-NH2 3.33Å
21	N	92.9	Very high	87.9	Confident	98 Å²	98	60 Å²	60	52%	0.524	31%	0.314	S	S	.	.	H	α-helix	trans	-57.3	-36.5	176.6	-71.4	-22.9	0	0	0	111.9	T17 F19 D25	T17-N21 WeakPolarHBondContact O-CB 3.25Å; T17-N21 VanDerWaalsContact O-CG 3.23Å; T17-N21 PolarHBondContact O-N 2.93Å; T17-N21 VanDerWaalsContact O-N 3.08Å; T17-N21 PolarHBondContact O-ND2 3.43Å; F19-N21 PolarHBondContact O-N 3.38Å; N21-D25 WeakPolarHBondContact O-CB 3.44Å; N21-D25 PolarHBondContact O-N 3.2Å
22	S	92.4	Very high	86.1	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.014	32%	0.323	C	S	.	.	H	α-helix	trans	-70.8	-34.4	178.8	-53.7	0	0	0	0	112.9	E18 F19 E20 W29 K74	E18-S22 WeakPolarHBondContact O-CB 3.15Å; E18-S22 PolarHBondContact O-N 2.66Å; E18-S22 PolarHBondContact O-OG 2.99Å; F19-S22 WeakPolarHBondContact O-CA 3.45Å; F19-S22 VanDerWaalsContact O-CB 3.3Å; F19-S22 WeakPolarHBondContact O-CB 3.34Å; F19-S22 PolarHBondContact O-N 2.84Å; E20-S22 PolarHBondContact O-N 3.4Å; S22-W29 WeakPolarHBondContact O-CZ2 3.34Å; S22-W29 PolarHBondContact O-NE1 3.3Å; S22-W29 VanDerWaalsContact O-NE1 3.17Å; S22-K74 WeakPolarHBondContact OG-CE 3.38Å; S22-K74 PolarHBondContact OG-NZ 3.25Å
23	V	91	Very high	84	Confident	5 Å²	5	67.7 Å²	67.7	3%	0.03	34%	0.337	C	S	.	.	H	α-helix	trans	-73	-48	178.4	175.7	0	0	0	0	110.2	F19 E20 K76 R181 I194 I196	F19-V23 HydrophobicContact CD1-CG2 4.2Å; F19-V23 HydrophobicContact CE1-CG2 3.74Å; F19-V23 HydrophobicContact CE2-CG2 4.16Å; F19-V23 HydrophobicContact CZ-CG2 3.72Å; F19-V23 WeakPolarHBondContact O-CG2 3.27Å; F19-V23 PolarHBondContact O-N 3.36Å; E20-V23 PolarHBondContact O-N 3.32Å; V23-K76 PolarHBondContact O-NZ 3Å; V23-R181 VanDerWaalsContact CG1-NH1 3.28Å; V23-I194 HydrophobicContact CG1-CD1 3.86Å; V23-I194 HydrophobicContact CG2-CG2 4.28Å; V23-I196 HydrophobicContact CG2-CG1 4.31Å
24	E	88	Confident	81.3	Confident	103 Å²	103	65.6 Å²	65.6	48%	0.481	33%	0.326	S	S	.	.	H	α-helix	trans	-87.1	-34.1	-169	-62.9	-56.4	143.6	0	0	114.4	E20 K26 R181	E20-E24 HydrophobicContact CG-CG 4.47Å; E20-E24 PolarHBondContact O-N 3.12Å; E20-E24 VanDerWaalsContact OE1-CG 3.23Å; E20-E24 WeakPolarHBondContact OE1-CG 3.26Å; E24-K26 PolarHBondContact O-N 2.76Å; E24-R181 IonicContact OE1-NH1 2.75Å; E24-R181 PolarHBondContact OE1-NH1 3.2Å
25	D	82.8	Confident	78.8	Confident	62 Å²	62	65.3 Å²	65.3	33%	0.332	33%	0.332	S	S	.	.			trans	-74.4	100.8	-179.5	-170.4	-11.1	0	0	0	110.8	N21 S27 I28 W29	N21-D25 WeakPolarHBondContact O-CB 3.44Å; N21-D25 PolarHBondContact O-N 3.2Å; D25-S27 VanDerWaalsContact C-N 3.32Å; D25-S27 WeakPolarHBondContact OD1-CA 3.34Å; D25-S27 VanDerWaalsContact OD1-CB 3.3Å; D25-S27 WeakPolarHBondContact OD1-CB 3.24Å; D25-S27 PolarHBondContact OD1-N 2.88Å; D25-S27 PolarHBondContact OD1-OG 2.63Å; D25-I28 HydrophobicContact CB-CD1 4.35Å; D25-I28 HydrophobicContact CB-CG1 4.25Å; D25-I28 WeakPolarHBondContact O-CG1 3.35Å; D25-I28 WeakPolarHBondContact OD2-CG2 3.13Å; D25-W29 PolarHBondContact O-NE1 2.99Å
26	K	76.9	Confident	75.8	Confident	169 Å²	169	69.9 Å²	69.9	74%	0.735	36%	0.36	S	S	*	.			trans	-76.6	-18	177	-65.2	-180	-175.2	173.2	0	113.1	E24	E24-K26 PolarHBondContact O-N 2.76Å
27	S	76.7	Confident	72.7	Confident	104 Å²	104	71 Å²	71	73%	0.727	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-24.1	-170.8	75.6	0	0	0	0	113.5	D25	D25-S27 VanDerWaalsContact C-N 3.32Å; D25-S27 WeakPolarHBondContact OD1-CA 3.34Å; D25-S27 VanDerWaalsContact OD1-CB 3.3Å; D25-S27 WeakPolarHBondContact OD1-CB 3.24Å; D25-S27 PolarHBondContact OD1-N 2.88Å; D25-S27 PolarHBondContact OD1-OG 2.63Å
28	I	77.3	Confident	69.5	Low	61 Å²	61	73 Å²	73	31%	0.313	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.9	-175.6	58.6	167.3	0	0	0	114.3	D25 T65	D25-I28 HydrophobicContact CB-CD1 4.35Å; D25-I28 HydrophobicContact CB-CG1 4.25Å; D25-I28 WeakPolarHBondContact O-CG1 3.35Å; D25-I28 WeakPolarHBondContact OD2-CG2 3.13Å; I28-T65 WeakPolarHBondContact O-CB 3.1Å; I28-T65 PolarHBondContact O-OG1 3.1Å
29	W	79.2	Confident	66.3	Low	29 Å²	29	77.7 Å²	77.7	11%	0.11	41%	0.409	C	S	.	.			trans	-96	127	-167.3	-63.9	109.5	0	0	0	113.5	S22 D25 F63 T65 K74 K76 I196	S22-W29 WeakPolarHBondContact O-CZ2 3.34Å; S22-W29 PolarHBondContact O-NE1 3.3Å; S22-W29 VanDerWaalsContact O-NE1 3.17Å; D25-W29 PolarHBondContact O-NE1 2.99Å; W29-F63 HydrophobicContact CB-CB 3.92Å; W29-F63 HydrophobicContact CB-CD1 4.07Å; W29-F63 HydrophobicContact CB-CG 4.17Å; W29-F63 HydrophobicContact CD2-CB 4.3Å; W29-F63 HydrophobicContact CE3-CB 3.95Å; W29-F63 HydrophobicContact CG-CB 4.31Å; W29-T65 HydrophobicContact CE3-CG2 4.12Å; W29-T65 HydrophobicContact CH2-CG2 4.35Å; W29-T65 HydrophobicContact CZ3-CG2 3.84Å; W29-K74 HydrophobicContact CH2-CD 3.92Å; W29-K74 HydrophobicContact CH2-CG 3.81Å; W29-K74 HydrophobicContact CZ3-CG 4.19Å; W29-K76 HydrophobicContact CD2-CB 3.81Å; W29-K76 HydrophobicContact CD2-CD 3.88Å; W29-K76 HydrophobicContact CD2-CG 4.49Å; W29-K76 VanDerWaalsContact CE2-CD 3.47Å; W29-K76 HydrophobicContact CE3-CB 3.63Å; W29-K76 HydrophobicContact CG-CD 4.16Å; W29-K76 HydrophobicContact CH2-CB 3.54Å; W29-K76 HydrophobicContact CZ2-CB 3.73Å; W29-K76 HydrophobicContact CZ2-CD 3.87Å; W29-K76 HydrophobicContact CZ2-CG 4.4Å; W29-K76 HydrophobicContact CZ3-CB 3.49Å; W29-K76 VanDerWaalsContact CZ3-CB 3.49Å; W29-I196 HydrophobicContact CH2-CD1 4.18Å; W29-I196 HydrophobicContact CZ2-CD1 4.04Å
30	T	74.4	Confident	63.3	Low	80 Å²	80	88.7 Å²	88.7	49%	0.491	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.1	169.5	-56.8	0	0	0	0	110.7	F63 S64	T30-F63 CarbonylContact O-C 3.53Å; T30-F63 WeakPolarHBondContact O-CA 3.42Å; T30-S64 PolarHBondContact N-O 2.92Å; T30-S64 VanDerWaalsContact N-O 3.13Å; T30-S64 PolarHBondContact O-N 2.93Å
31	V	65.1	Low	60.2	Low	37 Å²	37	94.6 Å²	94.6	22%	0.224	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	135	177.9	-178.8	0	0	0	0	111.5	L54 F63	V31-L54 HydrophobicContact CG1-CD1 4.11Å; V31-L54 HydrophobicContact CG2-CD1 4.45Å; V31-F63 HydrophobicContact CB-CD1 4.41Å; V31-F63 HydrophobicContact CG2-CD1 3.6Å; V31-F63 HydrophobicContact CG2-CE1 3.49Å; V31-F63 VanDerWaalsContact CG2-CE1 3.49Å
32	R	54.8	Low	57.2	Low	105 Å²	105	94.8 Å²	94.8	40%	0.396	48%	0.483	S	S	.	.			trans	-116.5	155.7	177.2	-72.2	-67.1	-174.1	-168.9	-6.6	114.2	V62 S64	R32-V62 PolarHBondContact N-O 3.13Å; R32-S64 WeakPolarHBondContact CG-OG 2.94Å; R32-S64 PolarHBondContact NE-OG 3.13Å; R32-S64 VanDerWaalsContact NE-OG 3.14Å
33	R	50.2	Low	54.2	Low	103 Å²	103	103.9 Å²	103.9	39%	0.389	52%	0.523	S	S	.	.			trans	-108.9	144.2	-174	-59	174.7	176.1	-149.3	-0.1	111.5	A51	R33-A51 PolarHBondContact NH2-O 3.1Å
34	K	40.2	Very low	51.2	Low	81 Å²	81	112.3 Å²	112.3	35%	0.352	56%	0.56	S	S	.	*			trans	-82	118.4	159	-169	177.4	-173.7	172	0	106.2	V36 L55	K34-V36 VanDerWaalsContact C-N 3.28Å; K34-V36 HydrophobicContact CB-CG2 4.41Å; K34-V36 HydrophobicContact CD-CG2 3.64Å; K34-V36 HydrophobicContact CG-CG2 3.68Å; K34-V36 PolarHBondContact O-N 3.29Å; K34-V36 VanDerWaalsContact O-N 3.15Å; K34-L55 HydrophobicContact CB-CD1 3.44Å; K34-L55 VanDerWaalsContact CB-CD1 3.44Å; K34-L55 HydrophobicContact CB-CD2 4.45Å
35	S	39.9	Very low	48.3	Very low	93 Å²	93	118.7 Å²	118.7	65%	0.65	58%	0.579	S	S	*	*			trans	-79.7	86.8	162.1	44	0	0	0	0	106.8	S37	S35-S37 PolarHBondContact O-N 2.82Å
36	V	34.3	Very low	45.8	Very low	97 Å²	97	124.5 Å²	124.5	59%	0.588	60%	0.602	S	S	*	*			trans	-74.1	87.3	160.7	-169.6	0	0	0	0	105.9	K34 V38	K34-V36 VanDerWaalsContact C-N 3.28Å; K34-V36 HydrophobicContact CB-CG2 4.41Å; K34-V36 HydrophobicContact CD-CG2 3.64Å; K34-V36 HydrophobicContact CG-CG2 3.68Å; K34-V36 PolarHBondContact O-N 3.29Å; K34-V36 VanDerWaalsContact O-N 3.15Å; V36-V38 HydrophobicContact CG1-CG2 3.55Å; V36-V38 PolarHBondContact O-N 2.82Å
37	S	30.3	Very low	43.4	Very low	89 Å²	89	122 Å²	122	62%	0.622	60%	0.601	S	S	*	*			trans	-74.2	86.3	160.9	65.7	0	0	0	0	107.2	S35 H39	S35-S37 PolarHBondContact O-N 2.82Å; S37-H39 PolarHBondContact O-N 2.94Å
38	V	28.5	Very low	41	Very low	115 Å²	115	126.7 Å²	126.7	70%	0.697	61%	0.608	S	S	*	*			trans	-71.5	74.7	153.3	-172.2	0	0	0	0	106	V36 R40	V36-V38 HydrophobicContact CG1-CG2 3.55Å; V36-V38 PolarHBondContact O-N 2.82Å; V38-R40 VanDerWaalsContact C-N 3.35Å; V38-R40 PolarHBondContact O-N 2.8Å
39	H	28.6	Very low	38.7	Very low	134 Å²	134	128.2 Å²	128.2	62%	0.62	62%	0.62	S	S	*	*			trans	-85.6	87.3	170.7	-96.3	66.3	0	0	0	108.6	S37 K41	S37-H39 PolarHBondContact O-N 2.94Å; H39-K41 PolarHBondContact O-N 2.88Å
40	R	32.1	Very low	36.2	Very low	231 Å²	231	133 Å²	133	87%	0.872	65%	0.653	S	S	*	*			trans	-64.1	93	147.2	-76.3	-171.9	175.8	-158	0	107.1	V38	V38-R40 VanDerWaalsContact C-N 3.35Å; V38-R40 PolarHBondContact O-N 2.8Å
41	K	28.8	Very low	34.1	Very low	188 Å²	188	132.8 Å²	132.8	82%	0.817	66%	0.66	S	S	*	*	S	Bend	trans	59.8	139.9	166.9	-67.9	-180	174.2	179.7	0	117.8	H39	H39-K41 PolarHBondContact O-N 2.88Å
42	C	28.6	Very low	32.4	Very low	102 Å²	102	135 Å²	135	69%	0.689	68%	0.682	S	S	*	*			trans	84.2	116.5	163.4	-71.9	0	0	0	0	120.5
43	F	29.9	Very low	31.4	Very low	194 Å²	194	139.7 Å²	139.7	85%	0.851	70%	0.699	S	S	*	*			trans	54.4	110.4	149.1	-83.9	-91.8	0	0	0	121.1	R45	F43-R45 PolarHBondContact O-N 2.88Å
44	F	28.6	Very low	30.7	Very low	182 Å²	182	138.7 Å²	138.7	80%	0.798	70%	0.701	S	S	*	*			trans	-55.1	117.9	170.1	-71.3	-98.1	0	0	0	113	F46	F44-F46 AromaticContact CD1-CE2 3.78Å; F44-F46 HydrophobicContact CD1-CE2 3.78Å; F44-F46 HydrophobicContact CD1-CZ 4.02Å; F44-F46 HydrophobicContact CE1-CZ 4.41Å
45	R	26.6	Very low	30.9	Very low	236 Å²	236	137.1 Å²	137.1	89%	0.891	70%	0.697	S	S	*	*			trans	-131	109.6	150.6	-97.4	-173.4	174.9	-172.7	-0.4	109.6	F43 T47	F43-R45 PolarHBondContact O-N 2.88Å; R45-T47 PolarHBondContact O-N 2.9Å
46	F	30.6	Very low	31.1	Very low	185 Å²	185	137.8 Å²	137.8	81%	0.811	69%	0.691	S	S	*	*			trans	-73.2	101.3	170.7	-69.5	-88.4	0	0	0	108.8	F44	F44-F46 AromaticContact CD1-CE2 3.78Å; F44-F46 HydrophobicContact CD1-CE2 3.78Å; F44-F46 HydrophobicContact CD1-CZ 4.02Å; F44-F46 HydrophobicContact CE1-CZ 4.41Å
47	T	27.4	Very low	31.9	Very low	116 Å²	116	137.7 Å²	137.7	71%	0.712	69%	0.685	S	S	*	*			trans	-91	121.8	169.7	-40.5	0	0	0	0	108	R45 V49	R45-T47 PolarHBondContact O-N 2.9Å; T47-V49 WeakPolarHBondContact O-CG2 3.37Å; T47-V49 PolarHBondContact O-N 2.86Å; T47-V49 VanDerWaalsContact O-N 3.1Å
48	K	25.4	Very low	33.6	Very low	202 Å²	202	138.5 Å²	138.5	88%	0.878	68%	0.682	S	S	*	*			trans	-53.4	114.2	169.9	-85	178.7	174.3	176.7	0	108.1
49	V	29.3	Very low	36.2	Very low	93 Å²	93	137.6 Å²	137.6	56%	0.564	67%	0.673	S	S	*	*			trans	-98.6	103.8	176.3	-169.7	0	0	0	0	110.7	T47	T47-V49 WeakPolarHBondContact O-CG2 3.37Å; T47-V49 PolarHBondContact O-N 2.86Å; T47-V49 VanDerWaalsContact O-N 3.1Å
50	T	27.4	Very low	39.2	Very low	129 Å²	129	131.2 Å²	131.2	79%	0.791	64%	0.644	S	S	*	*			trans	-88.9	149.9	160.5	-27.1	0	0	0	0	108
51	A	29	Very low	42	Very low	77 Å²	77	121 Å²	121	64%	0.636	61%	0.607	S	S	*	*	S	Bend	trans	89.6	128	-176.2	0	0	0	0	0	116.3	R33	R33-A51 PolarHBondContact NH2-O 3.1Å
52	A	30.8	Very low	44.9	Very low	83 Å²	83	112.1 Å²	112.1	69%	0.686	57%	0.569	S	S	*	*			trans	-71.5	132.5	-176.8	0	0	0	0	0	111.8
53	R	32.8	Very low	47.9	Very low	203 Å²	203	109 Å²	109	77%	0.766	54%	0.544	S	S	*	.			trans	-127.6	111.8	155.5	-145.8	178.2	-171.7	177.3	2.3	105.8	L55	R53-L55 PolarHBondContact O-N 3.46Å
54	L	36	Very low	50.8	Low	82 Å²	82	99.8 Å²	99.8	43%	0.429	50%	0.503	S	S	.	.			trans	-45.6	120.7	168.3	-161.6	68.1	0	0	0	108.3	V31 I56 V61	V31-L54 HydrophobicContact CG1-CD1 4.11Å; V31-L54 HydrophobicContact CG2-CD1 4.45Å; L54-I56 VanDerWaalsContact C-N 3.28Å; L54-I56 HydrophobicContact CB-CG1 4.2Å; L54-I56 HydrophobicContact CD2-CD1 3.37Å; L54-I56 HydrophobicContact CD2-CG1 3.19Å; L54-I56 HydrophobicContact CG-CD1 4.2Å; L54-I56 HydrophobicContact CG-CG1 3.48Å; L54-I56 VanDerWaalsContact CG-CG1 3.48Å; L54-I56 PolarHBondContact O-N 2.84Å; L54-V61 HydrophobicContact CD1-CB 4.14Å; L54-V61 HydrophobicContact CD1-CG1 3.32Å; L54-V61 HydrophobicContact CD1-CG2 3.64Å; L54-V61 HydrophobicContact CD2-CG2 4.31Å; L54-V61 HydrophobicContact CG-CG1 4.32Å; L54-V61 HydrophobicContact CG-CG2 3.91Å
55	L	44.9	Very low	53.7	Low	49 Å²	49	92.7 Å²	92.7	26%	0.257	47%	0.474	S	S	.	.			trans	-75.8	99.1	154	-76.3	177.1	0	0	0	105.4	K34 R53 F220	K34-L55 HydrophobicContact CB-CD1 3.44Å; K34-L55 VanDerWaalsContact CB-CD1 3.44Å; K34-L55 HydrophobicContact CB-CD2 4.45Å; R53-L55 PolarHBondContact O-N 3.46Å; L55-F220 HydrophobicContact CB-CE1 4.06Å; L55-F220 HydrophobicContact CB-CE2 4.35Å; L55-F220 HydrophobicContact CB-CZ 3.57Å; L55-F220 HydrophobicContact CD1-CD2 4.38Å; L55-F220 HydrophobicContact CD1-CE1 4.43Å; L55-F220 HydrophobicContact CD1-CE2 3.57Å; L55-F220 HydrophobicContact CD1-CZ 3.62Å; L55-F220 HydrophobicContact CG-CZ 4.31Å
56	I	43.1	Very low	56.8	Low	106 Å²	106	86.5 Å²	86.5	54%	0.544	46%	0.456	S	S	.	.			trans	-89.3	109.2	155.2	-54.5	172.6	0	0	0	104.2	L54 V61	L54-I56 VanDerWaalsContact C-N 3.28Å; L54-I56 HydrophobicContact CB-CG1 4.2Å; L54-I56 HydrophobicContact CD2-CD1 3.37Å; L54-I56 HydrophobicContact CD2-CG1 3.19Å; L54-I56 HydrophobicContact CG-CD1 4.2Å; L54-I56 HydrophobicContact CG-CG1 3.48Å; L54-I56 VanDerWaalsContact CG-CG1 3.48Å; L54-I56 PolarHBondContact O-N 2.84Å; I56-V61 HydrophobicContact CG1-CG2 4.47Å
57	Q	52.4	Low	59.7	Low	96 Å²	96	78 Å²	78	45%	0.449	42%	0.419	S	S	.	.	B	Isolated β-bridge	trans	-117.1	118.5	158.4	-173.3	172.3	-5.6	0	0	105.9	D59 T60	Q57-D59 PolarHBondContact O-N 3.09Å; Q57-T60 PolarHBondContact N-O 3.41Å; Q57-T60 WeakPolarHBondContact O-CB 3.45Å; Q57-T60 PolarHBondContact O-N 3.14Å; Q57-T60 PolarHBondContact O-OG1 2.82Å
58	N	66	Low	62.8	Low	105 Å²	105	77.3 Å²	77.3	56%	0.561	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	55.5	-179.3	-56.3	-14.9	0	0	0	112.2	T60 Q227	N58-T60 PolarHBondContact O-N 2.73Å; N58-Q227 PolarHBondContact O-NE2 3.05Å
59	D	82.6	Confident	66	Low	96 Å²	96	70.9 Å²	70.9	51%	0.513	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	12.9	-178.5	-54	-42.7	0	0	0	116.1	Q57 T79 V80	Q57-D59 PolarHBondContact O-N 3.09Å; D59-T79 WeakPolarHBondContact O-CA 3.4Å; D59-V80 HydrophobicContact CB-CB 4.22Å; D59-V80 HydrophobicContact CB-CG2 4.46Å
60	T	90.8	Very high	68.9	Low	0 Å²	0	68 Å²	68	0%	0	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-100.7	133	176.2	-57.6	0	0	0	0	111.2	Q57 N58 E78 T79 F220 L223 Q227	Q57-T60 PolarHBondContact N-O 3.41Å; Q57-T60 WeakPolarHBondContact O-CB 3.45Å; Q57-T60 PolarHBondContact O-N 3.14Å; Q57-T60 PolarHBondContact O-OG1 2.82Å; N58-T60 PolarHBondContact O-N 2.73Å; T60-E78 CarbonylContact C-O 3.51Å; T60-E78 VanDerWaalsContact CA-O 3.25Å; T60-E78 WeakPolarHBondContact CA-O 3.15Å; T60-T79 WeakPolarHBondContact OG1-CB 3.41Å; T60-T79 PolarHBondContact OG1-OG1 3.08Å; T60-F220 HydrophobicContact CG2-CD1 3.86Å; T60-F220 HydrophobicContact CG2-CE1 4.05Å; T60-L223 HydrophobicContact CG2-CB 3.78Å; T60-L223 HydrophobicContact CG2-CD1 3.75Å; T60-L223 HydrophobicContact CG2-CG 4.43Å; T60-Q227 PolarHBondContact OG1-NE2 3.24Å
61	V	90.9	Very high	71.8	Confident	18 Å²	18	64.7 Å²	64.7	11%	0.109	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.1	177.1	178.9	0	0	0	0	109.9	L54 I56 F63 G77 E78	L54-V61 HydrophobicContact CD1-CB 4.14Å; L54-V61 HydrophobicContact CD1-CG1 3.32Å; L54-V61 HydrophobicContact CD1-CG2 3.64Å; L54-V61 HydrophobicContact CD2-CG2 4.31Å; L54-V61 HydrophobicContact CG-CG1 4.32Å; L54-V61 HydrophobicContact CG-CG2 3.91Å; I56-V61 HydrophobicContact CG1-CG2 4.47Å; V61-F63 HydrophobicContact CB-CE2 4.1Å; V61-F63 HydrophobicContact CB-CZ 4.41Å; V61-F63 HydrophobicContact CG1-CD2 4.06Å; V61-F63 HydrophobicContact CG1-CE1 4.16Å; V61-F63 HydrophobicContact CG1-CE2 3.46Å; V61-F63 VanDerWaalsContact CG1-CE2 3.46Å; V61-F63 HydrophobicContact CG1-CZ 3.51Å; V61-G77 CarbonylContact O-C 3.5Å; V61-G77 VanDerWaalsContact O-CA 3.27Å; V61-G77 WeakPolarHBondContact O-CA 3.42Å; V61-E78 PolarHBondContact N-O 3.22Å; V61-E78 PolarHBondContact O-N 3.21Å
62	V	90.9	Very high	74.7	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.3	172.9	-178	0	0	0	0	111.2	R32 K76 V216 M219 F220	R32-V62 PolarHBondContact N-O 3.13Å; V62-K76 CarbonylContact C-O 3.56Å; V62-K76 WeakPolarHBondContact CA-O 3.21Å; V62-V216 HydrophobicContact CB-CG1 4.5Å; V62-V216 HydrophobicContact CG1-CG1 4.2Å; V62-M219 HydrophobicContact CB-CG 4.43Å; V62-M219 HydrophobicContact CG1-CB 4.33Å; V62-M219 HydrophobicContact CG1-CG 3.96Å; V62-M219 HydrophobicContact CG2-CB 4.18Å; V62-M219 HydrophobicContact CG2-CG 3.53Å; V62-F220 HydrophobicContact CB-CD2 4.07Å; V62-F220 HydrophobicContact CB-CE1 4.32Å; V62-F220 HydrophobicContact CB-CE2 3.49Å; V62-F220 VanDerWaalsContact CB-CE2 3.49Å; V62-F220 HydrophobicContact CB-CZ 3.62Å; V62-F220 HydrophobicContact CG2-CD1 3.87Å; V62-F220 HydrophobicContact CG2-CD2 3.64Å; V62-F220 HydrophobicContact CG2-CE1 3.74Å; V62-F220 HydrophobicContact CG2-CE2 3.5Å; V62-F220 VanDerWaalsContact CG2-CE2 3.5Å; V62-F220 HydrophobicContact CG2-CG 3.81Å; V62-F220 HydrophobicContact CG2-CZ 3.53Å
63	F	91.1	Very high	77.5	Confident	37 Å²	37	60 Å²	60	16%	0.162	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	158.5	171.9	-49.6	-97.7	0	0	0	109.9	W29 T30 V31 V61 L75 K76 E78	W29-F63 HydrophobicContact CB-CB 3.92Å; W29-F63 HydrophobicContact CB-CD1 4.07Å; W29-F63 HydrophobicContact CB-CG 4.17Å; W29-F63 HydrophobicContact CD2-CB 4.3Å; W29-F63 HydrophobicContact CE3-CB 3.95Å; W29-F63 HydrophobicContact CG-CB 4.31Å; T30-F63 CarbonylContact O-C 3.53Å; T30-F63 WeakPolarHBondContact O-CA 3.42Å; V31-F63 HydrophobicContact CB-CD1 4.41Å; V31-F63 HydrophobicContact CG2-CD1 3.6Å; V31-F63 HydrophobicContact CG2-CE1 3.49Å; V31-F63 VanDerWaalsContact CG2-CE1 3.49Å; V61-F63 HydrophobicContact CB-CE2 4.1Å; V61-F63 HydrophobicContact CB-CZ 4.41Å; V61-F63 HydrophobicContact CG1-CD2 4.06Å; V61-F63 HydrophobicContact CG1-CE1 4.16Å; V61-F63 HydrophobicContact CG1-CE2 3.46Å; V61-F63 VanDerWaalsContact CG1-CE2 3.46Å; V61-F63 HydrophobicContact CG1-CZ 3.51Å; F63-L75 WeakPolarHBondContact O-CA 3.37Å; F63-K76 HydrophobicContact CB-CB 4.27Å; F63-K76 HydrophobicContact CD2-CB 4.42Å; F63-K76 HydrophobicContact CD2-CG 4.23Å; F63-K76 WeakPolarHBondContact CD2-O 3.49Å; F63-K76 PolarHBondContact N-O 2.91Å; F63-K76 PolarHBondContact O-N 3.4Å; F63-E78 HydrophobicContact CE2-CG 4Å
