A0A096MDC4_POEFO Loading...

Cilia- and flagella-associated protein 299

May be involved in spermatogenesis.

AlphaFold DB , UniProt , Accession A0A096MDC4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 235 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	39.2	Very low	53.2	Low	227 Å²	227	122.4 Å²	122.4	100%	1.118	60%	0.601	S	S	*	*				0	-13.2	0	-85.4	179.7	-165	0	0	113.4	L3	M1-L3 PolarHBondContact O-N 3.07Å
2	E	39.1	Very low	54.6	Low	178 Å²	178	118.7 Å²	118.7	83%	0.832	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.8	-19.3	-174.7	-59.7	-159.8	148.8	0	0	116.2	N4	E2-N4 VanDerWaalsContact C-N 3.31Å; E2-N4 PolarHBondContact O-N 3.1Å
3	L	41.9	Very low	55.6	Low	153 Å²	153	109.5 Å²	109.5	80%	0.801	54%	0.535	S	S	*	.	H	α-helix	trans	-67.4	-27.6	-179.7	-74.9	157.4	0	0	0	113.6	M1 E7	M1-L3 PolarHBondContact O-N 3.07Å; L3-E7 PolarHBondContact O-N 2.99Å
4	N	52	Low	56.4	Low	90 Å²	90	103.9 Å²	103.9	48%	0.481	51%	0.51	S	S	.	.	H	α-helix	trans	-76.5	-28.9	-175.4	-158.8	-48.9	0	0	0	112.3	E2 R8	E2-N4 VanDerWaalsContact C-N 3.31Å; E2-N4 PolarHBondContact O-N 3.1Å; N4-R8 WeakPolarHBondContact O-CG 3.48Å; N4-R8 PolarHBondContact O-N 3.27Å; N4-R8 PolarHBondContact OD1-NE 2.91Å
5	T	53.3	Low	57.6	Low	104 Å²	104	105.3 Å²	105.3	64%	0.638	52%	0.52	S	S	*	.	H	α-helix	trans	-73.2	-39.3	-178.6	-32.2	0	0	0	0	111.5	F9	T5-F9 WeakPolarHBondContact O-CB 3.43Å; T5-F9 PolarHBondContact O-N 3.37Å; T5-F9 VanDerWaalsContact O-N 3.1Å
6	A	54.9	Low	58.7	Low	45 Å²	45	100.3 Å²	100.3	37%	0.372	50%	0.495	S	S	.	.	H	α-helix	trans	-67	-45.7	177.7	0	0	0	0	0	111.4	R8 F9 Y10	A6-R8 PolarHBondContact O-N 2.64Å; A6-F9 WeakPolarHBondContact O-CB 3.4Å; A6-F9 PolarHBondContact O-N 3.47Å; A6-F9 VanDerWaalsContact O-N 3.1Å; A6-Y10 HydrophobicContact CB-CD2 4.45Å; A6-Y10 HydrophobicContact CB-CE2 4.17Å; A6-Y10 WeakPolarHBondContact O-CD2 3.38Å; A6-Y10 PolarHBondContact O-N 3.5Å
7	E	56.8	Low	59.6	Low	118 Å²	118	104.4 Å²	104.4	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-59.4	-44.8	177.2	-76	-175.1	148.4	0	0	112.5	L3 F9 Y10 D11	L3-E7 PolarHBondContact O-N 2.99Å; E7-F9 VanDerWaalsContact C-N 3.27Å; E7-F9 PolarHBondContact O-N 3.26Å; E7-Y10 PolarHBondContact O-N 2.98Å; E7-D11 PolarHBondContact O-N 2.79Å
8	R	59.8	Low	60.5	Low	181 Å²	181	104.6 Å²	104.6	68%	0.683	51%	0.513	S	S	*	.	H	α-helix	trans	-61.5	-36	174.8	-75.3	-178.9	176.6	-166.2	-3.8	112.7	N4 A6 F12	N4-R8 WeakPolarHBondContact O-CG 3.48Å; N4-R8 PolarHBondContact O-N 3.27Å; N4-R8 PolarHBondContact OD1-NE 2.91Å; A6-R8 PolarHBondContact O-N 2.64Å; R8-F12 WeakPolarHBondContact O-CB 3.15Å; R8-F12 PolarHBondContact O-N 3.27Å
9	F	62.1	Low	61.3	Low	78 Å²	78	99.8 Å²	99.8	34%	0.342	49%	0.489	S	S	.	.	H	α-helix	trans	-69.2	-41.1	177	-167.4	-100	0	0	0	111.5	T5 A6 E7 F12 L13 L54	T5-F9 WeakPolarHBondContact O-CB 3.43Å; T5-F9 PolarHBondContact O-N 3.37Å; T5-F9 VanDerWaalsContact O-N 3.1Å; A6-F9 WeakPolarHBondContact O-CB 3.4Å; A6-F9 PolarHBondContact O-N 3.47Å; A6-F9 VanDerWaalsContact O-N 3.1Å; E7-F9 VanDerWaalsContact C-N 3.27Å; E7-F9 PolarHBondContact O-N 3.26Å; F9-F12 WeakPolarHBondContact O-CB 3.49Å; F9-F12 PolarHBondContact O-N 2.76Å; F9-L13 HydrophobicContact CD1-CD1 3.87Å; F9-L13 HydrophobicContact CD1-CG 4.36Å; F9-L13 HydrophobicContact CE1-CD1 3.68Å; F9-L13 HydrophobicContact CE1-CG 4.23Å; F9-L13 WeakPolarHBondContact O-CG 3.46Å; F9-L13 PolarHBondContact O-N 3.03Å; F9-L54 HydrophobicContact CE1-CD1 4.08Å; F9-L54 HydrophobicContact CZ-CD1 4.25Å
10	Y	63	Low	62.1	Low	89 Å²	89	98.8 Å²	98.8	35%	0.349	48%	0.483	S	S	.	.	H	α-helix	trans	-66.7	-40.1	174.9	-72.2	-64.4	0	0	0	112.7	A6 E7 F12 L13 T14 R62 A66	A6-Y10 HydrophobicContact CB-CD2 4.45Å; A6-Y10 HydrophobicContact CB-CE2 4.17Å; A6-Y10 WeakPolarHBondContact O-CD2 3.38Å; A6-Y10 PolarHBondContact O-N 3.5Å; E7-Y10 PolarHBondContact O-N 2.98Å; Y10-F12 VanDerWaalsContact C-N 3.33Å; Y10-F12 PolarHBondContact O-N 3.2Å; Y10-L13 PolarHBondContact O-N 3.48Å; Y10-T14 WeakPolarHBondContact O-CG2 3.41Å; Y10-T14 PolarHBondContact O-N 2.91Å; Y10-T14 VanDerWaalsContact O-N 3.1Å; Y10-T14 PolarHBondContact O-OG1 3.21Å; Y10-R62 HydrophobicContact CE1-CB 4.1Å; Y10-R62 HydrophobicContact CE1-CG 4.23Å; Y10-A66 HydrophobicContact CD1-CB 4.05Å; Y10-A66 HydrophobicContact CG-CB 4.46Å
11	D	63.7	Low	62.8	Low	83 Å²	83	97.2 Å²	97.2	44%	0.444	48%	0.477	S	S	.	.	H	α-helix	trans	-60.7	-43.7	173.1	-94.3	-13.5	0	0	0	111.7	E7 L13 T14 K70	E7-D11 PolarHBondContact O-N 2.79Å; D11-L13 PolarHBondContact O-N 2.67Å; D11-T14 PolarHBondContact O-N 3.37Å; D11-T14 PolarHBondContact O-OG1 3.35Å; D11-K70 WeakPolarHBondContact OD1-CE 3.24Å; D11-K70 IonicContact OD1-NZ 3.91Å; D11-K70 PolarHBondContact OD1-NZ 3.25Å
12	F	69.2	Low	64.7	Low	78 Å²	78	86.4 Å²	86.4	34%	0.342	42%	0.424	S	S	.	.	H	α-helix	trans	-58.3	-46.2	175.1	-179.2	-101.4	0	0	0	112.1	R8 F9 Y10 T14 N15 F16 Y22	R8-F12 WeakPolarHBondContact O-CB 3.15Å; R8-F12 PolarHBondContact O-N 3.27Å; F9-F12 WeakPolarHBondContact O-CB 3.49Å; F9-F12 PolarHBondContact O-N 2.76Å; Y10-F12 VanDerWaalsContact C-N 3.33Å; Y10-F12 PolarHBondContact O-N 3.2Å; F12-T14 VanDerWaalsContact C-N 3.32Å; F12-T14 PolarHBondContact O-N 3.2Å; F12-N15 WeakPolarHBondContact O-CB 3.39Å; F12-N15 PolarHBondContact O-N 3.23Å; F12-F16 AromaticContact CD1-CE2 3.73Å; F12-F16 HydrophobicContact CD1-CE2 3.73Å; F12-F16 HydrophobicContact CD1-CZ 4.45Å; F12-F16 HydrophobicContact CD2-CE2 4.25Å; F12-F16 HydrophobicContact CD2-CZ 4.49Å; F12-F16 AromaticContact CE1-CE2 3.42Å; F12-F16 HydrophobicContact CE1-CE2 3.42Å; F12-F16 VanDerWaalsContact CE1-CE2 3.42Å; F12-F16 AromaticContact CE1-CZ 3.78Å; F12-F16 HydrophobicContact CE1-CZ 3.78Å; F12-F16 AromaticContact CE2-CE2 3.98Å; F12-F16 HydrophobicContact CE2-CE2 3.98Å; F12-F16 AromaticContact CE2-CZ 3.83Å; F12-F16 HydrophobicContact CE2-CZ 3.83Å; F12-F16 HydrophobicContact CG-CE2 4.14Å; F12-F16 AromaticContact CZ-CE2 3.55Å; F12-F16 HydrophobicContact CZ-CE2 3.55Å; F12-F16 AromaticContact CZ-CZ 3.42Å; F12-F16 HydrophobicContact CZ-CZ 3.42Å; F12-F16 VanDerWaalsContact CZ-CZ 3.42Å; F12-F16 VanDerWaalsContact O-CD2 3.24Å; F12-F16 WeakPolarHBondContact O-CD2 3.48Å; F12-F16 WeakPolarHBondContact O-CE2 3.38Å; F12-Y22 HydrophobicContact CE1-CE2 4.37Å
13	L	67.5	Low	66.4	Low	0 Å²	0	78 Å²	78	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-64.7	-32.4	178.8	-68.7	175.1	0	0	0	113.3	F9 Y10 D11 N15 F16 Y22 L54 F59 R62	F9-L13 HydrophobicContact CD1-CD1 3.87Å; F9-L13 HydrophobicContact CD1-CG 4.36Å; F9-L13 HydrophobicContact CE1-CD1 3.68Å; F9-L13 HydrophobicContact CE1-CG 4.23Å; F9-L13 WeakPolarHBondContact O-CG 3.46Å; F9-L13 PolarHBondContact O-N 3.03Å; Y10-L13 PolarHBondContact O-N 3.48Å; D11-L13 PolarHBondContact O-N 2.67Å; L13-N15 PolarHBondContact O-N 2.92Å; L13-F16 PolarHBondContact O-N 3.24Å; L13-Y22 HydrophobicContact CD2-CD2 4.07Å; L13-Y22 HydrophobicContact CD2-CE2 3.89Å; L13-L54 HydrophobicContact CD1-CD1 3.97Å; L13-L54 HydrophobicContact CD2-CD1 4Å; L13-F59 HydrophobicContact CD2-CD2 3.79Å; L13-F59 HydrophobicContact CD2-CE2 3.75Å; L13-R62 HydrophobicContact CD1-CB 4.17Å
14	T	67.8	Low	68	Low	31 Å²	31	72 Å²	72	19%	0.19	35%	0.353	C	S	.	.	H	α-helix	trans	-71.3	-14.6	178.1	56.5	0	0	0	0	114.3	Y10 D11 F12 A66 K70	Y10-T14 WeakPolarHBondContact O-CG2 3.41Å; Y10-T14 PolarHBondContact O-N 2.91Å; Y10-T14 VanDerWaalsContact O-N 3.1Å; Y10-T14 PolarHBondContact O-OG1 3.21Å; D11-T14 PolarHBondContact O-N 3.37Å; D11-T14 PolarHBondContact O-OG1 3.35Å; F12-T14 VanDerWaalsContact C-N 3.32Å; F12-T14 PolarHBondContact O-N 3.2Å; T14-A66 HydrophobicContact CG2-CB 3.69Å; T14-K70 HydrophobicContact CG2-CD 4.5Å; T14-K70 PolarHBondContact OG1-NZ 3.2Å
15	N	73.2	Confident	69.2	Low	124 Å²	124	70.3 Å²	70.3	66%	0.663	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-18.4	179.5	-69.1	-20.3	0	0	0	113.5	F12 L13	F12-N15 WeakPolarHBondContact O-CB 3.39Å; F12-N15 PolarHBondContact O-N 3.23Å; L13-N15 PolarHBondContact O-N 2.92Å
16	F	76.3	Confident	70.2	Confident	26 Å²	26	69.2 Å²	69.2	11%	0.114	34%	0.335	C	S	.	.			trans	-88.7	137.1	-179.6	-60.6	-74.8	0	0	0	111.2	F12 L13 D21 Y22 F59 K63	F12-F16 AromaticContact CD1-CE2 3.73Å; F12-F16 HydrophobicContact CD1-CE2 3.73Å; F12-F16 HydrophobicContact CD1-CZ 4.45Å; F12-F16 HydrophobicContact CD2-CE2 4.25Å; F12-F16 HydrophobicContact CD2-CZ 4.49Å; F12-F16 AromaticContact CE1-CE2 3.42Å; F12-F16 HydrophobicContact CE1-CE2 3.42Å; F12-F16 VanDerWaalsContact CE1-CE2 3.42Å; F12-F16 AromaticContact CE1-CZ 3.78Å; F12-F16 HydrophobicContact CE1-CZ 3.78Å; F12-F16 AromaticContact CE2-CE2 3.98Å; F12-F16 HydrophobicContact CE2-CE2 3.98Å; F12-F16 AromaticContact CE2-CZ 3.83Å; F12-F16 HydrophobicContact CE2-CZ 3.83Å; F12-F16 HydrophobicContact CG-CE2 4.14Å; F12-F16 AromaticContact CZ-CE2 3.55Å; F12-F16 HydrophobicContact CZ-CE2 3.55Å; F12-F16 AromaticContact CZ-CZ 3.42Å; F12-F16 HydrophobicContact CZ-CZ 3.42Å; F12-F16 VanDerWaalsContact CZ-CZ 3.42Å; F12-F16 VanDerWaalsContact O-CD2 3.24Å; F12-F16 WeakPolarHBondContact O-CD2 3.48Å; F12-F16 WeakPolarHBondContact O-CE2 3.38Å; L13-F16 PolarHBondContact O-N 3.24Å; F16-D21 HydrophobicContact CB-CB 4.41Å; F16-D21 HydrophobicContact CD1-CB 4.33Å; F16-D21 WeakPolarHBondContact CD1-O 3.45Å; F16-Y22 HydrophobicContact CD2-CD2 4.23Å; F16-Y22 HydrophobicContact CE2-CD2 4.25Å; F16-F59 HydrophobicContact CB-CZ 4.14Å; F16-K63 WeakPolarHBondContact O-CE 3.42Å; F16-K63 PolarHBondContact O-NZ 3.26Å
17	K	73.3	Confident	71.3	Confident	169 Å²	169	68.1 Å²	68.1	74%	0.735	32%	0.322	S	S	*	.	S	Bend	trans	-73	-45.4	179.9	-71.7	-177.5	-178.6	179	0	111.9	D21 K63	K17-D21 PolarHBondContact N-OD2 3.43Å; K17-K63 VanDerWaalsContact C-NZ 3.33Å; K17-K63 PolarHBondContact O-NZ 3.06Å
18	D	76.4	Confident	72.2	Confident	108 Å²	108	65.5 Å²	65.5	58%	0.578	31%	0.314	S	S	*	.	S	Bend	trans	-138.3	168	-174.8	-61.8	-57.2	0	0	0	111	E20 D21 Y22	D18-E20 VanDerWaalsContact C-N 3.27Å; D18-E20 PolarHBondContact O-N 3.3Å; D18-D21 WeakPolarHBondContact O-CB 3.35Å; D18-D21 PolarHBondContact O-N 3.49Å; D18-Y22 PolarHBondContact O-N 2.87Å
19	Y	75.9	Confident	72.8	Confident	15 Å²	15	62 Å²	62	6%	0.059	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-34.9	177.9	179.6	-112.9	0	0	0	112.2	D21 Y22 L23 E46 L54 R56 F59	Y19-D21 VanDerWaalsContact C-N 3.29Å; Y19-D21 PolarHBondContact O-N 2.89Å; Y19-Y22 HydrophobicContact CD2-CD1 4.18Å; Y19-Y22 HydrophobicContact CE2-CD1 4.11Å; Y19-Y22 WeakPolarHBondContact O-CA 3.19Å; Y19-Y22 WeakPolarHBondContact O-CB 3.37Å; Y19-Y22 PolarHBondContact O-N 3.46Å; Y19-Y22 VanDerWaalsContact O-N 3.12Å; Y19-L23 HydrophobicContact CD1-CD1 4.04Å; Y19-L23 HydrophobicContact CD1-CG 4.38Å; Y19-L23 HydrophobicContact CE1-CD1 3.65Å; Y19-L23 HydrophobicContact CE1-CD2 4.41Å; Y19-L23 HydrophobicContact CE1-CG 4.07Å; Y19-L23 PolarHBondContact O-N 2.81Å; Y19-E46 WeakPolarHBondContact CE1-OE1 3.05Å; Y19-E46 PolarHBondContact OH-OE1 3.29Å; Y19-E46 VanDerWaalsContact OH-OE1 3.07Å; Y19-L54 WeakPolarHBondContact CE2-O 3.41Å; Y19-L54 PolarHBondContact OH-O 3.25Å; Y19-R56 HydrophobicContact CD1-CB 4.01Å; Y19-R56 HydrophobicContact CD1-CG 3.98Å; Y19-R56 HydrophobicContact CD2-CB 4.47Å; Y19-R56 HydrophobicContact CE1-CB 3.84Å; Y19-R56 HydrophobicContact CE1-CG 4.32Å; Y19-R56 HydrophobicContact CE2-CB 4.33Å; Y19-R56 HydrophobicContact CG-CB 4.31Å; Y19-R56 HydrophobicContact CG-CG 4.11Å; Y19-F59 HydrophobicContact CD2-CB 3.73Å; Y19-F59 AromaticContact CD2-CD1 3.92Å; Y19-F59 HydrophobicContact CD2-CD1 3.92Å; Y19-F59 HydrophobicContact CD2-CD2 4.42Å; Y19-F59 AromaticContact CD2-CG 3.78Å; Y19-F59 HydrophobicContact CD2-CG 3.78Å; Y19-F59 HydrophobicContact CE2-CB 4.1Å; Y19-F59 HydrophobicContact CG-CD1 4.47Å
20	E	76.6	Confident	73.3	Confident	78 Å²	78	62 Å²	62	36%	0.364	32%	0.322	S	S	.	.	H	α-helix	trans	-59.8	-38.5	174.6	-59.4	-61.4	130.2	0	0	112.6	D18 Y22 L23 D24 R42	D18-E20 VanDerWaalsContact C-N 3.27Å; D18-E20 PolarHBondContact O-N 3.3Å; E20-Y22 VanDerWaalsContact C-N 3.31Å; E20-L23 PolarHBondContact O-N 3.49Å; E20-D24 WeakPolarHBondContact O-CB 3.48Å; E20-D24 PolarHBondContact O-N 2.77Å; E20-D24 VanDerWaalsContact O-OD2 3.11Å; E20-R42 WeakPolarHBondContact OE2-CD 3.46Å; E20-R42 IonicContact OE2-CZ 3.39Å; E20-R42 IonicContact OE2-NE 2.81Å; E20-R42 PolarHBondContact OE2-NE 2.92Å; E20-R42 IonicContact OE2-NH1 3.49Å; E20-R42 PolarHBondContact OE2-NH1 3.32Å
21	D	77.7	Confident	73.7	Confident	67 Å²	67	59.7 Å²	59.7	36%	0.358	32%	0.315	S	S	.	.	H	α-helix	trans	-69.7	-32.8	178.5	-166.2	37.3	0	0	0	111	F16 K17 D18 Y19 S25	F16-D21 HydrophobicContact CB-CB 4.41Å; F16-D21 HydrophobicContact CD1-CB 4.33Å; F16-D21 WeakPolarHBondContact CD1-O 3.45Å; K17-D21 PolarHBondContact N-OD2 3.43Å; D18-D21 WeakPolarHBondContact O-CB 3.35Å; D18-D21 PolarHBondContact O-N 3.49Å; Y19-D21 VanDerWaalsContact C-N 3.29Å; Y19-D21 PolarHBondContact O-N 2.89Å; D21-S25 PolarHBondContact O-N 2.61Å