64	S	89.8	Confident	80.3	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	146.2	177	76.9	0	0	0	0	110.2	T30 R32 W73 K74	T30-S64 PolarHBondContact N-O 2.92Å; T30-S64 VanDerWaalsContact N-O 3.13Å; T30-S64 PolarHBondContact O-N 2.93Å; R32-S64 WeakPolarHBondContact CG-OG 2.94Å; R32-S64 PolarHBondContact NE-OG 3.13Å; R32-S64 VanDerWaalsContact NE-OG 3.14Å; S64-W73 VanDerWaalsContact OG-CZ3 3.23Å; S64-W73 WeakPolarHBondContact OG-CZ3 3.23Å; S64-K74 CarbonylContact C-O 3.54Å; S64-K74 WeakPolarHBondContact CA-O 3.14Å
65	T	91	Very high	83	Confident	32 Å²	32	47.1 Å²	47.1	20%	0.196	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	164.3	165.2	-163.8	0	0	0	0	110.4	I28 W29 S67 W73 K74	I28-T65 WeakPolarHBondContact O-CB 3.1Å; I28-T65 PolarHBondContact O-OG1 3.1Å; W29-T65 HydrophobicContact CE3-CG2 4.12Å; W29-T65 HydrophobicContact CH2-CG2 4.35Å; W29-T65 HydrophobicContact CZ3-CG2 3.84Å; T65-S67 PolarHBondContact O-N 3.17Å; T65-W73 VanDerWaalsContact C-CE3 3.48Å; T65-W73 WeakPolarHBondContact O-CA 3.4Å; T65-W73 VanDerWaalsContact O-CE3 3.26Å; T65-K74 HydrophobicContact CG2-CB 3.95Å; T65-K74 HydrophobicContact CG2-CD 4.28Å; T65-K74 HydrophobicContact CG2-CG 4.43Å; T65-K74 PolarHBondContact N-O 3.29Å; T65-K74 PolarHBondContact O-N 2.88Å
66	Q	90.5	Very high	85.4	Confident	106 Å²	106	45 Å²	45	50%	0.495	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	131.1	176.2	-177.5	56.5	47.9	0	0	108.9	F70 G72	Q66-F70 PolarHBondContact NE2-O 3.37Å; Q66-G72 PolarHBondContact NE2-O 2.97Å
67	S	91.3	Very high	87.8	Confident	6 Å²	6	40 Å²	40	4%	0.042	21%	0.214	C	C	.	.			trans	-67.3	131.9	172.9	171.3	0	0	0	0	109.9	T65 H69 F70 G72 Q198	T65-S67 PolarHBondContact O-N 3.17Å; S67-H69 PolarHBondContact O-N 2.78Å; S67-H69 PolarHBondContact OG-N 3.46Å; S67-H69 VanDerWaalsContact OG-N 3.14Å; S67-F70 WeakPolarHBondContact CB-O 3.33Å; S67-F70 WeakPolarHBondContact OG-CD1 3.09Å; S67-F70 WeakPolarHBondContact OG-CE1 3.44Å; S67-F70 PolarHBondContact OG-N 2.62Å; S67-G72 VanDerWaalsContact CB-O 3.3Å; S67-G72 WeakPolarHBondContact CB-O 3.39Å; S67-G72 PolarHBondContact N-O 2.8Å; S67-Q198 PolarHBondContact OG-NE2 2.96Å
68	P	92	Very high	89.8	Confident	102 Å²	102	37.6 Å²	37.6	66%	0.662	20%	0.203	S	C	*	.	S	Bend	trans	-71.6	-17	169.1	28.9	-36.8	0	0	0	113.3
69	H	93.1	Very high	91.2	Very high	67 Å²	67	32.8 Å²	32.8	31%	0.31	18%	0.177	S	C	.	.	S	Bend	trans	-98.1	-22.9	-169.3	-60.6	-54.6	0	0	0	114.7	E18 S67 Y176 Q198	E18-H69 IonicContact OE1-CE1 2.66Å; E18-H69 PolarHBondContact OE1-CE1 3.11Å; E18-H69 VanDerWaalsContact OE1-CE1 3.23Å; E18-H69 IonicContact OE1-NE2 3.51Å; E18-H69 PolarHBondContact OE1-NE2 3.39Å; E18-H69 IonicContact OE2-CD2 3.27Å; E18-H69 IonicContact OE2-CE1 3.06Å; E18-H69 IonicContact OE2-NE2 2.74Å; E18-H69 PolarHBondContact OE2-NE2 3.45Å; S67-H69 PolarHBondContact O-N 2.78Å; S67-H69 PolarHBondContact OG-N 3.46Å; S67-H69 VanDerWaalsContact OG-N 3.14Å; H69-Y176 HydrophobicContact CB-CD1 3.36Å; H69-Y176 HydrophobicContact CB-CD2 4.19Å; H69-Y176 HydrophobicContact CB-CE1 3.34Å; H69-Y176 HydrophobicContact CB-CE2 4.16Å; H69-Y176 HydrophobicContact CB-CG 3.79Å; H69-Y176 AromaticContact CD2-CD1 3.71Å; H69-Y176 AromaticContact CD2-CG 3.89Å; H69-Y176 AromaticContact CG-CD1 3.58Å; H69-Y176 AromaticContact CG-CE1 3.98Å; H69-Y176 PolarHBondContact O-OH 2.75Å; H69-Q198 PolarHBondContact CD2-NE2 3.25Å
70	F	91.3	Very high	91.7	Very high	33 Å²	33	30 Å²	30	15%	0.145	16%	0.164	C	C	.	.	S	Bend	trans	-157.5	167.9	-178.3	72.5	-76.9	0	0	0	111	Q66 S67 G72 Y176 Q198 A199 D200	Q66-F70 PolarHBondContact NE2-O 3.37Å; S67-F70 WeakPolarHBondContact CB-O 3.33Å; S67-F70 WeakPolarHBondContact OG-CD1 3.09Å; S67-F70 WeakPolarHBondContact OG-CE1 3.44Å; S67-F70 PolarHBondContact OG-N 2.62Å; F70-G72 VanDerWaalsContact CE2-CA 3.46Å; F70-G72 PolarHBondContact O-N 3.27Å; F70-Y176 HydrophobicContact CB-CE2 4.07Å; F70-Y176 AromaticContact CD1-CD2 3.53Å; F70-Y176 HydrophobicContact CD1-CD2 3.53Å; F70-Y176 AromaticContact CD1-CE2 3.24Å; F70-Y176 HydrophobicContact CD1-CE2 3.24Å; F70-Y176 AromaticContact CE1-CD2 3.75Å; F70-Y176 HydrophobicContact CE1-CD2 3.75Å; F70-Y176 AromaticContact CE1-CE2 3.88Å; F70-Y176 HydrophobicContact CE1-CE2 3.88Å; F70-Y176 AromaticContact CG-CE2 3.85Å; F70-Y176 HydrophobicContact CG-CE2 3.85Å; F70-Q198 HydrophobicContact CE1-CG 3.83Å; F70-A199 VanDerWaalsContact CZ-O 3.26Å; F70-A199 WeakPolarHBondContact CZ-O 3.16Å; F70-D200 HydrophobicContact CB-CB 4.47Å; F70-D200 HydrophobicContact CD2-CB 3.76Å; F70-D200 HydrophobicContact CE2-CB 4.07Å; F70-D200 HydrophobicContact CG-CB 4.02Å
71	A	88.6	Confident	91.9	Very high	60 Å²	60	30 Å²	30	50%	0.496	16%	0.164	S	C	.	.	S	Bend	trans	-77.1	63.8	179.1	0	0	0	0	0	112.7
72	G	88.4	Confident	92	Very high	5 Å²	5	32.9 Å²	32.9	5%	0.052	18%	0.179	C	C	.	.	S	Bend	trans	-159.6	-162.8	177.7	0	0	0	0	0	113.2	Q66 S67 F70	Q66-G72 PolarHBondContact NE2-O 2.97Å; S67-G72 VanDerWaalsContact CB-O 3.3Å; S67-G72 WeakPolarHBondContact CB-O 3.39Å; S67-G72 PolarHBondContact N-O 2.8Å; F70-G72 VanDerWaalsContact CE2-CA 3.46Å; F70-G72 PolarHBondContact O-N 3.27Å
73	W	90.1	Very high	92.1	Very high	57 Å²	57	33.5 Å²	33.5	22%	0.216	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	145.2	-177.3	-63.8	85.7	0	0	0	112.2	S64 T65 L75 N212	S64-W73 VanDerWaalsContact OG-CZ3 3.23Å; S64-W73 WeakPolarHBondContact OG-CZ3 3.23Å; T65-W73 VanDerWaalsContact C-CE3 3.48Å; T65-W73 WeakPolarHBondContact O-CA 3.4Å; T65-W73 VanDerWaalsContact O-CE3 3.26Å; W73-L75 HydrophobicContact CB-CD2 3.85Å; W73-L75 HydrophobicContact CB-CG 4.4Å; W73-N212 VanDerWaalsContact CD1-CB 3.42Å; W73-N212 VanDerWaalsContact NE1-CB 3.29Å; W73-N212 PolarHBondContact NE1-ND2 2.95Å; W73-N212 PolarHBondContact NE1-OD1 3.39Å
74	K	92	Very high	92.2	Very high	12 Å²	12	34.9 Å²	34.9	5%	0.052	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	129.6	152.6	-177.3	177.9	-165.6	143.2	0	107.9	S22 W29 S64 T65 I196 Q198	S22-K74 WeakPolarHBondContact OG-CE 3.38Å; S22-K74 PolarHBondContact OG-NZ 3.25Å; W29-K74 HydrophobicContact CH2-CD 3.92Å; W29-K74 HydrophobicContact CH2-CG 3.81Å; W29-K74 HydrophobicContact CZ3-CG 4.19Å; S64-K74 CarbonylContact C-O 3.54Å; S64-K74 WeakPolarHBondContact CA-O 3.14Å; T65-K74 HydrophobicContact CG2-CB 3.95Å; T65-K74 HydrophobicContact CG2-CD 4.28Å; T65-K74 HydrophobicContact CG2-CG 4.43Å; T65-K74 PolarHBondContact N-O 3.29Å; T65-K74 PolarHBondContact O-N 2.88Å; K74-I196 HydrophobicContact CG-CG2 4.49Å; K74-Q198 HydrophobicContact CB-CB 4.47Å; K74-Q198 HydrophobicContact CB-CG 4.03Å; K74-Q198 HydrophobicContact CG-CB 4.13Å; K74-Q198 HydrophobicContact CG-CG 4.12Å
75	L	93.2	Very high	92.5	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	143.6	-178.9	-60.1	-174	0	0	0	111	F63 W73 I196 I197 F215 V216 M219	F63-L75 WeakPolarHBondContact O-CA 3.37Å; W73-L75 HydrophobicContact CB-CD2 3.85Å; W73-L75 HydrophobicContact CB-CG 4.4Å; L75-I196 WeakPolarHBondContact O-CA 3.4Å; L75-I197 PolarHBondContact N-O 3.15Å; L75-I197 PolarHBondContact O-N 3.03Å; L75-F215 HydrophobicContact CD1-CB 3.89Å; L75-V216 HydrophobicContact CD1-CG2 4.2Å; L75-V216 HydrophobicContact CD2-CG2 3.9Å; L75-M219 HydrophobicContact CB-CE 3.94Å; L75-M219 HydrophobicContact CD1-CB 4.2Å
76	K	94.5	Very high	92.6	Very high	5 Å²	5	36.7 Å²	36.7	2%	0.022	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	121.3	167.4	173.2	172.5	179.9	179.2	0	108.7	V23 W29 V62 F63 E78 I194 C195 I196	V23-K76 PolarHBondContact O-NZ 3Å; W29-K76 HydrophobicContact CD2-CB 3.81Å; W29-K76 HydrophobicContact CD2-CD 3.88Å; W29-K76 HydrophobicContact CD2-CG 4.49Å; W29-K76 VanDerWaalsContact CE2-CD 3.47Å; W29-K76 HydrophobicContact CE3-CB 3.63Å; W29-K76 HydrophobicContact CG-CD 4.16Å; W29-K76 HydrophobicContact CH2-CB 3.54Å; W29-K76 HydrophobicContact CZ2-CB 3.73Å; W29-K76 HydrophobicContact CZ2-CD 3.87Å; W29-K76 HydrophobicContact CZ2-CG 4.4Å; W29-K76 HydrophobicContact CZ3-CB 3.49Å; W29-K76 VanDerWaalsContact CZ3-CB 3.49Å; V62-K76 CarbonylContact C-O 3.56Å; V62-K76 WeakPolarHBondContact CA-O 3.21Å; F63-K76 HydrophobicContact CB-CB 4.27Å; F63-K76 HydrophobicContact CD2-CB 4.42Å; F63-K76 HydrophobicContact CD2-CG 4.23Å; F63-K76 WeakPolarHBondContact CD2-O 3.49Å; F63-K76 PolarHBondContact N-O 2.91Å; F63-K76 PolarHBondContact O-N 3.4Å; K76-E78 WeakPolarHBondContact CE-OE1 3.49Å; K76-E78 IonicContact NZ-OE1 2.63Å; K76-E78 PolarHBondContact NZ-OE1 2.79Å; K76-I194 HydrophobicContact CD-CG2 4.48Å; K76-I194 HydrophobicContact CG-CG2 4.21Å; K76-C195 CarbonylContact C-O 3.54Å; K76-C195 VanDerWaalsContact CA-O 3.28Å; K76-C195 WeakPolarHBondContact CA-O 3.45Å; K76-I196 HydrophobicContact CB-CD1 3.69Å; K76-I196 HydrophobicContact CD-CD1 4Å; K76-I196 HydrophobicContact CG-CD1 3.68Å
77	G	94.2	Very high	92.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137	170	0	0	0	0	0	110.3	V61 I194 C195	V61-G77 CarbonylContact O-C 3.5Å; V61-G77 VanDerWaalsContact O-CA 3.27Å; V61-G77 WeakPolarHBondContact O-CA 3.42Å; G77-I194 CarbonylContact O-C 3.58Å; G77-I194 WeakPolarHBondContact O-CA 3.26Å; G77-C195 PolarHBondContact N-O 3.43Å; G77-C195 PolarHBondContact O-N 3.07Å
78	E	94.5	Very high	93	Very high	45 Å²	45	32.2 Å²	32.2	21%	0.21	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	136.3	167.6	-59	-159.3	-159.8	0	0	108.3	T60 V61 F63 K76 R192 I193 I194	T60-E78 CarbonylContact C-O 3.51Å; T60-E78 VanDerWaalsContact CA-O 3.25Å; T60-E78 WeakPolarHBondContact CA-O 3.15Å; V61-E78 PolarHBondContact N-O 3.22Å; V61-E78 PolarHBondContact O-N 3.21Å; F63-E78 HydrophobicContact CE2-CG 4Å; K76-E78 WeakPolarHBondContact CE-OE1 3.49Å; K76-E78 IonicContact NZ-OE1 2.63Å; K76-E78 PolarHBondContact NZ-OE1 2.79Å; E78-R192 IonicContact OE2-CZ 3.87Å; E78-R192 IonicContact OE2-NE 2.83Å; E78-R192 IonicContact OE2-NH2 3.16Å; E78-R192 PolarHBondContact OE2-NH2 3.25Å; E78-I193 WeakPolarHBondContact CA-O 3.21Å; E78-I194 HydrophobicContact CG-CG1 4.08Å
79	T	94.9	Very high	93.1	Very high	4 Å²	4	27.4 Å²	27.4	3%	0.025	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	166.6	177	-167.8	0	0	0	0	111.9	D59 T60 I193 L223 Q227	D59-T79 WeakPolarHBondContact O-CA 3.4Å; T60-T79 WeakPolarHBondContact OG1-CB 3.41Å; T60-T79 PolarHBondContact OG1-OG1 3.08Å; T79-I193 HydrophobicContact CG2-CB 3.94Å; T79-I193 PolarHBondContact N-O 3.33Å; T79-I193 PolarHBondContact O-N 3.22Å; T79-L223 HydrophobicContact CG2-CB 4.15Å; T79-L223 HydrophobicContact CG2-CD1 4.41Å; T79-L223 HydrophobicContact CG2-CD2 3.86Å; T79-L223 HydrophobicContact CG2-CG 4.35Å; T79-Q227 PolarHBondContact OG1-NE2 3.2Å
80	V	93.8	Very high	93.2	Very high	38 Å²	38	24.4 Å²	24.4	23%	0.23	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.3	169	179.9	0	0	0	0	108.6	D59 K190 T191 Q227	D59-V80 HydrophobicContact CB-CB 4.22Å; D59-V80 HydrophobicContact CB-CG2 4.46Å; V80-K190 HydrophobicContact CG1-CB 3.99Å; V80-K190 HydrophobicContact CG1-CD 4.42Å; V80-K190 HydrophobicContact CG1-CG 4.28Å; V80-T191 CarbonylContact C-O 3.32Å; V80-T191 WeakPolarHBondContact CA-O 3.49Å; V80-Q227 PolarHBondContact O-NE2 2.87Å
81	V	93.8	Very high	93.4	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.006	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	145.6	173.8	-56.1	0	0	0	0	110	F83 A88 K190 T191 I193 L226 Q227	V81-F83 VanDerWaalsContact C-N 3.29Å; V81-F83 HydrophobicContact CB-CD1 4.06Å; V81-F83 HydrophobicContact CB-CE1 3.59Å; V81-F83 HydrophobicContact CB-CE2 4.14Å; V81-F83 HydrophobicContact CB-CZ 3.63Å; V81-F83 HydrophobicContact CG1-CE1 4.27Å; V81-F83 HydrophobicContact CG1-CZ 4.05Å; V81-F83 HydrophobicContact CG2-CD1 4.26Å; V81-F83 HydrophobicContact CG2-CD2 3.93Å; V81-F83 HydrophobicContact CG2-CE1 3.98Å; V81-F83 HydrophobicContact CG2-CE2 3.61Å; V81-F83 HydrophobicContact CG2-CG 4.26Å; V81-F83 HydrophobicContact CG2-CZ 3.64Å; V81-F83 PolarHBondContact O-N 3.39Å; V81-A88 HydrophobicContact CG2-CB 4.27Å; V81-K190 WeakPolarHBondContact O-CA 3.47Å; V81-T191 HydrophobicContact CG2-CG2 4.14Å; V81-T191 PolarHBondContact N-O 3.02Å; V81-T191 PolarHBondContact O-N 3.04Å; V81-I193 HydrophobicContact CG1-CD1 3.85Å; V81-I193 HydrophobicContact CG2-CD1 3.95Å; V81-L226 HydrophobicContact CG1-CD2 4.4Å; V81-L226 HydrophobicContact CG1-CG 4.08Å; V81-Q227 HydrophobicContact CG1-CG 3.95Å
82	N	92.9	Very high	93.8	Very high	78 Å²	78	20.3 Å²	20.3	42%	0.417	10%	0.101	S	C	.	.	S	Bend	trans	-93.2	50.3	-173.6	-67.8	-44.3	0	0	0	112.6	E189 K230	N82-E189 CarbonylContact C-O 3.13Å; N82-E189 WeakPolarHBondContact CA-O 3.42Å; N82-K230 HydrophobicContact CB-CD 4.08Å
83	F	93.2	Very high	94.1	Very high	14 Å²	14	20.2 Å²	20.2	6%	0.061	10%	0.099	C	C	.	.	S	Bend	trans	-161.4	171.7	178	51.9	-97.8	0	0	0	111.2	V81 K87 A88 E189 T191 L226 C229 K230	V81-F83 VanDerWaalsContact C-N 3.29Å; V81-F83 HydrophobicContact CB-CD1 4.06Å; V81-F83 HydrophobicContact CB-CE1 3.59Å; V81-F83 HydrophobicContact CB-CE2 4.14Å; V81-F83 HydrophobicContact CB-CZ 3.63Å; V81-F83 HydrophobicContact CG1-CE1 4.27Å; V81-F83 HydrophobicContact CG1-CZ 4.05Å; V81-F83 HydrophobicContact CG2-CD1 4.26Å; V81-F83 HydrophobicContact CG2-CD2 3.93Å; V81-F83 HydrophobicContact CG2-CE1 3.98Å; V81-F83 HydrophobicContact CG2-CE2 3.61Å; V81-F83 HydrophobicContact CG2-CG 4.26Å; V81-F83 HydrophobicContact CG2-CZ 3.64Å; V81-F83 PolarHBondContact O-N 3.39Å; F83-K87 HydrophobicContact CB-CD 4.07Å; F83-K87 HydrophobicContact CD2-CB 3.84Å; F83-K87 HydrophobicContact CD2-CD 3.87Å; F83-K87 HydrophobicContact CD2-CG 3.7Å; F83-K87 HydrophobicContact CE2-CB 4.43Å; F83-K87 HydrophobicContact CE2-CG 4.08Å; F83-K87 HydrophobicContact CG-CD 4.05Å; F83-K87 HydrophobicContact CG-CG 4.39Å; F83-A88 HydrophobicContact CD2-CB 4.34Å; F83-A88 HydrophobicContact CE2-CB 3.72Å; F83-E189 PolarHBondContact N-O 3.5Å; F83-T191 WeakPolarHBondContact O-CB 3.24Å; F83-T191 PolarHBondContact O-OG1 3.19Å; F83-L226 WeakPolarHBondContact CE1-O 3.39Å; F83-L226 HydrophobicContact CZ-CD1 4.19Å; F83-L226 HydrophobicContact CZ-CG 4.48Å; F83-L226 VanDerWaalsContact CZ-O 3.3Å; F83-L226 WeakPolarHBondContact CZ-O 3.45Å; F83-C229 HydrophobicContact CE1-CB 4.14Å; F83-C229 HydrophobicContact CZ-CB 4.04Å; F83-K230 HydrophobicContact CD1-CB 3.88Å; F83-K230 HydrophobicContact CD1-CG 4.44Å; F83-K230 HydrophobicContact CE1-CB 4.41Å
84	L	94.3	Very high	94.1	Very high	66 Å²	66	18 Å²	18	35%	0.346	9%	0.092	S	C	.	.			trans	-57.1	145.1	-172.9	-68	171.8	0	0	0	114.4	E86 K87 A88 W234	L84-E86 PolarHBondContact O-N 2.92Å; L84-K87 HydrophobicContact CB-CB 4.3Å; L84-K87 WeakPolarHBondContact O-CB 3.49Å; L84-K87 PolarHBondContact O-N 2.91Å; L84-K87 VanDerWaalsContact O-N 3.1Å; L84-A88 PolarHBondContact O-N 3.4Å; L84-W234 HydrophobicContact CD1-CH2 4.48Å; L84-W234 HydrophobicContact CD1-CZ3 4.15Å
85	P	94.6	Very high	93.9	Very high	4 Å²	4	19.1 Å²	19.1	3%	0.026	10%	0.1	C	C	.	.	H	α-helix	trans	-55.3	-38.6	173.6	-26.4	34.9	0	0	0	113.5	A88 Y89 Y152 I182 R184 T191	P85-A88 WeakPolarHBondContact O-CB 3.36Å; P85-A88 PolarHBondContact O-N 2.9Å; P85-Y89 WeakPolarHBondContact O-CB 3.45Å; P85-Y89 PolarHBondContact O-N 3.43Å; P85-Y152 HydrophobicContact CB-CD2 4.1Å; P85-Y152 HydrophobicContact CB-CE2 3.85Å; P85-I182 HydrophobicContact CB-CG2 4.04Å; P85-R184 HydrophobicContact CB-CG 4.39Å; P85-T191 HydrophobicContact CB-CG2 4.1Å; P85-T191 WeakPolarHBondContact CD-OG1 3.17Å; P85-T191 HydrophobicContact CG-CG2 4.08Å; P85-T191 WeakPolarHBondContact CG-OG1 3.4Å
86	E	93.1	Very high	93.7	Very high	65 Å²	65	19.4 Å²	19.4	30%	0.304	10%	0.103	S	C	.	.	H	α-helix	trans	-61.1	-45	176.7	-65	69.8	-159.5	0	0	110.9	L84 Y89 D90 Y152 W234	L84-E86 PolarHBondContact O-N 2.92Å; E86-Y89 PolarHBondContact O-N 3.41Å; E86-D90 PolarHBondContact O-N 3.31Å; E86-Y152 HydrophobicContact CG-CE2 4.44Å; E86-Y152 WeakPolarHBondContact CG-OH 3.47Å; E86-Y152 PolarHBondContact OE1-OH 2.86Å; E86-Y152 VanDerWaalsContact OE1-OH 3.13Å; E86-W234 HydrophobicContact CB-CH2 4Å; E86-W234 HydrophobicContact CB-CZ2 4.1Å
87	K	94.5	Very high	93.4	Very high	19 Å²	19	26.1 Å²	26.1	8%	0.083	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-44.1	175.7	178.8	171.7	-179.6	172.7	0	110.4	F83 L84 Y89 D90 M91 C229 K230 L232 W234	F83-K87 HydrophobicContact CB-CD 4.07Å; F83-K87 HydrophobicContact CD2-CB 3.84Å; F83-K87 HydrophobicContact CD2-CD 3.87Å; F83-K87 HydrophobicContact CD2-CG 3.7Å; F83-K87 HydrophobicContact CE2-CB 4.43Å; F83-K87 HydrophobicContact CE2-CG 4.08Å; F83-K87 HydrophobicContact CG-CD 4.05Å; F83-K87 HydrophobicContact CG-CG 4.39Å; L84-K87 HydrophobicContact CB-CB 4.3Å; L84-K87 WeakPolarHBondContact O-CB 3.49Å; L84-K87 PolarHBondContact O-N 2.91Å; L84-K87 VanDerWaalsContact O-N 3.1Å; K87-Y89 VanDerWaalsContact C-N 3.3Å; K87-Y89 PolarHBondContact O-N 3.46Å; K87-D90 PolarHBondContact O-N 2.81Å; K87-M91 HydrophobicContact CG-CE 4.09Å; K87-M91 HydrophobicContact CG-CG 4.29Å; K87-M91 WeakPolarHBondContact O-CG 3.41Å; K87-M91 PolarHBondContact O-N 2.96Å; K87-C229 WeakPolarHBondContact CE-O 3.33Å; K87-C229 PolarHBondContact NZ-O 3.35Å; K87-K230 PolarHBondContact NZ-O 2.87Å; K87-L232 PolarHBondContact NZ-O 2.94Å; K87-W234 HydrophobicContact CB-CD2 3.72Å; K87-W234 HydrophobicContact CB-CE3 3.82Å; K87-W234 HydrophobicContact CB-CG 4.34Å; K87-W234 HydrophobicContact CB-CH2 3.94Å; K87-W234 HydrophobicContact CB-CZ2 3.87Å; K87-W234 HydrophobicContact CB-CZ3 3.93Å; K87-W234 HydrophobicContact CD-CB 3.98Å; K87-W234 HydrophobicContact CD-CD2 3.95Å; K87-W234 HydrophobicContact CD-CE3 3.93Å; K87-W234 HydrophobicContact CD-CG 4Å; K87-W234 HydrophobicContact CG-CB 4.24Å; K87-W234 HydrophobicContact CG-CD2 3.67Å; K87-W234 HydrophobicContact CG-CE3 4.02Å; K87-W234 HydrophobicContact CG-CG 3.78Å