22	Y	78.3	Confident	74.2	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67.2	-44.3	170.5	170.9	-103.8	0	0	0	111.9	F12 L13 F16 D18 Y19 E20 S25 M52 I53 F59	F12-Y22 HydrophobicContact CE1-CE2 4.37Å; L13-Y22 HydrophobicContact CD2-CD2 4.07Å; L13-Y22 HydrophobicContact CD2-CE2 3.89Å; F16-Y22 HydrophobicContact CD2-CD2 4.23Å; F16-Y22 HydrophobicContact CE2-CD2 4.25Å; D18-Y22 PolarHBondContact O-N 2.87Å; Y19-Y22 HydrophobicContact CD2-CD1 4.18Å; Y19-Y22 HydrophobicContact CE2-CD1 4.11Å; Y19-Y22 WeakPolarHBondContact O-CA 3.19Å; Y19-Y22 WeakPolarHBondContact O-CB 3.37Å; Y19-Y22 PolarHBondContact O-N 3.46Å; Y19-Y22 VanDerWaalsContact O-N 3.12Å; E20-Y22 VanDerWaalsContact C-N 3.31Å; Y22-S25 WeakPolarHBondContact O-CB 3.45Å; Y22-S25 PolarHBondContact O-N 2.99Å; Y22-S25 PolarHBondContact O-OG 3.31Å; Y22-M52 PolarHBondContact OH-O 2.67Å; Y22-I53 HydrophobicContact CE1-CG2 4.26Å; Y22-F59 HydrophobicContact CD1-CD2 4.15Å; Y22-F59 HydrophobicContact CD1-CE2 4.42Å; Y22-F59 HydrophobicContact CD2-CD2 4.33Å; Y22-F59 HydrophobicContact CD2-CE2 4.04Å; Y22-F59 AromaticContact CG-CD2 3.96Å; Y22-F59 HydrophobicContact CG-CD2 3.96Å; Y22-F59 AromaticContact CG-CE2 3.78Å; Y22-F59 HydrophobicContact CG-CE2 3.78Å
23	L	75.1	Confident	74.5	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-63.4	-42.3	175.8	-68.7	179.4	0	0	0	111.5	Y19 E20 S25 K26 I27 R42 V45 I53	Y19-L23 HydrophobicContact CD1-CD1 4.04Å; Y19-L23 HydrophobicContact CD1-CG 4.38Å; Y19-L23 HydrophobicContact CE1-CD1 3.65Å; Y19-L23 HydrophobicContact CE1-CD2 4.41Å; Y19-L23 HydrophobicContact CE1-CG 4.07Å; Y19-L23 PolarHBondContact O-N 2.81Å; E20-L23 PolarHBondContact O-N 3.49Å; L23-S25 PolarHBondContact O-N 3.4Å; L23-K26 WeakPolarHBondContact O-CA 3.5Å; L23-K26 WeakPolarHBondContact O-CB 3.3Å; L23-K26 PolarHBondContact O-N 2.95Å; L23-I27 PolarHBondContact O-N 2.97Å; L23-R42 HydrophobicContact CB-CG 4.26Å; L23-R42 HydrophobicContact CD1-CB 4.32Å; L23-V45 HydrophobicContact CD2-CG1 4.26Å; L23-I53 HydrophobicContact CD2-CG2 4.04Å
24	D	75.9	Confident	74.8	Confident	28 Å²	28	71.5 Å²	71.5	15%	0.15	36%	0.363	C	S	.	.	H	α-helix	trans	-59.7	-32.6	177.1	-71.7	-42.4	0	0	0	112.4	E20 K26 I27 R38 R42	E20-D24 WeakPolarHBondContact O-CB 3.48Å; E20-D24 PolarHBondContact O-N 2.77Å; E20-D24 VanDerWaalsContact O-OD2 3.11Å; D24-K26 PolarHBondContact O-N 2.92Å; D24-I27 PolarHBondContact O-N 3.02Å; D24-I27 WeakPolarHBondContact OD1-CD1 3.36Å; D24-R38 VanDerWaalsContact CG-NH2 3.25Å; D24-R38 IonicContact OD1-CZ 3.64Å; D24-R38 IonicContact OD1-NE 2.91Å; D24-R38 PolarHBondContact OD1-NE 2.84Å; D24-R38 IonicContact OD1-NH2 3.61Å; D24-R38 IonicContact OD2-CZ 3.39Å; D24-R38 IonicContact OD2-NE 3.37Å; D24-R38 PolarHBondContact OD2-NE 3.16Å; D24-R38 IonicContact OD2-NH2 2.64Å; D24-R38 PolarHBondContact OD2-NH2 3.44Å; D24-R42 IonicContact OD1-CZ 3.48Å; D24-R42 IonicContact OD1-NE 3.46Å; D24-R42 PolarHBondContact OD1-NE 2.95Å; D24-R42 IonicContact OD1-NH2 3.27Å; D24-R42 PolarHBondContact OD1-NH2 3.3Å; D24-R42 IonicContact OD2-CZ 3.5Å; D24-R42 IonicContact OD2-NE 2.6Å; D24-R42 PolarHBondContact OD2-NE 3.19Å; D24-R42 IonicContact OD2-NH2 2.79Å; D24-R42 PolarHBondContact OD2-NH2 2.81Å
25	S	77.3	Confident	75.2	Confident	53 Å²	53	72.6 Å²	72.6	37%	0.371	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.4	174.5	84.3	0	0	0	0	114.2	D21 Y22 L23	D21-S25 PolarHBondContact O-N 2.61Å; Y22-S25 WeakPolarHBondContact O-CB 3.45Å; Y22-S25 PolarHBondContact O-N 2.99Å; Y22-S25 PolarHBondContact O-OG 3.31Å; L23-S25 PolarHBondContact O-N 3.4Å
26	K	73.5	Confident	75.2	Confident	82 Å²	82	75.7 Å²	75.7	36%	0.357	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-10.1	-179.5	-58	-59.2	-178.2	-179.1	0	113	L23 D24 T28 V45	L23-K26 WeakPolarHBondContact O-CA 3.5Å; L23-K26 WeakPolarHBondContact O-CB 3.3Å; L23-K26 PolarHBondContact O-N 2.95Å; D24-K26 PolarHBondContact O-N 2.92Å; K26-T28 PolarHBondContact O-N 2.8Å; K26-V45 HydrophobicContact CB-CG1 3.89Å
27	I	78.9	Confident	75.2	Confident	22 Å²	22	75.9 Å²	75.9	11%	0.113	38%	0.379	C	S	.	.			trans	-71.3	126.2	174.6	-61.3	174.8	0	0	0	108.9	L23 D24 D31 L32 R38 A41 R42 V45	L23-I27 PolarHBondContact O-N 2.97Å; D24-I27 PolarHBondContact O-N 3.02Å; D24-I27 WeakPolarHBondContact OD1-CD1 3.36Å; I27-D31 HydrophobicContact CG2-CB 4.13Å; I27-L32 HydrophobicContact CG2-CD1 4.03Å; I27-L32 HydrophobicContact CG2-CD2 4.23Å; I27-L32 HydrophobicContact CG2-CG 3.68Å; I27-R38 HydrophobicContact CD1-CG 4.33Å; I27-A41 HydrophobicContact CD1-CB 4.02Å; I27-A41 HydrophobicContact CG1-CB 4.31Å; I27-A41 HydrophobicContact CG2-CB 4.02Å; I27-R42 HydrophobicContact CD1-CG 3.82Å; I27-V45 HydrophobicContact CG1-CG2 4.22Å
28	T	75.6	Confident	75.2	Confident	62 Å²	62	73.7 Å²	73.7	38%	0.38	37%	0.366	S	S	.	.			trans	-89.2	155	174.4	69.3	0	0	0	0	111.2	K26 T30 D31 L32	K26-T28 PolarHBondContact O-N 2.8Å; T28-T30 PolarHBondContact O-N 3.33Å; T28-T30 VanDerWaalsContact O-N 3.1Å; T28-D31 WeakPolarHBondContact CB-OD2 3.37Å; T28-D31 PolarHBondContact N-OD2 2.88Å; T28-D31 WeakPolarHBondContact O-CB 3.17Å; T28-D31 PolarHBondContact O-N 3.49Å; T28-D31 PolarHBondContact OG1-N 3.47Å; T28-D31 PolarHBondContact OG1-OD2 2.7Å; T28-L32 PolarHBondContact O-N 3.26Å
29	P	72.3	Confident	75.1	Confident	108 Å²	108	74.5 Å²	74.5	70%	0.701	37%	0.366	S	S	*	.	H	α-helix	trans	-56.2	-27.8	174.8	-25.1	34.3	0	0	0	113.2	F33	P29-F33 WeakPolarHBondContact O-CB 3.24Å; P29-F33 PolarHBondContact O-N 3.49Å
30	T	71.3	Confident	74.9	Confident	79 Å²	79	78 Å²	78	49%	0.485	39%	0.385	S	S	.	.	H	α-helix	trans	-66.8	-42	175.1	-52.8	0	0	0	0	111.7	T28 L32 F33 Y34	T28-T30 PolarHBondContact O-N 3.33Å; T28-T30 VanDerWaalsContact O-N 3.1Å; T30-L32 VanDerWaalsContact C-N 3.34Å; T30-L32 PolarHBondContact O-N 3.38Å; T30-F33 WeakPolarHBondContact O-CB 3.34Å; T30-F33 PolarHBondContact O-N 2.67Å; T30-Y34 HydrophobicContact CG2-CD2 3.61Å; T30-Y34 HydrophobicContact CG2-CE2 3.39Å; T30-Y34 WeakPolarHBondContact O-CD2 3.33Å; T30-Y34 PolarHBondContact O-N 3.28Å
31	D	72.4	Confident	74.9	Confident	39 Å²	39	74.3 Å²	74.3	21%	0.209	37%	0.369	C	S	.	.	H	α-helix	trans	-64.3	-41	177.6	-55.1	-44.3	0	0	0	110.8	I27 T28 F33 Y34 L35	I27-D31 HydrophobicContact CG2-CB 4.13Å; T28-D31 WeakPolarHBondContact CB-OD2 3.37Å; T28-D31 PolarHBondContact N-OD2 2.88Å; T28-D31 WeakPolarHBondContact O-CB 3.17Å; T28-D31 PolarHBondContact O-N 3.49Å; T28-D31 PolarHBondContact OG1-N 3.47Å; T28-D31 PolarHBondContact OG1-OD2 2.7Å; D31-F33 VanDerWaalsContact C-N 3.35Å; D31-F33 PolarHBondContact O-N 3.41Å; D31-Y34 PolarHBondContact O-N 3.12Å; D31-L35 HydrophobicContact CB-CD1 4.41Å; D31-L35 VanDerWaalsContact O-CB 3.24Å; D31-L35 WeakPolarHBondContact O-CB 3.5Å; D31-L35 WeakPolarHBondContact O-CG 3.43Å; D31-L35 PolarHBondContact O-N 3.23Å
32	L	74.4	Confident	74.9	Confident	84 Å²	84	73.3 Å²	73.3	44%	0.44	36%	0.36	S	S	.	.	H	α-helix	trans	-64.7	-37.6	173.9	-73.1	164	0	0	0	112.5	I27 T28 T30 K36 R38	I27-L32 HydrophobicContact CG2-CD1 4.03Å; I27-L32 HydrophobicContact CG2-CD2 4.23Å; I27-L32 HydrophobicContact CG2-CG 3.68Å; T28-L32 PolarHBondContact O-N 3.26Å; T30-L32 VanDerWaalsContact C-N 3.34Å; T30-L32 PolarHBondContact O-N 3.38Å; L32-K36 WeakPolarHBondContact O-CA 2.97Å; L32-K36 PolarHBondContact O-N 2.64Å; L32-K36 VanDerWaalsContact O-N 3.07Å; L32-R38 HydrophobicContact CD2-CB 4.47Å
33	F	74.2	Confident	74.7	Confident	150 Å²	150	78.5 Å²	78.5	66%	0.658	38%	0.384	S	S	*	.	H	α-helix	trans	-66.3	-41.6	178.5	-178	-98.1	0	0	0	112.3	P29 T30 D31	P29-F33 WeakPolarHBondContact O-CB 3.24Å; P29-F33 PolarHBondContact O-N 3.49Å; T30-F33 WeakPolarHBondContact O-CB 3.34Å; T30-F33 PolarHBondContact O-N 2.67Å; D31-F33 VanDerWaalsContact C-N 3.35Å; D31-F33 PolarHBondContact O-N 3.41Å
34	Y	74.5	Confident	74.6	Confident	176 Å²	176	82.4 Å²	82.4	69%	0.69	41%	0.405	S	S	*	.	H	α-helix	trans	-82.6	-38.8	-178.4	-73.7	-65.4	0	0	0	113.6	T30 D31	T30-Y34 HydrophobicContact CG2-CD2 3.61Å; T30-Y34 HydrophobicContact CG2-CE2 3.39Å; T30-Y34 WeakPolarHBondContact O-CD2 3.33Å; T30-Y34 PolarHBondContact O-N 3.28Å; D31-Y34 PolarHBondContact O-N 3.12Å
35	L	76.6	Confident	74.5	Confident	53 Å²	53	81.4 Å²	81.4	28%	0.277	40%	0.399	S	S	.	.	H	α-helix	trans	-88.9	-23.3	-174.1	-62.5	167.2	0	0	0	113	D31 S37 L40 A41 L44	D31-L35 HydrophobicContact CB-CD1 4.41Å; D31-L35 VanDerWaalsContact O-CB 3.24Å; D31-L35 WeakPolarHBondContact O-CB 3.5Å; D31-L35 WeakPolarHBondContact O-CG 3.43Å; D31-L35 PolarHBondContact O-N 3.23Å; L35-S37 PolarHBondContact O-N 2.95Å; L35-L40 HydrophobicContact CB-CB 4.49Å; L35-A41 VanDerWaalsContact CD1-CA 3.47Å; L35-A41 HydrophobicContact CD1-CB 3.8Å; L35-L44 HydrophobicContact CD1-CB 4.25Å; L35-L44 HydrophobicContact CD1-CD1 4.12Å; L35-L44 HydrophobicContact CD2-CD1 4.31Å
36	K	71.6	Confident	74.4	Confident	190 Å²	190	83.1 Å²	83.1	83%	0.826	40%	0.401	S	S	*	.			trans	52.9	0	-178.4	-64.1	-177.6	178.6	177.7	0	116.1	L32	L32-K36 WeakPolarHBondContact O-CA 2.97Å; L32-K36 PolarHBondContact O-N 2.64Å; L32-K36 VanDerWaalsContact O-N 3.07Å
37	S	76.9	Confident	74.1	Confident	29 Å²	29	85.6 Å²	85.6	20%	0.203	41%	0.414	C	S	.	.			trans	-126.8	134.2	173.2	155.9	0	0	0	0	108.2	L35 E39 L40 A41	L35-S37 PolarHBondContact O-N 2.95Å; S37-E39 PolarHBondContact OG-N 3.21Å; S37-E39 PolarHBondContact OG-OE2 2.86Å; S37-L40 PolarHBondContact OG-N 2.73Å; S37-A41 PolarHBondContact O-N 3.28Å
38	R	74.1	Confident	73.5	Confident	124 Å²	124	86.2 Å²	86.2	47%	0.468	42%	0.421	S	S	.	.	H	α-helix	trans	-75.4	-33.1	-179.7	-175.5	172.2	170.5	175	-10.1	110.9	D24 I27 L32 A41 R42	D24-R38 VanDerWaalsContact CG-NH2 3.25Å; D24-R38 IonicContact OD1-CZ 3.64Å; D24-R38 IonicContact OD1-NE 2.91Å; D24-R38 PolarHBondContact OD1-NE 2.84Å; D24-R38 IonicContact OD1-NH2 3.61Å; D24-R38 IonicContact OD2-CZ 3.39Å; D24-R38 IonicContact OD2-NE 3.37Å; D24-R38 PolarHBondContact OD2-NE 3.16Å; D24-R38 IonicContact OD2-NH2 2.64Å; D24-R38 PolarHBondContact OD2-NH2 3.44Å; I27-R38 HydrophobicContact CD1-CG 4.33Å; L32-R38 HydrophobicContact CD2-CB 4.47Å; R38-A41 PolarHBondContact O-N 3.45Å; R38-R42 VanDerWaalsContact NE-NH2 3.19Å; R38-R42 WeakPolarHBondContact O-CG 3.25Å; R38-R42 PolarHBondContact O-N 3.45Å
39	E	73.8	Confident	72.4	Confident	124 Å²	124	92.7 Å²	92.7	58%	0.579	45%	0.446	S	S	*	.	H	α-helix	trans	-64	-46.5	177.2	-55.8	76	-161.5	0	0	110.7	S37 A41 R42 E43	S37-E39 PolarHBondContact OG-N 3.21Å; S37-E39 PolarHBondContact OG-OE2 2.86Å; E39-A41 VanDerWaalsContact C-N 3.29Å; E39-A41 PolarHBondContact O-N 3.43Å; E39-R42 WeakPolarHBondContact O-CB 3.17Å; E39-R42 PolarHBondContact O-N 3.22Å; E39-E43 PolarHBondContact O-N 2.88Å
40	L	72.4	Confident	71.6	Confident	88 Å²	88	95.4 Å²	95.4	46%	0.461	45%	0.447	S	S	.	.	H	α-helix	trans	-65.5	-33.4	176.2	-67	178.9	0	0	0	112.3	L35 S37 L44	L35-L40 HydrophobicContact CB-CB 4.49Å; S37-L40 PolarHBondContact OG-N 2.73Å; L40-L44 VanDerWaalsContact O-CB 3.3Å; L40-L44 WeakPolarHBondContact O-CB 3.38Å; L40-L44 PolarHBondContact O-N 3.3Å
41	A	76.1	Confident	70.7	Confident	1 Å²	1	95.8 Å²	95.8	1%	0.008	47%	0.466	C	S	.	.	H	α-helix	trans	-67.4	-37.9	174.3	0	0	0	0	0	112.3	I27 L35 S37 R38 E39 V45	I27-A41 HydrophobicContact CD1-CB 4.02Å; I27-A41 HydrophobicContact CG1-CB 4.31Å; I27-A41 HydrophobicContact CG2-CB 4.02Å; L35-A41 VanDerWaalsContact CD1-CA 3.47Å; L35-A41 HydrophobicContact CD1-CB 3.8Å; S37-A41 PolarHBondContact O-N 3.28Å; R38-A41 PolarHBondContact O-N 3.45Å; E39-A41 VanDerWaalsContact C-N 3.29Å; E39-A41 PolarHBondContact O-N 3.43Å; A41-V45 WeakPolarHBondContact O-CB 3.31Å; A41-V45 WeakPolarHBondContact O-CG2 3.47Å; A41-V45 PolarHBondContact O-N 2.92Å
42	R	78.1	Confident	70	Confident	47 Å²	47	101.2 Å²	101.2	18%	0.177	49%	0.492	C	S	.	.	H	α-helix	trans	-65.1	-47.5	173.9	-70.8	-178.5	-167.2	158.5	-0.2	111.9	E20 L23 D24 I27 R38 E39 L44 V45 E46	E20-R42 WeakPolarHBondContact OE2-CD 3.46Å; E20-R42 IonicContact OE2-CZ 3.39Å; E20-R42 IonicContact OE2-NE 2.81Å; E20-R42 PolarHBondContact OE2-NE 2.92Å; E20-R42 IonicContact OE2-NH1 3.49Å; E20-R42 PolarHBondContact OE2-NH1 3.32Å; L23-R42 HydrophobicContact CB-CG 4.26Å; L23-R42 HydrophobicContact CD1-CB 4.32Å; D24-R42 IonicContact OD1-CZ 3.48Å; D24-R42 IonicContact OD1-NE 3.46Å; D24-R42 PolarHBondContact OD1-NE 2.95Å; D24-R42 IonicContact OD1-NH2 3.27Å; D24-R42 PolarHBondContact OD1-NH2 3.3Å; D24-R42 IonicContact OD2-CZ 3.5Å; D24-R42 IonicContact OD2-NE 2.6Å; D24-R42 PolarHBondContact OD2-NE 3.19Å; D24-R42 IonicContact OD2-NH2 2.79Å; D24-R42 PolarHBondContact OD2-NH2 2.81Å; I27-R42 HydrophobicContact CD1-CG 3.82Å; R38-R42 VanDerWaalsContact NE-NH2 3.19Å; R38-R42 WeakPolarHBondContact O-CG 3.25Å; R38-R42 PolarHBondContact O-N 3.45Å; E39-R42 WeakPolarHBondContact O-CB 3.17Å; E39-R42 PolarHBondContact O-N 3.22Å; R42-L44 VanDerWaalsContact C-N 3.31Å; R42-L44 PolarHBondContact O-N 3.24Å; R42-V45 PolarHBondContact O-N 3.41Å; R42-E46 WeakPolarHBondContact O-CB 3.42Å; R42-E46 PolarHBondContact O-N 3.23Å
43	E	73.4	Confident	69.7	Low	109 Å²	109	99.2 Å²	99.2	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-61	-41.9	178	-170.2	178.9	-179.5	0	0	111.1	E39 E46 H47	E39-E43 PolarHBondContact O-N 2.88Å; E43-E46 PolarHBondContact O-N 2.7Å; E43-H47 WeakPolarHBondContact O-CB 3.35Å; E43-H47 PolarHBondContact O-CD2 3.37Å; E43-H47 VanDerWaalsContact O-CD2 3.3Å; E43-H47 PolarHBondContact O-N 3.1Å
44	L	74.4	Confident	69.5	Low	83 Å²	83	93 Å²	93	44%	0.435	46%	0.455	S	S	.	.	H	α-helix	trans	-64.4	-42.4	176	-170.2	143	0	0	0	112	L35 L40 R42 S48	L35-L44 HydrophobicContact CD1-CB 4.25Å; L35-L44 HydrophobicContact CD1-CD1 4.12Å; L35-L44 HydrophobicContact CD2-CD1 4.31Å; L40-L44 VanDerWaalsContact O-CB 3.3Å; L40-L44 WeakPolarHBondContact O-CB 3.38Å; L40-L44 PolarHBondContact O-N 3.3Å; R42-L44 VanDerWaalsContact C-N 3.31Å; R42-L44 PolarHBondContact O-N 3.24Å; L44-S48 WeakPolarHBondContact O-CA 3Å; L44-S48 WeakPolarHBondContact O-CB 3.43Å; L44-S48 PolarHBondContact O-N 2.84Å
45	V	73.6	Confident	69.6	Low	7 Å²	7	86.7 Å²	86.7	4%	0.042	44%	0.436	C	S	.	.	H	α-helix	trans	-64.4	-47.6	177.4	166	0	0	0	0	110.2	L23 K26 I27 A41 R42 H47 S48 I53	L23-V45 HydrophobicContact CD2-CG1 4.26Å; K26-V45 HydrophobicContact CB-CG1 3.89Å; I27-V45 HydrophobicContact CG1-CG2 4.22Å; A41-V45 WeakPolarHBondContact O-CB 3.31Å; A41-V45 WeakPolarHBondContact O-CG2 3.47Å; A41-V45 PolarHBondContact O-N 2.92Å; R42-V45 PolarHBondContact O-N 3.41Å; V45-H47 PolarHBondContact O-N 2.89Å; V45-S48 PolarHBondContact O-N 3.36Å; V45-S48 VanDerWaalsContact O-N 3.16Å; V45-S48 PolarHBondContact O-OG 3.26Å; V45-I53 HydrophobicContact CG1-CD1 3.57Å; V45-I53 WeakPolarHBondContact O-CD1 3.25Å
46	E	73.8	Confident	69.6	Low	88 Å²	88	90.6 Å²	90.6	41%	0.411	45%	0.448	S	S	.	.	H	α-helix	trans	-60.3	-42.2	178.2	-177.8	163	-139.1	0	0	112.8	Y19 R42 E43	Y19-E46 WeakPolarHBondContact CE1-OE1 3.05Å; Y19-E46 PolarHBondContact OH-OE1 3.29Å; Y19-E46 VanDerWaalsContact OH-OE1 3.07Å; R42-E46 WeakPolarHBondContact O-CB 3.42Å; R42-E46 PolarHBondContact O-N 3.23Å; E43-E46 PolarHBondContact O-N 2.7Å
47	H	68.4	Low	69.8	Low	134 Å²	134	87.8 Å²	87.8	62%	0.62	44%	0.437	S	S	*	.	H	α-helix	trans	-82.9	-11.3	177	-78.6	-77.3	0	0	0	114.2	E43 V45 H49	E43-H47 WeakPolarHBondContact O-CB 3.35Å; E43-H47 PolarHBondContact O-CD2 3.37Å; E43-H47 VanDerWaalsContact O-CD2 3.3Å; E43-H47 PolarHBondContact O-N 3.1Å; V45-H47 PolarHBondContact O-N 2.89Å; H47-H49 PolarHBondContact O-N 2.77Å
48	S	65.9	Low	69.8	Low	36 Å²	36	89.8 Å²	89.8	25%	0.252	44%	0.444	S	S	.	.			trans	-69.6	117.4	178.6	73	0	0	0	0	109.9	L44 V45 K50	L44-S48 WeakPolarHBondContact O-CA 3Å; L44-S48 WeakPolarHBondContact O-CB 3.43Å; L44-S48 PolarHBondContact O-N 2.84Å; V45-S48 PolarHBondContact O-N 3.36Å; V45-S48 VanDerWaalsContact O-N 3.16Å; V45-S48 PolarHBondContact O-OG 3.26Å; S48-K50 PolarHBondContact O-N 3.29Å
49	H	51.7	Low	70	Confident	197 Å²	197	84 Å²	84	91%	0.912	42%	0.422	S	S	*	.			trans	-68.5	31.3	176.9	-103.5	70.9	0	0	0	113.7	H47 G51	H47-H49 PolarHBondContact O-N 2.77Å; H49-G51 PolarHBondContact O-N 2.8Å; H49-G51 VanDerWaalsContact O-N 3.16Å
50	K	55.5	Low	70.2	Confident	166 Å²	166	83.1 Å²	83.1	72%	0.722	42%	0.417	S	S	*	.			trans	-79.5	92.4	164.7	-70.4	-177.5	-178.3	173.6	0	106	S48 M52	S48-K50 PolarHBondContact O-N 3.29Å; K50-M52 PolarHBondContact O-N 3.06Å
51	G	52.8	Low	70.4	Confident	86 Å²	86	85.5 Å²	85.5	89%	0.887	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	51.2	-170.4	0	0	0	0	0	117.8	H49	H49-G51 PolarHBondContact O-N 2.8Å; H49-G51 VanDerWaalsContact O-N 3.16Å
52	M	57.5	Low	70.3	Confident	153 Å²	153	89 Å²	89	75%	0.754	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.1	5.5	177.2	-72.1	-169.5	74.9	0	0	112.5	Y22 K50	Y22-M52 PolarHBondContact OH-O 2.67Å; K50-M52 PolarHBondContact O-N 3.06Å
53	I	68.2	Low	70.3	Confident	43 Å²	43	87.9 Å²	87.9	22%	0.221	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-101.2	120.1	179.3	-57.5	169.6	0	0	0	107.3	Y22 L23 V45	Y22-I53 HydrophobicContact CE1-CG2 4.26Å; L23-I53 HydrophobicContact CD2-CG2 4.04Å; V45-I53 HydrophobicContact CG1-CD1 3.57Å; V45-I53 WeakPolarHBondContact O-CD1 3.25Å
54	L	69.9	Low	70.3	Confident	19 Å²	19	85.5 Å²	85.5	10%	0.099	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-70.2	142.2	176	-63.8	171.9	0	0	0	108.8	F9 L13 Y19 E58 F59	F9-L54 HydrophobicContact CE1-CD1 4.08Å; F9-L54 HydrophobicContact CZ-CD1 4.25Å; L13-L54 HydrophobicContact CD1-CD1 3.97Å; L13-L54 HydrophobicContact CD2-CD1 4Å; Y19-L54 WeakPolarHBondContact CE2-O 3.41Å; Y19-L54 PolarHBondContact OH-O 3.25Å; L54-E58 HydrophobicContact CB-CB 4.12Å; L54-E58 HydrophobicContact CD2-CB 4.38Å; L54-F59 HydrophobicContact CB-CB 4.4Å
55	S	76.5	Confident	70.2	Confident	43 Å²	43	84.1 Å²	84.1	30%	0.301	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-62.1	163.1	167.6	93	0	0	0	0	110.7	E57 E58 F59	S55-E57 VanDerWaalsContact C-N 3.28Å; S55-E57 PolarHBondContact O-N 3.44Å; S55-E57 PolarHBondContact OG-N 2.92Å; S55-E57 PolarHBondContact OG-OE2 3.36Å; S55-E58 PolarHBondContact N-OE2 2.91Å; S55-E58 WeakPolarHBondContact O-CB 3.13Å; S55-E58 PolarHBondContact O-N 3.24Å; S55-E58 PolarHBondContact OG-N 2.75Å; S55-E58 VanDerWaalsContact OG-N 3.17Å; S55-F59 WeakPolarHBondContact O-CB 3.05Å; S55-F59 PolarHBondContact O-N 3.45Å
56	R	76.6	Confident	70	Confident	136 Å²	136	84.1 Å²	84.1	51%	0.513	44%	0.436	S	S	.	.	H	α-helix	trans	-55.5	-45.7	176.1	-176.3	176.4	178.4	168.9	2.6	111.8	Y19 F59 E60	Y19-R56 HydrophobicContact CD1-CB 4.01Å; Y19-R56 HydrophobicContact CD1-CG 3.98Å; Y19-R56 HydrophobicContact CD2-CB 4.47Å; Y19-R56 HydrophobicContact CE1-CB 3.84Å; Y19-R56 HydrophobicContact CE1-CG 4.32Å; Y19-R56 HydrophobicContact CE2-CB 4.33Å; Y19-R56 HydrophobicContact CG-CB 4.31Å; Y19-R56 HydrophobicContact CG-CG 4.11Å; R56-F59 PolarHBondContact O-N 3.1Å; R56-E60 IonicContact NE-OE1 3.05Å; R56-E60 WeakPolarHBondContact O-CG 3.41Å; R56-E60 PolarHBondContact O-N 3.49Å
57	E	76.5	Confident	69.7	Low	131 Å²	131	85.5 Å²	85.5	61%	0.612	44%	0.441	S	S	*	.	H	α-helix	trans	-62.6	-45.6	178	-59.7	73.3	-157.7	0	0	110.9	S55 F59 E60 E61	S55-E57 VanDerWaalsContact C-N 3.28Å; S55-E57 PolarHBondContact O-N 3.44Å; S55-E57 PolarHBondContact OG-N 2.92Å; S55-E57 PolarHBondContact OG-OE2 3.36Å; E57-F59 VanDerWaalsContact C-N 3.33Å; E57-F59 PolarHBondContact O-N 3.31Å; E57-E60 PolarHBondContact O-N 3.36Å; E57-E61 WeakPolarHBondContact O-CB 3.41Å; E57-E61 PolarHBondContact O-N 3.04Å
58	E	76.9	Confident	69.6	Low	71 Å²	71	81.5 Å²	81.5	33%	0.332	43%	0.43	S	S	.	.	H	α-helix	trans	-64.1	-35.6	179.3	-80.6	-159.1	110	0	0	113.5	L54 S55 R62	L54-E58 HydrophobicContact CB-CB 4.12Å; L54-E58 HydrophobicContact CD2-CB 4.38Å; S55-E58 PolarHBondContact N-OE2 2.91Å; S55-E58 WeakPolarHBondContact O-CB 3.13Å; S55-E58 PolarHBondContact O-N 3.24Å; S55-E58 PolarHBondContact OG-N 2.75Å; S55-E58 VanDerWaalsContact OG-N 3.17Å; E58-R62 VanDerWaalsContact CB-NH1 3.26Å; E58-R62 VanDerWaalsContact CD-NH1 3.33Å; E58-R62 VanDerWaalsContact O-CB 3.29Å; E58-R62 WeakPolarHBondContact O-CB 3.38Å; E58-R62 VanDerWaalsContact O-CG 3.3Å; E58-R62 WeakPolarHBondContact O-CG 3.41Å; E58-R62 PolarHBondContact O-N 2.9Å; E58-R62 VanDerWaalsContact O-N 3.09Å; E58-R62 PolarHBondContact O-NH1 3.02Å; E58-R62 IonicContact OE1-CZ 3.23Å; E58-R62 IonicContact OE1-NH1 2.77Å; E58-R62 PolarHBondContact OE1-NH1 3.1Å; E58-R62 IonicContact OE1-NH2 2.87Å; E58-R62 PolarHBondContact OE1-NH2 3.1Å; E58-R62 VanDerWaalsContact OE1-NH2 3.15Å
59	F	78.6	Confident	69.4	Low	2 Å²	2	81.6 Å²	81.6	1%	0.009	43%	0.434	C	S	.	.	H	α-helix	trans	-68.3	-46.9	175.1	174.7	-95.4	0	0	0	111	L13 F16 Y19 Y22 L54 S55 R56 E57 K63	L13-F59 HydrophobicContact CD2-CD2 3.79Å; L13-F59 HydrophobicContact CD2-CE2 3.75Å; F16-F59 HydrophobicContact CB-CZ 4.14Å; Y19-F59 HydrophobicContact CD2-CB 3.73Å; Y19-F59 AromaticContact CD2-CD1 3.92Å; Y19-F59 HydrophobicContact CD2-CD1 3.92Å; Y19-F59 HydrophobicContact CD2-CD2 4.42Å; Y19-F59 AromaticContact CD2-CG 3.78Å; Y19-F59 HydrophobicContact CD2-CG 3.78Å; Y19-F59 HydrophobicContact CE2-CB 4.1Å; Y19-F59 HydrophobicContact CG-CD1 4.47Å; Y22-F59 HydrophobicContact CD1-CD2 4.15Å; Y22-F59 HydrophobicContact CD1-CE2 4.42Å; Y22-F59 HydrophobicContact CD2-CD2 4.33Å; Y22-F59 HydrophobicContact CD2-CE2 4.04Å; Y22-F59 AromaticContact CG-CD2 3.96Å; Y22-F59 HydrophobicContact CG-CD2 3.96Å; Y22-F59 AromaticContact CG-CE2 3.78Å; Y22-F59 HydrophobicContact CG-CE2 3.78Å; L54-F59 HydrophobicContact CB-CB 4.4Å; S55-F59 WeakPolarHBondContact O-CB 3.05Å; S55-F59 PolarHBondContact O-N 3.45Å; R56-F59 PolarHBondContact O-N 3.1Å; E57-F59 VanDerWaalsContact C-N 3.33Å; E57-F59 PolarHBondContact O-N 3.31Å; F59-K63 HydrophobicContact CE1-CD 3.85Å; F59-K63 HydrophobicContact CZ-CD 4.01Å; F59-K63 WeakPolarHBondContact O-CB 3.45Å; F59-K63 PolarHBondContact O-N 2.96Å
60	E	76.9	Confident	69.9	Low	105 Å²	105	76.1 Å²	76.1	49%	0.491	41%	0.407	S	S	.	.	H	α-helix	trans	-64.1	-43.9	179	-73.4	-178.4	-173.1	0	0	111.6	R56 E57 K63 A64	R56-E60 IonicContact NE-OE1 3.05Å; R56-E60 WeakPolarHBondContact O-CG 3.41Å; R56-E60 PolarHBondContact O-N 3.49Å; E57-E60 PolarHBondContact O-N 3.36Å; E60-K63 PolarHBondContact O-N 3.28Å; E60-A64 VanDerWaalsContact O-CB 3.29Å; E60-A64 WeakPolarHBondContact O-CB 3.35Å; E60-A64 PolarHBondContact O-N 3.47Å
61	E	77.3	Confident	70	Confident	138 Å²	138	72.6 Å²	72.6	65%	0.645	40%	0.4	S	S	*	.	H	α-helix	trans	-63.2	-48.1	177.7	-171.9	177.3	-164.9	0	0	111.7	E57 K63 A64 A65	E57-E61 WeakPolarHBondContact O-CB 3.41Å; E57-E61 PolarHBondContact O-N 3.04Å; E61-K63 VanDerWaalsContact C-N 3.34Å; E61-K63 PolarHBondContact O-N 3.47Å; E61-A64 PolarHBondContact O-N 2.64Å; E61-A65 WeakPolarHBondContact O-CB 3.38Å; E61-A65 PolarHBondContact O-N 3.2Å
62	R	74.8	Confident	70.2	Confident	76 Å²	76	74.9 Å²	74.9	29%	0.287	39%	0.387	S	S	.	.	H	α-helix	trans	-67.2	-34.7	178.7	-75.7	179.6	178.8	85.2	-10.8	112.5	Y10 L13 E58 A66	Y10-R62 HydrophobicContact CE1-CB 4.1Å; Y10-R62 HydrophobicContact CE1-CG 4.23Å; L13-R62 HydrophobicContact CD1-CB 4.17Å; E58-R62 VanDerWaalsContact CB-NH1 3.26Å; E58-R62 VanDerWaalsContact CD-NH1 3.33Å; E58-R62 VanDerWaalsContact O-CB 3.29Å; E58-R62 WeakPolarHBondContact O-CB 3.38Å; E58-R62 VanDerWaalsContact O-CG 3.3Å; E58-R62 WeakPolarHBondContact O-CG 3.41Å; E58-R62 PolarHBondContact O-N 2.9Å; E58-R62 VanDerWaalsContact O-N 3.09Å; E58-R62 PolarHBondContact O-NH1 3.02Å; E58-R62 IonicContact OE1-CZ 3.23Å; E58-R62 IonicContact OE1-NH1 2.77Å; E58-R62 PolarHBondContact OE1-NH1 3.1Å; E58-R62 IonicContact OE1-NH2 2.87Å; E58-R62 PolarHBondContact OE1-NH2 3.1Å; E58-R62 VanDerWaalsContact OE1-NH2 3.15Å; R62-A66 WeakPolarHBondContact O-CB 3.45Å; R62-A66 PolarHBondContact O-N 3.36Å
63	K	76.2	Confident	70	Confident	23 Å²	23	72.7 Å²	72.7	10%	0.1	38%	0.375	C	S	.	.	H	α-helix	trans	-70.1	-38.5	175	-174.7	175	180	178.5	0	111.7	F16 K17 F59 E60 E61 A66 K67	F16-K63 WeakPolarHBondContact O-CE 3.42Å; F16-K63 PolarHBondContact O-NZ 3.26Å; K17-K63 VanDerWaalsContact C-NZ 3.33Å; K17-K63 PolarHBondContact O-NZ 3.06Å; F59-K63 HydrophobicContact CE1-CD 3.85Å; F59-K63 HydrophobicContact CZ-CD 4.01Å; F59-K63 WeakPolarHBondContact O-CB 3.45Å; F59-K63 PolarHBondContact O-N 2.96Å; E60-K63 PolarHBondContact O-N 3.28Å; E61-K63 VanDerWaalsContact C-N 3.34Å; E61-K63 PolarHBondContact O-N 3.47Å; K63-A66 PolarHBondContact O-N 3.31Å; K63-K67 WeakPolarHBondContact O-CB 3.13Å; K63-K67 WeakPolarHBondContact O-CG 3.46Å; K63-K67 PolarHBondContact O-N 3.07Å
64	A	74.7	Confident	69.1	Low	59 Å²	59	72.7 Å²	72.7	49%	0.488	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-45.9	173.3	0	0	0	0	0	110.9	E60 E61 A66 K67 A68	E60-A64 VanDerWaalsContact O-CB 3.29Å; E60-A64 WeakPolarHBondContact O-CB 3.35Å; E60-A64 PolarHBondContact O-N 3.47Å; E61-A64 PolarHBondContact O-N 2.64Å; A64-A66 PolarHBondContact O-N 3.18Å; A64-K67 PolarHBondContact O-N 2.77Å; A64-A68 WeakPolarHBondContact O-CB 3.48Å; A64-A68 PolarHBondContact O-N 2.63Å
65	A	73	Confident	68.2	Low	54 Å²	54	75 Å²	75	45%	0.446	40%	0.397	S	S	.	.	H	α-helix	trans	-60.5	-43.5	175.5	0	0	0	0	0	112.3	E61 A68 A69	E61-A65 WeakPolarHBondContact O-CB 3.38Å; E61-A65 PolarHBondContact O-N 3.2Å; A65-A68 PolarHBondContact O-N 3.38Å; A65-A69 WeakPolarHBondContact O-CB 3.16Å; A65-A69 PolarHBondContact O-N 3.18Å
66	A	68.6	Low	66.9	Low	7 Å²	7	77.3 Å²	77.3	6%	0.058	41%	0.409	C	S	.	.	H	α-helix	trans	-65.3	-39.1	176.7	0	0	0	0	0	112.7	Y10 T14 R62 K63 A64 K70	Y10-A66 HydrophobicContact CD1-CB 4.05Å; Y10-A66 HydrophobicContact CG-CB 4.46Å; T14-A66 HydrophobicContact CG2-CB 3.69Å; R62-A66 WeakPolarHBondContact O-CB 3.45Å; R62-A66 PolarHBondContact O-N 3.36Å; K63-A66 PolarHBondContact O-N 3.31Å; A64-A66 PolarHBondContact O-N 3.18Å; A66-K70 WeakPolarHBondContact O-CB 3.48Å; A66-K70 WeakPolarHBondContact O-CG 3.44Å; A66-K70 PolarHBondContact O-N 2.85Å
67	K	67.6	Low	65.1	Low	117 Å²	117	77 Å²	77	51%	0.509	41%	0.412	S	S	.	.	H	α-helix	trans	-67.7	-39.6	174.6	-77.2	-178.9	178.1	-176.7	0	112.2	K63 A64 K70 T71	K63-K67 WeakPolarHBondContact O-CB 3.13Å; K63-K67 WeakPolarHBondContact O-CG 3.46Å; K63-K67 PolarHBondContact O-N 3.07Å; A64-K67 PolarHBondContact O-N 2.77Å; K67-K70 PolarHBondContact O-N 3.2Å; K67-T71 WeakPolarHBondContact O-CB 3.45Å; K67-T71 PolarHBondContact O-N 3.11Å; K67-T71 PolarHBondContact O-OG1 3.17Å
68	A	65.9	Low	63.5	Low	49 Å²	49	78.5 Å²	78.5	41%	0.405	41%	0.413	S	S	.	.	H	α-helix	trans	-62.3	-48.9	174.3	0	0	0	0	0	110.7	A64 A65 K70 T71 E72	A64-A68 WeakPolarHBondContact O-CB 3.48Å; A64-A68 PolarHBondContact O-N 2.63Å; A65-A68 PolarHBondContact O-N 3.38Å; A68-K70 PolarHBondContact O-N 3.02Å; A68-T71 WeakPolarHBondContact O-CB 3.3Å; A68-T71 PolarHBondContact O-N 2.87Å; A68-T71 VanDerWaalsContact O-N 3.08Å; A68-E72 WeakPolarHBondContact O-CG 3.43Å; A68-E72 PolarHBondContact O-N 3.07Å
69	A	62.8	Low	62.1	Low	39 Å²	39	78.6 Å²	78.6	32%	0.322	42%	0.421	S	S	.	.	H	α-helix	trans	-60.4	-41.3	176.3	0	0	0	0	0	112.7	A65 T71 E72 Q73	A65-A69 WeakPolarHBondContact O-CB 3.16Å; A65-A69 PolarHBondContact O-N 3.18Å; A69-T71 VanDerWaalsContact C-N 3.35Å; A69-E72 PolarHBondContact O-N 3.07Å; A69-Q73 WeakPolarHBondContact O-CB 3.23Å; A69-Q73 VanDerWaalsContact O-CG 3.27Å; A69-Q73 WeakPolarHBondContact O-CG 3.28Å; A69-Q73 PolarHBondContact O-N 3.44Å