88	A	95.4	Very high	93.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-58.4	-43.6	176.5	0	0	0	0	0	112.3	V81 F83 L84 P85 M91 I92 I182 T191 I193	V81-A88 HydrophobicContact CG2-CB 4.27Å; F83-A88 HydrophobicContact CD2-CB 4.34Å; F83-A88 HydrophobicContact CE2-CB 3.72Å; L84-A88 PolarHBondContact O-N 3.4Å; P85-A88 WeakPolarHBondContact O-CB 3.36Å; P85-A88 PolarHBondContact O-N 2.9Å; A88-M91 PolarHBondContact O-N 3.3Å; A88-I92 WeakPolarHBondContact O-CG1 3.46Å; A88-I92 PolarHBondContact O-N 3.26Å; A88-I182 HydrophobicContact CB-CD1 3.99Å; A88-I182 HydrophobicContact CB-CG2 3.96Å; A88-T191 HydrophobicContact CB-CG2 4.21Å; A88-I193 HydrophobicContact CB-CD1 3.97Å
89	Y	95	Very high	93.4	Very high	1 Å²	1	25.9 Å²	25.9	0%	0.004	13%	0.129	C	C	.	.	H	α-helix	trans	-63.6	-43.4	179	-171.5	-130.4	0	0	0	112	P85 E86 K87 M91 I92 H93 E147 Y152 L154 I182 R243	P85-Y89 WeakPolarHBondContact O-CB 3.45Å; P85-Y89 PolarHBondContact O-N 3.43Å; E86-Y89 PolarHBondContact O-N 3.41Å; K87-Y89 VanDerWaalsContact C-N 3.3Å; K87-Y89 PolarHBondContact O-N 3.46Å; Y89-M91 PolarHBondContact O-N 3.4Å; Y89-I92 WeakPolarHBondContact O-CG1 3.19Å; Y89-I92 PolarHBondContact O-N 2.86Å; Y89-H93 PolarHBondContact O-N 3.33Å; Y89-E147 HydrophobicContact CE1-CG 4.2Å; Y89-Y152 AromaticContact CD1-CD1 3.46Å; Y89-Y152 HydrophobicContact CD1-CD1 3.46Å; Y89-Y152 VanDerWaalsContact CD1-CD1 3.46Å; Y89-Y152 AromaticContact CD1-CE1 3.99Å; Y89-Y152 HydrophobicContact CD1-CE1 3.99Å; Y89-Y152 AromaticContact CD1-CG 3.95Å; Y89-Y152 HydrophobicContact CD1-CG 3.95Å; Y89-Y152 HydrophobicContact CD2-CD1 4.34Å; Y89-Y152 HydrophobicContact CD2-CG 4.14Å; Y89-Y152 AromaticContact CE1-CD1 3.7Å; Y89-Y152 HydrophobicContact CE1-CD1 3.7Å; Y89-Y152 HydrophobicContact CE1-CE1 4.35Å; Y89-Y152 HydrophobicContact CE1-CG 4.44Å; Y89-Y152 AromaticContact CG-CD1 3.8Å; Y89-Y152 HydrophobicContact CG-CD1 3.8Å; Y89-Y152 AromaticContact CG-CG 3.79Å; Y89-Y152 HydrophobicContact CG-CG 3.79Å; Y89-L154 HydrophobicContact CD2-CG 4.3Å; Y89-L154 HydrophobicContact CE2-CD1 4.32Å; Y89-L154 HydrophobicContact CE2-CD2 3.68Å; Y89-L154 HydrophobicContact CE2-CG 3.7Å; Y89-I182 VanDerWaalsContact CA-CD1 3.45Å; Y89-I182 HydrophobicContact CD2-CD1 4.1Å; Y89-I182 HydrophobicContact CG-CD1 4.48Å; Y89-R243 VanDerWaalsContact CE1-CZ 3.47Å
90	D	95.5	Very high	93.3	Very high	3 Å²	3	29.6 Å²	29.6	2%	0.016	15%	0.145	C	C	.	.	H	α-helix	trans	-67.1	-33.4	175.8	-73.9	-0.2	0	0	0	113.3	E86 K87 I92 Y98 W234 P236 I237 R243	E86-D90 PolarHBondContact O-N 3.31Å; K87-D90 PolarHBondContact O-N 2.81Å; D90-I92 VanDerWaalsContact C-N 3.32Å; D90-Y98 HydrophobicContact CB-CD2 4.34Å; D90-W234 PolarHBondContact OD2-NE1 3.44Å; D90-P236 VanDerWaalsContact OD2-CA 3.29Å; D90-P236 WeakPolarHBondContact OD2-CA 3.31Å; D90-I237 HydrophobicContact CB-CD1 3.7Å; D90-I237 HydrophobicContact CB-CG1 3.97Å; D90-I237 PolarHBondContact OD2-N 3.04Å; D90-R243 IonicContact OD1-CZ 3.28Å; D90-R243 IonicContact OD1-NH1 3.57Å; D90-R243 PolarHBondContact OD1-NH1 3.27Å
91	M	96	Very high	93.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.2	-34.4	176.1	-71.9	-58.6	121.8	0	0	112.1	K87 A88 Y89 Y98 W102 L226 C229 L232 W234	K87-M91 HydrophobicContact CG-CE 4.09Å; K87-M91 HydrophobicContact CG-CG 4.29Å; K87-M91 WeakPolarHBondContact O-CG 3.41Å; K87-M91 PolarHBondContact O-N 2.96Å; A88-M91 PolarHBondContact O-N 3.3Å; Y89-M91 PolarHBondContact O-N 3.4Å; M91-Y98 HydrophobicContact CE-CD1 3.82Å; M91-Y98 HydrophobicContact CE-CD2 3.88Å; M91-Y98 HydrophobicContact CE-CE1 4.36Å; M91-Y98 HydrophobicContact CE-CE2 4.42Å; M91-Y98 HydrophobicContact CE-CG 3.57Å; M91-Y98 HydrophobicContact SD-CG 4.21Å; M91-W102 HydrophobicContact CB-CZ2 4.4Å; M91-W102 WeakPolarHBondContact O-CZ2 3.37Å; M91-W102 PolarHBondContact O-NE1 2.85Å; M91-L226 HydrophobicContact CB-CD1 3.72Å; M91-L226 HydrophobicContact CG-CD1 4.36Å; M91-C229 HydrophobicContact CG-CB 3.98Å; M91-C229 HydrophobicContact SD-CB 3.95Å; M91-L232 HydrophobicContact CE-CD2 3.79Å; M91-L232 HydrophobicContact SD-CD1 4.47Å; M91-L232 HydrophobicContact SD-CD2 3.93Å; M91-W234 HydrophobicContact CE-CB 3.97Å; M91-W234 VanDerWaalsContact CE-CD1 3.48Å; M91-W234 HydrophobicContact CE-CG 3.92Å
92	I	95.4	Very high	93.3	Very high	8 Å²	8	33.6 Å²	33.6	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-94.9	-7.3	-177.4	69	160.4	0	0	0	113.6	A88 Y89 D90 W102 L154 M180 I182 L226	A88-I92 WeakPolarHBondContact O-CG1 3.46Å; A88-I92 PolarHBondContact O-N 3.26Å; Y89-I92 WeakPolarHBondContact O-CG1 3.19Å; Y89-I92 PolarHBondContact O-N 2.86Å; D90-I92 VanDerWaalsContact C-N 3.32Å; I92-W102 HydrophobicContact CG2-CH2 4.18Å; I92-W102 HydrophobicContact CG2-CZ2 3.86Å; I92-L154 HydrophobicContact CB-CD1 4.43Å; I92-L154 HydrophobicContact CD1-CD1 3.62Å; I92-L154 HydrophobicContact CD1-CG 4.2Å; I92-L154 HydrophobicContact CG1-CD1 3.66Å; I92-M180 HydrophobicContact CD1-CB 3.86Å; I92-M180 HydrophobicContact CD1-CG 4.42Å; I92-M180 HydrophobicContact CD1-SD 3.92Å; I92-M180 HydrophobicContact CG2-SD 4.22Å; I92-I182 HydrophobicContact CD1-CD1 3.57Å; I92-I182 HydrophobicContact CD1-CG1 4.27Å; I92-I182 HydrophobicContact CG1-CD1 4.01Å; I92-L226 HydrophobicContact CG2-CD1 4.04Å; I92-L226 HydrophobicContact CG2-CD2 3.85Å
93	H	94.8	Very high	93.4	Very high	3 Å²	3	30.1 Å²	30.1	1%	0.014	14%	0.142	C	C	.	.			trans	-56.1	127.2	-179.3	-175.3	-75.6	0	0	0	111.1	Y89 T95 A96 Q145 I237 A240 T241	Y89-H93 PolarHBondContact O-N 3.33Å; H93-T95 PolarHBondContact CE1-OG1 3.42Å; H93-T95 VanDerWaalsContact CE1-OG1 3.25Å; H93-T95 PolarHBondContact O-N 3.28Å; H93-A96 HydrophobicContact CB-CB 3.7Å; H93-A96 PolarHBondContact ND1-N 3.01Å; H93-A96 PolarHBondContact O-N 3.23Å; H93-Q145 PolarHBondContact CD2-OE1 3.29Å; H93-Q145 PolarHBondContact NE2-OE1 3.32Å; H93-I237 HydrophobicContact CB-CD1 4.38Å; H93-A240 WeakPolarHBondContact NE2-CB 3.4Å; H93-T241 PolarHBondContact CE1-O 3.07Å; H93-T241 PolarHBondContact NE2-O 2.91Å
94	P	90.2	Very high	93.3	Very high	10 Å²	10	34.8 Å²	34.8	7%	0.065	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-39.8	-161.2	22.3	-34.9	0	0	0	113.6	C109 I120 I143	P94-C109 VanDerWaalsContact O-CB 3.22Å; P94-C109 WeakPolarHBondContact O-CB 3.44Å; P94-C109 PolarHBondContact O-SG 3.19Å; P94-I120 HydrophobicContact CG-CD1 4.08Å; P94-I143 HydrophobicContact CB-CD1 3.53Å; P94-I143 HydrophobicContact CG-CD1 3.72Å; P94-I143 HydrophobicContact CG-CG2 4.45Å
95	T	87.5	Confident	93.1	Very high	35 Å²	35	33.1 Å²	33.1	22%	0.215	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	4.4	-175.5	60.1	0	0	0	0	113	H93 F111 V122	H93-T95 PolarHBondContact CE1-OG1 3.42Å; H93-T95 VanDerWaalsContact CE1-OG1 3.25Å; H93-T95 PolarHBondContact O-N 3.28Å; T95-F111 HydrophobicContact CG2-CB 4.08Å; T95-V122 HydrophobicContact CG2-CG1 4.24Å
96	A	88.6	Confident	93.1	Very high	9 Å²	9	33.3 Å²	33.3	7%	0.074	16%	0.159	C	C	.	.	S	Bend	trans	-79.7	146.9	-176.2	0	0	0	0	0	112.1	H93 Y98 R99 F100 I237	H93-A96 HydrophobicContact CB-CB 3.7Å; H93-A96 PolarHBondContact ND1-N 3.01Å; H93-A96 PolarHBondContact O-N 3.23Å; A96-Y98 PolarHBondContact O-N 2.82Å; A96-R99 WeakPolarHBondContact O-CB 3.23Å; A96-R99 PolarHBondContact O-N 2.79Å; A96-R99 VanDerWaalsContact O-N 3.11Å; A96-F100 WeakPolarHBondContact O-CD2 3.47Å; A96-F100 WeakPolarHBondContact O-CE2 3.33Å; A96-I237 HydrophobicContact CB-CD1 3.39Å
97	K	88.8	Confident	93.1	Very high	146 Å²	146	33.1 Å²	33.1	64%	0.635	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-26.1	177.7	69	179	179.9	-178.7	0	114.4	Q101	K97-Q101 PolarHBondContact O-NE2 3Å
98	Y	94.6	Very high	93.1	Very high	9 Å²	9	34 Å²	34	4%	0.035	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-34.9	-178.1	-61.5	-56.8	0	0	0	111.8	D90 M91 A96 F100 Q101 W102 L232 W234 T235 I237	D90-Y98 HydrophobicContact CB-CD2 4.34Å; M91-Y98 HydrophobicContact CE-CD1 3.82Å; M91-Y98 HydrophobicContact CE-CD2 3.88Å; M91-Y98 HydrophobicContact CE-CE1 4.36Å; M91-Y98 HydrophobicContact CE-CE2 4.42Å; M91-Y98 HydrophobicContact CE-CG 3.57Å; M91-Y98 HydrophobicContact SD-CG 4.21Å; A96-Y98 PolarHBondContact O-N 2.82Å; Y98-F100 PolarHBondContact O-N 2.75Å; Y98-Q101 WeakPolarHBondContact O-CB 3.28Å; Y98-Q101 PolarHBondContact O-N 2.86Å; Y98-W102 PolarHBondContact O-NE1 2.77Å; Y98-L232 HydrophobicContact CD1-CD2 3.65Å; Y98-L232 HydrophobicContact CE1-CD2 4.13Å; Y98-W234 AromaticContact CE2-CD1 3.59Å; Y98-W234 AromaticContact CZ-CD1 3.79Å; Y98-T235 PolarHBondContact OH-N 2.9Å; Y98-T235 PolarHBondContact OH-O 2.84Å; Y98-I237 HydrophobicContact CD2-CD1 3.91Å; Y98-I237 HydrophobicContact CD2-CG1 4.03Å; Y98-I237 HydrophobicContact CE2-CD1 4.12Å; Y98-I237 HydrophobicContact CE2-CG1 3.69Å
99	R	94.1	Very high	93.2	Very high	30 Å²	30	34.5 Å²	34.5	11%	0.113	17%	0.17	C	C	.	.	H	α-helix	trans	-52.3	-44.8	-178	178.8	53.9	174.4	-171.6	-0.4	112.4	A96 Q101 D103 V106 Y222	A96-R99 WeakPolarHBondContact O-CB 3.23Å; A96-R99 PolarHBondContact O-N 2.79Å; A96-R99 VanDerWaalsContact O-N 3.11Å; R99-Q101 VanDerWaalsContact C-N 3.27Å; R99-Q101 PolarHBondContact O-N 2.96Å; R99-D103 IonicContact CZ-OD2 3.37Å; R99-D103 IonicContact NE-OD2 3.02Å; R99-D103 PolarHBondContact NE-OD2 2.86Å; R99-D103 IonicContact NH1-OD2 3.52Å; R99-D103 IonicContact NH2-OD2 2.78Å; R99-D103 PolarHBondContact NH2-OD2 3Å; R99-D103 WeakPolarHBondContact O-CB 3.13Å; R99-D103 PolarHBondContact O-N 2.98Å; R99-D103 VanDerWaalsContact O-N 3.11Å; R99-V106 HydrophobicContact CG-CG1 4.15Å; R99-Y222 VanDerWaalsContact CZ-CE2 3.41Å; R99-Y222 VanDerWaalsContact NH1-CZ 3.26Å; R99-Y222 PolarHBondContact NH1-OH 2.72Å; R99-Y222 PolarHBondContact NH2-OH 3.48Å
100	F	92.9	Very high	93.2	Very high	82 Å²	82	37.7 Å²	37.7	36%	0.36	19%	0.19	S	C	.	.	H	α-helix	trans	-78.9	-4.9	-176.2	-49.4	-70.8	0	0	0	114.5	A96 Y98 V106 C109	A96-F100 WeakPolarHBondContact O-CD2 3.47Å; A96-F100 WeakPolarHBondContact O-CE2 3.33Å; Y98-F100 PolarHBondContact O-N 2.75Å; F100-V106 HydrophobicContact CD1-CG1 3.87Å; F100-V106 HydrophobicContact CD1-CG2 4.47Å; F100-V106 HydrophobicContact CE1-CG1 4.14Å; F100-V106 HydrophobicContact CE1-CG2 4Å; F100-C109 HydrophobicContact CE1-CB 4.23Å; F100-C109 HydrophobicContact CZ-CB 3.95Å
101	Q	94.3	Very high	93.2	Very high	107 Å²	107	41 Å²	41	50%	0.5	20%	0.204	S	C	.	.	H	α-helix	trans	-88.4	-16.9	178.7	-67.1	173.6	50.3	0	0	113	K97 Y98 R99 L232	K97-Q101 PolarHBondContact O-NE2 3Å; Y98-Q101 WeakPolarHBondContact O-CB 3.28Å; Y98-Q101 PolarHBondContact O-N 2.86Å; R99-Q101 VanDerWaalsContact C-N 3.27Å; R99-Q101 PolarHBondContact O-N 2.96Å; Q101-L232 HydrophobicContact CB-CD1 3.76Å
102	W	94.5	Very high	93.1	Very high	16 Å²	16	43.5 Å²	43.5	6%	0.061	22%	0.217	C	C	.	.	H	α-helix	trans	-136.9	-26.8	-173.5	68.6	-98.4	0	0	0	114.3	M91 I92 Y98 D104 Y222 L226 C229	M91-W102 HydrophobicContact CB-CZ2 4.4Å; M91-W102 WeakPolarHBondContact O-CZ2 3.37Å; M91-W102 PolarHBondContact O-NE1 2.85Å; I92-W102 HydrophobicContact CG2-CH2 4.18Å; I92-W102 HydrophobicContact CG2-CZ2 3.86Å; Y98-W102 PolarHBondContact O-NE1 2.77Å; W102-D104 PolarHBondContact O-N 2.85Å; W102-Y222 HydrophobicContact CH2-CD2 4.17Å; W102-Y222 HydrophobicContact CH2-CE1 4.23Å; W102-Y222 AromaticContact CH2-CE2 3.33Å; W102-Y222 HydrophobicContact CH2-CE2 3.33Å; W102-Y222 AromaticContact CH2-CZ 3.41Å; W102-Y222 VanDerWaalsContact CH2-CZ 3.41Å; W102-Y222 WeakPolarHBondContact CH2-OH 3.44Å; W102-Y222 HydrophobicContact CZ2-CE2 4.39Å; W102-Y222 AromaticContact CZ3-CD2 3.88Å; W102-Y222 HydrophobicContact CZ3-CD2 3.88Å; W102-Y222 AromaticContact CZ3-CE2 3.49Å; W102-Y222 HydrophobicContact CZ3-CE2 3.49Å; W102-Y222 VanDerWaalsContact CZ3-CE2 3.49Å; W102-Y222 AromaticContact CZ3-CZ 3.96Å; W102-Y222 WeakPolarHBondContact CZ3-O 3.28Å; W102-L226 HydrophobicContact CE3-CB 4.31Å; W102-L226 HydrophobicContact CH2-CB 3.71Å; W102-L226 HydrophobicContact CH2-CD1 3.8Å; W102-L226 HydrophobicContact CH2-CD2 4.37Å; W102-L226 HydrophobicContact CH2-CG 4.14Å; W102-L226 HydrophobicContact CZ2-CB 4.42Å; W102-L226 HydrophobicContact CZ2-CD1 3.66Å; W102-L226 HydrophobicContact CZ2-CG 4.49Å; W102-L226 HydrophobicContact CZ3-CB 3.7Å; W102-L226 HydrophobicContact CZ3-CD1 4.45Å; W102-C229 WeakPolarHBondContact CB-SG 3.36Å
103	D	94.2	Very high	93	Very high	6 Å²	6	46 Å²	46	3%	0.032	23%	0.229	C	C	.	.			trans	-81.6	99.4	177.9	-179.5	14	0	0	0	110.2	R99 H105 V106 Y222	R99-D103 IonicContact CZ-OD2 3.37Å; R99-D103 IonicContact NE-OD2 3.02Å; R99-D103 PolarHBondContact NE-OD2 2.86Å; R99-D103 IonicContact NH1-OD2 3.52Å; R99-D103 IonicContact NH2-OD2 2.78Å; R99-D103 PolarHBondContact NH2-OD2 3Å; R99-D103 WeakPolarHBondContact O-CB 3.13Å; R99-D103 PolarHBondContact O-N 2.98Å; R99-D103 VanDerWaalsContact O-N 3.11Å; D103-H105 PolarHBondContact O-N 3.38Å; D103-H105 WeakPolarHBondContact OD1-CB 3.45Å; D103-H105 IonicContact OD1-CD2 3.23Å; D103-H105 IonicContact OD1-CG 3.22Å; D103-H105 PolarHBondContact OD1-N 2.88Å; D103-V106 HydrophobicContact CB-CG1 3.73Å; D103-V106 PolarHBondContact O-N 3Å; D103-V106 WeakPolarHBondContact OD2-CB 3.5Å; D103-V106 WeakPolarHBondContact OD2-CG1 3.46Å; D103-Y222 HydrophobicContact CB-CE2 4.46Å
104	D	90.3	Very high	92.9	Very high	111 Å²	111	50.3 Å²	50.3	59%	0.594	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-18.5	178.5	-74.4	-35.6	0	0	0	113.3	W102 K127	W102-D104 PolarHBondContact O-N 2.85Å; D104-K127 VanDerWaalsContact O-CD 3.3Å; D104-K127 WeakPolarHBondContact O-CD 2.96Å; D104-K127 PolarHBondContact O-NZ 3.2Å
105	H	91.1	Very high	93	Very high	31 Å²	31	51.4 Å²	51.4	14%	0.144	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-25.8	-175.3	-60.9	-57.8	0	0	0	113.5	D103 M126 K127 L129	D103-H105 PolarHBondContact O-N 3.38Å; D103-H105 WeakPolarHBondContact OD1-CB 3.45Å; D103-H105 IonicContact OD1-CD2 3.23Å; D103-H105 IonicContact OD1-CG 3.22Å; D103-H105 PolarHBondContact OD1-N 2.88Å; H105-M126 CarbonylContact O-C 3.5Å; H105-M126 VanDerWaalsContact O-CA 3.28Å; H105-M126 WeakPolarHBondContact O-CA 3.44Å; H105-K127 PolarHBondContact O-N 3.05Å; H105-L129 VanDerWaalsContact ND1-CD2 3.3Å; H105-L129 WeakPolarHBondContact ND1-CD2 3.3Å
106	V	93.4	Very high	93.3	Very high	8 Å²	8	51.6 Å²	51.6	5%	0.048	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	130.6	179.2	70.9	0	0	0	0	110.8	R99 F100 D103 K127	R99-V106 HydrophobicContact CG-CG1 4.15Å; F100-V106 HydrophobicContact CD1-CG1 3.87Å; F100-V106 HydrophobicContact CD1-CG2 4.47Å; F100-V106 HydrophobicContact CE1-CG1 4.14Å; F100-V106 HydrophobicContact CE1-CG2 4Å; D103-V106 HydrophobicContact CB-CG1 3.73Å; D103-V106 PolarHBondContact O-N 3Å; D103-V106 WeakPolarHBondContact OD2-CB 3.5Å; D103-V106 WeakPolarHBondContact OD2-CG1 3.46Å; V106-K127 WeakPolarHBondContact O-CE 3.36Å; V106-K127 PolarHBondContact O-NZ 2.88Å
107	E	94.3	Very high	93.4	Very high	61 Å²	61	56.6 Å²	56.6	29%	0.285	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-49.1	170.8	-176.9	169.7	171.2	0	0	110.1	H125 K127 R169 Y170	E107-H125 HydrophobicContact CB-CB 4.06Å; E107-H125 PolarHBondContact N-O 2.7Å; E107-K127 HydrophobicContact CB-CG 3.84Å; E107-R169 IonicContact OE1-CZ 3.88Å; E107-R169 VanDerWaalsContact OE1-CZ 3.28Å; E107-R169 IonicContact OE1-NH1 2.62Å; E107-R169 PolarHBondContact OE1-NH1 2.93Å; E107-R169 IonicContact OE1-NH2 2.92Å; E107-R169 PolarHBondContact OE1-NH2 3.33Å; E107-R169 IonicContact OE2-NH2 3.73Å; E107-R169 PolarHBondContact OE2-NH2 3.35Å; E107-Y170 PolarHBondContact OE1-OH 2.94Å
108	S	95.2	Very high	93.6	Very high	37 Å²	37	49.9 Å²	49.9	26%	0.259	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	160.2	176.1	64.7	0	0	0	0	110.6	H125	S108-H125 PolarHBondContact N-O 2.62Å; S108-H125 PolarHBondContact O-N 2.96Å; S108-H125 PolarHBondContact OG-ND1 3.05Å
109	C	96.1	Very high	93.6	Very high	12 Å²	12	50 Å²	50	8%	0.081	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	109.2	170.8	178.9	0	0	0	0	108.2	P94 F100 H123 Q124	P94-C109 VanDerWaalsContact O-CB 3.22Å; P94-C109 WeakPolarHBondContact O-CB 3.44Å; P94-C109 PolarHBondContact O-SG 3.19Å; F100-C109 HydrophobicContact CE1-CB 4.23Å; F100-C109 HydrophobicContact CZ-CB 3.95Å; C109-H123 WeakPolarHBondContact CA-O 3.5Å; C109-Q124 HydrophobicContact CB-CG 4.46Å
110	T	95.2	Very high	93.7	Very high	67 Å²	67	48.5 Å²	48.5	41%	0.411	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.9	-175.3	-55.8	0	0	0	0	109.4	L112 V122 H123	T110-L112 HydrophobicContact CG2-CD2 4.38Å; T110-V122 CarbonylContact O-C 3.53Å; T110-V122 VanDerWaalsContact O-CA 3.26Å; T110-V122 WeakPolarHBondContact O-CA 3.45Å; T110-H123 PolarHBondContact N-O 3.17Å; T110-H123 PolarHBondContact O-N 2.78Å
111	F	95.4	Very high	93.9	Very high	73 Å²	73	44.6 Å²	44.6	32%	0.32	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	134.9	168.1	172.6	-104.7	0	0	0	110.4	T95 E113 D114 I120 T241	T95-F111 HydrophobicContact CG2-CB 4.08Å; F111-E113 VanDerWaalsContact CE2-C 3.4Å; F111-E113 WeakPolarHBondContact CE2-O 3.34Å; F111-D114 HydrophobicContact CZ-CB 4.39Å; F111-D114 WeakPolarHBondContact CZ-OD2 3.42Å; F111-I120 HydrophobicContact CD2-CB 4.32Å; F111-I120 HydrophobicContact CD2-CG2 4.43Å; F111-I120 HydrophobicContact CE2-CB 4.07Å; F111-I120 HydrophobicContact CE2-CG2 3.87Å; F111-T241 HydrophobicContact CB-CG2 4.46Å; F111-T241 HydrophobicContact CD1-CG2 4.28Å; F111-T241 HydrophobicContact CD2-CG2 3.27Å; F111-T241 HydrophobicContact CE1-CG2 4.34Å; F111-T241 HydrophobicContact CE2-CG2 3.34Å; F111-T241 HydrophobicContact CG-CG2 3.75Å; F111-T241 HydrophobicContact CZ-CG2 3.89Å
112	L	94.9	Very high	94	Very high	53 Å²	53	39.5 Å²	39.5	28%	0.277	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-53.4	178.6	-56.5	176	0	0	0	111.7	T110 L121 H123 V140 Y161 I164	T110-L112 HydrophobicContact CG2-CD2 4.38Å; L112-L121 HydrophobicContact CB-CB 4.24Å; L112-L121 HydrophobicContact CB-CD2 4.15Å; L112-L121 HydrophobicContact CB-CG 4.31Å; L112-L121 WeakPolarHBondContact CB-O 3.36Å; L112-L121 HydrophobicContact CD1-CD2 3.84Å; L112-L121 HydrophobicContact CD1-CG 3.92Å; L112-L121 PolarHBondContact N-O 2.68Å; L112-H123 HydrophobicContact CD1-CB 4.05Å; L112-H123 HydrophobicContact CD2-CB 4.13Å; L112-H123 HydrophobicContact CG-CB 4.28Å; L112-V140 HydrophobicContact CD1-CG1 4Å; L112-Y161 HydrophobicContact CD1-CD1 4.35Å; L112-Y161 HydrophobicContact CD1-CE1 4.2Å; L112-I164 HydrophobicContact CD1-CD1 3.28Å; L112-I164 HydrophobicContact CD2-CD1 3.58Å; L112-I164 HydrophobicContact CG-CD1 4.05Å
113	E	93.2	Very high	94.1	Very high	60 Å²	60	39.2 Å²	39.2	28%	0.28	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	145.5	-170.4	-169.1	171.6	174.7	0	0	111.8	F111 L115 I120 L121	F111-E113 VanDerWaalsContact CE2-C 3.4Å; F111-E113 WeakPolarHBondContact CE2-O 3.34Å; E113-L115 HydrophobicContact CB-CD2 4.4Å; E113-L115 HydrophobicContact CG-CD2 4.21Å; E113-I120 WeakPolarHBondContact O-CA 3.43Å; E113-L121 HydrophobicContact CB-CB 4.25Å; E113-L121 PolarHBondContact N-O 3.23Å; E113-L121 PolarHBondContact O-N 2.66Å
114	D	92.5	Very high	94.2	Very high	94 Å²	94	40.6 Å²	40.6	50%	0.503	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	112.5	163.8	-75.8	-65.7	0	0	0	108.2	F111 I120	F111-D114 HydrophobicContact CZ-CB 4.39Å; F111-D114 WeakPolarHBondContact CZ-OD2 3.42Å; D114-I120 WeakPolarHBondContact OD1-CG2 3.37Å
115	L	93.1	Very high	94.5	Very high	33 Å²	33	35.9 Å²	35.9	17%	0.173	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-36.2	-178.7	-59.9	176.4	0	0	0	111.5	I3 V8 E113 V119 L121 I142	I3-L115 HydrophobicContact CG2-CD2 4.15Å; V8-L115 HydrophobicContact CG1-CB 4.1Å; V8-L115 HydrophobicContact CG1-CD1 4.37Å; V8-L115 HydrophobicContact CG2-CB 4.35Å; V8-L115 HydrophobicContact CG2-CD1 4.19Å; V8-L115 HydrophobicContact CG2-CD2 4.44Å; E113-L115 HydrophobicContact CB-CD2 4.4Å; E113-L115 HydrophobicContact CG-CD2 4.21Å; L115-V119 HydrophobicContact CB-CB 4.45Å; L115-V119 HydrophobicContact CB-CG1 4.1Å; L115-V119 HydrophobicContact CD1-CG1 4.28Å; L115-V119 PolarHBondContact N-O 3.5Å; L115-L121 HydrophobicContact CD1-CB 4.03Å; L115-L121 HydrophobicContact CD1-CD1 4.28Å; L115-L121 HydrophobicContact CD2-CB 4.3Å; L115-L121 HydrophobicContact CG-CB 4.12Å; L115-I142 HydrophobicContact CD1-CD1 4.16Å; L115-I142 HydrophobicContact CD1-CG1 3.81Å; L115-I142 HydrophobicContact CD1-CG2 4.38Å
116	A	92.7	Very high	94.7	Very high	38 Å²	38	36.7 Å²	36.7	31%	0.314	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-164	170.6	176.3	0	0	0	0	0	109.5	G118 V119	A116-G118 PolarHBondContact O-N 3.2Å; A116-G118 VanDerWaalsContact O-N 3.12Å; A116-V119 HydrophobicContact CB-CB 4.02Å; A116-V119 HydrophobicContact CB-CG2 4.1Å; A116-V119 PolarHBondContact N-O 3.44Å; A116-V119 PolarHBondContact O-N 3.05Å
117	P	90.4	Very high	94.7	Very high	115 Å²	115	40.1 Å²	40.1	75%	0.747	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	121	172.2	-24.2	34.7	0	0	0	111.2	V119 T244	P117-V119 VanDerWaalsContact C-N 3.27Å; P117-V119 PolarHBondContact O-N 2.95Å; P117-T244 HydrophobicContact CB-CG2 3.52Å
118	G	93.1	Very high	94.6	Very high	4 Å²	4	40.4 Å²	40.4	4%	0.041	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	85	-2.6	-178.2	0	0	0	0	0	113.5	A116 V144 Q145 G242 T244	A116-G118 PolarHBondContact O-N 3.2Å; A116-G118 VanDerWaalsContact O-N 3.12Å; G118-V144 CarbonylContact O-C 3.59Å; G118-V144 VanDerWaalsContact O-CA 3.31Å; G118-V144 WeakPolarHBondContact O-CA 3.37Å; G118-Q145 PolarHBondContact O-N 3.01Å; G118-G242 WeakPolarHBondContact CA-O 3.35Å; G118-G242 PolarHBondContact N-O 3.46Å; G118-T244 VanDerWaalsContact N-CG2 3.3Å
119	V	95.3	Very high	94	Very high	11 Å²	11	39.8 Å²	39.8	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	114.8	-171.7	-169.8	0	0	0	0	109.9	V8 V12 L115 A116 P117 I142 I143 V144	V8-V119 HydrophobicContact CG1-CG1 4.23Å; V12-V119 HydrophobicContact CG2-CG1 3.92Å; V12-V119 HydrophobicContact CG2-CG2 4.27Å; L115-V119 HydrophobicContact CB-CB 4.45Å; L115-V119 HydrophobicContact CB-CG1 4.1Å; L115-V119 HydrophobicContact CD1-CG1 4.28Å; L115-V119 PolarHBondContact N-O 3.5Å; A116-V119 HydrophobicContact CB-CB 4.02Å; A116-V119 HydrophobicContact CB-CG2 4.1Å; A116-V119 PolarHBondContact N-O 3.44Å; A116-V119 PolarHBondContact O-N 3.05Å; P117-V119 VanDerWaalsContact C-N 3.27Å; P117-V119 PolarHBondContact O-N 2.95Å; V119-I142 HydrophobicContact CG1-CG2 3.54Å; V119-I143 WeakPolarHBondContact CA-O 2.95Å; V119-V144 HydrophobicContact CG1-CG2 4.27Å; V119-V144 HydrophobicContact CG2-CG1 4.48Å; V119-V144 HydrophobicContact CG2-CG2 4.23Å
120	I	95.6	Very high	93.4	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	154.2	-178.4	59.7	173.8	0	0	0	111.5	P94 F111 E113 D114 V122 I142 I143	P94-I120 HydrophobicContact CG-CD1 4.08Å; F111-I120 HydrophobicContact CD2-CB 4.32Å; F111-I120 HydrophobicContact CD2-CG2 4.43Å; F111-I120 HydrophobicContact CE2-CB 4.07Å; F111-I120 HydrophobicContact CE2-CG2 3.87Å; E113-I120 WeakPolarHBondContact O-CA 3.43Å; D114-I120 WeakPolarHBondContact OD1-CG2 3.37Å; I120-V122 HydrophobicContact CD1-CG1 3.77Å; I120-V122 HydrophobicContact CG1-CG1 4.12Å; I120-I142 CarbonylContact O-C 3.57Å; I120-I142 WeakPolarHBondContact O-CA 3.35Å; I120-I143 HydrophobicContact CD1-CB 4.47Å; I120-I143 HydrophobicContact CG1-CB 3.9Å; I120-I143 PolarHBondContact N-O 3.29Å; I120-I143 PolarHBondContact O-N 3.36Å
121	L	96.4	Very high	92.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.5	168.2	-165.1	73.7	0	0	0	109.4	L112 E113 L115 V140 I142 V159 Y161	L112-L121 HydrophobicContact CB-CB 4.24Å; L112-L121 HydrophobicContact CB-CD2 4.15Å; L112-L121 HydrophobicContact CB-CG 4.31Å; L112-L121 WeakPolarHBondContact CB-O 3.36Å; L112-L121 HydrophobicContact CD1-CD2 3.84Å; L112-L121 HydrophobicContact CD1-CG 3.92Å; L112-L121 PolarHBondContact N-O 2.68Å; E113-L121 HydrophobicContact CB-CB 4.25Å; E113-L121 PolarHBondContact N-O 3.23Å; E113-L121 PolarHBondContact O-N 2.66Å; L115-L121 HydrophobicContact CD1-CB 4.03Å; L115-L121 HydrophobicContact CD1-CD1 4.28Å; L115-L121 HydrophobicContact CD2-CB 4.3Å; L115-L121 HydrophobicContact CG-CB 4.12Å; L121-V140 HydrophobicContact CD1-CG1 4Å; L121-V140 HydrophobicContact CD2-CG1 4.36Å; L121-V140 HydrophobicContact CG-CG1 4.14Å; L121-I142 HydrophobicContact CD1-CG1 4.04Å; L121-V159 HydrophobicContact CD1-CG2 3.66Å; L121-Y161 HydrophobicContact CD2-CD1 4.16Å; L121-Y161 HydrophobicContact CD2-CD2 3.91Å; L121-Y161 HydrophobicContact CD2-CE1 3.94Å; L121-Y161 HydrophobicContact CD2-CE2 3.68Å; L121-Y161 HydrophobicContact CD2-CG 4.14Å
122	V	96.8	Very high	92.1	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	154.9	178.4	-58.5	0	0	0	0	112.1	T95 T110 I120 Q124 V140 D141 I143	T95-V122 HydrophobicContact CG2-CG1 4.24Å; T110-V122 CarbonylContact O-C 3.53Å; T110-V122 VanDerWaalsContact O-CA 3.26Å; T110-V122 WeakPolarHBondContact O-CA 3.45Å; I120-V122 HydrophobicContact CD1-CG1 3.77Å; I120-V122 HydrophobicContact CG1-CG1 4.12Å; V122-Q124 HydrophobicContact CG2-CG 3.9Å; V122-V140 WeakPolarHBondContact O-CA 3.38Å; V122-D141 HydrophobicContact CG2-CB 4.27Å; V122-D141 PolarHBondContact N-O 3.08Å; V122-D141 PolarHBondContact O-N 3.01Å; V122-I143 HydrophobicContact CB-CD1 4.5Å; V122-I143 HydrophobicContact CG1-CD1 4.21Å; V122-I143 HydrophobicContact CG2-CD1 3.46Å; V122-I143 VanDerWaalsContact CG2-CD1 3.46Å; V122-I143 HydrophobicContact CG2-CG1 3.9Å
123	H	97.3	Very high	91.4	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.046	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	109.4	167.6	-173.5	-153.8	0	0	0	109.4	C109 T110 L112 H125 D138 S139 I164	C109-H123 WeakPolarHBondContact CA-O 3.5Å; T110-H123 PolarHBondContact N-O 3.17Å; T110-H123 PolarHBondContact O-N 2.78Å; L112-H123 HydrophobicContact CD1-CB 4.05Å; L112-H123 HydrophobicContact CD2-CB 4.13Å; L112-H123 HydrophobicContact CG-CB 4.28Å; H123-H125 AromaticContact CE1-CE1 3.24Å; H123-H125 PolarHBondContact CE1-CE1 3.47Å; H123-H125 AromaticContact CE1-NE2 3.05Å; H123-H125 PolarHBondContact CE1-NE2 2.84Å; H123-H125 AromaticContact CG-CE1 3.84Å; H123-H125 AromaticContact ND1-CE1 3.2Å; H123-H125 PolarHBondContact ND1-CE1 3.11Å; H123-H125 AromaticContact ND1-NE2 3.55Å; H123-H125 AromaticContact NE2-CE1 3.89Å; H123-H125 AromaticContact NE2-NE2 3.62Å; H123-D138 IonicContact CD2-OD2 3.85Å; H123-D138 IonicContact CE1-OD2 3.79Å; H123-D138 IonicContact NE2-OD2 2.87Å; H123-D138 PolarHBondContact NE2-OD2 3.31Å; H123-S139 CarbonylContact C-O 3.58Å; H123-S139 WeakPolarHBondContact CA-O 3.27Å; H123-S139 PolarHBondContact CD2-O 3.3Å; H123-I164 HydrophobicContact CB-CD1 4Å
124	Q	96.9	Very high	91	Very high	34 Å²	34	48.8 Å²	48.8	16%	0.159	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	137	-179.8	-60.7	-170.6	70.9	0	0	110.4	C109 V122 D138 S139 D141	C109-Q124 HydrophobicContact CB-CG 4.46Å; V122-Q124 HydrophobicContact CG2-CG 3.9Å; Q124-D138 CarbonylContact O-C 3.59Å; Q124-D138 WeakPolarHBondContact O-CA 3.32Å; Q124-S139 PolarHBondContact N-O 2.87Å; Q124-S139 PolarHBondContact O-N 2.73Å; Q124-D141 PolarHBondContact NE2-OD2 3.04Å
125	H	96.6	Very high	91	Very high	13 Å²	13	47.3 Å²	47.3	6%	0.06	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.3	170.2	-60.2	89.9	0	0	0	109.1	E107 S108 H123 Y170	E107-H125 HydrophobicContact CB-CB 4.06Å; E107-H125 PolarHBondContact N-O 2.7Å; S108-H125 PolarHBondContact N-O 2.62Å; S108-H125 PolarHBondContact O-N 2.96Å; S108-H125 PolarHBondContact OG-ND1 3.05Å; H123-H125 AromaticContact CE1-CE1 3.24Å; H123-H125 PolarHBondContact CE1-CE1 3.47Å; H123-H125 AromaticContact CE1-NE2 3.05Å; H123-H125 PolarHBondContact CE1-NE2 2.84Å; H123-H125 AromaticContact CG-CE1 3.84Å; H123-H125 AromaticContact ND1-CE1 3.2Å; H123-H125 PolarHBondContact ND1-CE1 3.11Å; H123-H125 AromaticContact ND1-NE2 3.55Å; H123-H125 AromaticContact NE2-CE1 3.89Å; H123-H125 AromaticContact NE2-NE2 3.62Å; H125-Y170 HydrophobicContact CB-CE1 4.18Å; H125-Y170 AromaticContact CD2-CD2 3.75Å; H125-Y170 AromaticContact CD2-CE1 3.76Å; H125-Y170 AromaticContact CD2-CE2 3.39Å; H125-Y170 WeakPolarHBondContact CD2-CE2 3.29Å; H125-Y170 AromaticContact CD2-CZ 3.39Å; H125-Y170 AromaticContact NE2-CE2 3.82Å
126	M	94.7	Very high	91	Very high	47 Å²	47	46 Å²	46	23%	0.232	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137.2	176.8	-68.7	178.2	-87.4	0	0	110.4	H105 A136 R137 A173	H105-M126 CarbonylContact O-C 3.5Å; H105-M126 VanDerWaalsContact O-CA 3.28Å; H105-M126 WeakPolarHBondContact O-CA 3.44Å; M126-A136 WeakPolarHBondContact O-CA 3.34Å; M126-A136 WeakPolarHBondContact O-CB 3.4Å; M126-R137 HydrophobicContact CB-CB 4.24Å; M126-R137 HydrophobicContact CE-CB 3.51Å; M126-R137 HydrophobicContact CE-CG 4.35Å; M126-R137 PolarHBondContact N-O 2.62Å; M126-R137 PolarHBondContact O-N 3.32Å; M126-R137 VanDerWaalsContact O-N 3.13Å; M126-A173 HydrophobicContact CE-CB 4.07Å
127	K	93.8	Very high	91.2	Very high	80 Å²	80	44.9 Å²	44.9	35%	0.348	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-65	156.7	173.7	-61.8	-171.5	-159.3	133.1	0	110.8	D104 H105 V106 E107	D104-K127 VanDerWaalsContact O-CD 3.3Å; D104-K127 WeakPolarHBondContact O-CD 2.96Å; D104-K127 PolarHBondContact O-NZ 3.2Å; H105-K127 PolarHBondContact O-N 3.05Å; V106-K127 WeakPolarHBondContact O-CE 3.36Å; V106-K127 PolarHBondContact O-NZ 2.88Å; E107-K127 HydrophobicContact CB-CG 3.84Å
128	P	90.9	Very high	91.5	Very high	68 Å²	68	39.4 Å²	39.4	44%	0.442	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-56.3	141.8	170.7	-21.5	31.7	0	0	0	112.2	I134 A136	P128-I134 CarbonylContact C-O 3.56Å; P128-I134 WeakPolarHBondContact CA-O 3.13Å; P128-I134 WeakPolarHBondContact CB-O 3.46Å; P128-A136 HydrophobicContact CG-CB 4.09Å
129	L	84.3	Confident	91.7	Very high	24 Å²	24	39.4 Å²	39.4	13%	0.126	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-103.5	162.3	175.5	-53	174.1	0	0	0	110.7	H105 M131 G132 F133 I134 M218	H105-L129 VanDerWaalsContact ND1-CD2 3.3Å; H105-L129 WeakPolarHBondContact ND1-CD2 3.3Å; L129-M131 PolarHBondContact O-N 2.92Å; L129-G132 PolarHBondContact O-N 3.34Å; L129-G132 VanDerWaalsContact O-N 3.13Å; L129-F133 PolarHBondContact O-N 3.09Å; L129-I134 HydrophobicContact CB-CB 3.96Å; L129-I134 HydrophobicContact CB-CD1 4.22Å; L129-I134 HydrophobicContact CB-CG2 4.23Å; L129-I134 HydrophobicContact CD1-CG2 4.45Å; L129-I134 PolarHBondContact N-O 3.42Å; L129-I134 PolarHBondContact O-N 2.92Å; L129-I134 VanDerWaalsContact O-N 3.1Å; L129-M218 HydrophobicContact CD1-SD 3.84Å
130	L	82	Confident	91.7	Very high	83 Å²	83	39 Å²	39	44%	0.435	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	51.3	51.3	177.7	-60.7	-176.2	0	0	0	113.4	G132 F133 I134 I210 A214	L130-G132 PolarHBondContact O-N 2.79Å; L130-F133 HydrophobicContact CB-CB 4.02Å; L130-F133 HydrophobicContact CD1-CD1 4.49Å; L130-F133 WeakPolarHBondContact O-CB 3.4Å; L130-F133 PolarHBondContact O-N 3.27Å; L130-F133 VanDerWaalsContact O-N 3.1Å; L130-I134 HydrophobicContact CD1-CD1 3.97Å; L130-I134 HydrophobicContact CD1-CG1 4.41Å; L130-I134 HydrophobicContact CG-CD1 4.26Å; L130-I210 HydrophobicContact CD1-CG2 4.06Å; L130-A214 HydrophobicContact CD1-CB 3.83Å; L130-A214 HydrophobicContact CD2-CB 4.38Å; L130-A214 HydrophobicContact CG-CB 4.13Å
131	M	80	Confident	91.8	Very high	195 Å²	195	39 Å²	39	96%	0.961	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	55.9	33.6	-179.6	-53.3	-54	-66.6	0	0	113.6	L129	L129-M131 PolarHBondContact O-N 2.92Å
132	G	83.9	Confident	91.8	Very high	42 Å²	42	39 Å²	39	43%	0.433	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	89.4	-2.5	178.7	0	0	0	0	0	114.9	L129 L130 I134	L129-G132 PolarHBondContact O-N 3.34Å; L129-G132 VanDerWaalsContact O-N 3.13Å; L130-G132 PolarHBondContact O-N 2.79Å; G132-I134 PolarHBondContact O-N 3.36Å
133	F	80.6	Confident	91.9	Very high	130 Å²	130	39.3 Å²	39.3	57%	0.57	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-27.2	172.8	-169.1	-102.5	0	0	0	112.1	L129 L130 A206 I210	L129-F133 PolarHBondContact O-N 3.09Å; L130-F133 HydrophobicContact CB-CB 4.02Å; L130-F133 HydrophobicContact CD1-CD1 4.49Å; L130-F133 WeakPolarHBondContact O-CB 3.4Å; L130-F133 PolarHBondContact O-N 3.27Å; L130-F133 VanDerWaalsContact O-N 3.1Å; F133-A206 HydrophobicContact CE1-CB 3.98Å; F133-I210 HydrophobicContact CE1-CG2 4.31Å
134	I	84.8	Confident	91.8	Very high	3 Å²	3	39 Å²	39	2%	0.015	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-111	107.6	166.8	-61.4	174.6	0	0	0	106.2	P128 L129 L130 G132 I201 V203 A214	P128-I134 CarbonylContact C-O 3.56Å; P128-I134 WeakPolarHBondContact CA-O 3.13Å; P128-I134 WeakPolarHBondContact CB-O 3.46Å; L129-I134 HydrophobicContact CB-CB 3.96Å; L129-I134 HydrophobicContact CB-CD1 4.22Å; L129-I134 HydrophobicContact CB-CG2 4.23Å; L129-I134 HydrophobicContact CD1-CG2 4.45Å; L129-I134 PolarHBondContact N-O 3.42Å; L129-I134 PolarHBondContact O-N 2.92Å; L129-I134 VanDerWaalsContact O-N 3.1Å; L130-I134 HydrophobicContact CD1-CD1 3.97Å; L130-I134 HydrophobicContact CD1-CG1 4.41Å; L130-I134 HydrophobicContact CG-CD1 4.26Å; G132-I134 PolarHBondContact O-N 3.36Å; I134-I201 HydrophobicContact CD1-CD1 4.43Å; I134-I201 HydrophobicContact CG2-CD1 4.11Å; I134-V203 HydrophobicContact CG2-CG2 4.46Å; I134-A214 HydrophobicContact CD1-CB 3.9Å
135	S	91	Very high	91.7	Very high	63 Å²	63	37.5 Å²	37.5	44%	0.441	20%	0.203	S	C	.	.			trans	-47.8	167.4	173.4	-38.7	0	0	0	0	115	R137	S135-R137 VanDerWaalsContact CA-NH1 3.27Å; S135-R137 WeakPolarHBondContact O-CD 3.21Å; S135-R137 PolarHBondContact O-NH1 3.07Å
136	A	94.7	Very high	91.6	Very high	7 Å²	7	39.1 Å²	39.1	6%	0.058	21%	0.211	C	C	.	.			trans	-63.2	148.8	172.3	0	0	0	0	0	111.5	M126 P128 Y170 V171	M126-A136 WeakPolarHBondContact O-CA 3.34Å; M126-A136 WeakPolarHBondContact O-CB 3.4Å; P128-A136 HydrophobicContact CG-CB 4.09Å; A136-Y170 HydrophobicContact CB-CD1 3.51Å; A136-Y170 HydrophobicContact CB-CE1 3.73Å; A136-V171 PolarHBondContact O-N 2.65Å
137	R	95.3	Very high	91.5	Very high	14 Å²	14	39.5 Å²	39.5	5%	0.053	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	155	179.3	-87.8	60.4	-176.5	162.8	10.2	110.2	M126 S135 V171 A173 I201 V203	M126-R137 HydrophobicContact CB-CB 4.24Å; M126-R137 HydrophobicContact CE-CB 3.51Å; M126-R137 HydrophobicContact CE-CG 4.35Å; M126-R137 PolarHBondContact N-O 2.62Å; M126-R137 PolarHBondContact O-N 3.32Å; M126-R137 VanDerWaalsContact O-N 3.13Å; S135-R137 VanDerWaalsContact CA-NH1 3.27Å; S135-R137 WeakPolarHBondContact O-CD 3.21Å; S135-R137 PolarHBondContact O-NH1 3.07Å; R137-V171 WeakPolarHBondContact CA-O 3.05Å; R137-V171 WeakPolarHBondContact CB-O 3.39Å; R137-V171 HydrophobicContact CG-CB 4.41Å; R137-V171 VanDerWaalsContact CG-O 3.29Å; R137-V171 WeakPolarHBondContact CG-O 3.39Å; R137-A173 HydrophobicContact CB-CB 4.35Å; R137-A173 HydrophobicContact CG-CB 4.17Å; R137-I201 HydrophobicContact CG-CB 4.18Å; R137-I201 HydrophobicContact CG-CG2 4.31Å; R137-I201 PolarHBondContact NE-O 3.18Å; R137-I201 PolarHBondContact NH2-O 3.01Å; R137-V203 VanDerWaalsContact NH2-CG2 3.31Å
138	D	97.2	Very high	91.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	154.4	165.4	77.1	-45.8	0	0	0	110.9	H123 Q124 Y170 V171 R172 A173	H123-D138 IonicContact CD2-OD2 3.85Å; H123-D138 IonicContact CE1-OD2 3.79Å; H123-D138 IonicContact NE2-OD2 2.87Å; H123-D138 PolarHBondContact NE2-OD2 3.31Å; Q124-D138 CarbonylContact O-C 3.59Å; Q124-D138 WeakPolarHBondContact O-CA 3.32Å; D138-Y170 HydrophobicContact CB-CG 4.1Å; D138-V171 PolarHBondContact N-O 3.31Å; D138-R172 CarbonylContact O-C 3.49Å; D138-R172 WeakPolarHBondContact O-CA 3.3Å; D138-R172 WeakPolarHBondContact O-CD 3.45Å; D138-R172 VanDerWaalsContact OD1-CA 3.23Å; D138-R172 WeakPolarHBondContact OD1-CA 3.33Å; D138-R172 PolarHBondContact OD1-N 3.14Å; D138-R172 IonicContact OD1-NE 3.8Å; D138-R172 PolarHBondContact OD1-NE 2.79Å; D138-R172 IonicContact OD2-CZ 3.35Å; D138-R172 IonicContact OD2-NE 2.73Å; D138-R172 PolarHBondContact OD2-NE 3.18Å; D138-R172 IonicContact OD2-NH2 2.85Å; D138-R172 PolarHBondContact OD2-NH2 3.47Å; D138-A173 PolarHBondContact O-N 3.48Å