70	K	61.3	Low	60.5	Low	82 Å²	82	88.1 Å²	88.1	36%	0.357	46%	0.457	S	S	.	.	H	α-helix	trans	-67.6	-32.2	174.1	-77.2	-176	178	-175.8	0	112.8	D11 T14 A66 K67 A68 S74	D11-K70 WeakPolarHBondContact OD1-CE 3.24Å; D11-K70 IonicContact OD1-NZ 3.91Å; D11-K70 PolarHBondContact OD1-NZ 3.25Å; T14-K70 HydrophobicContact CG2-CD 4.5Å; T14-K70 PolarHBondContact OG1-NZ 3.2Å; A66-K70 WeakPolarHBondContact O-CB 3.48Å; A66-K70 WeakPolarHBondContact O-CG 3.44Å; A66-K70 PolarHBondContact O-N 2.85Å; K67-K70 PolarHBondContact O-N 3.2Å; A68-K70 PolarHBondContact O-N 3.02Å; K70-S74 WeakPolarHBondContact O-CB 3.29Å; K70-S74 PolarHBondContact O-N 2.77Å; K70-S74 PolarHBondContact O-OG 3.34Å
71	T	58.4	Low	58.6	Low	91 Å²	91	87.9 Å²	87.9	56%	0.558	47%	0.467	S	S	*	.	H	α-helix	trans	-69.4	-42.5	175.3	-57.2	0	0	0	0	110.6	K67 A68 A69 S74 S75	K67-T71 WeakPolarHBondContact O-CB 3.45Å; K67-T71 PolarHBondContact O-N 3.11Å; K67-T71 PolarHBondContact O-OG1 3.17Å; A68-T71 WeakPolarHBondContact O-CB 3.3Å; A68-T71 PolarHBondContact O-N 2.87Å; A68-T71 VanDerWaalsContact O-N 3.08Å; A69-T71 VanDerWaalsContact C-N 3.35Å; T71-S74 WeakPolarHBondContact CA-OG 3.47Å; T71-S74 PolarHBondContact O-OG 3.17Å; T71-S74 VanDerWaalsContact O-OG 3.06Å; T71-S75 WeakPolarHBondContact O-CB 3.49Å; T71-S75 PolarHBondContact O-N 3.34Å
72	E	56.4	Low	57	Low	134 Å²	134	87.2 Å²	87.2	63%	0.626	46%	0.464	S	S	*	.	H	α-helix	trans	-64.6	-47.3	173.6	-69.7	178.1	-178.1	0	0	111.7	A68 A69 S74 S75 V76	A68-E72 WeakPolarHBondContact O-CG 3.43Å; A68-E72 PolarHBondContact O-N 3.07Å; A69-E72 PolarHBondContact O-N 3.07Å; E72-S74 PolarHBondContact O-N 2.96Å; E72-S75 PolarHBondContact O-N 3.16Å; E72-S75 PolarHBondContact O-OG 3.11Å; E72-V76 WeakPolarHBondContact O-CG2 3.33Å; E72-V76 PolarHBondContact O-N 3.05Å; E72-V76 VanDerWaalsContact O-N 3.09Å
73	Q	53.3	Low	55.5	Low	107 Å²	107	89.3 Å²	89.3	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-66	-38.6	177.5	-72.5	-179.1	19.8	0	0	112.6	A69 V76 F77	A69-Q73 WeakPolarHBondContact O-CB 3.23Å; A69-Q73 VanDerWaalsContact O-CG 3.27Å; A69-Q73 WeakPolarHBondContact O-CG 3.28Å; A69-Q73 PolarHBondContact O-N 3.44Å; Q73-V76 CarbonylContact O-C 3.56Å; Q73-V76 WeakPolarHBondContact O-CB 3.49Å; Q73-V76 PolarHBondContact O-N 2.84Å; Q73-V76 VanDerWaalsContact O-N 3.17Å; Q73-F77 WeakPolarHBondContact O-CB 3.42Å; Q73-F77 WeakPolarHBondContact O-CD2 3.46Å; Q73-F77 PolarHBondContact O-N 2.82Å
74	S	49.2	Very low	54.5	Low	44 Å²	44	91.2 Å²	91.2	31%	0.308	50%	0.5	S	S	.	.	H	α-helix	trans	-68.1	-37.4	174.9	62.9	0	0	0	0	111	K70 T71 E72 V76 F77 Y78	K70-S74 WeakPolarHBondContact O-CB 3.29Å; K70-S74 PolarHBondContact O-N 2.77Å; K70-S74 PolarHBondContact O-OG 3.34Å; T71-S74 WeakPolarHBondContact CA-OG 3.47Å; T71-S74 PolarHBondContact O-OG 3.17Å; T71-S74 VanDerWaalsContact O-OG 3.06Å; E72-S74 PolarHBondContact O-N 2.96Å; S74-V76 PolarHBondContact O-N 3.43Å; S74-F77 CarbonylContact O-C 3.47Å; S74-F77 PolarHBondContact O-N 3.12Å; S74-F77 VanDerWaalsContact O-N 3.12Å; S74-Y78 VanDerWaalsContact O-CB 3.25Å; S74-Y78 WeakPolarHBondContact O-CB 3.16Å; S74-Y78 WeakPolarHBondContact O-CD2 3.27Å; S74-Y78 PolarHBondContact O-N 3.17Å
75	S	50	Low	53.8	Low	68 Å²	68	94.3 Å²	94.3	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-58.5	-35.3	170.2	81	0	0	0	0	112.5	T71 E72 S79	T71-S75 WeakPolarHBondContact O-CB 3.49Å; T71-S75 PolarHBondContact O-N 3.34Å; E72-S75 PolarHBondContact O-N 3.16Å; E72-S75 PolarHBondContact O-OG 3.11Å; S75-S79 PolarHBondContact O-OG 2.66Å
76	V	49.5	Very low	53.5	Low	91 Å²	91	94 Å²	94	55%	0.552	50%	0.504	S	S	*	.	H	α-helix	trans	-75	-33.2	177.2	177.4	0	0	0	0	111.6	E72 Q73 S74 S79	E72-V76 WeakPolarHBondContact O-CG2 3.33Å; E72-V76 PolarHBondContact O-N 3.05Å; E72-V76 VanDerWaalsContact O-N 3.09Å; Q73-V76 CarbonylContact O-C 3.56Å; Q73-V76 WeakPolarHBondContact O-CB 3.49Å; Q73-V76 PolarHBondContact O-N 2.84Å; Q73-V76 VanDerWaalsContact O-N 3.17Å; S74-V76 PolarHBondContact O-N 3.43Å; V76-S79 WeakPolarHBondContact O-CB 3.36Å
77	F	39.9	Very low	53.6	Low	130 Å²	130	94 Å²	94	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-87.4	-33.3	179.5	-97.1	-87.8	0	0	0	114.5	Q73 S74 S79 R80	Q73-F77 WeakPolarHBondContact O-CB 3.42Å; Q73-F77 WeakPolarHBondContact O-CD2 3.46Å; Q73-F77 PolarHBondContact O-N 2.82Å; S74-F77 CarbonylContact O-C 3.47Å; S74-F77 PolarHBondContact O-N 3.12Å; S74-F77 VanDerWaalsContact O-N 3.12Å; F77-S79 PolarHBondContact O-N 3.09Å; F77-R80 WeakPolarHBondContact O-CB 3.46Å; F77-R80 PolarHBondContact O-N 2.9Å
78	Y	41.7	Very low	53.6	Low	162 Å²	162	89.2 Å²	89.2	64%	0.635	49%	0.485	S	S	*	.	H	α-helix	trans	-59.8	-26.8	170.3	-84	-67.2	0	0	0	111.1	S74 R80	S74-Y78 VanDerWaalsContact O-CB 3.25Å; S74-Y78 WeakPolarHBondContact O-CB 3.16Å; S74-Y78 WeakPolarHBondContact O-CD2 3.27Å; S74-Y78 PolarHBondContact O-N 3.17Å; Y78-R80 VanDerWaalsContact C-N 3.26Å; Y78-R80 PolarHBondContact O-N 3.28Å
79	S	48.1	Very low	53.6	Low	72 Å²	72	89.6 Å²	89.6	50%	0.503	49%	0.489	S	S	.	.	H	α-helix	trans	-71.5	-13.2	172.1	-56.5	0	0	0	0	114.3	S75 V76 F77	S75-S79 PolarHBondContact O-OG 2.66Å; V76-S79 WeakPolarHBondContact O-CB 3.36Å; F77-S79 PolarHBondContact O-N 3.09Å
80	R	44.8	Very low	53.5	Low	202 Å²	202	92 Å²	92	76%	0.762	52%	0.517	S	S	*	.	H	α-helix	trans	-107.4	-19	-171.7	-106.9	178.9	169.3	168.3	-4	115.2	F77 Y78	F77-R80 WeakPolarHBondContact O-CB 3.46Å; F77-R80 PolarHBondContact O-N 2.9Å; Y78-R80 VanDerWaalsContact C-N 3.26Å; Y78-R80 PolarHBondContact O-N 3.28Å
81	S	37.8	Very low	53.9	Low	101 Å²	101	90.4 Å²	90.4	71%	0.706	51%	0.51	S	S	*	.	H	α-helix	trans	-118.4	-4.7	-166.6	-169.3	0	0	0	0	116.4
82	H	42.2	Very low	54.3	Low	124 Å²	124	94.7 Å²	94.7	57%	0.574	52%	0.524	S	S	*	.	S	Bend	trans	-92.7	133	170	-73.1	80.1	0	0	0	108.9	V84	H82-V84 VanDerWaalsContact C-N 3.31Å; H82-V84 PolarHBondContact O-N 2.85Å
83	P	43.4	Very low	55.3	Low	119 Å²	119	89.4 Å²	89.4	77%	0.773	50%	0.5	S	S	*	.			trans	-58.2	104.7	162.7	24.3	-29	0	0	0	106	T85	P83-T85 PolarHBondContact O-N 3.49Å
84	V	56.5	Low	56.3	Low	63 Å²	63	93.3 Å²	93.3	38%	0.382	52%	0.516	S	S	.	.			trans	-68.5	103.4	-176.3	178.5	0	0	0	0	106.6	H82 L86 R109	H82-V84 VanDerWaalsContact C-N 3.31Å; H82-V84 PolarHBondContact O-N 2.85Å; V84-L86 PolarHBondContact O-N 3.49Å; V84-R109 VanDerWaalsContact CG1-NH1 3.33Å
85	T	59.7	Low	57.8	Low	124 Å²	124	91.7 Å²	91.7	76%	0.761	50%	0.503	S	S	*	.			trans	-55.5	109.1	158.9	-46.2	0	0	0	0	105.8	P83 A87	P83-T85 PolarHBondContact O-N 3.49Å; T85-A87 PolarHBondContact O-N 3.37Å
86	L	67.3	Low	59.4	Low	47 Å²	47	92.5 Å²	92.5	25%	0.246	50%	0.502	C	S	.	.			trans	-57.1	135.9	-178.6	-60.9	171.3	0	0	0	107.9	V84 S88 A89 E105 E106	V84-L86 PolarHBondContact O-N 3.49Å; L86-S88 PolarHBondContact O-N 2.92Å; L86-S88 VanDerWaalsContact O-N 3.1Å; L86-A89 HydrophobicContact CB-CB 4.11Å; L86-A89 VanDerWaalsContact O-CB 3.31Å; L86-A89 WeakPolarHBondContact O-CB 2.97Å; L86-A89 PolarHBondContact O-N 3.4Å; L86-E105 HydrophobicContact CD2-CG 4.2Å; L86-E106 HydrophobicContact CD1-CB 4.13Å; L86-E106 HydrophobicContact CD2-CB 3.9Å; L86-E106 HydrophobicContact CD2-CG 4.32Å
87	A	69	Low	61.2	Low	9 Å²	9	88.2 Å²	88.2	7%	0.074	48%	0.476	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.3	-179.4	0	0	0	0	0	111.9	T85 K91 E105 F144 F148	T85-A87 PolarHBondContact O-N 3.37Å; A87-K91 VanDerWaalsContact O-CD 3.25Å; A87-K91 WeakPolarHBondContact O-CD 3.4Å; A87-K91 WeakPolarHBondContact O-CE 3.42Å; A87-K91 PolarHBondContact O-NZ 2.88Å; A87-E105 VanDerWaalsContact CB-OE1 3.29Å; A87-E105 WeakPolarHBondContact CB-OE1 3.47Å; A87-E105 PolarHBondContact N-OE1 3.43Å; A87-E105 PolarHBondContact N-OE2 2.8Å; A87-F144 HydrophobicContact CB-CB 4.11Å; A87-F148 HydrophobicContact CB-CD2 3.8Å; A87-F148 HydrophobicContact CB-CE2 4.09Å
88	S	68.7	Low	63.3	Low	15 Å²	15	82.8 Å²	82.8	11%	0.105	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-13.3	172.7	55	0	0	0	0	115.2	L86 G90 K91 E105	L86-S88 PolarHBondContact O-N 2.92Å; L86-S88 VanDerWaalsContact O-N 3.1Å; S88-G90 PolarHBondContact O-N 2.91Å; S88-K91 PolarHBondContact O-N 2.9Å; S88-E105 VanDerWaalsContact CB-OE2 3.3Å; S88-E105 WeakPolarHBondContact CB-OE2 3.38Å; S88-E105 PolarHBondContact N-OE2 2.98Å; S88-E105 PolarHBondContact OG-OE2 3.08Å
89	A	65.1	Low	65.4	Low	57 Å²	57	79.6 Å²	79.6	47%	0.471	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	123.5	-175.2	0	0	0	0	0	111.5	L86 K91	L86-A89 HydrophobicContact CB-CB 4.11Å; L86-A89 VanDerWaalsContact O-CB 3.31Å; L86-A89 WeakPolarHBondContact O-CB 2.97Å; L86-A89 PolarHBondContact O-N 3.4Å; A89-K91 VanDerWaalsContact C-N 3.32Å; A89-K91 PolarHBondContact O-N 3.36Å
90	G	60.9	Low	67.2	Low	90 Å²	90	76.5 Å²	76.5	93%	0.928	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	10.5	177.8	0	0	0	0	0	115.5	S88	S88-G90 PolarHBondContact O-N 2.91Å
91	K	69.8	Low	69.3	Low	48 Å²	48	67 Å²	67	21%	0.209	39%	0.386	C	S	.	.			trans	-97.4	132.7	178.8	-65	-175.7	-177.6	170	0	111.9	A87 S88 A89 L93 E145 F148 C149	A87-K91 VanDerWaalsContact O-CD 3.25Å; A87-K91 WeakPolarHBondContact O-CD 3.4Å; A87-K91 WeakPolarHBondContact O-CE 3.42Å; A87-K91 PolarHBondContact O-NZ 2.88Å; S88-K91 PolarHBondContact O-N 2.9Å; A89-K91 VanDerWaalsContact C-N 3.32Å; A89-K91 PolarHBondContact O-N 3.36Å; K91-L93 HydrophobicContact CB-CD2 4.19Å; K91-L93 PolarHBondContact O-N 3.44Å; K91-L93 VanDerWaalsContact O-N 3.11Å; K91-E145 VanDerWaalsContact NZ-CG 3.32Å; K91-E145 PolarHBondContact NZ-O 3.47Å; K91-E145 IonicContact NZ-OE1 2.77Å; K91-E145 PolarHBondContact NZ-OE1 2.93Å; K91-F148 HydrophobicContact CD-CB 3.81Å; K91-C149 WeakPolarHBondContact CE-SG 3.43Å; K91-C149 PolarHBondContact NZ-SG 2.9Å
92	E	67.2	Low	71.6	Confident	182 Å²	182	63 Å²	63	85%	0.85	36%	0.359	S	S	*	.			trans	-78.3	93.7	172.1	-66.9	-167.5	155.3	0	0	110.4	K94	E92-K94 PolarHBondContact O-N 3.41Å
93	L	77.4	Confident	73.6	Confident	23 Å²	23	64.2 Å²	64.2	12%	0.12	37%	0.365	C	S	.	.			trans	-83.4	115	177.7	-55.8	176.7	0	0	0	109.2	K91 L98 K99 A102 F148	K91-L93 HydrophobicContact CB-CD2 4.19Å; K91-L93 PolarHBondContact O-N 3.44Å; K91-L93 VanDerWaalsContact O-N 3.11Å; L93-L98 HydrophobicContact CB-CB 4.19Å; L93-L98 HydrophobicContact CD1-CB 4.3Å; L93-L98 WeakPolarHBondContact CD1-O 3.37Å; L93-L98 HydrophobicContact CD2-CB 4.16Å; L93-L98 HydrophobicContact CD2-CD1 4.49Å; L93-L98 HydrophobicContact CG-CB 4.44Å; L93-K99 HydrophobicContact CB-CG 3.88Å; L93-K99 WeakPolarHBondContact O-CE 2.85Å; L93-A102 HydrophobicContact CD1-CB 3.42Å; L93-A102 VanDerWaalsContact CD1-CB 3.42Å; L93-F148 HydrophobicContact CD1-CD1 3.87Å; L93-F148 HydrophobicContact CD1-CE1 4.21Å; L93-F148 HydrophobicContact CD2-CB 4.05Å; L93-F148 HydrophobicContact CD2-CD1 3.84Å; L93-F148 HydrophobicContact CD2-CG 4.43Å; L93-F148 VanDerWaalsContact CD2-O 3.23Å; L93-F148 WeakPolarHBondContact CD2-O 3.35Å
94	K	73.3	Confident	75.6	Confident	189 Å²	189	60.2 Å²	60.2	82%	0.822	33%	0.334	S	S	*	.			trans	-79.3	-40.4	179.1	-67.3	-176.5	178.8	-179.5	0	112.3	E92	E92-K94 PolarHBondContact O-N 3.41Å
95	D	81.9	Confident	77	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.053	32%	0.316	C	S	.	.	S	Bend	trans	-84.9	140.7	-173.7	-177.7	-82.2	0	0	0	112.6	F97 L98 K99 S219 D220 L221	D95-F97 VanDerWaalsContact C-N 3.31Å; D95-F97 PolarHBondContact O-N 2.9Å; D95-F97 WeakPolarHBondContact OD1-CA 3.29Å; D95-F97 WeakPolarHBondContact OD1-CB 3.44Å; D95-F97 PolarHBondContact OD1-N 2.87Å; D95-L98 HydrophobicContact CB-CD1 4.35Å; D95-L98 HydrophobicContact CB-CG 4.31Å; D95-L98 PolarHBondContact O-N 3.3Å; D95-L98 PolarHBondContact OD1-N 3.09Å; D95-K99 WeakPolarHBondContact O-CG 3.3Å; D95-K99 PolarHBondContact O-N 2.86Å; D95-S219 PolarHBondContact OD1-OG 2.67Å; D95-S219 WeakPolarHBondContact OD2-CA 3.29Å; D95-S219 PolarHBondContact OD2-OG 2.85Å; D95-D220 PolarHBondContact OD2-N 2.9Å; D95-L221 HydrophobicContact CB-CD1 3.79Å; D95-L221 HydrophobicContact CB-CG 4.19Å; D95-L221 PolarHBondContact OD2-N 3.49Å
96	N	83.8	Confident	78	Confident	85 Å²	85	57 Å²	57	46%	0.455	31%	0.307	S	S	.	.	H	α-helix	trans	-64.2	-33.4	-177.7	-66.4	-35.6	0	0	0	113.1	A100 Q218	N96-A100 WeakPolarHBondContact O-CB 3.46Å; N96-A100 PolarHBondContact O-N 3.4Å; N96-Q218 PolarHBondContact ND2-O 3.48Å
97	F	86	Confident	78.7	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-66.6	-44.2	175.2	165.9	-114.3	0	0	0	111.4	D95 K99 A100 L101 I117 I119 L154 L217 Y222 V225 L227	D95-F97 VanDerWaalsContact C-N 3.31Å; D95-F97 PolarHBondContact O-N 2.9Å; D95-F97 WeakPolarHBondContact OD1-CA 3.29Å; D95-F97 WeakPolarHBondContact OD1-CB 3.44Å; D95-F97 PolarHBondContact OD1-N 2.87Å; F97-K99 PolarHBondContact O-N 3.17Å; F97-A100 PolarHBondContact O-N 3.26Å; F97-L101 HydrophobicContact CD1-CD1 4.27Å; F97-L101 HydrophobicContact CD2-CD1 4.41Å; F97-L101 HydrophobicContact CD2-CD2 4.5Å; F97-L101 HydrophobicContact CD2-CG 4.09Å; F97-L101 HydrophobicContact CE1-CD1 3.65Å; F97-L101 HydrophobicContact CE1-CG 4.36Å; F97-L101 HydrophobicContact CE2-CD1 3.82Å; F97-L101 HydrophobicContact CE2-CD2 3.84Å; F97-L101 HydrophobicContact CE2-CG 3.72Å; F97-L101 HydrophobicContact CZ-CD1 3.43Å; F97-L101 VanDerWaalsContact CZ-CD1 3.43Å; F97-L101 HydrophobicContact CZ-CD2 4.19Å; F97-L101 HydrophobicContact CZ-CG 3.91Å; F97-L101 WeakPolarHBondContact O-CG 3.37Å; F97-L101 PolarHBondContact O-N 2.88Å; F97-I117 HydrophobicContact CE2-CG2 3.74Å; F97-I117 HydrophobicContact CZ-CG2 3.88Å; F97-I119 HydrophobicContact CZ-CD1 4.14Å; F97-L154 HydrophobicContact CE1-CD2 4.34Å; F97-L154 HydrophobicContact CZ-CD2 3.98Å; F97-L217 HydrophobicContact CD2-CD1 4.14Å; F97-Y222 HydrophobicContact CD1-CD2 4.04Å; F97-Y222 AromaticContact CD1-CE2 3.61Å; F97-Y222 HydrophobicContact CD1-CE2 3.61Å; F97-Y222 HydrophobicContact CE1-CD2 4.33Å; F97-Y222 AromaticContact CE1-CE2 3.66Å; F97-Y222 HydrophobicContact CE1-CE2 3.66Å; F97-V225 HydrophobicContact CD2-CB 4.48Å; F97-V225 HydrophobicContact CD2-CG1 3.39Å; F97-V225 HydrophobicContact CE2-CG1 3.43Å; F97-V225 VanDerWaalsContact CE2-CG1 3.43Å; F97-V225 HydrophobicContact CG-CG1 4.08Å; F97-V225 HydrophobicContact CZ-CG1 4.16Å; F97-L227 HydrophobicContact CE2-CD2 4.02Å
98	L	85.8	Confident	79.4	Confident	17 Å²	17	55.7 Å²	55.7	9%	0.089	30%	0.302	C	S	.	.	H	α-helix	trans	-63.8	-41.7	176.8	-64.5	-179.7	0	0	0	111.6	L93 D95 A100 L101 A102 L221	L93-L98 HydrophobicContact CB-CB 4.19Å; L93-L98 HydrophobicContact CD1-CB 4.3Å; L93-L98 WeakPolarHBondContact CD1-O 3.37Å; L93-L98 HydrophobicContact CD2-CB 4.16Å; L93-L98 HydrophobicContact CD2-CD1 4.49Å; L93-L98 HydrophobicContact CG-CB 4.44Å; D95-L98 HydrophobicContact CB-CD1 4.35Å; D95-L98 HydrophobicContact CB-CG 4.31Å; D95-L98 PolarHBondContact O-N 3.3Å; D95-L98 PolarHBondContact OD1-N 3.09Å; L98-A100 VanDerWaalsContact C-N 3.34Å; L98-A100 PolarHBondContact O-N 3.42Å; L98-L101 PolarHBondContact O-N 3.39Å; L98-A102 WeakPolarHBondContact O-CB 3.5Å; L98-A102 PolarHBondContact O-N 3.16Å; L98-L221 HydrophobicContact CD1-CD1 4.18Å; L98-L221 HydrophobicContact CG-CD1 4.44Å
99	K	85.3	Confident	80.1	Confident	95 Å²	95	58.8 Å²	58.8	41%	0.413	31%	0.312	S	S	.	.	H	α-helix	trans	-57.4	-47.8	173.2	-70	176.9	-173.3	174.3	0	111.6	L93 D95 F97 L101 A102 E103	L93-K99 HydrophobicContact CB-CG 3.88Å; L93-K99 WeakPolarHBondContact O-CE 2.85Å; D95-K99 WeakPolarHBondContact O-CG 3.3Å; D95-K99 PolarHBondContact O-N 2.86Å; F97-K99 PolarHBondContact O-N 3.17Å; K99-L101 VanDerWaalsContact C-N 3.31Å; K99-L101 PolarHBondContact O-N 3.37Å; K99-A102 WeakPolarHBondContact O-CB 3.47Å; K99-A102 PolarHBondContact O-N 2.86Å; K99-A102 VanDerWaalsContact O-N 3.16Å; K99-E103 WeakPolarHBondContact O-CG 3.49Å; K99-E103 PolarHBondContact O-N 3.28Å
100	A	85.9	Confident	80.6	Confident	6 Å²	6	58.9 Å²	58.9	5%	0.05	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-36.8	178.6	0	0	0	0	0	112.5	N96 F97 L98 R104 L217 L227	N96-A100 WeakPolarHBondContact O-CB 3.46Å; N96-A100 PolarHBondContact O-N 3.4Å; F97-A100 PolarHBondContact O-N 3.26Å; L98-A100 VanDerWaalsContact C-N 3.34Å; L98-A100 PolarHBondContact O-N 3.42Å; A100-R104 WeakPolarHBondContact O-CD 3.34Å; A100-R104 WeakPolarHBondContact O-CG 3.33Å; A100-R104 PolarHBondContact O-N 3.04Å; A100-R104 PolarHBondContact O-NH1 3.13Å; A100-L217 HydrophobicContact CB-CD1 3.41Å; A100-L217 VanDerWaalsContact CB-CD1 3.41Å; A100-L217 HydrophobicContact CB-CD2 4.38Å; A100-L227 HydrophobicContact CB-CD1 3.75Å
101	L	87.7	Confident	81.2	Confident	3 Å²	3	54.9 Å²	54.9	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-67.6	-38.9	174.2	-72.8	-172.7	0	0	0	112.7	F97 L98 K99 R104 E105 I117 Y135 F148 L154 L227	F97-L101 HydrophobicContact CD1-CD1 4.27Å; F97-L101 HydrophobicContact CD2-CD1 4.41Å; F97-L101 HydrophobicContact CD2-CD2 4.5Å; F97-L101 HydrophobicContact CD2-CG 4.09Å; F97-L101 HydrophobicContact CE1-CD1 3.65Å; F97-L101 HydrophobicContact CE1-CG 4.36Å; F97-L101 HydrophobicContact CE2-CD1 3.82Å; F97-L101 HydrophobicContact CE2-CD2 3.84Å; F97-L101 HydrophobicContact CE2-CG 3.72Å; F97-L101 HydrophobicContact CZ-CD1 3.43Å; F97-L101 VanDerWaalsContact CZ-CD1 3.43Å; F97-L101 HydrophobicContact CZ-CD2 4.19Å; F97-L101 HydrophobicContact CZ-CG 3.91Å; F97-L101 WeakPolarHBondContact O-CG 3.37Å; F97-L101 PolarHBondContact O-N 2.88Å; L98-L101 PolarHBondContact O-N 3.39Å; K99-L101 VanDerWaalsContact C-N 3.31Å; K99-L101 PolarHBondContact O-N 3.37Å; L101-R104 CarbonylContact O-C 3.58Å; L101-R104 PolarHBondContact O-N 3.16Å; L101-E105 PolarHBondContact O-N 3.06Å; L101-I117 HydrophobicContact CD2-CD1 3.59Å; L101-I117 HydrophobicContact CD2-CG1 4.19Å; L101-Y135 HydrophobicContact CD2-CD1 4.46Å; L101-Y135 HydrophobicContact CD2-CD2 4.3Å; L101-Y135 HydrophobicContact CD2-CE1 4.21Å; L101-Y135 HydrophobicContact CD2-CE2 4.07Å; L101-Y135 PolarHBondContact O-OH 3.48Å; L101-F148 HydrophobicContact CB-CE1 3.93Å; L101-F148 HydrophobicContact CB-CZ 4.06Å; L101-L154 HydrophobicContact CD1-CD2 4.21Å; L101-L227 HydrophobicContact CD2-CD1 4.46Å; L101-L227 HydrophobicContact CD2-CD2 4.02Å
102	A	85.9	Confident	81.7	Confident	18 Å²	18	58.9 Å²	58.9	15%	0.149	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-47.9	178.5	0	0	0	0	0	111.7	L93 L98 K99 R104 E105 F148	L93-A102 HydrophobicContact CD1-CB 3.42Å; L93-A102 VanDerWaalsContact CD1-CB 3.42Å; L98-A102 WeakPolarHBondContact O-CB 3.5Å; L98-A102 PolarHBondContact O-N 3.16Å; K99-A102 WeakPolarHBondContact O-CB 3.47Å; K99-A102 PolarHBondContact O-N 2.86Å; K99-A102 VanDerWaalsContact O-N 3.16Å; A102-R104 PolarHBondContact O-N 3.47Å; A102-R104 VanDerWaalsContact O-N 3.13Å; A102-E105 WeakPolarHBondContact O-CB 3.45Å; A102-E105 PolarHBondContact O-N 3.37Å; A102-F148 HydrophobicContact CB-CE1 3.88Å; A102-F148 HydrophobicContact CB-CZ 4.37Å
103	E	85.1	Confident	82.3	Confident	148 Å²	148	51.7 Å²	51.7	69%	0.692	25%	0.252	S	S	*	.	H	α-helix	trans	-56.1	-31.1	174.7	-70.6	172.3	176.8	0	0	112.5	K99	K99-E103 WeakPolarHBondContact O-CG 3.49Å; K99-E103 PolarHBondContact O-N 3.28Å
104	R	84.8	Confident	82.7	Confident	35 Å²	35	50.7 Å²	50.7	13%	0.132	25%	0.246	C	C	.	.	H	α-helix	trans	-91.1	-13	-177.8	-67.1	170.4	174	63.6	4.5	113.3	A100 L101 A102 N108 M113 Y135 D229	A100-R104 WeakPolarHBondContact O-CD 3.34Å; A100-R104 WeakPolarHBondContact O-CG 3.33Å; A100-R104 PolarHBondContact O-N 3.04Å; A100-R104 PolarHBondContact O-NH1 3.13Å; L101-R104 CarbonylContact O-C 3.58Å; L101-R104 PolarHBondContact O-N 3.16Å; A102-R104 PolarHBondContact O-N 3.47Å; A102-R104 VanDerWaalsContact O-N 3.13Å; R104-N108 WeakPolarHBondContact O-CB 3.29Å; R104-N108 PolarHBondContact O-N 3.47Å; R104-N108 PolarHBondContact O-ND2 3.24Å; R104-M113 HydrophobicContact CB-CE 3.64Å; R104-M113 HydrophobicContact CG-CE 3.54Å; R104-Y135 HydrophobicContact CB-CE1 4.08Å; R104-D229 VanDerWaalsContact CD-OD1 3.31Å; R104-D229 WeakPolarHBondContact CD-OD1 3.33Å; R104-D229 IonicContact CZ-OD2 3.49Å; R104-D229 IonicContact NE-OD1 3.15Å; R104-D229 PolarHBondContact NE-OD1 2.94Å; R104-D229 IonicContact NE-OD2 2.63Å; R104-D229 PolarHBondContact NE-OD2 3.09Å; R104-D229 IonicContact NH2-OD2 2.87Å; R104-D229 PolarHBondContact NH2-OD2 3.26Å
105	E	85.5	Confident	83.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-51.6	-172.7	-174.1	-178.3	-178.9	0	0	110.9	L86 A87 S88 L101 A102 A107 N108 R109 L139	L86-E105 HydrophobicContact CD2-CG 4.2Å; A87-E105 VanDerWaalsContact CB-OE1 3.29Å; A87-E105 WeakPolarHBondContact CB-OE1 3.47Å; A87-E105 PolarHBondContact N-OE1 3.43Å; A87-E105 PolarHBondContact N-OE2 2.8Å; S88-E105 VanDerWaalsContact CB-OE2 3.3Å; S88-E105 WeakPolarHBondContact CB-OE2 3.38Å; S88-E105 PolarHBondContact N-OE2 2.98Å; S88-E105 PolarHBondContact OG-OE2 3.08Å; L101-E105 PolarHBondContact O-N 3.06Å; A102-E105 WeakPolarHBondContact O-CB 3.45Å; A102-E105 PolarHBondContact O-N 3.37Å; E105-A107 PolarHBondContact O-N 3.44Å; E105-N108 PolarHBondContact O-N 3.38Å; E105-R109 HydrophobicContact CG-CG 4.28Å; E105-R109 WeakPolarHBondContact O-CB 3.41Å; E105-R109 WeakPolarHBondContact O-CG 3.46Å; E105-R109 PolarHBondContact O-N 3.06Å; E105-R109 IonicContact OE1-CZ 2.81Å; E105-R109 VanDerWaalsContact OE1-CZ 3.23Å; E105-R109 IonicContact OE1-NE 3.57Å; E105-R109 PolarHBondContact OE1-NE 3Å; E105-R109 IonicContact OE1-NH2 2.67Å; E105-R109 PolarHBondContact OE1-NH2 3.38Å; E105-L139 HydrophobicContact CG-CD2 4.07Å
106	E	82.1	Confident	83.7	Confident	121 Å²	121	41.2 Å²	41.2	57%	0.565	21%	0.205	S	C	*	.	H	α-helix	trans	-61.1	-46.7	-177.2	-172.2	-174.2	177.7	0	0	112	L86 N108 R109 S110	L86-E106 HydrophobicContact CD1-CB 4.13Å; L86-E106 HydrophobicContact CD2-CB 3.9Å; L86-E106 HydrophobicContact CD2-CG 4.32Å; E106-N108 VanDerWaalsContact C-N 3.34Å; E106-N108 PolarHBondContact O-N 3.29Å; E106-R109 PolarHBondContact O-N 3Å; E106-S110 WeakPolarHBondContact O-CB 3.38Å; E106-S110 PolarHBondContact O-N 3.17Å; E106-S110 PolarHBondContact O-OG 3.32Å
107	A	81.4	Confident	84	Confident	27 Å²	27	37.2 Å²	37.2	22%	0.223	18%	0.184	C	C	.	.	H	α-helix	trans	-66.8	-35.1	-179.7	0	0	0	0	0	112.4	E105 S110 G111 K112 M113	E105-A107 PolarHBondContact O-N 3.44Å; A107-S110 WeakPolarHBondContact CA-OG 3.48Å; A107-S110 PolarHBondContact O-OG 3.13Å; A107-G111 PolarHBondContact O-N 3.23Å; A107-K112 PolarHBondContact O-N 3.41Å; A107-M113 HydrophobicContact CB-CB 3.8Å; A107-M113 HydrophobicContact CB-CE 3.81Å; A107-M113 PolarHBondContact O-N 2.85Å
108	N	84.5	Confident	84.2	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-72.6	-42.8	175	-83.8	-90.1	0	0	0	112.2	R104 E105 E106 G111 M113 S115 Y135 T136 L139	R104-N108 WeakPolarHBondContact O-CB 3.29Å; R104-N108 PolarHBondContact O-N 3.47Å; R104-N108 PolarHBondContact O-ND2 3.24Å; E105-N108 PolarHBondContact O-N 3.38Å; E106-N108 VanDerWaalsContact C-N 3.34Å; E106-N108 PolarHBondContact O-N 3.29Å; N108-G111 PolarHBondContact O-N 2.75Å; N108-G111 VanDerWaalsContact O-N 3.13Å; N108-M113 WeakPolarHBondContact CA-O 3.4Å; N108-M113 WeakPolarHBondContact ND2-CE 3.46Å; N108-M113 PolarHBondContact OD1-O 3.49Å; N108-S115 PolarHBondContact ND2-OG 3.34Å; N108-S115 PolarHBondContact OD1-N 2.89Å; N108-Y135 HydrophobicContact CB-CD1 4.06Å; N108-Y135 HydrophobicContact CB-CE1 4.29Å; N108-T136 PolarHBondContact OD1-OG1 2.83Å; N108-L139 HydrophobicContact CB-CD1 3.65Å
109	R	82.1	Confident	84.5	Confident	80 Å²	80	37.4 Å²	37.4	30%	0.302	18%	0.184	S	C	.	.	H	α-helix	trans	-65.4	-42.6	178	-73.1	-168.2	-176.2	-119.9	8.3	112.3	V84 E105 E106 G111 L139	V84-R109 VanDerWaalsContact CG1-NH1 3.33Å; E105-R109 HydrophobicContact CG-CG 4.28Å; E105-R109 WeakPolarHBondContact O-CB 3.41Å; E105-R109 WeakPolarHBondContact O-CG 3.46Å; E105-R109 PolarHBondContact O-N 3.06Å; E105-R109 IonicContact OE1-CZ 2.81Å; E105-R109 VanDerWaalsContact OE1-CZ 3.23Å; E105-R109 IonicContact OE1-NE 3.57Å; E105-R109 PolarHBondContact OE1-NE 3Å; E105-R109 IonicContact OE1-NH2 2.67Å; E105-R109 PolarHBondContact OE1-NH2 3.38Å; E106-R109 PolarHBondContact O-N 3Å; R109-G111 PolarHBondContact O-N 2.92Å; R109-L139 HydrophobicContact CG-CD1 4.18Å
110	S	75.4	Confident	84.8	Confident	58 Å²	58	37 Å²	37	41%	0.406	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.5	174.4	59.6	0	0	0	0	113.3	E106 A107 K112	E106-S110 WeakPolarHBondContact O-CB 3.38Å; E106-S110 PolarHBondContact O-N 3.17Å; E106-S110 PolarHBondContact O-OG 3.32Å; A107-S110 WeakPolarHBondContact CA-OG 3.48Å; A107-S110 PolarHBondContact O-OG 3.13Å; S110-K112 PolarHBondContact O-N 3.46Å; S110-K112 WeakPolarHBondContact OG-CG 3.45Å
111	G	74.6	Confident	85.1	Confident	7 Å²	7	37.2 Å²	37.2	7%	0.072	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.4	14	-179.9	0	0	0	0	0	114.4	A107 N108 R109 R195	A107-G111 PolarHBondContact O-N 3.23Å; N108-G111 PolarHBondContact O-N 2.75Å; N108-G111 VanDerWaalsContact O-N 3.13Å; R109-G111 PolarHBondContact O-N 2.92Å; G111-R195 PolarHBondContact O-NH1 2.83Å
112	K	79.3	Confident	85.2	Confident	131 Å²	131	42.1 Å²	42.1	57%	0.57	20%	0.199	S	C	*	.	S	Bend	trans	-68.8	-26.3	170	-68.2	177.1	-178.5	173.9	0	111.7	A107 S110 V232	A107-K112 PolarHBondContact O-N 3.41Å; S110-K112 PolarHBondContact O-N 3.46Å; S110-K112 WeakPolarHBondContact OG-CG 3.45Å; K112-V232 PolarHBondContact O-N 3.02Å
113	M	81.4	Confident	85.3	Confident	32 Å²	32	43 Å²	43	16%	0.158	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150	179.2	-175.8	165.1	70.7	0	0	109.8	R104 A107 N108 D229 R230	R104-M113 HydrophobicContact CB-CE 3.64Å; R104-M113 HydrophobicContact CG-CE 3.54Å; A107-M113 HydrophobicContact CB-CB 3.8Å; A107-M113 HydrophobicContact CB-CE 3.81Å; A107-M113 PolarHBondContact O-N 2.85Å; N108-M113 WeakPolarHBondContact CA-O 3.4Å; N108-M113 WeakPolarHBondContact ND2-CE 3.46Å; N108-M113 PolarHBondContact OD1-O 3.49Å; M113-D229 HydrophobicContact SD-CB 4.1Å; M113-R230 CarbonylContact C-O 3.52Å; M113-R230 WeakPolarHBondContact CA-O 3.46Å; M113-R230 WeakPolarHBondContact CG-O 3.45Å
114	T	84.1	Confident	85.3	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.006	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.8	165.2	51.4	0	0	0	0	108.8	R230 V232	T114-R230 PolarHBondContact N-O 2.87Å; T114-R230 WeakPolarHBondContact O-CB 3.37Å; T114-R230 PolarHBondContact O-N 3.47Å; T114-V232 HydrophobicContact CG2-CG2 4.21Å
115	S	87.1	Confident	85.3	Confident	1 Å²	1	47.6 Å²	47.6	1%	0.007	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.3	179.5	-58	0	0	0	0	110.3	N108 Y135 Y228 D229	N108-S115 PolarHBondContact ND2-OG 3.34Å; N108-S115 PolarHBondContact OD1-N 2.89Å; S115-Y135 VanDerWaalsContact O-CB 3.27Å; S115-Y135 WeakPolarHBondContact O-CB 3.5Å; S115-Y135 PolarHBondContact O-N 3.44Å; S115-Y228 CarbonylContact C-O 3.53Å; S115-Y228 WeakPolarHBondContact CA-O 3.25Å; S115-D229 WeakPolarHBondContact CB-OD1 3.47Å; S115-D229 PolarHBondContact OG-OD1 3.18Å