139	S	96.9	Very high	91.4	Very high	3 Å²	3	39.1 Å²	39.1	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	146.1	172.5	56.3	0	0	0	0	110.4	H123 Q124 D141	H123-S139 CarbonylContact C-O 3.58Å; H123-S139 WeakPolarHBondContact CA-O 3.27Å; H123-S139 PolarHBondContact CD2-O 3.3Å; Q124-S139 PolarHBondContact N-O 2.87Å; Q124-S139 PolarHBondContact O-N 2.73Å; S139-D141 WeakPolarHBondContact CB-OD2 3.41Å; S139-D141 PolarHBondContact OG-OD2 2.87Å
140	V	97	Very high	91.8	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	118.7	170.2	-176.4	0	0	0	0	106.7	L112 L121 V122 G158 V159 Y161 I164	L112-V140 HydrophobicContact CD1-CG1 4Å; L121-V140 HydrophobicContact CD1-CG1 4Å; L121-V140 HydrophobicContact CD2-CG1 4.36Å; L121-V140 HydrophobicContact CG-CG1 4.14Å; V122-V140 WeakPolarHBondContact O-CA 3.38Å; V140-G158 WeakPolarHBondContact O-CA 3.45Å; V140-V159 HydrophobicContact CG1-CG2 4.07Å; V140-V159 PolarHBondContact O-N 3.16Å; V140-Y161 HydrophobicContact CG1-CD1 4.24Å; V140-Y161 HydrophobicContact CG1-CG 4.2Å; V140-I164 HydrophobicContact CG2-CB 4.08Å; V140-I164 HydrophobicContact CG2-CD1 4.25Å; V140-I164 HydrophobicContact CG2-CG2 3.98Å
141	D	97.2	Very high	92.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	139.3	-168	-54.6	-65.7	0	0	0	111	V122 Q124 S139 L156 T157 G158 T175	V122-D141 HydrophobicContact CG2-CB 4.27Å; V122-D141 PolarHBondContact N-O 3.08Å; V122-D141 PolarHBondContact O-N 3.01Å; Q124-D141 PolarHBondContact NE2-OD2 3.04Å; S139-D141 WeakPolarHBondContact CB-OD2 3.41Å; S139-D141 PolarHBondContact OG-OD2 2.87Å; D141-L156 HydrophobicContact CB-CD1 4.42Å; D141-T157 CarbonylContact C-O 3.55Å; D141-T157 VanDerWaalsContact CA-O 3.32Å; D141-T157 WeakPolarHBondContact CA-O 3.3Å; D141-G158 VanDerWaalsContact OD1-CA 3.25Å; D141-G158 WeakPolarHBondContact OD1-CA 3.36Å; D141-T175 WeakPolarHBondContact OD1-CB 3.36Å; D141-T175 PolarHBondContact OD1-OG1 3.49Å
142	I	97.1	Very high	93.2	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	131.6	158.8	-64.7	176.9	0	0	0	106.8	I6 V12 L115 V119 I120 L121 V144 L156 T157 V159	I6-I142 HydrophobicContact CG2-CD1 3.89Å; V12-I142 HydrophobicContact CG2-CG2 4.41Å; L115-I142 HydrophobicContact CD1-CD1 4.16Å; L115-I142 HydrophobicContact CD1-CG1 3.81Å; L115-I142 HydrophobicContact CD1-CG2 4.38Å; V119-I142 HydrophobicContact CG1-CG2 3.54Å; I120-I142 CarbonylContact O-C 3.57Å; I120-I142 WeakPolarHBondContact O-CA 3.35Å; L121-I142 HydrophobicContact CD1-CG1 4.04Å; I142-V144 HydrophobicContact CG2-CG2 4.32Å; I142-L156 WeakPolarHBondContact O-CA 3.2Å; I142-L156 WeakPolarHBondContact O-CB 2.95Å; I142-T157 PolarHBondContact N-O 2.89Å; I142-T157 PolarHBondContact O-N 2.89Å; I142-T157 VanDerWaalsContact O-N 3.11Å; I142-V159 HydrophobicContact CD1-CG1 3.65Å; I142-V159 HydrophobicContact CG1-CG1 3.77Å; I142-V159 HydrophobicContact CG1-CG2 4.39Å
143	I	97.2	Very high	93.8	Very high	7 Å²	7	32.2 Å²	32.2	4%	0.036	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127	170.7	-58.8	-175.9	0	0	0	109.1	P94 V119 I120 V122 Q145 L154 M155 L156	P94-I143 HydrophobicContact CB-CD1 3.53Å; P94-I143 HydrophobicContact CG-CD1 3.72Å; P94-I143 HydrophobicContact CG-CG2 4.45Å; V119-I143 WeakPolarHBondContact CA-O 2.95Å; I120-I143 HydrophobicContact CD1-CB 4.47Å; I120-I143 HydrophobicContact CG1-CB 3.9Å; I120-I143 PolarHBondContact N-O 3.29Å; I120-I143 PolarHBondContact O-N 3.36Å; V122-I143 HydrophobicContact CB-CD1 4.5Å; V122-I143 HydrophobicContact CG1-CD1 4.21Å; V122-I143 HydrophobicContact CG2-CD1 3.46Å; V122-I143 VanDerWaalsContact CG2-CD1 3.46Å; V122-I143 HydrophobicContact CG2-CG1 3.9Å; I143-Q145 HydrophobicContact CG2-CG 4.14Å; I143-L154 HydrophobicContact CG2-CD2 4.36Å; I143-M155 CarbonylContact C-O 3.55Å; I143-M155 VanDerWaalsContact CA-O 3.3Å; I143-M155 WeakPolarHBondContact CA-O 3.47Å; I143-L156 HydrophobicContact CG1-CB 3.95Å
144	V	96.4	Very high	94.5	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.018	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	125.4	173.2	-177.5	0	0	0	0	108.8	V12 L15 G118 V119 I142 E146 L154 M155	V12-V144 HydrophobicContact CB-CG2 4.46Å; V12-V144 HydrophobicContact CG1-CG2 4.1Å; V12-V144 HydrophobicContact CG2-CG2 3.83Å; L15-V144 HydrophobicContact CD2-CB 4.41Å; L15-V144 HydrophobicContact CD2-CG2 3.8Å; G118-V144 CarbonylContact O-C 3.59Å; G118-V144 VanDerWaalsContact O-CA 3.31Å; G118-V144 WeakPolarHBondContact O-CA 3.37Å; V119-V144 HydrophobicContact CG1-CG2 4.27Å; V119-V144 HydrophobicContact CG2-CG1 4.48Å; V119-V144 HydrophobicContact CG2-CG2 4.23Å; I142-V144 HydrophobicContact CG2-CG2 4.32Å; V144-E146 HydrophobicContact CG1-CG 4.12Å; V144-L154 CarbonylContact O-C 3.44Å; V144-L154 WeakPolarHBondContact O-CA 2.94Å; V144-M155 HydrophobicContact CB-CB 4.39Å; V144-M155 HydrophobicContact CB-CE 4.05Å; V144-M155 HydrophobicContact CG1-CE 3.73Å; V144-M155 PolarHBondContact N-O 3.43Å; V144-M155 PolarHBondContact O-N 2.63Å
145	Q	95.2	Very high	95.1	Very high	3 Å²	3	26.5 Å²	26.5	1%	0.014	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.1	-177.9	-49.4	-163.7	48.9	0	0	109.4	H93 G118 I143 L154 T241	H93-Q145 PolarHBondContact CD2-OE1 3.29Å; H93-Q145 PolarHBondContact NE2-OE1 3.32Å; G118-Q145 PolarHBondContact O-N 3.01Å; I143-Q145 HydrophobicContact CG2-CG 4.14Å; Q145-L154 HydrophobicContact CB-CD2 3.88Å; Q145-L154 HydrophobicContact CG-CD2 3.49Å; Q145-L154 VanDerWaalsContact CG-CD2 3.49Å; Q145-T241 PolarHBondContact NE2-O 3.43Å
146	E	93.4	Very high	95.5	Very high	47 Å²	47	25.1 Å²	25.1	22%	0.22	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	135.8	-179.2	-65	-173.7	157.2	0	0	112.2	K16 V144 Y152 Q153 M155	K16-E146 WeakPolarHBondContact CE-OE1 3.4Å; K16-E146 IonicContact NZ-OE1 3.32Å; K16-E146 PolarHBondContact NZ-OE1 2.94Å; V144-E146 HydrophobicContact CG1-CG 4.12Å; E146-Y152 WeakPolarHBondContact O-CA 3.3Å; E146-Q153 HydrophobicContact CB-CG 3.86Å; E146-Q153 PolarHBondContact N-O 2.99Å; E146-Q153 PolarHBondContact O-N 3.42Å; E146-Q153 PolarHBondContact OE2-NE2 2.83Å; E146-M155 HydrophobicContact CG-CE 4.28Å
147	E	93.1	Very high	95.6	Very high	56 Å²	56	25.7 Å²	25.7	26%	0.262	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	103.2	171.3	-51.8	-160.8	-173.6	0	0	109.6	Y89 Y152 R184 R243	Y89-E147 HydrophobicContact CE1-CG 4.2Å; E147-Y152 HydrophobicContact CB-CD1 4.19Å; E147-Y152 HydrophobicContact CB-CE1 4.3Å; E147-Y152 HydrophobicContact CG-CD1 3.82Å; E147-Y152 HydrophobicContact CG-CE1 4.01Å; E147-Y152 WeakPolarHBondContact OE2-CE1 3.11Å; E147-R184 IonicContact OE2-NH2 3.86Å; E147-R243 IonicContact OE1-CZ 3.46Å; E147-R243 IonicContact OE1-NE 3.89Å; E147-R243 PolarHBondContact OE1-NE 3.2Å; E147-R243 IonicContact OE1-NH2 3.65Å; E147-R243 PolarHBondContact OE1-NH2 3.29Å; E147-R243 IonicContact OE2-NH2 3.02Å
148	A	92	Very high	95.6	Very high	31 Å²	31	26.1 Å²	26.1	26%	0.256	14%	0.138	S	C	.	.			trans	-100.4	165.1	171.8	0	0	0	0	0	110.5	Q150 Y151 R184	A148-Q150 PolarHBondContact O-N 3.34Å; A148-Y151 CarbonylContact C-O 3.47Å; A148-Y151 WeakPolarHBondContact CA-O 3.39Å; A148-Y151 HydrophobicContact CB-CD1 4.46Å; A148-Y151 HydrophobicContact CB-CD2 3.97Å; A148-Y151 HydrophobicContact CB-CE1 4.24Å; A148-Y151 HydrophobicContact CB-CE2 3.68Å; A148-Y151 HydrophobicContact CB-CG 4.33Å; A148-Y151 PolarHBondContact N-O 3.47Å; A148-Y151 PolarHBondContact O-N 3.21Å; A148-R184 WeakPolarHBondContact O-CD 3.2Å; A148-R184 PolarHBondContact O-NE 3.39Å; A148-R184 VanDerWaalsContact O-NE 3.09Å
149	D	90.8	Very high	95.5	Very high	108 Å²	108	27.3 Å²	27.3	58%	0.578	15%	0.145	S	C	*	.	S	Bend	trans	-62.2	-28.5	178.2	-72.1	-31.8	0	0	0	113	R184 R246	D149-R184 WeakPolarHBondContact O-CD 3.26Å; D149-R246 IonicContact OD1-NH2 2.62Å; D149-R246 PolarHBondContact OD1-NH2 3.38Å
150	Q	93.1	Very high	95.2	Very high	132 Å²	132	35.7 Å²	35.7	62%	0.617	18%	0.181	S	C	*	.	S	Bend	trans	-100.6	-16.1	-176.3	-55	-51.4	-42.3	0	0	113.6	A148 R184	A148-Q150 PolarHBondContact O-N 3.34Å; Q150-R184 PolarHBondContact O-N 3.03Å
151	Y	95.4	Very high	94.9	Very high	53 Å²	53	37.3 Å²	37.3	21%	0.208	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	157.8	-177.7	56.4	-103	0	0	0	112.8	A148 Q153 R181 I182	A148-Y151 CarbonylContact C-O 3.47Å; A148-Y151 WeakPolarHBondContact CA-O 3.39Å; A148-Y151 HydrophobicContact CB-CD1 4.46Å; A148-Y151 HydrophobicContact CB-CD2 3.97Å; A148-Y151 HydrophobicContact CB-CE1 4.24Å; A148-Y151 HydrophobicContact CB-CE2 3.68Å; A148-Y151 HydrophobicContact CB-CG 4.33Å; A148-Y151 PolarHBondContact N-O 3.47Å; A148-Y151 PolarHBondContact O-N 3.21Å; Y151-Q153 HydrophobicContact CD2-CB 4.09Å; Y151-Q153 HydrophobicContact CD2-CG 3.92Å; Y151-Q153 HydrophobicContact CE2-CB 4.33Å; Y151-Q153 HydrophobicContact CE2-CG 3.69Å; Y151-R181 HydrophobicContact CD1-CG 4.39Å; Y151-R181 HydrophobicContact CD2-CG 4.24Å; Y151-R181 HydrophobicContact CG-CG 3.89Å; Y151-I182 CarbonylContact C-O 3.55Å; Y151-I182 WeakPolarHBondContact CA-O 3.49Å; Y151-I182 VanDerWaalsContact CB-O 3.24Å; Y151-I182 WeakPolarHBondContact CB-O 3.42Å
152	Y	95.2	Very high	94.5	Very high	9 Å²	9	41.1 Å²	41.1	4%	0.035	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	146.4	154.2	-56.3	-87.9	0	0	0	108.8	P85 E86 Y89 E146 E147 I182 R184	P85-Y152 HydrophobicContact CB-CD2 4.1Å; P85-Y152 HydrophobicContact CB-CE2 3.85Å; E86-Y152 HydrophobicContact CG-CE2 4.44Å; E86-Y152 WeakPolarHBondContact CG-OH 3.47Å; E86-Y152 PolarHBondContact OE1-OH 2.86Å; E86-Y152 VanDerWaalsContact OE1-OH 3.13Å; Y89-Y152 AromaticContact CD1-CD1 3.46Å; Y89-Y152 HydrophobicContact CD1-CD1 3.46Å; Y89-Y152 VanDerWaalsContact CD1-CD1 3.46Å; Y89-Y152 AromaticContact CD1-CE1 3.99Å; Y89-Y152 HydrophobicContact CD1-CE1 3.99Å; Y89-Y152 AromaticContact CD1-CG 3.95Å; Y89-Y152 HydrophobicContact CD1-CG 3.95Å; Y89-Y152 HydrophobicContact CD2-CD1 4.34Å; Y89-Y152 HydrophobicContact CD2-CG 4.14Å; Y89-Y152 AromaticContact CE1-CD1 3.7Å; Y89-Y152 HydrophobicContact CE1-CD1 3.7Å; Y89-Y152 HydrophobicContact CE1-CE1 4.35Å; Y89-Y152 HydrophobicContact CE1-CG 4.44Å; Y89-Y152 AromaticContact CG-CD1 3.8Å; Y89-Y152 HydrophobicContact CG-CD1 3.8Å; Y89-Y152 AromaticContact CG-CG 3.79Å; Y89-Y152 HydrophobicContact CG-CG 3.79Å; E146-Y152 WeakPolarHBondContact O-CA 3.3Å; E147-Y152 HydrophobicContact CB-CD1 4.19Å; E147-Y152 HydrophobicContact CB-CE1 4.3Å; E147-Y152 HydrophobicContact CG-CD1 3.82Å; E147-Y152 HydrophobicContact CG-CE1 4.01Å; E147-Y152 WeakPolarHBondContact OE2-CE1 3.11Å; Y152-I182 HydrophobicContact CD2-CG2 4.47Å; Y152-I182 PolarHBondContact N-O 3.35Å; Y152-I182 PolarHBondContact O-N 2.99Å; Y152-R184 HydrophobicContact CD2-CG 4.08Å; Y152-R184 HydrophobicContact CE2-CG 3.78Å; Y152-R184 VanDerWaalsContact CE2-NE 3.3Å; Y152-R184 VanDerWaalsContact CZ-NE 3.33Å; Y152-R184 PolarHBondContact OH-NH2 3.1Å
153	Q	95.8	Very high	94.2	Very high	5 Å²	5	44.7 Å²	44.7	2%	0.023	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	144.7	168.7	64	-175	8.3	0	0	113.7	E146 Y151 M155 M180 R181	E146-Q153 HydrophobicContact CB-CG 3.86Å; E146-Q153 PolarHBondContact N-O 2.99Å; E146-Q153 PolarHBondContact O-N 3.42Å; E146-Q153 PolarHBondContact OE2-NE2 2.83Å; Y151-Q153 HydrophobicContact CD2-CB 4.09Å; Y151-Q153 HydrophobicContact CD2-CG 3.92Å; Y151-Q153 HydrophobicContact CE2-CB 4.33Å; Y151-Q153 HydrophobicContact CE2-CG 3.69Å; Q153-M155 HydrophobicContact CG-CE 4.2Å; Q153-M180 CarbonylContact C-O 3.59Å; Q153-M180 WeakPolarHBondContact CA-O 3.22Å; Q153-M180 VanDerWaalsContact CB-O 3.28Å; Q153-M180 WeakPolarHBondContact CB-O 3.36Å; Q153-R181 VanDerWaalsContact OE1-NE 3.1Å
154	L	96.6	Very high	94	Very high	13 Å²	13	45.3 Å²	45.3	7%	0.068	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	119.1	168.4	-65	177	0	0	0	107	Y89 I92 I143 V144 Q145 G179 M180	Y89-L154 HydrophobicContact CD2-CG 4.3Å; Y89-L154 HydrophobicContact CE2-CD1 4.32Å; Y89-L154 HydrophobicContact CE2-CD2 3.68Å; Y89-L154 HydrophobicContact CE2-CG 3.7Å; I92-L154 HydrophobicContact CB-CD1 4.43Å; I92-L154 HydrophobicContact CD1-CD1 3.62Å; I92-L154 HydrophobicContact CD1-CG 4.2Å; I92-L154 HydrophobicContact CG1-CD1 3.66Å; I143-L154 HydrophobicContact CG2-CD2 4.36Å; V144-L154 CarbonylContact O-C 3.44Å; V144-L154 WeakPolarHBondContact O-CA 2.94Å; Q145-L154 HydrophobicContact CB-CD2 3.88Å; Q145-L154 HydrophobicContact CG-CD2 3.49Å; Q145-L154 VanDerWaalsContact CG-CD2 3.49Å; L154-G179 CarbonylContact O-C 3.49Å; L154-G179 WeakPolarHBondContact O-CA 3.44Å; L154-M180 PolarHBondContact N-O 2.96Å; L154-M180 PolarHBondContact O-N 3.5Å
155	M	97.6	Very high	93.7	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	147.2	175.6	-60.8	169.9	-73.6	0	0	108.4	L15 K16 F19 I143 V144 E146 Q153 S178	L15-M155 HydrophobicContact CD1-CB 3.91Å; L15-M155 HydrophobicContact CD2-CB 3.82Å; L15-M155 HydrophobicContact CG-CB 3.79Å; K16-M155 HydrophobicContact CG-CE 3.8Å; K16-M155 HydrophobicContact CG-SD 4.07Å; F19-M155 HydrophobicContact CB-CG 4.18Å; F19-M155 HydrophobicContact CB-SD 4.04Å; F19-M155 HydrophobicContact CD1-CG 3.54Å; F19-M155 HydrophobicContact CD1-SD 3.57Å; F19-M155 VanDerWaalsContact CD1-SD 3.57Å; F19-M155 HydrophobicContact CD2-CG 4.26Å; F19-M155 HydrophobicContact CE1-CG 3.93Å; F19-M155 HydrophobicContact CE1-SD 4.32Å; F19-M155 HydrophobicContact CG-CG 3.71Å; F19-M155 HydrophobicContact CG-SD 3.98Å; F19-M155 HydrophobicContact CZ-CG 4.46Å; I143-M155 CarbonylContact C-O 3.55Å; I143-M155 VanDerWaalsContact CA-O 3.3Å; I143-M155 WeakPolarHBondContact CA-O 3.47Å; V144-M155 HydrophobicContact CB-CB 4.39Å; V144-M155 HydrophobicContact CB-CE 4.05Å; V144-M155 HydrophobicContact CG1-CE 3.73Å; V144-M155 PolarHBondContact N-O 3.43Å; V144-M155 PolarHBondContact O-N 2.63Å; E146-M155 HydrophobicContact CG-CE 4.28Å; Q153-M155 HydrophobicContact CG-CE 4.2Å; M155-S178 CarbonylContact C-O 3.57Å; M155-S178 WeakPolarHBondContact CA-O 3.48Å
156	L	97.8	Very high	93.5	Very high	34 Å²	34	53.8 Å²	53.8	18%	0.178	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.8	178.4	70.7	158.3	0	0	0	113.7	L15 D141 I142 I143 T175 S178	L15-L156 VanDerWaalsContact CD1-O 3.24Å; L15-L156 WeakPolarHBondContact CD1-O 3.43Å; D141-L156 HydrophobicContact CB-CD1 4.42Å; I142-L156 WeakPolarHBondContact O-CA 3.2Å; I142-L156 WeakPolarHBondContact O-CB 2.95Å; I143-L156 HydrophobicContact CG1-CB 3.95Å; L156-T175 HydrophobicContact CD1-CG2 3.95Å; L156-T175 HydrophobicContact CG-CG2 4.1Å; L156-S178 PolarHBondContact N-O 3.34Å; L156-S178 PolarHBondContact O-N 2.87Å
157	T	97.6	Very high	93.5	Very high	19 Å²	19	55 Å²	55	12%	0.117	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	146.8	169.6	-168.1	0	0	0	0	110.1	L15 D141 I142	L15-T157 HydrophobicContact CB-CG2 4.36Å; L15-T157 HydrophobicContact CD2-CG2 4.26Å; D141-T157 CarbonylContact C-O 3.55Å; D141-T157 VanDerWaalsContact CA-O 3.32Å; D141-T157 WeakPolarHBondContact CA-O 3.3Å; I142-T157 PolarHBondContact N-O 2.89Å; I142-T157 PolarHBondContact O-N 2.89Å; I142-T157 VanDerWaalsContact O-N 3.11Å
158	G	95.9	Very high	93.4	Very high	22 Å²	22	59.3 Å²	59.3	23%	0.227	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	147.6	179.8	0	0	0	0	0	111	V140 D141 T175	V140-G158 WeakPolarHBondContact O-CA 3.45Å; D141-G158 VanDerWaalsContact OD1-CA 3.25Å; D141-G158 WeakPolarHBondContact OD1-CA 3.36Å; G158-T175 WeakPolarHBondContact CA-O 3.3Å; G158-T175 PolarHBondContact N-O 2.62Å
159	V	94.6	Very high	93.5	Very high	25 Å²	25	65.5 Å²	65.5	15%	0.152	35%	0.347	C	S	.	.			trans	-131.3	156.6	176.3	-66.3	0	0	0	0	110.6	I6 L121 V140 I142	I6-V159 HydrophobicContact CD1-CB 4.09Å; I6-V159 HydrophobicContact CD1-CG2 3.85Å; I6-V159 HydrophobicContact CG1-CB 4.49Å; I6-V159 HydrophobicContact CG2-CG1 4.23Å; L121-V159 HydrophobicContact CD1-CG2 3.66Å; V140-V159 HydrophobicContact CG1-CG2 4.07Å; V140-V159 PolarHBondContact O-N 3.16Å; I142-V159 HydrophobicContact CD1-CG1 3.65Å; I142-V159 HydrophobicContact CG1-CG1 3.77Å; I142-V159 HydrophobicContact CG1-CG2 4.39Å
160	K	90.7	Very high	93.7	Very high	180 Å²	180	61.5 Å²	61.5	78%	0.783	32%	0.324	S	S	*	.			trans	-81.4	129	165	-66.4	-178.9	-176.1	174.7	0	107.5
161	Y	90.4	Very high	93.8	Very high	36 Å²	36	57.7 Å²	57.7	14%	0.141	31%	0.309	C	S	.	.			trans	-134.7	109.9	179.5	-167.9	-122.8	0	0	0	108.6	I6 L112 L121 V140 D163 I164	I6-Y161 HydrophobicContact CD1-CD2 3.87Å; L112-Y161 HydrophobicContact CD1-CD1 4.35Å; L112-Y161 HydrophobicContact CD1-CE1 4.2Å; L121-Y161 HydrophobicContact CD2-CD1 4.16Å; L121-Y161 HydrophobicContact CD2-CD2 3.91Å; L121-Y161 HydrophobicContact CD2-CE1 3.94Å; L121-Y161 HydrophobicContact CD2-CE2 3.68Å; L121-Y161 HydrophobicContact CD2-CG 4.14Å; V140-Y161 HydrophobicContact CG1-CD1 4.24Å; V140-Y161 HydrophobicContact CG1-CG 4.2Å; Y161-D163 VanDerWaalsContact C-N 3.27Å; Y161-D163 HydrophobicContact CD1-CB 4.12Å; Y161-D163 HydrophobicContact CE1-CB 3.66Å; Y161-D163 PolarHBondContact O-N 2.7Å; Y161-I164 HydrophobicContact CD1-CB 4.03Å; Y161-I164 HydrophobicContact CD1-CD1 3.85Å; Y161-I164 HydrophobicContact CD1-CG1 3.72Å; Y161-I164 HydrophobicContact CE1-CD1 4.07Å; Y161-I164 HydrophobicContact CE1-CG1 4.01Å; Y161-I164 CarbonylContact O-C 3.56Å; Y161-I164 PolarHBondContact O-N 3.44Å
162	S	88.3	Confident	93.8	Very high	79 Å²	79	57.6 Å²	57.6	55%	0.552	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-31.6	-172.7	47.9	0	0	0	0	112.7	I164	S162-I164 PolarHBondContact O-N 2.75Å
163	D	91.3	Very high	93.8	Very high	76 Å²	76	57.4 Å²	57.4	41%	0.406	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-13.8	178.4	-63.4	-31.5	0	0	0	113.1	Y161 P165	Y161-D163 VanDerWaalsContact C-N 3.27Å; Y161-D163 HydrophobicContact CD1-CB 4.12Å; Y161-D163 HydrophobicContact CE1-CB 3.66Å; Y161-D163 PolarHBondContact O-N 2.7Å; D163-P165 WeakPolarHBondContact O-CD 3.28Å