116	V	89.1	Confident	85.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.2	170.5	178.6	0	0	0	0	108.5	Y132 I133 L161 F179 Y228	V116-Y132 HydrophobicContact CG1-CD1 4.06Å; V116-I133 CarbonylContact C-O 3.42Å; V116-I133 WeakPolarHBondContact CA-O 3.34Å; V116-L161 HydrophobicContact CG1-CD1 3.98Å; V116-L161 HydrophobicContact CG2-CD1 4.2Å; V116-F179 HydrophobicContact CG2-CD2 4Å; V116-F179 HydrophobicContact CG2-CE1 4.16Å; V116-F179 HydrophobicContact CG2-CE2 3.54Å; V116-F179 HydrophobicContact CG2-CG 4.49Å; V116-F179 HydrophobicContact CG2-CZ 3.63Å; V116-Y228 PolarHBondContact N-O 2.8Å; V116-Y228 PolarHBondContact O-N 3.14Å
117	I	91.1	Very high	85.8	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.9	-179.8	-48.7	170.8	0	0	0	108	F97 L101 I119 Y132 I133 Y135 L154 V225 L227	F97-I117 HydrophobicContact CE2-CG2 3.74Å; F97-I117 HydrophobicContact CZ-CG2 3.88Å; L101-I117 HydrophobicContact CD2-CD1 3.59Å; L101-I117 HydrophobicContact CD2-CG1 4.19Å; I117-I119 HydrophobicContact CG2-CD1 4.05Å; I117-I119 HydrophobicContact CG2-CG1 3.68Å; I117-Y132 CarbonylContact O-C 3.58Å; I117-Y132 VanDerWaalsContact O-CA 3.31Å; I117-Y132 WeakPolarHBondContact O-CA 3.42Å; I117-I133 HydrophobicContact CB-CB 4.3Å; I117-I133 PolarHBondContact N-O 3.22Å; I117-I133 PolarHBondContact O-N 3.25Å; I117-Y135 HydrophobicContact CD1-CD2 3.68Å; I117-Y135 HydrophobicContact CD1-CE2 4.49Å; I117-Y135 HydrophobicContact CD1-CG 3.89Å; I117-Y135 HydrophobicContact CG1-CG 4.45Å; I117-L154 HydrophobicContact CD1-CD2 3.9Å; I117-V225 HydrophobicContact CG2-CG1 4.37Å; I117-L227 HydrophobicContact CB-CD2 4.03Å; I117-L227 HydrophobicContact CD1-CD2 4.5Å; I117-L227 HydrophobicContact CG1-CD2 3.61Å; I117-L227 HydrophobicContact CG2-CD2 3.84Å
118	F	90.6	Very high	86.3	Confident	21 Å²	21	46.5 Å²	46.5	9%	0.092	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	129.7	164.1	175.7	-103.8	0	0	0	109.3	R120 G131 Y132 H224 V225 M226 Y228	F118-R120 HydrophobicContact CE1-CB 4.09Å; F118-R120 HydrophobicContact CZ-CB 4.07Å; F118-G131 WeakPolarHBondContact CA-O 3.37Å; F118-G131 WeakPolarHBondContact CD2-O 3.27Å; F118-Y132 HydrophobicContact CB-CD1 3.87Å; F118-Y132 HydrophobicContact CB-CE1 3.7Å; F118-Y132 AromaticContact CD2-CD1 3.89Å; F118-Y132 HydrophobicContact CD2-CD1 3.89Å; F118-Y132 HydrophobicContact CD2-CD2 4.15Å; F118-Y132 AromaticContact CD2-CE1 3.49Å; F118-Y132 HydrophobicContact CD2-CE1 3.49Å; F118-Y132 VanDerWaalsContact CD2-CE1 3.49Å; F118-Y132 AromaticContact CD2-CE2 3.78Å; F118-Y132 HydrophobicContact CD2-CE2 3.78Å; F118-Y132 HydrophobicContact CD2-CG 4.21Å; F118-Y132 AromaticContact CD2-CZ 3.43Å; F118-Y132 VanDerWaalsContact CD2-CZ 3.43Å; F118-Y132 HydrophobicContact CE2-CE1 4.44Å; F118-Y132 HydrophobicContact CE2-CE2 4.08Å; F118-Y132 AromaticContact CE2-CZ 3.95Å; F118-Y132 HydrophobicContact CG-CD1 4.35Å; F118-Y132 AromaticContact CG-CE1 3.91Å; F118-Y132 HydrophobicContact CG-CE1 3.91Å; F118-H224 AromaticContact CE1-ND1 3.83Å; F118-V225 VanDerWaalsContact O-CA 3.28Å; F118-V225 WeakPolarHBondContact O-CA 3.13Å; F118-M226 HydrophobicContact CB-CB 4.13Å; F118-M226 HydrophobicContact CD1-CB 4.43Å; F118-M226 HydrophobicContact CD1-CE 3.77Å; F118-M226 HydrophobicContact CE1-CE 4.05Å; F118-M226 PolarHBondContact N-O 2.88Å; F118-M226 PolarHBondContact O-N 3.44Å; F118-Y228 HydrophobicContact CB-CE2 4.02Å
119	I	91.6	Very high	86.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	134.5	173.9	-57.4	-176.5	0	0	0	108	F97 I117 D121 S130 G131 I133 L154 Y222 V225	F97-I119 HydrophobicContact CZ-CD1 4.14Å; I117-I119 HydrophobicContact CG2-CD1 4.05Å; I117-I119 HydrophobicContact CG2-CG1 3.68Å; I119-D121 HydrophobicContact CG2-CB 4.29Å; I119-S130 CarbonylContact O-C 3.57Å; I119-S130 WeakPolarHBondContact O-CA 3.21Å; I119-G131 PolarHBondContact N-O 3.12Å; I119-G131 PolarHBondContact O-N 2.87Å; I119-I133 HydrophobicContact CD1-CD1 3.87Å; I119-I133 HydrophobicContact CG1-CD1 4.36Å; I119-L154 HydrophobicContact CD1-CB 4.34Å; I119-L154 HydrophobicContact CD1-CD2 4.05Å; I119-L154 HydrophobicContact CD1-CG 3.95Å; I119-L154 WeakPolarHBondContact CD1-O 3.31Å; I119-Y222 HydrophobicContact CD1-CE1 4.43Å; I119-Y222 HydrophobicContact CG2-CD1 3.6Å; I119-Y222 HydrophobicContact CG2-CE1 3.91Å; I119-Y222 HydrophobicContact CG2-CG 4.3Å; I119-V225 HydrophobicContact CG1-CG2 4.38Å
120	R	91.4	Very high	87.2	Confident	86 Å²	86	43.3 Å²	43.3	33%	0.325	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	121.8	164.9	175.9	-176	-177.1	-178.3	1.8	108.4	F118 E128 V129 V223 H224	F118-R120 HydrophobicContact CE1-CB 4.09Å; F118-R120 HydrophobicContact CZ-CB 4.07Å; R120-E128 IonicContact CZ-OE1 2.76Å; R120-E128 IonicContact NE-OE1 3.9Å; R120-E128 PolarHBondContact NE-OE1 3.5Å; R120-E128 IonicContact NH2-OE1 3.91Å; R120-E128 PolarHBondContact NH2-OE1 2.98Å; R120-V129 WeakPolarHBondContact CA-O 3.31Å; R120-V223 WeakPolarHBondContact O-CB 3.5Å; R120-V223 PolarHBondContact O-N 3.37Å; R120-H224 HydrophobicContact CB-CB 4.21Å; R120-H224 PolarHBondContact N-O 3.43Å; R120-H224 PolarHBondContact O-N 3.07Å; R120-H224 VanDerWaalsContact O-N 3.16Å
121	D	92	Very high	87.9	Confident	11 Å²	11	40.6 Å²	40.6	6%	0.059	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	176.7	-178	-169.8	36.2	0	0	0	112.1	I119 V129 R153 M155 Y222	I119-D121 HydrophobicContact CG2-CB 4.29Å; D121-V129 PolarHBondContact N-O 2.78Å; D121-V129 WeakPolarHBondContact O-CG2 3.15Å; D121-V129 PolarHBondContact O-N 3.15Å; D121-R153 IonicContact OD1-NH2 3.27Å; D121-R153 IonicContact OD2-CZ 3.19Å; D121-R153 VanDerWaalsContact OD2-CZ 3.27Å; D121-R153 IonicContact OD2-NH1 2.77Å; D121-R153 PolarHBondContact OD2-NH1 2.98Å; D121-R153 IonicContact OD2-NH2 3.92Å; D121-R153 PolarHBondContact OD2-NH2 2.78Å; D121-M155 HydrophobicContact CB-CE 4.09Å; D121-M155 HydrophobicContact CB-SD 4.16Å; D121-Y222 HydrophobicContact CB-CD1 3.85Å
122	Y	89.3	Confident	88.7	Confident	107 Å²	107	41.9 Å²	41.9	42%	0.42	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	132.7	177.8	-60.6	-88.5	0	0	0	112.1	Q127 E128 V223	Y122-Q127 CarbonylContact C-O 3.55Å; Y122-Q127 WeakPolarHBondContact CA-O 3.35Å; Y122-E128 HydrophobicContact CD1-CB 3.9Å; Y122-E128 HydrophobicContact CD1-CG 4.46Å; Y122-E128 HydrophobicContact CE1-CB 3.61Å; Y122-E128 HydrophobicContact CE1-CG 4.02Å; Y122-E128 PolarHBondContact OH-OE2 2.77Å; Y122-V223 HydrophobicContact CD2-CG2 4.11Å; Y122-V223 HydrophobicContact CE2-CG2 3.84Å
123	N	87.9	Confident	89.3	Confident	37 Å²	37	35.7 Å²	35.7	20%	0.198	19%	0.189	C	C	.	.			trans	-71.3	175.1	171.3	75.4	7.7	0	0	0	111.7	L125 G126 Q127	N123-L125 PolarHBondContact O-N 3.41Å; N123-L125 VanDerWaalsContact O-N 3.09Å; N123-L125 VanDerWaalsContact OD1-C 3.31Å; N123-L125 VanDerWaalsContact OD1-CA 3.3Å; N123-L125 WeakPolarHBondContact OD1-CA 3.46Å; N123-L125 VanDerWaalsContact OD1-CB 3.32Å; N123-L125 WeakPolarHBondContact OD1-CB 3.35Å; N123-L125 PolarHBondContact OD1-N 3.48Å; N123-G126 PolarHBondContact O-N 2.75Å; N123-G126 PolarHBondContact OD1-N 3.33Å; N123-G126 VanDerWaalsContact OD1-N 3.14Å; N123-Q127 PolarHBondContact N-O 2.91Å; N123-Q127 PolarHBondContact ND2-OE1 2.86Å; N123-Q127 WeakPolarHBondContact OD1-CB 3.33Å; N123-Q127 PolarHBondContact OD1-N 3.46Å; N123-Q127 PolarHBondContact OD1-O 3.18Å
124	T	85.6	Confident	89.7	Confident	151 Å²	151	34.3 Å²	34.3	93%	0.926	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-17.9	178.7	51.6	0	0	0	0	114	G126	T124-G126 VanDerWaalsContact C-N 3.32Å
125	L	86.1	Confident	90	Very high	128 Å²	128	34.3 Å²	34.3	67%	0.67	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	6.4	175	-57.3	173.5	0	0	0	112.5	N123 Q127	N123-L125 PolarHBondContact O-N 3.41Å; N123-L125 VanDerWaalsContact O-N 3.09Å; N123-L125 VanDerWaalsContact OD1-C 3.31Å; N123-L125 VanDerWaalsContact OD1-CA 3.3Å; N123-L125 WeakPolarHBondContact OD1-CA 3.46Å; N123-L125 VanDerWaalsContact OD1-CB 3.32Å; N123-L125 WeakPolarHBondContact OD1-CB 3.35Å; N123-L125 PolarHBondContact OD1-N 3.48Å; L125-Q127 HydrophobicContact CB-CG 4.07Å; L125-Q127 PolarHBondContact O-N 3.25Å
126	G	87.5	Confident	90	Very high	50 Å²	50	34.3 Å²	34.3	52%	0.515	18%	0.182	S	C	.	.	S	Bend	trans	68.8	18.4	-176.8	0	0	0	0	0	114	N123 T124	N123-G126 PolarHBondContact O-N 2.75Å; N123-G126 PolarHBondContact OD1-N 3.33Å; N123-G126 VanDerWaalsContact OD1-N 3.14Å; T124-G126 VanDerWaalsContact C-N 3.32Å
127	Q	89.8	Confident	89.9	Confident	37 Å²	37	37 Å²	37	17%	0.173	20%	0.195	C	C	.	.			trans	-89	131.9	175.1	-48	178	-37.1	0	0	109.4	Y122 N123 L125 V129 N165 K167	Y122-Q127 CarbonylContact C-O 3.55Å; Y122-Q127 WeakPolarHBondContact CA-O 3.35Å; N123-Q127 PolarHBondContact N-O 2.91Å; N123-Q127 PolarHBondContact ND2-OE1 2.86Å; N123-Q127 WeakPolarHBondContact OD1-CB 3.33Å; N123-Q127 PolarHBondContact OD1-N 3.46Å; N123-Q127 PolarHBondContact OD1-O 3.18Å; L125-Q127 HydrophobicContact CB-CG 4.07Å; L125-Q127 PolarHBondContact O-N 3.25Å; Q127-V129 PolarHBondContact O-N 2.96Å; Q127-N165 PolarHBondContact OE1-ND2 2.91Å; Q127-K167 HydrophobicContact CB-CB 4.23Å; Q127-K167 HydrophobicContact CB-CD 4.32Å; Q127-K167 HydrophobicContact CG-CB 4.46Å; Q127-K167 HydrophobicContact CG-CD 3.78Å
128	E	92.4	Very high	89.7	Confident	38 Å²	38	39.1 Å²	39.1	18%	0.178	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	125.8	176	-168.1	179.8	157.3	0	0	110.4	R120 Y122 W166	R120-E128 IonicContact CZ-OE1 2.76Å; R120-E128 IonicContact NE-OE1 3.9Å; R120-E128 PolarHBondContact NE-OE1 3.5Å; R120-E128 IonicContact NH2-OE1 3.91Å; R120-E128 PolarHBondContact NH2-OE1 2.98Å; Y122-E128 HydrophobicContact CD1-CB 3.9Å; Y122-E128 HydrophobicContact CD1-CG 4.46Å; Y122-E128 HydrophobicContact CE1-CB 3.61Å; Y122-E128 HydrophobicContact CE1-CG 4.02Å; Y122-E128 PolarHBondContact OH-OE2 2.77Å; E128-W166 HydrophobicContact CB-CB 4.1Å; E128-W166 HydrophobicContact CB-CG 4.36Å; E128-W166 HydrophobicContact CG-CB 4.45Å; E128-W166 HydrophobicContact CG-CG 4.2Å; E128-W166 PolarHBondContact O-N 2.76Å
129	V	93	Very high	89.4	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.012	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145.2	179.1	-61.6	0	0	0	0	109.9	R120 D121 Q127 M155 P156 Y163 Y164 N165	R120-V129 WeakPolarHBondContact CA-O 3.31Å; D121-V129 PolarHBondContact N-O 2.78Å; D121-V129 WeakPolarHBondContact O-CG2 3.15Å; D121-V129 PolarHBondContact O-N 3.15Å; Q127-V129 PolarHBondContact O-N 2.96Å; V129-M155 HydrophobicContact CG2-CE 3.48Å; V129-M155 VanDerWaalsContact CG2-CE 3.48Å; V129-P156 HydrophobicContact CG2-CG 4.14Å; V129-Y163 HydrophobicContact CB-CE2 3.95Å; V129-Y163 HydrophobicContact CG1-CE2 3.88Å; V129-Y164 CarbonylContact C-O 3.56Å; V129-Y164 VanDerWaalsContact CA-O 3.31Å; V129-Y164 WeakPolarHBondContact CA-O 3.47Å; V129-N165 HydrophobicContact CG1-CB 4.28Å
130	S	92.2	Very high	89	Confident	11 Å²	11	44.4 Å²	44.4	8%	0.077	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	146.7	172.6	56.4	0	0	0	0	110.6	I119 Y163 Y164 W166	I119-S130 CarbonylContact O-C 3.57Å; I119-S130 WeakPolarHBondContact O-CA 3.21Å; S130-Y163 CarbonylContact O-C 3.6Å; S130-Y164 PolarHBondContact N-O 2.9Å; S130-Y164 PolarHBondContact O-N 2.97Å; S130-W166 PolarHBondContact OG-NE1 3.08Å
131	G	90.9	Very high	88.5	Confident	2 Å²	2	44 Å²	44	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168	166.9	178.6	0	0	0	0	0	114.2	F118 I119 C162	F118-G131 WeakPolarHBondContact CA-O 3.37Å; F118-G131 WeakPolarHBondContact CD2-O 3.27Å; I119-G131 PolarHBondContact N-O 3.12Å; I119-G131 PolarHBondContact O-N 2.87Å; G131-C162 CarbonylContact C-O 3.56Å; G131-C162 WeakPolarHBondContact CA-O 3.15Å
132	Y	90.6	Very high	88	Confident	33 Å²	33	46.2 Å²	46.2	13%	0.129	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.1	175.3	-66.5	-87.3	0	0	0	109	V116 I117 F118 D160 L161 C162 L189 F191 P202 Y228	V116-Y132 HydrophobicContact CG1-CD1 4.06Å; I117-Y132 CarbonylContact O-C 3.58Å; I117-Y132 VanDerWaalsContact O-CA 3.31Å; I117-Y132 WeakPolarHBondContact O-CA 3.42Å; F118-Y132 HydrophobicContact CB-CD1 3.87Å; F118-Y132 HydrophobicContact CB-CE1 3.7Å; F118-Y132 AromaticContact CD2-CD1 3.89Å; F118-Y132 HydrophobicContact CD2-CD1 3.89Å; F118-Y132 HydrophobicContact CD2-CD2 4.15Å; F118-Y132 AromaticContact CD2-CE1 3.49Å; F118-Y132 HydrophobicContact CD2-CE1 3.49Å; F118-Y132 VanDerWaalsContact CD2-CE1 3.49Å; F118-Y132 AromaticContact CD2-CE2 3.78Å; F118-Y132 HydrophobicContact CD2-CE2 3.78Å; F118-Y132 HydrophobicContact CD2-CG 4.21Å; F118-Y132 AromaticContact CD2-CZ 3.43Å; F118-Y132 VanDerWaalsContact CD2-CZ 3.43Å; F118-Y132 HydrophobicContact CE2-CE1 4.44Å; F118-Y132 HydrophobicContact CE2-CE2 4.08Å; F118-Y132 AromaticContact CE2-CZ 3.95Å; F118-Y132 HydrophobicContact CG-CD1 4.35Å; F118-Y132 AromaticContact CG-CE1 3.91Å; F118-Y132 HydrophobicContact CG-CE1 3.91Å; Y132-D160 WeakPolarHBondContact O-CB 3.38Å; Y132-L161 VanDerWaalsContact O-CB 3.31Å; Y132-L161 WeakPolarHBondContact O-CB 3.5Å; Y132-L161 PolarHBondContact O-N 3.03Å; Y132-C162 HydrophobicContact CD2-CB 4.02Å; Y132-C162 PolarHBondContact N-O 3Å; Y132-C162 PolarHBondContact O-N 2.64Å; Y132-L189 HydrophobicContact CD2-CD2 3.83Å; Y132-L189 HydrophobicContact CE2-CD2 3.57Å; Y132-F191 AromaticContact CD1-CE2 3.65Å; Y132-F191 HydrophobicContact CD1-CE2 3.65Å; Y132-F191 AromaticContact CD1-CZ 3.94Å; Y132-F191 HydrophobicContact CD1-CZ 3.94Å; Y132-F191 HydrophobicContact CD2-CE2 4.07Å; Y132-F191 AromaticContact CD2-CZ 3.66Å; Y132-F191 HydrophobicContact CD2-CZ 3.66Å; Y132-F191 HydrophobicContact CE1-CE2 4.03Å; Y132-F191 HydrophobicContact CE2-CE2 4.42Å; Y132-F191 HydrophobicContact CE2-CZ 4.32Å; Y132-F191 AromaticContact CG-CE2 3.68Å; Y132-F191 HydrophobicContact CG-CE2 3.68Å; Y132-F191 AromaticContact CG-CZ 3.44Å; Y132-F191 HydrophobicContact CG-CZ 3.44Å; Y132-F191 VanDerWaalsContact CG-CZ 3.44Å; Y132-P202 HydrophobicContact CD1-CB 4.31Å; Y132-P202 HydrophobicContact CE1-CB 3.44Å; Y132-P202 VanDerWaalsContact CE1-CB 3.44Å; Y132-P202 HydrophobicContact CE1-CG 4.27Å; Y132-Y228 HydrophobicContact CE1-CE2 4.02Å
133	I	91	Very high	87.7	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.1	-176.6	-56.3	165	0	0	0	107.7	V116 I117 I119 Y135 R138 L154 P156 D160	V116-I133 CarbonylContact C-O 3.42Å; V116-I133 WeakPolarHBondContact CA-O 3.34Å; I117-I133 HydrophobicContact CB-CB 4.3Å; I117-I133 PolarHBondContact N-O 3.22Å; I117-I133 PolarHBondContact O-N 3.25Å; I119-I133 HydrophobicContact CD1-CD1 3.87Å; I119-I133 HydrophobicContact CG1-CD1 4.36Å; I133-Y135 PolarHBondContact O-N 3.36Å; I133-R138 HydrophobicContact CG2-CB 4.22Å; I133-R138 HydrophobicContact CG2-CG 4.28Å; I133-L154 HydrophobicContact CD1-CD1 4.47Å; I133-L154 HydrophobicContact CD1-CD2 4.5Å; I133-L154 HydrophobicContact CD1-CG 4.21Å; I133-P156 HydrophobicContact CD1-CB 4.29Å; I133-P156 HydrophobicContact CG1-CB 4.33Å; I133-D160 HydrophobicContact CG1-CB 4.19Å
134	D	90.5	Very high	87.6	Confident	4 Å²	4	44 Å²	44	2%	0.021	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	106.4	167.3	177.4	-13.7	0	0	0	108.5	T136 H137 R138 L161 S176 N178 F179	D134-T136 VanDerWaalsContact C-N 3.33Å; D134-T136 PolarHBondContact O-N 3.21Å; D134-T136 WeakPolarHBondContact OD1-CA 3.4Å; D134-T136 WeakPolarHBondContact OD1-CB 3.47Å; D134-T136 PolarHBondContact OD1-N 3.5Å; D134-H137 HydrophobicContact CB-CB 3.81Å; D134-H137 VanDerWaalsContact CG-CB 3.41Å; D134-H137 PolarHBondContact O-N 2.96Å; D134-H137 PolarHBondContact OD1-N 2.85Å; D134-H137 WeakPolarHBondContact OD2-CB 3.11Å; D134-R138 WeakPolarHBondContact O-CB 3.37Å; D134-R138 PolarHBondContact O-N 2.99Å; D134-L161 HydrophobicContact CB-CD1 3.93Å; D134-L161 HydrophobicContact CB-CD2 4.37Å; D134-L161 HydrophobicContact CB-CG 4.05Å; D134-S176 PolarHBondContact OD2-OG 2.73Å; D134-N178 WeakPolarHBondContact OD2-CB 3.44Å; D134-N178 PolarHBondContact OD2-ND2 3.2Å; D134-F179 HydrophobicContact CB-CD2 4.42Å
135	Y	89.8	Confident	87.4	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-41	-177.5	-174.7	-139.3	0	0	0	111.7	L101 R104 N108 S115 I117 I133 H137 R138 L139 F144	L101-Y135 HydrophobicContact CD2-CD1 4.46Å; L101-Y135 HydrophobicContact CD2-CD2 4.3Å; L101-Y135 HydrophobicContact CD2-CE1 4.21Å; L101-Y135 HydrophobicContact CD2-CE2 4.07Å; L101-Y135 PolarHBondContact O-OH 3.48Å; R104-Y135 HydrophobicContact CB-CE1 4.08Å; N108-Y135 HydrophobicContact CB-CD1 4.06Å; N108-Y135 HydrophobicContact CB-CE1 4.29Å; S115-Y135 VanDerWaalsContact O-CB 3.27Å; S115-Y135 WeakPolarHBondContact O-CB 3.5Å; S115-Y135 PolarHBondContact O-N 3.44Å; I117-Y135 HydrophobicContact CD1-CD2 3.68Å; I117-Y135 HydrophobicContact CD1-CE2 4.49Å; I117-Y135 HydrophobicContact CD1-CG 3.89Å; I117-Y135 HydrophobicContact CG1-CG 4.45Å; I133-Y135 PolarHBondContact O-N 3.36Å; Y135-H137 VanDerWaalsContact C-N 3.35Å; Y135-H137 PolarHBondContact O-N 3.47Å; Y135-R138 PolarHBondContact O-N 3.46Å; Y135-L139 HydrophobicContact CD1-CD1 3.84Å; Y135-L139 HydrophobicContact CD2-CD1 4.01Å; Y135-L139 HydrophobicContact CD2-CG 3.89Å; Y135-L139 HydrophobicContact CE1-CD1 3.59Å; Y135-L139 HydrophobicContact CE1-CG 4.38Å; Y135-L139 HydrophobicContact CE2-CD1 3.75Å; Y135-L139 HydrophobicContact CE2-CD2 3.8Å; Y135-L139 HydrophobicContact CE2-CG 3.6Å; Y135-L139 HydrophobicContact CG-CD1 4.05Å; Y135-L139 HydrophobicContact CG-CG 4.39Å; Y135-L139 WeakPolarHBondContact O-CB 3.44Å; Y135-L139 VanDerWaalsContact O-CG 3.29Å; Y135-L139 WeakPolarHBondContact O-CG 3.49Å; Y135-L139 PolarHBondContact O-N 2.76Å; Y135-F144 HydrophobicContact CD2-CE1 4.02Å; Y135-F144 HydrophobicContact CD2-CZ 4.05Å; Y135-F144 AromaticContact CE2-CD1 3.99Å; Y135-F144 HydrophobicContact CE2-CD1 3.99Å; Y135-F144 AromaticContact CE2-CE1 3.51Å; Y135-F144 HydrophobicContact CE2-CE1 3.51Å; Y135-F144 AromaticContact CE2-CZ 3.94Å; Y135-F144 HydrophobicContact CE2-CZ 3.94Å
136	T	87.5	Confident	87.2	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-62.6	-43.5	179.1	-49.2	0	0	0	0	111.1	N108 D134 K140	N108-T136 PolarHBondContact OD1-OG1 2.83Å; D134-T136 VanDerWaalsContact C-N 3.33Å; D134-T136 PolarHBondContact O-N 3.21Å; D134-T136 WeakPolarHBondContact OD1-CA 3.4Å; D134-T136 WeakPolarHBondContact OD1-CB 3.47Å; D134-T136 PolarHBondContact OD1-N 3.5Å; T136-K140 WeakPolarHBondContact O-CG 3.31Å; T136-K140 PolarHBondContact O-N 2.95Å
137	H	86.3	Confident	87.2	Confident	57 Å²	57	35.4 Å²	35.4	26%	0.264	17%	0.174	S	C	.	.	H	α-helix	trans	-66.9	-41	176.6	-178.9	-118.4	0	0	0	111.6	D134 Y135 K140 T141 P177	D134-H137 HydrophobicContact CB-CB 3.81Å; D134-H137 VanDerWaalsContact CG-CB 3.41Å; D134-H137 PolarHBondContact O-N 2.96Å; D134-H137 PolarHBondContact OD1-N 2.85Å; D134-H137 WeakPolarHBondContact OD2-CB 3.11Å; Y135-H137 VanDerWaalsContact C-N 3.35Å; Y135-H137 PolarHBondContact O-N 3.47Å; H137-K140 PolarHBondContact O-N 3.18Å; H137-T141 WeakPolarHBondContact O-CG2 3.39Å; H137-T141 PolarHBondContact O-N 2.71Å; H137-T141 VanDerWaalsContact O-N 3.12Å; H137-T141 PolarHBondContact O-OG1 2.99Å; H137-P177 VanDerWaalsContact CD2-CD 3.44Å; H137-P177 WeakPolarHBondContact CD2-CD 3.34Å
138	R	86.8	Confident	86.9	Confident	44 Å²	44	34 Å²	34	17%	0.166	17%	0.167	C	C	.	.	H	α-helix	trans	-65.7	-42.5	179.9	-151	60.9	162.5	163.4	-11.3	111.9	I133 D134 Y135 K140 T141 Q142 F144 D160	I133-R138 HydrophobicContact CG2-CB 4.22Å; I133-R138 HydrophobicContact CG2-CG 4.28Å; D134-R138 WeakPolarHBondContact O-CB 3.37Å; D134-R138 PolarHBondContact O-N 2.99Å; Y135-R138 PolarHBondContact O-N 3.46Å; R138-K140 PolarHBondContact O-N 3.46Å; R138-T141 PolarHBondContact O-N 2.98Å; R138-T141 PolarHBondContact O-OG1 3.01Å; R138-Q142 PolarHBondContact O-N 3.27Å; R138-F144 VanDerWaalsContact C-CE2 3.43Å; R138-F144 HydrophobicContact CB-CE2 3.81Å; R138-F144 HydrophobicContact CB-CZ 3.79Å; R138-F144 HydrophobicContact CG-CE2 3.67Å; R138-F144 HydrophobicContact CG-CZ 3.64Å; R138-F144 WeakPolarHBondContact O-CE2 3.33Å; R138-D160 IonicContact CZ-OD1 3Å; R138-D160 IonicContact NE-OD1 3.27Å
139	L	85.4	Confident	86.2	Confident	9 Å²	9	35.1 Å²	35.1	5%	0.047	18%	0.178	C	C	.	.	H	α-helix	trans	-59.6	-27.6	176.1	-78.8	169	0	0	0	113.5	E105 N108 R109 Y135 F144	E105-L139 HydrophobicContact CG-CD2 4.07Å; N108-L139 HydrophobicContact CB-CD1 3.65Å; R109-L139 HydrophobicContact CG-CD1 4.18Å; Y135-L139 HydrophobicContact CD1-CD1 3.84Å; Y135-L139 HydrophobicContact CD2-CD1 4.01Å; Y135-L139 HydrophobicContact CD2-CG 3.89Å; Y135-L139 HydrophobicContact CE1-CD1 3.59Å; Y135-L139 HydrophobicContact CE1-CG 4.38Å; Y135-L139 HydrophobicContact CE2-CD1 3.75Å; Y135-L139 HydrophobicContact CE2-CD2 3.8Å; Y135-L139 HydrophobicContact CE2-CG 3.6Å; Y135-L139 HydrophobicContact CG-CD1 4.05Å; Y135-L139 HydrophobicContact CG-CG 4.39Å; Y135-L139 WeakPolarHBondContact O-CB 3.44Å; Y135-L139 VanDerWaalsContact O-CG 3.29Å; Y135-L139 WeakPolarHBondContact O-CG 3.49Å; Y135-L139 PolarHBondContact O-N 2.76Å; L139-F144 HydrophobicContact CD2-CB 4.03Å; L139-F144 HydrophobicContact CD2-CD1 4.09Å; L139-F144 HydrophobicContact CD2-CD2 3.67Å; L139-F144 HydrophobicContact CD2-CE2 4.13Å; L139-F144 HydrophobicContact CD2-CG 3.64Å; L139-F144 HydrophobicContact CG-CD2 4.29Å; L139-F144 HydrophobicContact CG-CE2 4.28Å
140	K	82.4	Confident	85.5	Confident	124 Å²	124	37.8 Å²	37.8	54%	0.539	21%	0.206	S	C	.	.	H	α-helix	trans	-85.5	-30.8	177.6	-70.5	-179.9	178.6	-171.8	0	113.2	T136 H137 R138	T136-K140 WeakPolarHBondContact O-CG 3.31Å; T136-K140 PolarHBondContact O-N 2.95Å; H137-K140 PolarHBondContact O-N 3.18Å; R138-K140 PolarHBondContact O-N 3.46Å
141	T	81.7	Confident	85	Confident	78 Å²	78	46 Å²	46	48%	0.479	24%	0.241	S	C	.	.	H	α-helix	trans	-97.2	-18.9	-173.1	51.5	0	0	0	0	113.3	H137 R138	H137-T141 WeakPolarHBondContact O-CG2 3.39Å; H137-T141 PolarHBondContact O-N 2.71Å; H137-T141 VanDerWaalsContact O-N 3.12Å; H137-T141 PolarHBondContact O-OG1 2.99Å; R138-T141 PolarHBondContact O-N 2.98Å; R138-T141 PolarHBondContact O-OG1 3.01Å
142	Q	81.9	Confident	84.7	Confident	57 Å²	57	51 Å²	51	27%	0.266	26%	0.262	S	S	.	.	S	Bend	trans	-134.6	151.6	-178.2	-65.8	-163.8	-12.2	0	0	112	R138 F144 Y147	R138-Q142 PolarHBondContact O-N 3.27Å; Q142-F144 HydrophobicContact CB-CE2 4.5Å; Q142-Y147 PolarHBondContact OE1-OH 3.46Å
143	D	82.5	Confident	84.5	Confident	97 Å²	97	54.8 Å²	54.8	52%	0.519	28%	0.276	S	S	.	.			trans	-75.1	126.2	168.8	-178.5	17.5	0	0	0	110.7	E145	D143-E145 WeakPolarHBondContact OD1-CB 3.41Å; D143-E145 PolarHBondContact OD1-N 2.68Å
144	F	84.8	Confident	84.4	Confident	1 Å²	1	55 Å²	55	0%	0.004	28%	0.277	C	S	.	.			trans	-94	-9.3	-178.5	-94.3	-105.5	0	0	0	114.9	A87 Y135 R138 L139 Q142 Y147 F148 L154	A87-F144 HydrophobicContact CB-CB 4.11Å; Y135-F144 HydrophobicContact CD2-CE1 4.02Å; Y135-F144 HydrophobicContact CD2-CZ 4.05Å; Y135-F144 AromaticContact CE2-CD1 3.99Å; Y135-F144 HydrophobicContact CE2-CD1 3.99Å; Y135-F144 AromaticContact CE2-CE1 3.51Å; Y135-F144 HydrophobicContact CE2-CE1 3.51Å; Y135-F144 AromaticContact CE2-CZ 3.94Å; Y135-F144 HydrophobicContact CE2-CZ 3.94Å; R138-F144 VanDerWaalsContact C-CE2 3.43Å; R138-F144 HydrophobicContact CB-CE2 3.81Å; R138-F144 HydrophobicContact CB-CZ 3.79Å; R138-F144 HydrophobicContact CG-CE2 3.67Å; R138-F144 HydrophobicContact CG-CZ 3.64Å; R138-F144 WeakPolarHBondContact O-CE2 3.33Å; L139-F144 HydrophobicContact CD2-CB 4.03Å; L139-F144 HydrophobicContact CD2-CD1 4.09Å; L139-F144 HydrophobicContact CD2-CD2 3.67Å; L139-F144 HydrophobicContact CD2-CE2 4.13Å; L139-F144 HydrophobicContact CD2-CG 3.64Å; L139-F144 HydrophobicContact CG-CD2 4.29Å; L139-F144 HydrophobicContact CG-CE2 4.28Å; Q142-F144 HydrophobicContact CB-CE2 4.5Å; F144-Y147 HydrophobicContact CB-CD2 4.41Å; F144-Y147 AromaticContact CD1-CD2 3.79Å; F144-Y147 HydrophobicContact CD1-CD2 3.79Å; F144-Y147 HydrophobicContact CD2-CD2 4.33Å; F144-Y147 HydrophobicContact CD2-CE2 4.45Å; F144-Y147 HydrophobicContact CE1-CD2 4.06Å; F144-Y147 HydrophobicContact CE2-CE2 4.46Å; F144-Y147 AromaticContact CG-CD2 3.94Å; F144-Y147 HydrophobicContact CG-CD2 3.94Å; F144-Y147 HydrophobicContact CZ-CD2 4.46Å; F144-Y147 PolarHBondContact O-N 3.26Å; F144-Y147 VanDerWaalsContact O-N 3.16Å; F144-F148 HydrophobicContact CB-CD2 4.12Å; F144-F148 HydrophobicContact CB-CE2 3.94Å; F144-F148 HydrophobicContact CD1-CE2 4.23Å; F144-F148 VanDerWaalsContact O-CD2 3.28Å; F144-F148 WeakPolarHBondContact O-CD2 3.28Å; F144-F148 PolarHBondContact O-N 3.35Å; F144-F148 VanDerWaalsContact O-N 3.17Å; F144-L154 HydrophobicContact CE1-CD1 4.44Å; F144-L154 HydrophobicContact CE1-CD2 4.42Å; F144-L154 HydrophobicContact CZ-CD1 4.35Å
145	E	81.5	Confident	84.4	Confident	101 Å²	101	57 Å²	57	47%	0.472	29%	0.286	S	S	.	.	H	α-helix	trans	-49	-49.8	174.5	166.8	136.7	-106	0	0	114.1	K91 D143 Y147 F148 C149	K91-E145 VanDerWaalsContact NZ-CG 3.32Å; K91-E145 PolarHBondContact NZ-O 3.47Å; K91-E145 IonicContact NZ-OE1 2.77Å; K91-E145 PolarHBondContact NZ-OE1 2.93Å; D143-E145 WeakPolarHBondContact OD1-CB 3.41Å; D143-E145 PolarHBondContact OD1-N 2.68Å; E145-Y147 VanDerWaalsContact C-N 3.29Å; E145-Y147 PolarHBondContact O-N 2.92Å; E145-F148 PolarHBondContact O-N 2.83Å; E145-C149 WeakPolarHBondContact O-CB 3.43Å; E145-C149 PolarHBondContact O-N 3.44Å; E145-C149 PolarHBondContact O-SG 3.38Å; E145-C149 VanDerWaalsContact O-SG 3.36Å
146	P	83.4	Confident	84.5	Confident	35 Å²	35	57.3 Å²	57.3	23%	0.227	29%	0.289	C	S	.	.	H	α-helix	trans	-68.6	-25.3	-177.6	25.8	-35.3	0	0	0	113.7	G150 K151 K152	P146-G150 PolarHBondContact O-N 3.05Å; P146-K151 PolarHBondContact O-N 2.87Å; P146-K151 VanDerWaalsContact O-N 3.07Å; P146-K152 HydrophobicContact CB-CB 4.22Å; P146-K152 PolarHBondContact O-N 2.85Å; P146-K152 VanDerWaalsContact O-N 3.11Å
147	Y	85.9	Confident	84.4	Confident	12 Å²	12	58 Å²	58	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-73.1	-45.4	175.4	-57.6	-69	0	0	0	110.6	Q142 F144 E145 C149 G150 K152 L154	Q142-Y147 PolarHBondContact OE1-OH 3.46Å; F144-Y147 HydrophobicContact CB-CD2 4.41Å; F144-Y147 AromaticContact CD1-CD2 3.79Å; F144-Y147 HydrophobicContact CD1-CD2 3.79Å; F144-Y147 HydrophobicContact CD2-CD2 4.33Å; F144-Y147 HydrophobicContact CD2-CE2 4.45Å; F144-Y147 HydrophobicContact CE1-CD2 4.06Å; F144-Y147 HydrophobicContact CE2-CE2 4.46Å; F144-Y147 AromaticContact CG-CD2 3.94Å; F144-Y147 HydrophobicContact CG-CD2 3.94Å; F144-Y147 HydrophobicContact CZ-CD2 4.46Å; F144-Y147 PolarHBondContact O-N 3.26Å; F144-Y147 VanDerWaalsContact O-N 3.16Å; E145-Y147 VanDerWaalsContact C-N 3.29Å; E145-Y147 PolarHBondContact O-N 2.92Å; Y147-C149 VanDerWaalsContact C-N 3.31Å; Y147-C149 PolarHBondContact O-N 2.76Å; Y147-G150 PolarHBondContact O-N 2.91Å; Y147-K152 WeakPolarHBondContact CA-O 3.47Å; Y147-K152 HydrophobicContact CD1-CB 3.91Å; Y147-K152 HydrophobicContact CD1-CD 4.19Å; Y147-K152 HydrophobicContact CD1-CG 3.97Å; Y147-K152 WeakPolarHBondContact CD1-O 3.37Å; Y147-K152 HydrophobicContact CE1-CB 4.05Å; Y147-K152 HydrophobicContact CE1-CD 3.47Å; Y147-K152 VanDerWaalsContact CE1-CD 3.47Å; Y147-K152 HydrophobicContact CE1-CG 3.6Å; Y147-K152 WeakPolarHBondContact OH-CE 3.31Å; Y147-K152 PolarHBondContact OH-NZ 3.43Å; Y147-L154 HydrophobicContact CD1-CB 4.1Å; Y147-L154 HydrophobicContact CE1-CB 4.37Å; Y147-L154 HydrophobicContact CE1-CD1 4.24Å