164	I	92.4	Very high	93.8	Very high	20 Å²	20	60 Å²	60	10%	0.103	32%	0.324	C	S	.	.	S	Bend	trans	-120.3	81.6	173.8	-60.6	177.2	0	0	0	110.1	L112 H123 V140 Y161 S162 R172	L112-I164 HydrophobicContact CD1-CD1 3.28Å; L112-I164 HydrophobicContact CD2-CD1 3.58Å; L112-I164 HydrophobicContact CG-CD1 4.05Å; H123-I164 HydrophobicContact CB-CD1 4Å; V140-I164 HydrophobicContact CG2-CB 4.08Å; V140-I164 HydrophobicContact CG2-CD1 4.25Å; V140-I164 HydrophobicContact CG2-CG2 3.98Å; Y161-I164 HydrophobicContact CD1-CB 4.03Å; Y161-I164 HydrophobicContact CD1-CD1 3.85Å; Y161-I164 HydrophobicContact CD1-CG1 3.72Å; Y161-I164 HydrophobicContact CE1-CD1 4.07Å; Y161-I164 HydrophobicContact CE1-CG1 4.01Å; Y161-I164 CarbonylContact O-C 3.56Å; Y161-I164 PolarHBondContact O-N 3.44Å; S162-I164 PolarHBondContact O-N 2.75Å; I164-R172 PolarHBondContact O-NH1 2.94Å; I164-R172 PolarHBondContact O-NH2 2.9Å; I164-R172 VanDerWaalsContact O-NH2 3.07Å
165	P	90.9	Very high	93.8	Very high	82 Å²	82	59.9 Å²	59.9	53%	0.532	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-66	162.1	176.7	28.9	-35.4	0	0	0	111.5	D163 Q167 R172	D163-P165 WeakPolarHBondContact O-CD 3.28Å; P165-Q167 PolarHBondContact O-N 2.84Å; P165-R172 PolarHBondContact O-NH2 3.48Å
166	P	90.8	Very high	93.7	Very high	101 Å²	101	62.2 Å²	62.2	66%	0.656	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-54.9	135.5	174.2	-25.2	34.7	0	0	0	112.1
167	Q	92.4	Very high	93.7	Very high	74 Å²	74	60.9 Å²	60.9	35%	0.346	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-103.4	138	-179.2	-63.5	-176.1	8.4	0	0	110.7	P165 R169 Y170	P165-Q167 PolarHBondContact O-N 2.84Å; Q167-R169 PolarHBondContact O-N 2.86Å; Q167-Y170 HydrophobicContact CB-CD2 4.01Å; Q167-Y170 PolarHBondContact O-N 2.88Å
168	P	91.1	Very high	93.7	Very high	145 Å²	145	60.1 Å²	60.1	94%	0.942	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-28.5	-175.3	-27.4	34.5	0	0	0	115.6	Y170	P168-Y170 VanDerWaalsContact C-N 3.33Å
169	R	93.8	Very high	93.8	Very high	162 Å²	162	59.1 Å²	59.1	61%	0.611	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-20.3	-179.8	-176.1	173.1	176	-143.4	-13.9	113	E107 Q167	E107-R169 IonicContact OE1-CZ 3.88Å; E107-R169 VanDerWaalsContact OE1-CZ 3.28Å; E107-R169 IonicContact OE1-NH1 2.62Å; E107-R169 PolarHBondContact OE1-NH1 2.93Å; E107-R169 IonicContact OE1-NH2 2.92Å; E107-R169 PolarHBondContact OE1-NH2 3.33Å; E107-R169 IonicContact OE2-NH2 3.73Å; E107-R169 PolarHBondContact OE2-NH2 3.35Å; Q167-R169 PolarHBondContact O-N 2.86Å
170	Y	95.6	Very high	94	Very high	24 Å²	24	59 Å²	59	9%	0.094	31%	0.311	C	S	.	.	S	Bend	trans	-124.7	139.6	-169.7	-57.6	-76.1	0	0	0	111.5	E107 H125 A136 D138 Q167 P168	E107-Y170 PolarHBondContact OE1-OH 2.94Å; H125-Y170 HydrophobicContact CB-CE1 4.18Å; H125-Y170 AromaticContact CD2-CD2 3.75Å; H125-Y170 AromaticContact CD2-CE1 3.76Å; H125-Y170 AromaticContact CD2-CE2 3.39Å; H125-Y170 WeakPolarHBondContact CD2-CE2 3.29Å; H125-Y170 AromaticContact CD2-CZ 3.39Å; H125-Y170 AromaticContact NE2-CE2 3.82Å; A136-Y170 HydrophobicContact CB-CD1 3.51Å; A136-Y170 HydrophobicContact CB-CE1 3.73Å; D138-Y170 HydrophobicContact CB-CG 4.1Å; Q167-Y170 HydrophobicContact CB-CD2 4.01Å; Q167-Y170 PolarHBondContact O-N 2.88Å; P168-Y170 VanDerWaalsContact C-N 3.33Å
171	V	94.7	Very high	94.3	Very high	51 Å²	51	50.6 Å²	50.6	31%	0.309	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	119.5	166.3	178.7	0	0	0	0	107.7	A136 R137 D138 A173 N202	A136-V171 PolarHBondContact O-N 2.65Å; R137-V171 WeakPolarHBondContact CA-O 3.05Å; R137-V171 WeakPolarHBondContact CB-O 3.39Å; R137-V171 HydrophobicContact CG-CB 4.41Å; R137-V171 VanDerWaalsContact CG-O 3.29Å; R137-V171 WeakPolarHBondContact CG-O 3.39Å; D138-V171 PolarHBondContact N-O 3.31Å; V171-A173 PolarHBondContact O-N 3.46Å; V171-A173 VanDerWaalsContact O-N 3.17Å; V171-N202 HydrophobicContact CG1-CB 3.84Å
172	R	95.8	Very high	94.6	Very high	52 Å²	52	48.9 Å²	48.9	20%	0.196	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	120	175	-179.1	59	55.1	82.2	0.6	110.3	D138 I164 P165 N202	D138-R172 CarbonylContact O-C 3.49Å; D138-R172 WeakPolarHBondContact O-CA 3.3Å; D138-R172 WeakPolarHBondContact O-CD 3.45Å; D138-R172 VanDerWaalsContact OD1-CA 3.23Å; D138-R172 WeakPolarHBondContact OD1-CA 3.33Å; D138-R172 PolarHBondContact OD1-N 3.14Å; D138-R172 IonicContact OD1-NE 3.8Å; D138-R172 PolarHBondContact OD1-NE 2.79Å; D138-R172 IonicContact OD2-CZ 3.35Å; D138-R172 IonicContact OD2-NE 2.73Å; D138-R172 PolarHBondContact OD2-NE 3.18Å; D138-R172 IonicContact OD2-NH2 2.85Å; D138-R172 PolarHBondContact OD2-NH2 3.47Å; I164-R172 PolarHBondContact O-NH1 2.94Å; I164-R172 PolarHBondContact O-NH2 2.9Å; I164-R172 VanDerWaalsContact O-NH2 3.07Å; P165-R172 PolarHBondContact O-NH2 3.48Å; R172-N202 PolarHBondContact O-ND2 3.34Å
173	A	95.2	Very high	95	Very high	5 Å²	5	47.4 Å²	47.4	4%	0.041	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-88.7	155.7	168.5	0	0	0	0	0	110.3	M126 R137 D138 V171 D200 I201	M126-A173 HydrophobicContact CE-CB 4.07Å; R137-A173 HydrophobicContact CB-CB 4.35Å; R137-A173 HydrophobicContact CG-CB 4.17Å; D138-A173 PolarHBondContact O-N 3.48Å; V171-A173 PolarHBondContact O-N 3.46Å; V171-A173 VanDerWaalsContact O-N 3.17Å; A173-D200 CarbonylContact C-O 3.47Å; A173-D200 VanDerWaalsContact CA-O 3.28Å; A173-D200 WeakPolarHBondContact CA-O 3.2Å; A173-I201 HydrophobicContact CB-CG2 4.32Å
174	V	95.6	Very high	95.1	Very high	58 Å²	58	46.5 Å²	46.5	35%	0.352	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	110.8	170.6	-177.3	0	0	0	0	107.9	Y176 A199 D200	V174-Y176 HydrophobicContact CB-CE2 4.37Å; V174-Y176 HydrophobicContact CG1-CE1 4.11Å; V174-Y176 HydrophobicContact CG1-CE2 4.03Å; V174-A199 CarbonylContact O-C 3.56Å; V174-A199 VanDerWaalsContact O-CA 3.28Å; V174-A199 WeakPolarHBondContact O-CA 3.16Å; V174-D200 HydrophobicContact CB-CB 4.46Å; V174-D200 PolarHBondContact N-O 3.3Å; V174-D200 PolarHBondContact O-N 3.49Å
175	T	96.5	Very high	94.6	Very high	12 Å²	12	48.3 Å²	48.3	7%	0.074	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	129.7	173.1	-47.6	0	0	0	0	109	D141 L156 G158	D141-T175 WeakPolarHBondContact OD1-CB 3.36Å; D141-T175 PolarHBondContact OD1-OG1 3.49Å; L156-T175 HydrophobicContact CD1-CG2 3.95Å; L156-T175 HydrophobicContact CG-CG2 4.1Å; G158-T175 WeakPolarHBondContact CA-O 3.3Å; G158-T175 PolarHBondContact N-O 2.62Å
176	Y	96.7	Very high	93.8	Very high	49 Å²	49	50.7 Å²	50.7	19%	0.192	27%	0.274	C	S	.	.			trans	-103.2	168.9	169.4	-62.9	-79	0	0	0	109.2	H69 F70 V174 S178 Q198 D200	H69-Y176 HydrophobicContact CB-CD1 3.36Å; H69-Y176 HydrophobicContact CB-CD2 4.19Å; H69-Y176 HydrophobicContact CB-CE1 3.34Å; H69-Y176 HydrophobicContact CB-CE2 4.16Å; H69-Y176 HydrophobicContact CB-CG 3.79Å; H69-Y176 AromaticContact CD2-CD1 3.71Å; H69-Y176 AromaticContact CD2-CG 3.89Å; H69-Y176 AromaticContact CG-CD1 3.58Å; H69-Y176 AromaticContact CG-CE1 3.98Å; H69-Y176 PolarHBondContact O-OH 2.75Å; F70-Y176 HydrophobicContact CB-CE2 4.07Å; F70-Y176 AromaticContact CD1-CD2 3.53Å; F70-Y176 HydrophobicContact CD1-CD2 3.53Å; F70-Y176 AromaticContact CD1-CE2 3.24Å; F70-Y176 HydrophobicContact CD1-CE2 3.24Å; F70-Y176 AromaticContact CE1-CD2 3.75Å; F70-Y176 HydrophobicContact CE1-CD2 3.75Å; F70-Y176 AromaticContact CE1-CE2 3.88Å; F70-Y176 HydrophobicContact CE1-CE2 3.88Å; F70-Y176 AromaticContact CG-CE2 3.85Å; F70-Y176 HydrophobicContact CG-CE2 3.85Å; V174-Y176 HydrophobicContact CB-CE2 4.37Å; V174-Y176 HydrophobicContact CG1-CE1 4.11Å; V174-Y176 HydrophobicContact CG1-CE2 4.03Å; Y176-S178 WeakPolarHBondContact O-CB 3.46Å; Y176-S178 PolarHBondContact O-N 2.94Å; Y176-S178 PolarHBondContact O-OG 3.06Å; Y176-Q198 WeakPolarHBondContact CA-O 3.33Å; Y176-Q198 WeakPolarHBondContact CB-O 3.16Å; Y176-Q198 HydrophobicContact CD2-CG 4.43Å; Y176-Q198 HydrophobicContact CG-CG 4.49Å; Y176-Q198 PolarHBondContact N-O 3.34Å; Y176-D200 HydrophobicContact CE2-CB 4.11Å
177	P	97.4	Very high	93.1	Very high	6 Å²	6	49.5 Å²	49.5	4%	0.039	26%	0.262	C	S	.	.	S	Bend	trans	-45.5	110.9	-175.9	-34.9	40.2	0	0	0	113.8	L15 E18	L15-P177 HydrophobicContact CD1-CB 3.86Å; L15-P177 HydrophobicContact CD1-CG 4.47Å; E18-P177 HydrophobicContact CB-CB 3.64Å; E18-P177 HydrophobicContact CB-CG 4.02Å; E18-P177 HydrophobicContact CG-CB 4.49Å; E18-P177 HydrophobicContact CG-CG 4.37Å
178	S	97.8	Very high	92.2	Very high	4 Å²	4	49.4 Å²	49.4	3%	0.028	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	172.3	-171.7	-66.2	0	0	0	0	108.9	M155 L156 Y176 I196 Q198	M155-S178 CarbonylContact C-O 3.57Å; M155-S178 WeakPolarHBondContact CA-O 3.48Å; L156-S178 PolarHBondContact N-O 3.34Å; L156-S178 PolarHBondContact O-N 2.87Å; Y176-S178 WeakPolarHBondContact O-CB 3.46Å; Y176-S178 PolarHBondContact O-N 2.94Å; Y176-S178 PolarHBondContact O-OG 3.06Å; S178-I196 WeakPolarHBondContact CA-O 3.4Å; S178-I196 VanDerWaalsContact CB-O 3.27Å; S178-I196 WeakPolarHBondContact CB-O 3.39Å; S178-Q198 PolarHBondContact OG-N 3.25Å; S178-Q198 PolarHBondContact OG-O 3.47Å
179	G	97.7	Very high	91.7	Very high	1 Å²	1	49 Å²	49	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.7	-172.5	175.8	0	0	0	0	0	114.6	F19 L154 C195 I196	F19-G179 VanDerWaalsContact CE2-CA 3.41Å; L154-G179 CarbonylContact O-C 3.49Å; L154-G179 WeakPolarHBondContact O-CA 3.44Å; G179-C195 CarbonylContact O-C 3.53Å; G179-C195 WeakPolarHBondContact O-CA 3.11Å; G179-I196 PolarHBondContact N-O 3.5Å; G179-I196 PolarHBondContact O-N 3.29Å
180	M	97.9	Very high	91.6	Very high	23 Å²	23	46.5 Å²	46.5	11%	0.113	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138.5	174.6	-63.9	179.9	-160.7	0	0	110.5	I92 Q153 L154 I194 C195 Y222	I92-M180 HydrophobicContact CD1-CB 3.86Å; I92-M180 HydrophobicContact CD1-CG 4.42Å; I92-M180 HydrophobicContact CD1-SD 3.92Å; I92-M180 HydrophobicContact CG2-SD 4.22Å; Q153-M180 CarbonylContact C-O 3.59Å; Q153-M180 WeakPolarHBondContact CA-O 3.22Å; Q153-M180 VanDerWaalsContact CB-O 3.28Å; Q153-M180 WeakPolarHBondContact CB-O 3.36Å; L154-M180 PolarHBondContact N-O 2.96Å; L154-M180 PolarHBondContact O-N 3.5Å; M180-I194 CarbonylContact C-O 3.5Å; M180-I194 WeakPolarHBondContact CA-O 3.31Å; M180-C195 HydrophobicContact CE-CB 4.28Å; M180-C195 WeakPolarHBondContact CE-SG 3.18Å; M180-C195 HydrophobicContact CG-CB 3.84Å; M180-C195 HydrophobicContact SD-CB 4.39Å; M180-Y222 HydrophobicContact CE-CD1 4.15Å; M180-Y222 HydrophobicContact CE-CE1 3.13Å; M180-Y222 WeakPolarHBondContact CE-OH 3.33Å; M180-Y222 HydrophobicContact SD-CE1 3.77Å; M180-Y222 PolarHBondContact SD-OH 3.3Å; M180-Y222 VanDerWaalsContact SD-OH 3.32Å
181	R	97.8	Very high	91.5	Very high	3 Å²	3	45.3 Å²	45.3	1%	0.011	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.6	170.4	-177.3	170.8	-67.3	163.4	0.9	108.6	F19 E20 V23 E24 Y151 Q153 Y183 I193 I194	F19-R181 HydrophobicContact CE1-CB 4.37Å; F19-R181 HydrophobicContact CZ-CB 4.26Å; E20-R181 IonicContact OE1-CZ 3.59Å; E20-R181 IonicContact OE1-NH1 3.87Å; E20-R181 PolarHBondContact OE1-NH1 2.85Å; E20-R181 IonicContact OE1-NH2 3.82Å; E20-R181 PolarHBondContact OE1-NH2 3.15Å; E20-R181 IonicContact OE2-CZ 3.42Å; E20-R181 IonicContact OE2-NH1 2.98Å; E20-R181 IonicContact OE2-NH2 3.21Å; E20-R181 PolarHBondContact OE2-NH2 3.33Å; V23-R181 VanDerWaalsContact CG1-NH1 3.28Å; E24-R181 IonicContact OE1-NH1 2.75Å; E24-R181 PolarHBondContact OE1-NH1 3.2Å; Y151-R181 HydrophobicContact CD1-CG 4.39Å; Y151-R181 HydrophobicContact CD2-CG 4.24Å; Y151-R181 HydrophobicContact CG-CG 3.89Å; Q153-R181 VanDerWaalsContact OE1-NE 3.1Å; R181-Y183 HydrophobicContact CG-CE1 4.41Å; R181-Y183 HydrophobicContact CG-CE2 4.16Å; R181-I193 CarbonylContact O-C 3.58Å; R181-I193 WeakPolarHBondContact O-CA 3.3Å; R181-I194 PolarHBondContact N-O 3.22Å; R181-I194 PolarHBondContact O-N 3.49Å
182	I	97.1	Very high	91.5	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	108.1	179.7	-58.3	172.4	0	0	0	106.8	P85 A88 Y89 I92 Y151 Y152 R184 T191 I193	P85-I182 HydrophobicContact CB-CG2 4.04Å; A88-I182 HydrophobicContact CB-CD1 3.99Å; A88-I182 HydrophobicContact CB-CG2 3.96Å; Y89-I182 VanDerWaalsContact CA-CD1 3.45Å; Y89-I182 HydrophobicContact CD2-CD1 4.1Å; Y89-I182 HydrophobicContact CG-CD1 4.48Å; I92-I182 HydrophobicContact CD1-CD1 3.57Å; I92-I182 HydrophobicContact CD1-CG1 4.27Å; I92-I182 HydrophobicContact CG1-CD1 4.01Å; Y151-I182 CarbonylContact C-O 3.55Å; Y151-I182 WeakPolarHBondContact CA-O 3.49Å; Y151-I182 VanDerWaalsContact CB-O 3.24Å; Y151-I182 WeakPolarHBondContact CB-O 3.42Å; Y152-I182 HydrophobicContact CD2-CG2 4.47Å; Y152-I182 PolarHBondContact N-O 3.35Å; Y152-I182 PolarHBondContact O-N 2.99Å; I182-R184 PolarHBondContact O-N 3.01Å; I182-T191 HydrophobicContact CG2-CG2 3.33Å; I182-I193 HydrophobicContact CG1-CD1 4.36Å; I182-I193 HydrophobicContact CG1-CG1 4.2Å; I182-I193 HydrophobicContact CG1-CG2 4.34Å; I182-I193 HydrophobicContact CG2-CG1 4.34Å
183	Y	95.8	Very high	91.6	Very high	47 Å²	47	45.6 Å²	45.6	18%	0.184	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	129.4	-178	-67.8	-87.6	0	0	0	110.5	R181 R192 I194	R181-Y183 HydrophobicContact CG-CE1 4.41Å; R181-Y183 HydrophobicContact CG-CE2 4.16Å; Y183-R192 HydrophobicContact CD2-CB 4.13Å; Y183-R192 HydrophobicContact CD2-CG 3.96Å; Y183-R192 HydrophobicContact CE2-CG 4.49Å; Y183-R192 PolarHBondContact N-O 3.47Å; Y183-I194 HydrophobicContact CE2-CD1 3.73Å; Y183-I194 HydrophobicContact CE2-CG1 3.92Å; Y183-I194 WeakPolarHBondContact OH-CD1 3.34Å
184	R	93.2	Very high	91.7	Very high	58 Å²	58	45.4 Å²	45.4	22%	0.219	24%	0.238	C	C	.	.			trans	-72.2	138.6	166.7	-68.7	173.4	176.7	-134.9	15	108	P85 E147 A148 D149 Q150 Y152 I182	P85-R184 HydrophobicContact CB-CG 4.39Å; E147-R184 IonicContact OE2-NH2 3.86Å; A148-R184 WeakPolarHBondContact O-CD 3.2Å; A148-R184 PolarHBondContact O-NE 3.39Å; A148-R184 VanDerWaalsContact O-NE 3.09Å; D149-R184 WeakPolarHBondContact O-CD 3.26Å; Q150-R184 PolarHBondContact O-N 3.03Å; Y152-R184 HydrophobicContact CD2-CG 4.08Å; Y152-R184 HydrophobicContact CE2-CG 3.78Å; Y152-R184 VanDerWaalsContact CE2-NE 3.3Å; Y152-R184 VanDerWaalsContact CZ-NE 3.33Å; Y152-R184 PolarHBondContact OH-NH2 3.1Å; I182-R184 PolarHBondContact O-N 3.01Å
185	S	83.3	Confident	91.7	Very high	57 Å²	57	42.7 Å²	42.7	40%	0.399	22%	0.221	S	C	.	.			trans	-141.5	153.4	174.7	99.7	0	0	0	0	109	N187 K190	S185-N187 PolarHBondContact O-N 3.39Å; S185-N187 PolarHBondContact OG-N 3.13Å; S185-N187 VanDerWaalsContact OG-N 3.09Å; S185-N187 PolarHBondContact OG-O 3.1Å; S185-N187 VanDerWaalsContact OG-O 3.05Å; S185-K190 PolarHBondContact OG-O 3.11Å
186	S	74.5	Confident	91.8	Very high	133 Å²	133	42.1 Å²	42.1	93%	0.93	22%	0.217	S	C	*	.	S	Bend	trans	-68.7	-14.9	172.4	53.4	0	0	0	0	112.6	S188	S186-S188 PolarHBondContact O-N 3.19Å
187	N	75.9	Confident	91.7	Very high	75 Å²	75	41.3 Å²	41.3	40%	0.401	22%	0.216	S	C	.	.			trans	-84.3	102.4	174.8	-173.1	-22.3	0	0	0	109.6	S185 E189 K190	S185-N187 PolarHBondContact O-N 3.39Å; S185-N187 PolarHBondContact OG-N 3.13Å; S185-N187 VanDerWaalsContact OG-N 3.09Å; S185-N187 PolarHBondContact OG-O 3.1Å; S185-N187 VanDerWaalsContact OG-O 3.05Å; N187-E189 PolarHBondContact O-N 2.86Å; N187-E189 VanDerWaalsContact O-N 3.15Å; N187-E189 WeakPolarHBondContact OD1-CB 3.28Å; N187-E189 PolarHBondContact OD1-N 2.83Å; N187-K190 PolarHBondContact O-N 3.2Å
188	S	71.9	Confident	91.5	Very high	73 Å²	73	41 Å²	41	51%	0.51	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13.2	-179.6	53.1	0	0	0	0	114.4	S186	S186-S188 PolarHBondContact O-N 3.19Å
189	E	82.3	Confident	91.3	Very high	137 Å²	137	41.4 Å²	41.4	64%	0.64	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-16.4	-177.1	-57.1	-170	151.7	0	0	113.5	N82 F83 N187	N82-E189 CarbonylContact C-O 3.13Å; N82-E189 WeakPolarHBondContact CA-O 3.42Å; F83-E189 PolarHBondContact N-O 3.5Å; N187-E189 PolarHBondContact O-N 2.86Å; N187-E189 VanDerWaalsContact O-N 3.15Å; N187-E189 WeakPolarHBondContact OD1-CB 3.28Å; N187-E189 PolarHBondContact OD1-N 2.83Å
190	K	90	Very high	91.1	Very high	108 Å²	108	43.5 Å²	43.5	47%	0.47	23%	0.229	S	C	.	.			trans	-139.2	126.4	-173.8	-67.3	-174.2	-179	-176.5	0	112	V80 V81 S185 N187	V80-K190 HydrophobicContact CG1-CB 3.99Å; V80-K190 HydrophobicContact CG1-CD 4.42Å; V80-K190 HydrophobicContact CG1-CG 4.28Å; V81-K190 WeakPolarHBondContact O-CA 3.47Å; S185-K190 PolarHBondContact OG-O 3.11Å; N187-K190 PolarHBondContact O-N 3.2Å
191	T	94.8	Very high	90.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.5	177.6	-65.4	0	0	0	0	109.7	V80 V81 F83 P85 A88 I182 I193	V80-T191 CarbonylContact C-O 3.32Å; V80-T191 WeakPolarHBondContact CA-O 3.49Å; V81-T191 HydrophobicContact CG2-CG2 4.14Å; V81-T191 PolarHBondContact N-O 3.02Å; V81-T191 PolarHBondContact O-N 3.04Å; F83-T191 WeakPolarHBondContact O-CB 3.24Å; F83-T191 PolarHBondContact O-OG1 3.19Å; P85-T191 HydrophobicContact CB-CG2 4.1Å; P85-T191 WeakPolarHBondContact CD-OG1 3.17Å; P85-T191 HydrophobicContact CG-CG2 4.08Å; P85-T191 WeakPolarHBondContact CG-OG1 3.4Å; A88-T191 HydrophobicContact CB-CG2 4.21Å; I182-T191 HydrophobicContact CG2-CG2 3.33Å; T191-I193 HydrophobicContact CG2-CD1 4.49Å; T191-I193 HydrophobicContact CG2-CG1 4.09Å
192	R	95.3	Very high	90.1	Very high	108 Å²	108	45.4 Å²	45.4	41%	0.408	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	136	174.7	-178.4	-178.6	174.2	-141.8	-1.7	109.7	E78 Y183	E78-R192 IonicContact OE2-CZ 3.87Å; E78-R192 IonicContact OE2-NE 2.83Å; E78-R192 IonicContact OE2-NH2 3.16Å; E78-R192 PolarHBondContact OE2-NH2 3.25Å; Y183-R192 HydrophobicContact CD2-CB 4.13Å; Y183-R192 HydrophobicContact CD2-CG 3.96Å; Y183-R192 HydrophobicContact CE2-CG 4.49Å; Y183-R192 PolarHBondContact N-O 3.47Å
193	I	96.9	Very high	89.3	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	135.5	-179.8	-55	-180	0	0	0	109.5	E78 T79 V81 A88 R181 I182 T191 L226	E78-I193 WeakPolarHBondContact CA-O 3.21Å; T79-I193 HydrophobicContact CG2-CB 3.94Å; T79-I193 PolarHBondContact N-O 3.33Å; T79-I193 PolarHBondContact O-N 3.22Å; V81-I193 HydrophobicContact CG1-CD1 3.85Å; V81-I193 HydrophobicContact CG2-CD1 3.95Å; A88-I193 HydrophobicContact CB-CD1 3.97Å; R181-I193 CarbonylContact O-C 3.58Å; R181-I193 WeakPolarHBondContact O-CA 3.3Å; I182-I193 HydrophobicContact CG1-CD1 4.36Å; I182-I193 HydrophobicContact CG1-CG1 4.2Å; I182-I193 HydrophobicContact CG1-CG2 4.34Å; I182-I193 HydrophobicContact CG2-CG1 4.34Å; T191-I193 HydrophobicContact CG2-CD1 4.49Å; T191-I193 HydrophobicContact CG2-CG1 4.09Å; I193-L226 HydrophobicContact CD1-CD2 3.63Å
194	I	96.5	Very high	88.2	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.7	165.1	-65.1	177.4	0	0	0	107.9	V23 K76 G77 E78 M180 R181 Y183 I196	V23-I194 HydrophobicContact CG1-CD1 3.86Å; V23-I194 HydrophobicContact CG2-CG2 4.28Å; K76-I194 HydrophobicContact CD-CG2 4.48Å; K76-I194 HydrophobicContact CG-CG2 4.21Å; G77-I194 CarbonylContact O-C 3.58Å; G77-I194 WeakPolarHBondContact O-CA 3.26Å; E78-I194 HydrophobicContact CG-CG1 4.08Å; M180-I194 CarbonylContact C-O 3.5Å; M180-I194 WeakPolarHBondContact CA-O 3.31Å; R181-I194 PolarHBondContact N-O 3.22Å; R181-I194 PolarHBondContact O-N 3.49Å; Y183-I194 HydrophobicContact CE2-CD1 3.73Å; Y183-I194 HydrophobicContact CE2-CG1 3.92Å; Y183-I194 WeakPolarHBondContact OH-CD1 3.34Å; I194-I196 HydrophobicContact CG2-CD1 4.16Å
195	C	97.3	Very high	87.3	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.5	174.8	177.9	0	0	0	0	110.2	K76 G77 G179 M180 M219 L223	K76-C195 CarbonylContact C-O 3.54Å; K76-C195 VanDerWaalsContact CA-O 3.28Å; K76-C195 WeakPolarHBondContact CA-O 3.45Å; G77-C195 PolarHBondContact N-O 3.43Å; G77-C195 PolarHBondContact O-N 3.07Å; G179-C195 CarbonylContact O-C 3.53Å; G179-C195 WeakPolarHBondContact O-CA 3.11Å; M180-C195 HydrophobicContact CE-CB 4.28Å; M180-C195 WeakPolarHBondContact CE-SG 3.18Å; M180-C195 HydrophobicContact CG-CB 3.84Å; M180-C195 HydrophobicContact SD-CB 4.39Å; C195-M219 HydrophobicContact CB-CE 4.24Å; C195-M219 HydrophobicContact CB-SD 4.02Å; C195-M219 VanDerWaalsContact SG-SD 3.66Å; C195-L223 HydrophobicContact CB-CD2 4.03Å
196	I	96.9	Very high	86.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125.9	172.2	-53.4	-59.6	0	0	0	107.7	F19 V23 W29 K74 L75 K76 S178 G179 I194	F19-I196 HydrophobicContact CD2-CB 4.17Å; F19-I196 HydrophobicContact CD2-CG1 4.07Å; F19-I196 HydrophobicContact CE2-CB 3.94Å; F19-I196 HydrophobicContact CE2-CG1 3.69Å; V23-I196 HydrophobicContact CG2-CG1 4.31Å; W29-I196 HydrophobicContact CH2-CD1 4.18Å; W29-I196 HydrophobicContact CZ2-CD1 4.04Å; K74-I196 HydrophobicContact CG-CG2 4.49Å; L75-I196 WeakPolarHBondContact O-CA 3.4Å; K76-I196 HydrophobicContact CB-CD1 3.69Å; K76-I196 HydrophobicContact CD-CD1 4Å; K76-I196 HydrophobicContact CG-CD1 3.68Å; S178-I196 WeakPolarHBondContact CA-O 3.4Å; S178-I196 VanDerWaalsContact CB-O 3.27Å; S178-I196 WeakPolarHBondContact CB-O 3.39Å; G179-I196 PolarHBondContact N-O 3.5Å; G179-I196 PolarHBondContact O-N 3.29Å; I194-I196 HydrophobicContact CG2-CD1 4.16Å
197	I	95.1	Very high	86.9	Confident	33 Å²	33	54.1 Å²	54.1	17%	0.169	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	127.9	173.2	-65.9	174.6	0	0	0	109.1	L75 M218 M219	L75-I197 PolarHBondContact N-O 3.15Å; L75-I197 PolarHBondContact O-N 3.03Å; I197-M218 HydrophobicContact CD1-CE 4.33Å; I197-M218 HydrophobicContact CG2-CE 4.43Å; I197-M219 HydrophobicContact CB-CE 3.73Å; I197-M219 HydrophobicContact CD1-CE 3.53Å; I197-M219 HydrophobicContact CD1-SD 3.88Å; I197-M219 HydrophobicContact CG1-CE 3.54Å; I197-M219 HydrophobicContact CG1-SD 4.47Å
198	Q	94.2	Very high	86.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.283	C	S	.	.			trans	-144.3	100.4	177	-166.8	174.3	-6.1	0	0	108.4	S67 H69 F70 K74 Y176 S178	S67-Q198 PolarHBondContact OG-NE2 2.96Å; H69-Q198 PolarHBondContact CD2-NE2 3.25Å; F70-Q198 HydrophobicContact CE1-CG 3.83Å; K74-Q198 HydrophobicContact CB-CB 4.47Å; K74-Q198 HydrophobicContact CB-CG 4.03Å; K74-Q198 HydrophobicContact CG-CB 4.13Å; K74-Q198 HydrophobicContact CG-CG 4.12Å; Y176-Q198 WeakPolarHBondContact CA-O 3.33Å; Y176-Q198 WeakPolarHBondContact CB-O 3.16Å; Y176-Q198 HydrophobicContact CD2-CG 4.43Å; Y176-Q198 HydrophobicContact CG-CG 4.49Å; Y176-Q198 PolarHBondContact N-O 3.34Å; S178-Q198 PolarHBondContact OG-N 3.25Å; S178-Q198 PolarHBondContact OG-O 3.47Å
199	A	94.1	Very high	87.2	Confident	12 Å²	12	62.3 Å²	62.3	10%	0.099	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	137.2	-178.4	0	0	0	0	0	111.6	F70 V174 F215	F70-A199 VanDerWaalsContact CZ-O 3.26Å; F70-A199 WeakPolarHBondContact CZ-O 3.16Å; V174-A199 CarbonylContact O-C 3.56Å; V174-A199 VanDerWaalsContact O-CA 3.28Å; V174-A199 WeakPolarHBondContact O-CA 3.16Å; A199-F215 WeakPolarHBondContact O-CZ 3.37Å
200	D	91.9	Very high	86.9	Confident	44 Å²	44	57.7 Å²	57.7	24%	0.235	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	107.5	165.3	-167.3	-11.9	0	0	0	109.5	F70 A173 V174 Y176 N202	F70-D200 HydrophobicContact CB-CB 4.47Å; F70-D200 HydrophobicContact CD2-CB 3.76Å; F70-D200 HydrophobicContact CE2-CB 4.07Å; F70-D200 HydrophobicContact CG-CB 4.02Å; A173-D200 CarbonylContact C-O 3.47Å; A173-D200 VanDerWaalsContact CA-O 3.28Å; A173-D200 WeakPolarHBondContact CA-O 3.2Å; V174-D200 HydrophobicContact CB-CB 4.46Å; V174-D200 PolarHBondContact N-O 3.3Å; V174-D200 PolarHBondContact O-N 3.49Å; Y176-D200 HydrophobicContact CE2-CB 4.11Å; D200-N202 PolarHBondContact O-N 2.88Å; D200-N202 WeakPolarHBondContact OD1-CA 3.39Å; D200-N202 PolarHBondContact OD1-N 3.5Å
201	I	88.2	Confident	86.3	Confident	11 Å²	11	53.2 Å²	53.2	6%	0.056	25%	0.248	C	C	.	.			trans	-87.4	11.9	176.9	59.3	165.2	0	0	0	113	I134 R137 A173 V203 F215	I134-I201 HydrophobicContact CD1-CD1 4.43Å; I134-I201 HydrophobicContact CG2-CD1 4.11Å; R137-I201 HydrophobicContact CG-CB 4.18Å; R137-I201 HydrophobicContact CG-CG2 4.31Å; R137-I201 PolarHBondContact NE-O 3.18Å; R137-I201 PolarHBondContact NH2-O 3.01Å; A173-I201 HydrophobicContact CB-CG2 4.32Å; I201-V203 HydrophobicContact CD1-CG2 3.54Å; I201-V203 HydrophobicContact CG1-CG2 3.71Å; I201-V203 PolarHBondContact O-N 2.85Å; I201-F215 HydrophobicContact CB-CE2 4.37Å; I201-F215 HydrophobicContact CB-CZ 3.96Å; I201-F215 HydrophobicContact CD1-CD2 4.13Å; I201-F215 HydrophobicContact CD1-CE2 3.2Å; I201-F215 HydrophobicContact CD1-CZ 3.58Å; I201-F215 HydrophobicContact CG1-CE2 3.37Å; I201-F215 HydrophobicContact CG1-CZ 3.44Å; I201-F215 VanDerWaalsContact CG1-CZ 3.44Å; I201-F215 HydrophobicContact CG2-CE1 4.09Å; I201-F215 HydrophobicContact CG2-CE2 4.23Å; I201-F215 HydrophobicContact CG2-CZ 3.39Å
202	N	86.4	Confident	85.6	Confident	56 Å²	56	55 Å²	55	30%	0.299	26%	0.257	S	S	.	.			trans	53.3	47.5	170.2	-75.4	-48.7	0	0	0	113.9	V171 R172 D200 K204	V171-N202 HydrophobicContact CG1-CB 3.84Å; R172-N202 PolarHBondContact O-ND2 3.34Å; D200-N202 PolarHBondContact O-N 2.88Å; D200-N202 WeakPolarHBondContact OD1-CA 3.39Å; D200-N202 PolarHBondContact OD1-N 3.5Å; N202-K204 PolarHBondContact O-N 2.81Å
203	V	80.9	Confident	84.9	Confident	40 Å²	40	52.9 Å²	52.9	24%	0.242	25%	0.254	C	S	.	.			trans	-83.4	98.6	176.5	-178.6	0	0	0	0	109.2	I134 R137 I201 A206 T211	I134-V203 HydrophobicContact CG2-CG2 4.46Å; R137-V203 VanDerWaalsContact NH2-CG2 3.31Å; I201-V203 HydrophobicContact CD1-CG2 3.54Å; I201-V203 HydrophobicContact CG1-CG2 3.71Å; I201-V203 PolarHBondContact O-N 2.85Å; V203-A206 HydrophobicContact CG1-CB 3.29Å; V203-T211 HydrophobicContact CB-CG2 3.72Å; V203-T211 HydrophobicContact CG1-CG2 3.64Å; V203-T211 HydrophobicContact CG2-CG2 3.95Å
204	K	73	Confident	84.3	Confident	175 Å²	175	53.2 Å²	53.2	76%	0.761	26%	0.257	S	S	*	.	S	Bend	trans	-75.5	-24.2	-173.7	-65.3	-174.4	179.3	-179.3	0	114.9	N202	N202-K204 PolarHBondContact O-N 2.81Å
205	H	73.2	Confident	83.7	Confident	178 Å²	178	54.3 Å²	54.3	82%	0.824	26%	0.262	S	S	*	.	S	Bend	trans	-127.2	2.1	-167.2	-57.5	-57.7	0	0	0	115.2
206	A	73.2	Confident	83.2	Confident	16 Å²	16	54.7 Å²	54.7	13%	0.132	26%	0.264	C	S	.	.	S	Bend	trans	-92.4	139.4	174.2	0	0	0	0	0	110.5	F133 V203 R208 T211	F133-A206 HydrophobicContact CE1-CB 3.98Å; V203-A206 HydrophobicContact CG1-CB 3.29Å; A206-R208 PolarHBondContact O-N 3.11Å; A206-T211 HydrophobicContact CB-CG2 3.79Å
207	P	77.3	Confident	82.7	Confident	68 Å²	68	56.7 Å²	56.7	44%	0.442	28%	0.276	S	S	.	.			trans	-51.6	130.6	166.8	-25.8	32.7	0	0	0	110.9	Y209 I210 T211	P207-Y209 HydrophobicContact CB-CD1 3.6Å; P207-Y209 HydrophobicContact CB-CE1 3.56Å; P207-Y209 HydrophobicContact CG-CE1 4.22Å; P207-Y209 PolarHBondContact O-N 3.12Å; P207-I210 HydrophobicContact CB-CD1 4.34Å; P207-I210 HydrophobicContact CB-CG1 4.29Å; P207-I210 HydrophobicContact CG-CD1 4.07Å; P207-I210 WeakPolarHBondContact O-CB 3.48Å; P207-I210 PolarHBondContact O-N 3.22Å; P207-T211 PolarHBondContact O-N 2.94Å
208	R	76	Confident	82.4	Confident	170 Å²	170	56.2 Å²	56.2	64%	0.642	27%	0.273	S	S	*	.	H	α-helix	trans	-52.7	-34	-176.1	-70.4	-176.5	-175.9	170.7	0.8	113.4	A206 I210 T211 N212	A206-R208 PolarHBondContact O-N 3.11Å; R208-I210 PolarHBondContact O-N 3.23Å; R208-T211 WeakPolarHBondContact CA-OG1 3.44Å; R208-T211 PolarHBondContact O-N 2.8Å; R208-T211 PolarHBondContact O-OG1 2.92Å; R208-N212 WeakPolarHBondContact O-CB 3.37Å; R208-N212 PolarHBondContact O-N 3.43Å; R208-N212 PolarHBondContact O-ND2 3.42Å; R208-N212 PolarHBondContact O-OD1 2.75Å
209	Y	77.9	Confident	82.3	Confident	150 Å²	150	56.2 Å²	56.2	59%	0.588	27%	0.273	S	S	*	.	H	α-helix	trans	-62.8	-31.2	178.5	86.9	-91.7	0	0	0	112.6	P207 N213	P207-Y209 HydrophobicContact CB-CD1 3.6Å; P207-Y209 HydrophobicContact CB-CE1 3.56Å; P207-Y209 HydrophobicContact CG-CE1 4.22Å; P207-Y209 PolarHBondContact O-N 3.12Å; Y209-N213 WeakPolarHBondContact O-CB 3.33Å; Y209-N213 PolarHBondContact O-N 2.85Å; Y209-N213 VanDerWaalsContact O-N 3.16Å; Y209-N213 PolarHBondContact O-ND2 2.78Å
210	I	76.5	Confident	82.1	Confident	41 Å²	41	56 Å²	56	21%	0.21	27%	0.27	C	S	.	.	H	α-helix	trans	-70.6	-50.1	177.8	-61.4	-176.5	0	0	0	109.4	L130 F133 P207 R208 N212 N213 A214	L130-I210 HydrophobicContact CD1-CG2 4.06Å; F133-I210 HydrophobicContact CE1-CG2 4.31Å; P207-I210 HydrophobicContact CB-CD1 4.34Å; P207-I210 HydrophobicContact CB-CG1 4.29Å; P207-I210 HydrophobicContact CG-CD1 4.07Å; P207-I210 WeakPolarHBondContact O-CB 3.48Å; P207-I210 PolarHBondContact O-N 3.22Å; R208-I210 PolarHBondContact O-N 3.23Å; I210-N212 VanDerWaalsContact C-N 3.32Å; I210-N212 PolarHBondContact O-N 3.44Å; I210-N213 PolarHBondContact O-N 2.86Å; I210-A214 WeakPolarHBondContact O-CB 3.28Å; I210-A214 PolarHBondContact O-N 3.13Å
211	T	77.2	Confident	82	Confident	14 Å²	14	56.9 Å²	56.9	9%	0.086	28%	0.275	C	S	.	.	H	α-helix	trans	-60.3	-46.6	-180	56.9	0	0	0	0	110.3	V203 A206 P207 R208 N213 A214 F215	V203-T211 HydrophobicContact CB-CG2 3.72Å; V203-T211 HydrophobicContact CG1-CG2 3.64Å; V203-T211 HydrophobicContact CG2-CG2 3.95Å; A206-T211 HydrophobicContact CB-CG2 3.79Å; P207-T211 PolarHBondContact O-N 2.94Å; R208-T211 WeakPolarHBondContact CA-OG1 3.44Å; R208-T211 PolarHBondContact O-N 2.8Å; R208-T211 PolarHBondContact O-OG1 2.92Å; T211-N213 PolarHBondContact O-N 3.24Å; T211-A214 WeakPolarHBondContact O-CB 3.07Å; T211-A214 PolarHBondContact O-N 2.85Å; T211-A214 VanDerWaalsContact O-N 3.09Å; T211-F215 VanDerWaalsContact O-CD2 3.32Å; T211-F215 WeakPolarHBondContact O-CD2 3.29Å; T211-F215 PolarHBondContact O-N 2.96Å
212	N	79.1	Confident	82.3	Confident	36 Å²	36	56.8 Å²	56.8	19%	0.193	27%	0.274	C	S	.	.	H	α-helix	trans	-59.3	-44.8	-179.9	-65.1	-15.5	0	0	0	112.6	W73 R208 I210 F215 V216	W73-N212 VanDerWaalsContact CD1-CB 3.42Å; W73-N212 VanDerWaalsContact NE1-CB 3.29Å; W73-N212 PolarHBondContact NE1-ND2 2.95Å; W73-N212 PolarHBondContact NE1-OD1 3.39Å; R208-N212 WeakPolarHBondContact O-CB 3.37Å; R208-N212 PolarHBondContact O-N 3.43Å; R208-N212 PolarHBondContact O-ND2 3.42Å; R208-N212 PolarHBondContact O-OD1 2.75Å; I210-N212 VanDerWaalsContact C-N 3.32Å; I210-N212 PolarHBondContact O-N 3.44Å; N212-F215 PolarHBondContact O-N 3Å; N212-V216 WeakPolarHBondContact O-CG2 3.36Å; N212-V216 PolarHBondContact O-N 3.44Å
213	N	82.2	Confident	82.7	Confident	64 Å²	64	54.1 Å²	54.1	34%	0.342	26%	0.26	S	S	.	.	H	α-helix	trans	-69.5	-33	176.1	-75.8	-51.9	0	0	0	112.5	Y209 I210 T211 V216 T217	Y209-N213 WeakPolarHBondContact O-CB 3.33Å; Y209-N213 PolarHBondContact O-N 2.85Å; Y209-N213 VanDerWaalsContact O-N 3.16Å; Y209-N213 PolarHBondContact O-ND2 2.78Å; I210-N213 PolarHBondContact O-N 2.86Å; T211-N213 PolarHBondContact O-N 3.24Å; N213-V216 PolarHBondContact O-N 3.38Å; N213-T217 WeakPolarHBondContact O-CB 3.44Å; N213-T217 PolarHBondContact O-N 2.78Å; N213-T217 PolarHBondContact O-OG1 2.66Å
214	A	82.9	Confident	83.2	Confident	8 Å²	8	53.9 Å²	53.9	7%	0.066	26%	0.258	C	S	.	.	H	α-helix	trans	-62.4	-44.2	175.3	0	0	0	0	0	111.2	L130 I134 I210 T211 T217 M218	L130-A214 HydrophobicContact CD1-CB 3.83Å; L130-A214 HydrophobicContact CD2-CB 4.38Å; L130-A214 HydrophobicContact CG-CB 4.13Å; I134-A214 HydrophobicContact CD1-CB 3.9Å; I210-A214 WeakPolarHBondContact O-CB 3.28Å; I210-A214 PolarHBondContact O-N 3.13Å; T211-A214 WeakPolarHBondContact O-CB 3.07Å; T211-A214 PolarHBondContact O-N 2.85Å; T211-A214 VanDerWaalsContact O-N 3.09Å; A214-T217 WeakPolarHBondContact O-CB 3.32Å; A214-T217 PolarHBondContact O-N 3.27Å; A214-M218 WeakPolarHBondContact O-CB 3.25Å; A214-M218 PolarHBondContact O-N 2.72Å
215	F	83.9	Confident	84.2	Confident	25 Å²	25	47.2 Å²	47.2	11%	0.11	23%	0.234	C	C	.	.	H	α-helix	trans	-63.6	-43.3	176.2	-90.8	-87	0	0	0	113.4	L75 A199 I201 T211 N212 T217 M218 M219	L75-F215 HydrophobicContact CD1-CB 3.89Å; A199-F215 WeakPolarHBondContact O-CZ 3.37Å; I201-F215 HydrophobicContact CB-CE2 4.37Å; I201-F215 HydrophobicContact CB-CZ 3.96Å; I201-F215 HydrophobicContact CD1-CD2 4.13Å; I201-F215 HydrophobicContact CD1-CE2 3.2Å; I201-F215 HydrophobicContact CD1-CZ 3.58Å; I201-F215 HydrophobicContact CG1-CE2 3.37Å; I201-F215 HydrophobicContact CG1-CZ 3.44Å; I201-F215 VanDerWaalsContact CG1-CZ 3.44Å; I201-F215 HydrophobicContact CG2-CE1 4.09Å; I201-F215 HydrophobicContact CG2-CE2 4.23Å; I201-F215 HydrophobicContact CG2-CZ 3.39Å; T211-F215 VanDerWaalsContact O-CD2 3.32Å; T211-F215 WeakPolarHBondContact O-CD2 3.29Å; T211-F215 PolarHBondContact O-N 2.96Å; N212-F215 PolarHBondContact O-N 3Å; F215-T217 VanDerWaalsContact C-N 3.27Å; F215-T217 PolarHBondContact O-N 2.89Å; F215-M218 HydrophobicContact CD1-CE 3.75Å; F215-M218 HydrophobicContact CE1-CE 4.15Å; F215-M218 WeakPolarHBondContact O-CB 3.38Å; F215-M218 PolarHBondContact O-N 2.82Å; F215-M219 PolarHBondContact O-N 3.44Å
216	V	87	Confident	85.3	Confident	8 Å²	8	38.8 Å²	38.8	5%	0.048	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-42.9	175.5	172.9	0	0	0	0	109.9	V62 L75 N212 N213 M219 F220	V62-V216 HydrophobicContact CB-CG1 4.5Å; V62-V216 HydrophobicContact CG1-CG1 4.2Å; L75-V216 HydrophobicContact CD1-CG2 4.2Å; L75-V216 HydrophobicContact CD2-CG2 3.9Å; N212-V216 WeakPolarHBondContact O-CG2 3.36Å; N212-V216 PolarHBondContact O-N 3.44Å; N213-V216 PolarHBondContact O-N 3.38Å; V216-M219 PolarHBondContact O-N 3.49Å; V216-F220 HydrophobicContact CG1-CD2 3.87Å; V216-F220 HydrophobicContact CG1-CE2 3.79Å; V216-F220 VanDerWaalsContact O-CD2 3.26Å; V216-F220 WeakPolarHBondContact O-CD2 3.22Å; V216-F220 PolarHBondContact O-N 3.22Å
217	T	86.5	Confident	86.2	Confident	41 Å²	41	39.4 Å²	39.4	25%	0.252	20%	0.195	S	C	.	.	H	α-helix	trans	-64.6	-41.2	176.9	-56.6	0	0	0	0	112	N213 A214 F215 F220 N221	N213-T217 WeakPolarHBondContact O-CB 3.44Å; N213-T217 PolarHBondContact O-N 2.78Å; N213-T217 PolarHBondContact O-OG1 2.66Å; A214-T217 WeakPolarHBondContact O-CB 3.32Å; A214-T217 PolarHBondContact O-N 3.27Å; F215-T217 VanDerWaalsContact C-N 3.27Å; F215-T217 PolarHBondContact O-N 2.89Å; T217-F220 PolarHBondContact O-N 2.93Å; T217-N221 WeakPolarHBondContact O-CB 3.28Å; T217-N221 VanDerWaalsContact O-CG 3.25Å; T217-N221 PolarHBondContact O-N 2.63Å; T217-N221 PolarHBondContact O-OD1 3.5Å
218	M	88.5	Confident	87	Confident	23 Å²	23	38.7 Å²	38.7	11%	0.113	20%	0.2	C	C	.	.	H	α-helix	trans	-59.7	-48.5	175.6	-176.4	-170.3	78.5	0	0	110.9	L129 I197 A214 F215 F220 N221 Y222	L129-M218 HydrophobicContact CD1-SD 3.84Å; I197-M218 HydrophobicContact CD1-CE 4.33Å; I197-M218 HydrophobicContact CG2-CE 4.43Å; A214-M218 WeakPolarHBondContact O-CB 3.25Å; A214-M218 PolarHBondContact O-N 2.72Å; F215-M218 HydrophobicContact CD1-CE 3.75Å; F215-M218 HydrophobicContact CE1-CE 4.15Å; F215-M218 WeakPolarHBondContact O-CB 3.38Å; F215-M218 PolarHBondContact O-N 2.82Å; M218-F220 VanDerWaalsContact C-N 3.34Å; M218-F220 PolarHBondContact O-N 2.72Å; M218-N221 PolarHBondContact O-N 2.81Å; M218-Y222 WeakPolarHBondContact O-CB 3.44Å; M218-Y222 PolarHBondContact O-N 3.47Å
219	M	91.9	Very high	87.9	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.2	-44.8	175.5	177.5	67.6	88.4	0	0	111.9	V62 L75 C195 I197 F215 V216 L223	V62-M219 HydrophobicContact CB-CG 4.43Å; V62-M219 HydrophobicContact CG1-CB 4.33Å; V62-M219 HydrophobicContact CG1-CG 3.96Å; V62-M219 HydrophobicContact CG2-CB 4.18Å; V62-M219 HydrophobicContact CG2-CG 3.53Å; L75-M219 HydrophobicContact CB-CE 3.94Å; L75-M219 HydrophobicContact CD1-CB 4.2Å; C195-M219 HydrophobicContact CB-CE 4.24Å; C195-M219 HydrophobicContact CB-SD 4.02Å; C195-M219 VanDerWaalsContact SG-SD 3.66Å; I197-M219 HydrophobicContact CB-CE 3.73Å; I197-M219 HydrophobicContact CD1-CE 3.53Å; I197-M219 HydrophobicContact CD1-SD 3.88Å; I197-M219 HydrophobicContact CG1-CE 3.54Å; I197-M219 HydrophobicContact CG1-SD 4.47Å; F215-M219 PolarHBondContact O-N 3.44Å; V216-M219 PolarHBondContact O-N 3.49Å; M219-L223 HydrophobicContact CG-CD1 4.21Å; M219-L223 WeakPolarHBondContact O-CG 3.44Å; M219-L223 PolarHBondContact O-N 2.88Å; M219-L223 VanDerWaalsContact O-N 3.07Å; M219-L223 HydrophobicContact SD-CD1 3.96Å; M219-L223 HydrophobicContact SD-CG 4.17Å
220	F	90.5	Very high	88.6	Confident	7 Å²	7	28.8 Å²	28.8	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-60.7	-52.6	176.7	-90.1	-68.5	0	0	0	111.8	L55 T60 V62 V216 T217 M218 Y222 L223 T224	L55-F220 HydrophobicContact CB-CE1 4.06Å; L55-F220 HydrophobicContact CB-CE2 4.35Å; L55-F220 HydrophobicContact CB-CZ 3.57Å; L55-F220 HydrophobicContact CD1-CD2 4.38Å; L55-F220 HydrophobicContact CD1-CE1 4.43Å; L55-F220 HydrophobicContact CD1-CE2 3.57Å; L55-F220 HydrophobicContact CD1-CZ 3.62Å; L55-F220 HydrophobicContact CG-CZ 4.31Å; T60-F220 HydrophobicContact CG2-CD1 3.86Å; T60-F220 HydrophobicContact CG2-CE1 4.05Å; V62-F220 HydrophobicContact CB-CD2 4.07Å; V62-F220 HydrophobicContact CB-CE1 4.32Å; V62-F220 HydrophobicContact CB-CE2 3.49Å; V62-F220 VanDerWaalsContact CB-CE2 3.49Å; V62-F220 HydrophobicContact CB-CZ 3.62Å; V62-F220 HydrophobicContact CG2-CD1 3.87Å; V62-F220 HydrophobicContact CG2-CD2 3.64Å; V62-F220 HydrophobicContact CG2-CE1 3.74Å; V62-F220 HydrophobicContact CG2-CE2 3.5Å; V62-F220 VanDerWaalsContact CG2-CE2 3.5Å; V62-F220 HydrophobicContact CG2-CG 3.81Å; V62-F220 HydrophobicContact CG2-CZ 3.53Å; V216-F220 HydrophobicContact CG1-CD2 3.87Å; V216-F220 HydrophobicContact CG1-CE2 3.79Å; V216-F220 VanDerWaalsContact O-CD2 3.26Å; V216-F220 WeakPolarHBondContact O-CD2 3.22Å; V216-F220 PolarHBondContact O-N 3.22Å; T217-F220 PolarHBondContact O-N 2.93Å; M218-F220 VanDerWaalsContact C-N 3.34Å; M218-F220 PolarHBondContact O-N 2.72Å; F220-Y222 VanDerWaalsContact C-N 3.3Å; F220-Y222 PolarHBondContact O-N 2.8Å; F220-L223 PolarHBondContact O-N 2.9Å; F220-T224 WeakPolarHBondContact O-CG2 3.39Å; F220-T224 PolarHBondContact O-N 3.01Å; F220-T224 PolarHBondContact O-OG1 2.93Å
221	N	90.7	Very high	89.4	Confident	64 Å²	64	33.5 Å²	33.5	34%	0.342	19%	0.19	S	C	.	.	H	α-helix	trans	-58.5	-46.8	-178.6	-70.8	-2.1	0	0	0	110.5	T217 M218 L223 T224 S225	T217-N221 WeakPolarHBondContact O-CB 3.28Å; T217-N221 VanDerWaalsContact O-CG 3.25Å; T217-N221 PolarHBondContact O-N 2.63Å; T217-N221 PolarHBondContact O-OD1 3.5Å; M218-N221 PolarHBondContact O-N 2.81Å; N221-L223 PolarHBondContact O-N 2.84Å; N221-T224 WeakPolarHBondContact CA-OG1 3.23Å; N221-T224 PolarHBondContact O-N 2.89Å; N221-T224 PolarHBondContact O-OG1 3.36Å; N221-S225 WeakPolarHBondContact O-CB 3.3Å; N221-S225 PolarHBondContact O-N 3.17Å; N221-S225 PolarHBondContact O-OG 2.89Å; N221-S225 VanDerWaalsContact O-OG 3.07Å
222	Y	93.1	Very high	90.2	Very high	9 Å²	9	33.9 Å²	33.9	4%	0.035	19%	0.192	C	C	.	.	H	α-helix	trans	-52.3	-53.6	176.5	178	-97.2	0	0	0	112.7	R99 W102 D103 M180 M218 F220 S225 L226	R99-Y222 VanDerWaalsContact CZ-CE2 3.41Å; R99-Y222 VanDerWaalsContact NH1-CZ 3.26Å; R99-Y222 PolarHBondContact NH1-OH 2.72Å; R99-Y222 PolarHBondContact NH2-OH 3.48Å; W102-Y222 HydrophobicContact CH2-CD2 4.17Å; W102-Y222 HydrophobicContact CH2-CE1 4.23Å; W102-Y222 AromaticContact CH2-CE2 3.33Å; W102-Y222 HydrophobicContact CH2-CE2 3.33Å; W102-Y222 AromaticContact CH2-CZ 3.41Å; W102-Y222 VanDerWaalsContact CH2-CZ 3.41Å; W102-Y222 WeakPolarHBondContact CH2-OH 3.44Å; W102-Y222 HydrophobicContact CZ2-CE2 4.39Å; W102-Y222 AromaticContact CZ3-CD2 3.88Å; W102-Y222 HydrophobicContact CZ3-CD2 3.88Å; W102-Y222 AromaticContact CZ3-CE2 3.49Å; W102-Y222 HydrophobicContact CZ3-CE2 3.49Å; W102-Y222 VanDerWaalsContact CZ3-CE2 3.49Å; W102-Y222 AromaticContact CZ3-CZ 3.96Å; W102-Y222 WeakPolarHBondContact CZ3-O 3.28Å; D103-Y222 HydrophobicContact CB-CE2 4.46Å; M180-Y222 HydrophobicContact CE-CD1 4.15Å; M180-Y222 HydrophobicContact CE-CE1 3.13Å; M180-Y222 WeakPolarHBondContact CE-OH 3.33Å; M180-Y222 HydrophobicContact SD-CE1 3.77Å; M180-Y222 PolarHBondContact SD-OH 3.3Å; M180-Y222 VanDerWaalsContact SD-OH 3.32Å; M218-Y222 WeakPolarHBondContact O-CB 3.44Å; M218-Y222 PolarHBondContact O-N 3.47Å; F220-Y222 VanDerWaalsContact C-N 3.3Å; F220-Y222 PolarHBondContact O-N 2.8Å; Y222-S225 PolarHBondContact O-N 3.32Å; Y222-L226 PolarHBondContact O-N 2.74Å; Y222-L226 VanDerWaalsContact O-N 3.08Å
223	L	94.6	Very high	90.9	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.8	-38.4	-179.6	-66	176.8	0	0	0	112.1	T60 T79 C195 M219 F220 N221 L226 Q227	T60-L223 HydrophobicContact CG2-CB 3.78Å; T60-L223 HydrophobicContact CG2-CD1 3.75Å; T60-L223 HydrophobicContact CG2-CG 4.43Å; T79-L223 HydrophobicContact CG2-CB 4.15Å; T79-L223 HydrophobicContact CG2-CD1 4.41Å; T79-L223 HydrophobicContact CG2-CD2 3.86Å; T79-L223 HydrophobicContact CG2-CG 4.35Å; C195-L223 HydrophobicContact CB-CD2 4.03Å; M219-L223 HydrophobicContact CG-CD1 4.21Å; M219-L223 WeakPolarHBondContact O-CG 3.44Å; M219-L223 PolarHBondContact O-N 2.88Å; M219-L223 VanDerWaalsContact O-N 3.07Å; M219-L223 HydrophobicContact SD-CD1 3.96Å; M219-L223 HydrophobicContact SD-CG 4.17Å; F220-L223 PolarHBondContact O-N 2.9Å; N221-L223 PolarHBondContact O-N 2.84Å; L223-L226 WeakPolarHBondContact O-CB 3.4Å; L223-L226 PolarHBondContact O-N 3.06Å; L223-Q227 WeakPolarHBondContact O-CG 3.45Å; L223-Q227 PolarHBondContact O-N 3.4Å; L223-Q227 VanDerWaalsContact O-N 3.12Å
224	T	92.7	Very high	91.5	Very high	34 Å²	34	37.4 Å²	37.4	21%	0.209	21%	0.212	C	C	.	.	H	α-helix	trans	-69.5	-33.1	177	55.9	0	0	0	0	112.9	F220 N221 Q227 G228	F220-T224 WeakPolarHBondContact O-CG2 3.39Å; F220-T224 PolarHBondContact O-N 3.01Å; F220-T224 PolarHBondContact O-OG1 2.93Å; N221-T224 WeakPolarHBondContact CA-OG1 3.23Å; N221-T224 PolarHBondContact O-N 2.89Å; N221-T224 PolarHBondContact O-OG1 3.36Å; T224-Q227 WeakPolarHBondContact O-CB 3.43Å; T224-Q227 PolarHBondContact O-N 2.97Å; T224-G228 PolarHBondContact O-N 3.17Å
225	S	93.7	Very high	92.1	Very high	36 Å²	36	41.7 Å²	41.7	25%	0.252	24%	0.238	S	C	.	.	H	α-helix	trans	-67	-39.8	173.3	-66	0	0	0	0	110.7	N221 Y222 Q227 G228 C229	N221-S225 WeakPolarHBondContact O-CB 3.3Å; N221-S225 PolarHBondContact O-N 3.17Å; N221-S225 PolarHBondContact O-OG 2.89Å; N221-S225 VanDerWaalsContact O-OG 3.07Å; Y222-S225 PolarHBondContact O-N 3.32Å; S225-Q227 VanDerWaalsContact C-N 3.28Å; S225-Q227 PolarHBondContact O-N 2.99Å; S225-G228 WeakPolarHBondContact O-CA 3.14Å; S225-G228 PolarHBondContact O-N 2.79Å; S225-C229 PolarHBondContact O-N 3.02Å
226	L	95.4	Very high	92.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-36.9	173.8	-178	58	0	0	0	112.2	V81 F83 M91 I92 W102 I193 Y222 L223 G228 C229	V81-L226 HydrophobicContact CG1-CD2 4.4Å; V81-L226 HydrophobicContact CG1-CG 4.08Å; F83-L226 WeakPolarHBondContact CE1-O 3.39Å; F83-L226 HydrophobicContact CZ-CD1 4.19Å; F83-L226 HydrophobicContact CZ-CG 4.48Å; F83-L226 VanDerWaalsContact CZ-O 3.3Å; F83-L226 WeakPolarHBondContact CZ-O 3.45Å; M91-L226 HydrophobicContact CB-CD1 3.72Å; M91-L226 HydrophobicContact CG-CD1 4.36Å; I92-L226 HydrophobicContact CG2-CD1 4.04Å; I92-L226 HydrophobicContact CG2-CD2 3.85Å; W102-L226 HydrophobicContact CE3-CB 4.31Å; W102-L226 HydrophobicContact CH2-CB 3.71Å; W102-L226 HydrophobicContact CH2-CD1 3.8Å; W102-L226 HydrophobicContact CH2-CD2 4.37Å; W102-L226 HydrophobicContact CH2-CG 4.14Å; W102-L226 HydrophobicContact CZ2-CB 4.42Å; W102-L226 HydrophobicContact CZ2-CD1 3.66Å; W102-L226 HydrophobicContact CZ2-CG 4.49Å; W102-L226 HydrophobicContact CZ3-CB 3.7Å; W102-L226 HydrophobicContact CZ3-CD1 4.45Å; I193-L226 HydrophobicContact CD1-CD2 3.63Å; Y222-L226 PolarHBondContact O-N 2.74Å; Y222-L226 VanDerWaalsContact O-N 3.08Å; L223-L226 WeakPolarHBondContact O-CB 3.4Å; L223-L226 PolarHBondContact O-N 3.06Å; L226-G228 VanDerWaalsContact C-N 3.25Å; L226-G228 PolarHBondContact O-N 3.27Å; L226-C229 VanDerWaalsContact O-CB 3.26Å; L226-C229 WeakPolarHBondContact O-CB 3.46Å; L226-C229 PolarHBondContact O-N 3.39Å; L226-C229 VanDerWaalsContact O-N 3.11Å
227	Q	93.7	Very high	92.7	Very high	30 Å²	30	45.7 Å²	45.7	14%	0.14	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-35.5	172.9	-66.1	176.7	-40.2	0	0	112.4	N58 T60 T79 V80 V81 L223 T224 S225 C229 K230	N58-Q227 PolarHBondContact O-NE2 3.05Å; T60-Q227 PolarHBondContact OG1-NE2 3.24Å; T79-Q227 PolarHBondContact OG1-NE2 3.2Å; V80-Q227 PolarHBondContact O-NE2 2.87Å; V81-Q227 HydrophobicContact CG1-CG 3.95Å; L223-Q227 WeakPolarHBondContact O-CG 3.45Å; L223-Q227 PolarHBondContact O-N 3.4Å; L223-Q227 VanDerWaalsContact O-N 3.12Å; T224-Q227 WeakPolarHBondContact O-CB 3.43Å; T224-Q227 PolarHBondContact O-N 2.97Å; S225-Q227 VanDerWaalsContact C-N 3.28Å; S225-Q227 PolarHBondContact O-N 2.99Å; Q227-C229 PolarHBondContact O-N 3.22Å; Q227-K230 PolarHBondContact O-N 2.82Å
228	G	93.1	Very high	92.6	Very high	52 Å²	52	51.5 Å²	51.5	54%	0.536	29%	0.288	S	S	.	.	H	α-helix	trans	-65	-16.5	174.9	0	0	0	0	0	114	T224 S225 L226 K230	T224-G228 PolarHBondContact O-N 3.17Å; S225-G228 WeakPolarHBondContact O-CA 3.14Å; S225-G228 PolarHBondContact O-N 2.79Å; L226-G228 VanDerWaalsContact C-N 3.25Å; L226-G228 PolarHBondContact O-N 3.27Å; G228-K230 PolarHBondContact O-N 2.93Å; G228-K230 VanDerWaalsContact O-N 3.08Å
229	C	94.9	Very high	92.4	Very high	2 Å²	2	58 Å²	58	1%	0.014	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-70.2	-1.9	177.9	-60.1	0	0	0	0	114.2	F83 K87 M91 W102 S225 L226 Q227 D231 L232	F83-C229 HydrophobicContact CE1-CB 4.14Å; F83-C229 HydrophobicContact CZ-CB 4.04Å; K87-C229 WeakPolarHBondContact CE-O 3.33Å; K87-C229 PolarHBondContact NZ-O 3.35Å; M91-C229 HydrophobicContact CG-CB 3.98Å; M91-C229 HydrophobicContact SD-CB 3.95Å; W102-C229 WeakPolarHBondContact CB-SG 3.36Å; S225-C229 PolarHBondContact O-N 3.02Å; L226-C229 VanDerWaalsContact O-CB 3.26Å; L226-C229 WeakPolarHBondContact O-CB 3.46Å; L226-C229 PolarHBondContact O-N 3.39Å; L226-C229 VanDerWaalsContact O-N 3.11Å; Q227-C229 PolarHBondContact O-N 3.22Å; C229-D231 PolarHBondContact O-N 2.85Å; C229-L232 HydrophobicContact CB-CB 4.43Å; C229-L232 WeakPolarHBondContact O-CB 3.26Å; C229-L232 PolarHBondContact O-N 2.85Å; C229-L232 VanDerWaalsContact O-N 3.15Å
230	K	92.6	Very high	92.1	Very high	111 Å²	111	58.6 Å²	58.6	48%	0.483	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-50.4	-46.6	175.5	-177.3	-176.7	178.8	-177.3	0	111.5	N82 F83 K87 Q227 G228	N82-K230 HydrophobicContact CB-CD 4.08Å; F83-K230 HydrophobicContact CD1-CB 3.88Å; F83-K230 HydrophobicContact CD1-CG 4.44Å; F83-K230 HydrophobicContact CE1-CB 4.41Å; K87-K230 PolarHBondContact NZ-O 2.87Å; Q227-K230 PolarHBondContact O-N 2.82Å; G228-K230 PolarHBondContact O-N 2.93Å; G228-K230 VanDerWaalsContact O-N 3.08Å
231	D	92.5	Very high	91.9	Very high	139 Å²	139	60.7 Å²	60.7	74%	0.743	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-89.8	-2.9	-173.9	-54.9	-40.9	0	0	0	113	C229 P233	C229-D231 PolarHBondContact O-N 2.85Å; D231-P233 WeakPolarHBondContact O-CD 3.42Å
232	L	94.4	Very high	91.6	Very high	23 Å²	23	58.1 Å²	58.1	12%	0.12	33%	0.33	C	S	.	.	S	Bend	trans	-69.9	124.6	177.5	-167.1	146.8	0	0	0	109.9	K87 M91 Y98 Q101 C229 W234	K87-L232 PolarHBondContact NZ-O 2.94Å; M91-L232 HydrophobicContact CE-CD2 3.79Å; M91-L232 HydrophobicContact SD-CD1 4.47Å; M91-L232 HydrophobicContact SD-CD2 3.93Å; Y98-L232 HydrophobicContact CD1-CD2 3.65Å; Y98-L232 HydrophobicContact CE1-CD2 4.13Å; Q101-L232 HydrophobicContact CB-CD1 3.76Å; C229-L232 HydrophobicContact CB-CB 4.43Å; C229-L232 WeakPolarHBondContact O-CB 3.26Å; C229-L232 PolarHBondContact O-N 2.85Å; C229-L232 VanDerWaalsContact O-N 3.15Å; L232-W234 PolarHBondContact O-N 2.94Å
233	P	95.1	Very high	91.2	Very high	113 Å²	113	60.3 Å²	60.3	73%	0.734	34%	0.338	S	S	*	.			trans	-57.8	125.2	177.1	-25.4	34.7	0	0	0	111.4	D231	D231-P233 WeakPolarHBondContact O-CD 3.42Å
234	W	94.3	Very high	90.4	Very high	60 Å²	60	63 Å²	63	23%	0.227	36%	0.355	C	S	.	.			trans	-134.7	133.6	-172	169.9	72.2	0	0	0	111.4	L84 E86 K87 D90 M91 Y98 L232 P236	L84-W234 HydrophobicContact CD1-CH2 4.48Å; L84-W234 HydrophobicContact CD1-CZ3 4.15Å; E86-W234 HydrophobicContact CB-CH2 4Å; E86-W234 HydrophobicContact CB-CZ2 4.1Å; K87-W234 HydrophobicContact CB-CD2 3.72Å; K87-W234 HydrophobicContact CB-CE3 3.82Å; K87-W234 HydrophobicContact CB-CG 4.34Å; K87-W234 HydrophobicContact CB-CH2 3.94Å; K87-W234 HydrophobicContact CB-CZ2 3.87Å; K87-W234 HydrophobicContact CB-CZ3 3.93Å; K87-W234 HydrophobicContact CD-CB 3.98Å; K87-W234 HydrophobicContact CD-CD2 3.95Å; K87-W234 HydrophobicContact CD-CE3 3.93Å; K87-W234 HydrophobicContact CD-CG 4Å; K87-W234 HydrophobicContact CG-CB 4.24Å; K87-W234 HydrophobicContact CG-CD2 3.67Å; K87-W234 HydrophobicContact CG-CE3 4.02Å; K87-W234 HydrophobicContact CG-CG 3.78Å; D90-W234 PolarHBondContact OD2-NE1 3.44Å; M91-W234 HydrophobicContact CE-CB 3.97Å; M91-W234 VanDerWaalsContact CE-CD1 3.48Å; M91-W234 HydrophobicContact CE-CG 3.92Å; Y98-W234 AromaticContact CE2-CD1 3.59Å; Y98-W234 AromaticContact CZ-CD1 3.79Å; L232-W234 PolarHBondContact O-N 2.94Å; W234-P236 HydrophobicContact CH2-CG 3.82Å; W234-P236 HydrophobicContact CZ2-CB 4.14Å; W234-P236 HydrophobicContact CZ2-CG 3.77Å; W234-P236 HydrophobicContact CZ3-CG 4.42Å
235	T	94.2	Very high	88.8	Confident	99 Å²	99	65.7 Å²	65.7	61%	0.607	38%	0.381	S	S	*	.			trans	-121.2	136.8	162.7	-51.7	0	0	0	0	107	Y98 I237	Y98-T235 PolarHBondContact OH-N 2.9Å; Y98-T235 PolarHBondContact OH-O 2.84Å; T235-I237 PolarHBondContact O-N 2.9Å
236	P	93	Very high	87.2	Confident	75 Å²	75	72.4 Å²	72.4	49%	0.487	40%	0.401	S	S	.	.			trans	-47.4	135.6	175.2	-28.9	34.5	0	0	0	112.3	D90 W234 E238	D90-P236 VanDerWaalsContact OD2-CA 3.29Å; D90-P236 WeakPolarHBondContact OD2-CA 3.31Å; W234-P236 HydrophobicContact CH2-CG 3.82Å; W234-P236 HydrophobicContact CZ2-CB 4.14Å; W234-P236 HydrophobicContact CZ2-CG 3.77Å; W234-P236 HydrophobicContact CZ3-CG 4.42Å; P236-E238 PolarHBondContact O-N 2.77Å
237	I	90.5	Very high	84.7	Confident	41 Å²	41	85.3 Å²	85.3	21%	0.21	46%	0.457	C	S	.	.			trans	-78.3	113.6	176	-53.5	168.6	0	0	0	108.9	D90 H93 A96 Y98 T235 A240	D90-I237 HydrophobicContact CB-CD1 3.7Å; D90-I237 HydrophobicContact CB-CG1 3.97Å; D90-I237 PolarHBondContact OD2-N 3.04Å; H93-I237 HydrophobicContact CB-CD1 4.38Å; A96-I237 HydrophobicContact CB-CD1 3.39Å; Y98-I237 HydrophobicContact CD2-CD1 3.91Å; Y98-I237 HydrophobicContact CD2-CG1 4.03Å; Y98-I237 HydrophobicContact CE2-CD1 4.12Å; Y98-I237 HydrophobicContact CE2-CG1 3.69Å; T235-I237 PolarHBondContact O-N 2.9Å; I237-A240 HydrophobicContact CB-CB 4.34Å; I237-A240 HydrophobicContact CG2-CB 3.58Å
238	E	85.8	Confident	84.3	Confident	163 Å²	163	88.1 Å²	88.1	76%	0.762	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	140.1	169.4	-61.5	-179.6	-179.5	0	0	110.1	P236 A240	P236-E238 PolarHBondContact O-N 2.77Å; E238-A240 VanDerWaalsContact C-N 3.3Å; E238-A240 PolarHBondContact O-N 2.99Å
239	N	83.1	Confident	83.8	Confident	161 Å²	161	89.9 Å²	89.9	86%	0.861	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	38.8	175.2	-51.4	-52.5	0	0	0	114.6	T241	N239-T241 PolarHBondContact O-N 3.06Å
240	A	87.3	Confident	83.2	Confident	12 Å²	12	94.8 Å²	94.8	10%	0.099	49%	0.494	C	S	.	.			trans	-59.4	138.2	177.6	0	0	0	0	0	111.2	H93 I237 E238 G242 R243	H93-A240 WeakPolarHBondContact NE2-CB 3.4Å; I237-A240 HydrophobicContact CB-CB 4.34Å; I237-A240 HydrophobicContact CG2-CB 3.58Å; E238-A240 VanDerWaalsContact C-N 3.3Å; E238-A240 PolarHBondContact O-N 2.99Å; A240-G242 PolarHBondContact O-N 3Å; A240-R243 HydrophobicContact CB-CB 3.95Å; A240-R243 WeakPolarHBondContact O-CB 3.38Å; A240-R243 PolarHBondContact O-N 3.45Å
241	T	86.1	Confident	82.7	Confident	51 Å²	51	93.9 Å²	93.9	31%	0.313	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	130.6	-178.1	-52.1	0	0	0	0	111.8	H93 F111 Q145 N239 R243	H93-T241 PolarHBondContact CE1-O 3.07Å; H93-T241 PolarHBondContact NE2-O 2.91Å; F111-T241 HydrophobicContact CB-CG2 4.46Å; F111-T241 HydrophobicContact CD1-CG2 4.28Å; F111-T241 HydrophobicContact CD2-CG2 3.27Å; F111-T241 HydrophobicContact CE1-CG2 4.34Å; F111-T241 HydrophobicContact CE2-CG2 3.34Å; F111-T241 HydrophobicContact CG-CG2 3.75Å; F111-T241 HydrophobicContact CZ-CG2 3.89Å; Q145-T241 PolarHBondContact NE2-O 3.43Å; N239-T241 PolarHBondContact O-N 3.06Å; T241-R243 PolarHBondContact O-N 3.4Å
242	G	83.9	Confident	82.1	Confident	10 Å²	10	91.1 Å²	91.1	10%	0.103	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	-5.4	-179.3	0	0	0	0	0	115.5	G118 A240 T244	G118-G242 WeakPolarHBondContact CA-O 3.35Å; G118-G242 PolarHBondContact N-O 3.46Å; A240-G242 PolarHBondContact O-N 3Å; G242-T244 PolarHBondContact O-N 3.07Å
243	R	84.3	Confident	81.2	Confident	54 Å²	54	95.6 Å²	95.6	20%	0.204	50%	0.503	C	S	.	.	P	Polyproline II helix	trans	-80.4	117.4	179.4	-168.8	173.4	178.3	162.5	5.9	109.1	Y89 D90 E147 A240 T241 A245	Y89-R243 VanDerWaalsContact CE1-CZ 3.47Å; D90-R243 IonicContact OD1-CZ 3.28Å; D90-R243 IonicContact OD1-NH1 3.57Å; D90-R243 PolarHBondContact OD1-NH1 3.27Å; E147-R243 IonicContact OE1-CZ 3.46Å; E147-R243 IonicContact OE1-NE 3.89Å; E147-R243 PolarHBondContact OE1-NE 3.2Å; E147-R243 IonicContact OE1-NH2 3.65Å; E147-R243 PolarHBondContact OE1-NH2 3.29Å; E147-R243 IonicContact OE2-NH2 3.02Å; A240-R243 HydrophobicContact CB-CB 3.95Å; A240-R243 WeakPolarHBondContact O-CB 3.38Å; A240-R243 PolarHBondContact O-N 3.45Å; T241-R243 PolarHBondContact O-N 3.4Å; R243-A245 PolarHBondContact O-N 2.92Å
244	T	77.2	Confident	80.2	Confident	57 Å²	57	94.4 Å²	94.4	35%	0.35	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-76	125.6	170	41.4	0	0	0	0	109.1	P117 G118 G242	P117-T244 HydrophobicContact CB-CG2 3.52Å; G118-T244 VanDerWaalsContact N-CG2 3.3Å; G242-T244 PolarHBondContact O-N 3.07Å
245	A	59.9	Low	79.2	Confident	91 Å²	91	97 Å²	97	75%	0.752	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-59.3	145.1	169.4	0	0	0	0	0	109.7	R243 K247	R243-A245 PolarHBondContact O-N 2.92Å; A245-K247 PolarHBondContact O-N 2.73Å
246	R	59.8	Low	77.9	Confident	177 Å²	177	96.8 Å²	96.8	67%	0.668	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-50.7	130.5	171.3	-166.4	-178.5	-169.3	-177.2	5.8	109.2	D149	D149-R246 IonicContact OD1-NH2 2.62Å; D149-R246 PolarHBondContact OD1-NH2 3.38Å
247	K	44.2	Very low	76.5	Confident	270 Å²	270	98.8 Å²	98.8	100%	1.174	50%	0.5	S	S	*	.			trans	-77.4	0	162.8	-78.9	-171.1	178.6	-179.5	0	110.2	A245	A245-K247 PolarHBondContact O-N 2.73Å

Retrieved 247 of 247 residues in 52.7 ms (Link to these results)

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