148	F	83.6	Confident	84.3	Confident	8 Å²	8	58.9 Å²	58.9	4%	0.035	31%	0.307	C	S	.	.	H	α-helix	trans	-68.1	-29	176.3	-71.9	-61.9	0	0	0	113.1	A87 K91 L93 L101 A102 F144 E145 G150	A87-F148 HydrophobicContact CB-CD2 3.8Å; A87-F148 HydrophobicContact CB-CE2 4.09Å; K91-F148 HydrophobicContact CD-CB 3.81Å; L93-F148 HydrophobicContact CD1-CD1 3.87Å; L93-F148 HydrophobicContact CD1-CE1 4.21Å; L93-F148 HydrophobicContact CD2-CB 4.05Å; L93-F148 HydrophobicContact CD2-CD1 3.84Å; L93-F148 HydrophobicContact CD2-CG 4.43Å; L93-F148 VanDerWaalsContact CD2-O 3.23Å; L93-F148 WeakPolarHBondContact CD2-O 3.35Å; L101-F148 HydrophobicContact CB-CE1 3.93Å; L101-F148 HydrophobicContact CB-CZ 4.06Å; A102-F148 HydrophobicContact CB-CE1 3.88Å; A102-F148 HydrophobicContact CB-CZ 4.37Å; F144-F148 HydrophobicContact CB-CD2 4.12Å; F144-F148 HydrophobicContact CB-CE2 3.94Å; F144-F148 HydrophobicContact CD1-CE2 4.23Å; F144-F148 VanDerWaalsContact O-CD2 3.28Å; F144-F148 WeakPolarHBondContact O-CD2 3.28Å; F144-F148 PolarHBondContact O-N 3.35Å; F144-F148 VanDerWaalsContact O-N 3.17Å; E145-F148 PolarHBondContact O-N 2.83Å; F148-G150 PolarHBondContact O-N 3.27Å
149	C	78.6	Confident	84.2	Confident	60 Å²	60	61.2 Å²	61.2	41%	0.405	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-5.1	171.8	-71.9	0	0	0	0	114	K91 E145 Y147 K151	K91-C149 WeakPolarHBondContact CE-SG 3.43Å; K91-C149 PolarHBondContact NZ-SG 2.9Å; E145-C149 WeakPolarHBondContact O-CB 3.43Å; E145-C149 PolarHBondContact O-N 3.44Å; E145-C149 PolarHBondContact O-SG 3.38Å; E145-C149 VanDerWaalsContact O-SG 3.36Å; Y147-C149 VanDerWaalsContact C-N 3.31Å; Y147-C149 PolarHBondContact O-N 2.76Å; C149-K151 HydrophobicContact CB-CD 4.47Å; C149-K151 HydrophobicContact CB-CG 4.16Å; C149-K151 PolarHBondContact O-N 2.85Å
150	G	77.7	Confident	84.3	Confident	58 Å²	58	61.2 Å²	61.2	60%	0.598	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	69	7.5	-176	0	0	0	0	0	114.6	P146 Y147 F148 K152	P146-G150 PolarHBondContact O-N 3.05Å; Y147-G150 PolarHBondContact O-N 2.91Å; F148-G150 PolarHBondContact O-N 3.27Å; G150-K152 VanDerWaalsContact C-N 3.26Å; G150-K152 PolarHBondContact O-N 2.8Å
151	K	81.9	Confident	84.6	Confident	184 Å²	184	55.4 Å²	55.4	80%	0.8	31%	0.305	S	S	*	.	S	Bend	trans	-70.8	-27	174.9	-68	-177.4	179.8	176.8	0	111.5	P146 C149	P146-K151 PolarHBondContact O-N 2.87Å; P146-K151 VanDerWaalsContact O-N 3.07Å; C149-K151 HydrophobicContact CB-CD 4.47Å; C149-K151 HydrophobicContact CB-CG 4.16Å; C149-K151 PolarHBondContact O-N 2.85Å
152	K	85.3	Confident	84.9	Confident	107 Å²	107	52.1 Å²	52.1	47%	0.465	29%	0.285	S	S	.	.	S	Bend	trans	-134.8	141.2	-178.3	-165	178	177.8	-168.1	0	110.4	P146 Y147 G150	P146-K152 HydrophobicContact CB-CB 4.22Å; P146-K152 PolarHBondContact O-N 2.85Å; P146-K152 VanDerWaalsContact O-N 3.11Å; Y147-K152 WeakPolarHBondContact CA-O 3.47Å; Y147-K152 HydrophobicContact CD1-CB 3.91Å; Y147-K152 HydrophobicContact CD1-CD 4.19Å; Y147-K152 HydrophobicContact CD1-CG 3.97Å; Y147-K152 WeakPolarHBondContact CD1-O 3.37Å; Y147-K152 HydrophobicContact CE1-CB 4.05Å; Y147-K152 HydrophobicContact CE1-CD 3.47Å; Y147-K152 VanDerWaalsContact CE1-CD 3.47Å; Y147-K152 HydrophobicContact CE1-CG 3.6Å; Y147-K152 WeakPolarHBondContact OH-CE 3.31Å; Y147-K152 PolarHBondContact OH-NZ 3.43Å; G150-K152 VanDerWaalsContact C-N 3.26Å; G150-K152 PolarHBondContact O-N 2.8Å
153	R	86.3	Confident	85.4	Confident	113 Å²	113	50.8 Å²	50.8	43%	0.426	28%	0.277	S	S	.	.			trans	-91.7	135.9	173	-63.2	174.3	74.5	-141.6	5.9	109.6	D121 M155 L221	D121-R153 IonicContact OD1-NH2 3.27Å; D121-R153 IonicContact OD2-CZ 3.19Å; D121-R153 VanDerWaalsContact OD2-CZ 3.27Å; D121-R153 IonicContact OD2-NH1 2.77Å; D121-R153 PolarHBondContact OD2-NH1 2.98Å; D121-R153 IonicContact OD2-NH2 3.92Å; D121-R153 PolarHBondContact OD2-NH2 2.78Å; R153-M155 PolarHBondContact O-N 2.83Å; R153-L221 PolarHBondContact NH2-O 3Å
154	L	89.5	Confident	85.7	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.021	27%	0.266	C	S	.	.			trans	-74.6	117.9	171.8	-176.6	64.7	0	0	0	108.7	F97 L101 I117 I119 I133 F144 Y147 Y222	F97-L154 HydrophobicContact CE1-CD2 4.34Å; F97-L154 HydrophobicContact CZ-CD2 3.98Å; L101-L154 HydrophobicContact CD1-CD2 4.21Å; I117-L154 HydrophobicContact CD1-CD2 3.9Å; I119-L154 HydrophobicContact CD1-CB 4.34Å; I119-L154 HydrophobicContact CD1-CD2 4.05Å; I119-L154 HydrophobicContact CD1-CG 3.95Å; I119-L154 WeakPolarHBondContact CD1-O 3.31Å; I133-L154 HydrophobicContact CD1-CD1 4.47Å; I133-L154 HydrophobicContact CD1-CD2 4.5Å; I133-L154 HydrophobicContact CD1-CG 4.21Å; F144-L154 HydrophobicContact CE1-CD1 4.44Å; F144-L154 HydrophobicContact CE1-CD2 4.42Å; F144-L154 HydrophobicContact CZ-CD1 4.35Å; Y147-L154 HydrophobicContact CD1-CB 4.1Å; Y147-L154 HydrophobicContact CE1-CB 4.37Å; Y147-L154 HydrophobicContact CE1-CD1 4.24Å; L154-Y222 WeakPolarHBondContact CA-OH 3.42Å; L154-Y222 WeakPolarHBondContact CB-OH 3.37Å; L154-Y222 PolarHBondContact N-OH 2.8Å; L154-Y222 WeakPolarHBondContact O-CE1 3.46Å; L154-Y222 VanDerWaalsContact O-CZ 3.25Å; L154-Y222 PolarHBondContact O-OH 2.9Å
155	M	90.1	Very high	86	Confident	46 Å²	46	49.6 Å²	49.6	23%	0.227	27%	0.267	C	S	.	.			trans	-128.2	144.2	179.7	-72	-63.5	-72	0	0	109.9	D121 V129 R153 Y222	D121-M155 HydrophobicContact CB-CE 4.09Å; D121-M155 HydrophobicContact CB-SD 4.16Å; V129-M155 HydrophobicContact CG2-CE 3.48Å; V129-M155 VanDerWaalsContact CG2-CE 3.48Å; R153-M155 PolarHBondContact O-N 2.83Å; M155-Y222 HydrophobicContact SD-CE1 3.98Å
156	P	90.4	Very high	86.3	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.052	27%	0.265	C	S	.	.			trans	-67.4	137.3	174.9	29	-33.1	0	0	0	109.9	V129 I133 Y163	V129-P156 HydrophobicContact CG2-CG 4.14Å; I133-P156 HydrophobicContact CD1-CB 4.29Å; I133-P156 HydrophobicContact CG1-CB 4.33Å; P156-Y163 HydrophobicContact CB-CD2 4.29Å; P156-Y163 WeakPolarHBondContact O-CD2 3.45Å
157	G	87	Confident	86.5	Confident	15 Å²	15	55.9 Å²	55.9	16%	0.155	29%	0.285	C	S	.	.			trans	-123.9	169.7	177.6	0	0	0	0	0	112.6	S159 D160 Y163	G157-S159 PolarHBondContact O-N 2.87Å; G157-S159 VanDerWaalsContact O-N 3.08Å; G157-D160 PolarHBondContact N-OD2 2.63Å; G157-D160 WeakPolarHBondContact O-CB 3.33Å; G157-D160 PolarHBondContact O-N 3.38Å; G157-Y163 WeakPolarHBondContact O-CB 3.42Å
158	P	84.2	Confident	86.6	Confident	76 Å²	76	58.7 Å²	58.7	49%	0.494	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.3	-173.5	26.2	-35.2	0	0	0	114.3	Y163 T172 N174	P158-Y163 HydrophobicContact CB-CD1 4.45Å; P158-T172 WeakPolarHBondContact CA-OG1 3.46Å; P158-T172 HydrophobicContact CB-CG2 4.36Å; P158-T172 PolarHBondContact O-OG1 2.81Å; P158-N174 PolarHBondContact O-ND2 2.85Å
159	S	84.1	Confident	86.7	Confident	93 Å²	93	65.4 Å²	65.4	65%	0.65	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-3.9	176.8	-48.3	0	0	0	0	113.9	G157	G157-S159 PolarHBondContact O-N 2.87Å; G157-S159 VanDerWaalsContact O-N 3.08Å
160	D	88.5	Confident	87.1	Confident	8 Å²	8	67.7 Å²	67.7	4%	0.043	34%	0.342	C	S	.	.	S	Bend	trans	-78.8	178.8	177.2	-67.3	-54.1	0	0	0	111	Y132 I133 R138 G157 C162 N174	Y132-D160 WeakPolarHBondContact O-CB 3.38Å; I133-D160 HydrophobicContact CG1-CB 4.19Å; R138-D160 IonicContact CZ-OD1 3Å; R138-D160 IonicContact NE-OD1 3.27Å; G157-D160 PolarHBondContact N-OD2 2.63Å; G157-D160 WeakPolarHBondContact O-CB 3.33Å; G157-D160 PolarHBondContact O-N 3.38Å; D160-C162 VanDerWaalsContact C-N 3.31Å; D160-C162 PolarHBondContact O-N 2.77Å; D160-N174 WeakPolarHBondContact O-CB 3.42Å; D160-N174 PolarHBondContact O-ND2 3.42Å
161	L	87.2	Confident	87.6	Confident	3 Å²	3	68.1 Å²	68.1	2%	0.016	34%	0.335	C	S	.	.	S	Bend	trans	-57.2	-47.6	-173.6	-68.1	171.7	0	0	0	111.4	V116 Y132 D134 S173 N174 S176 F179 V181 F191	V116-L161 HydrophobicContact CG1-CD1 3.98Å; V116-L161 HydrophobicContact CG2-CD1 4.2Å; Y132-L161 VanDerWaalsContact O-CB 3.31Å; Y132-L161 WeakPolarHBondContact O-CB 3.5Å; Y132-L161 PolarHBondContact O-N 3.03Å; D134-L161 HydrophobicContact CB-CD1 3.93Å; D134-L161 HydrophobicContact CB-CD2 4.37Å; D134-L161 HydrophobicContact CB-CG 4.05Å; L161-S173 CarbonylContact O-C 3.51Å; L161-S173 WeakPolarHBondContact O-CA 3.3Å; L161-N174 WeakPolarHBondContact CA-O 3.32Å; L161-N174 PolarHBondContact O-N 2.6Å; L161-S176 WeakPolarHBondContact CD2-OG 3.38Å; L161-F179 HydrophobicContact CD1-CB 4.45Å; L161-F179 HydrophobicContact CD1-CD2 4.44Å; L161-F179 HydrophobicContact CD2-CB 3.96Å; L161-V181 HydrophobicContact CB-CG2 4.25Å; L161-V181 HydrophobicContact CD2-CG2 4.15Å; L161-F191 HydrophobicContact CB-CE1 3.91Å; L161-F191 HydrophobicContact CD1-CD1 4.28Å; L161-F191 HydrophobicContact CD1-CE1 4.18Å
162	C	89.5	Confident	87.8	Confident	8 Å²	8	61 Å²	61	5%	0.054	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	146.7	167.2	-48.5	0	0	0	0	109.6	G131 Y132 D160 T172	G131-C162 CarbonylContact C-O 3.56Å; G131-C162 WeakPolarHBondContact CA-O 3.15Å; Y132-C162 HydrophobicContact CD2-CB 4.02Å; Y132-C162 PolarHBondContact N-O 3Å; Y132-C162 PolarHBondContact O-N 2.64Å; D160-C162 VanDerWaalsContact C-N 3.31Å; D160-C162 PolarHBondContact O-N 2.77Å; C162-T172 CarbonylContact C-O 3.6Å; C162-T172 VanDerWaalsContact CA-O 3.26Å; C162-T172 WeakPolarHBondContact CA-O 3.29Å
163	Y	91.3	Very high	87.8	Confident	29 Å²	29	58.2 Å²	58.2	11%	0.114	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	135	172.1	164.9	-91.7	0	0	0	108.6	V129 S130 P156 G157 P158 N165 S171 T172	V129-Y163 HydrophobicContact CB-CE2 3.95Å; V129-Y163 HydrophobicContact CG1-CE2 3.88Å; S130-Y163 CarbonylContact O-C 3.6Å; P156-Y163 HydrophobicContact CB-CD2 4.29Å; P156-Y163 WeakPolarHBondContact O-CD2 3.45Å; G157-Y163 WeakPolarHBondContact O-CB 3.42Å; P158-Y163 HydrophobicContact CB-CD1 4.45Å; Y163-N165 HydrophobicContact CE1-CB 4.14Å; Y163-N165 PolarHBondContact OH-ND2 3.31Å; Y163-S171 CarbonylContact O-C 3.59Å; Y163-S171 VanDerWaalsContact O-CA 3.26Å; Y163-S171 WeakPolarHBondContact O-CA 3.14Å; Y163-T172 PolarHBondContact N-O 3.45Å; Y163-T172 PolarHBondContact O-N 3.25Å
164	Y	89.6	Confident	87.8	Confident	70 Å²	70	55.8 Å²	55.8	28%	0.275	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124.6	179.2	-172.4	-102.5	0	0	0	109.2	V129 S130 W166 M170	V129-Y164 CarbonylContact C-O 3.56Å; V129-Y164 VanDerWaalsContact CA-O 3.31Å; V129-Y164 WeakPolarHBondContact CA-O 3.47Å; S130-Y164 PolarHBondContact N-O 2.9Å; S130-Y164 PolarHBondContact O-N 2.97Å; Y164-W166 AromaticContact CD1-CD1 3.9Å; Y164-W166 AromaticContact CD1-CD2 3.8Å; Y164-W166 HydrophobicContact CD1-CD2 3.8Å; Y164-W166 AromaticContact CD1-CE2 3.72Å; Y164-W166 HydrophobicContact CD1-CE3 4.37Å; Y164-W166 AromaticContact CD1-CG 3.92Å; Y164-W166 HydrophobicContact CD1-CG 3.92Å; Y164-W166 HydrophobicContact CD1-CZ2 4.23Å; Y164-W166 AromaticContact CD1-NE1 3.76Å; Y164-W166 HydrophobicContact CE1-CB 4.34Å; Y164-W166 AromaticContact CE1-CD2 3.59Å; Y164-W166 HydrophobicContact CE1-CD2 3.59Å; Y164-W166 AromaticContact CE1-CE2 3.94Å; Y164-W166 AromaticContact CE1-CE3 3.75Å; Y164-W166 HydrophobicContact CE1-CE3 3.75Å; Y164-W166 AromaticContact CE1-CG 3.87Å; Y164-W166 HydrophobicContact CE1-CG 3.87Å; Y164-W166 HydrophobicContact CE1-CZ2 4.41Å; Y164-W166 HydrophobicContact CE1-CZ3 4.22Å; Y164-M170 CarbonylContact C-O 3.48Å; Y164-M170 WeakPolarHBondContact CA-O 3.46Å
165	N	90.8	Very high	87.6	Confident	4 Å²	4	59 Å²	59	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	113.8	172.3	-174.5	-43.4	0	0	0	108.9	Q127 V129 Y163 K167 T168 Q169 M170	Q127-N165 PolarHBondContact OE1-ND2 2.91Å; V129-N165 HydrophobicContact CG1-CB 4.28Å; Y163-N165 HydrophobicContact CE1-CB 4.14Å; Y163-N165 PolarHBondContact OH-ND2 3.31Å; N165-K167 VanDerWaalsContact C-N 3.26Å; N165-K167 PolarHBondContact O-N 3.04Å; N165-K167 WeakPolarHBondContact OD1-CB 3.37Å; N165-K167 PolarHBondContact OD1-N 3.14Å; N165-T168 VanDerWaalsContact CB-OG1 3.31Å; N165-T168 WeakPolarHBondContact CB-OG1 3.49Å; N165-T168 PolarHBondContact OD1-N 2.92Å; N165-T168 VanDerWaalsContact OD1-N 3.07Å; N165-T168 PolarHBondContact OD1-OG1 3.37Å; N165-Q169 WeakPolarHBondContact O-CA 3.09Å; N165-Q169 PolarHBondContact O-N 2.89Å; N165-M170 HydrophobicContact CB-CB 4.39Å; N165-M170 PolarHBondContact N-O 3.02Å; N165-M170 PolarHBondContact O-N 3.28Å
166	W	87.4	Confident	87.2	Confident	118 Å²	118	57.3 Å²	57.3	45%	0.447	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-26.3	-175.7	-66.4	83.6	0	0	0	112.8	E128 S130 Y164	E128-W166 HydrophobicContact CB-CB 4.1Å; E128-W166 HydrophobicContact CB-CG 4.36Å; E128-W166 HydrophobicContact CG-CB 4.45Å; E128-W166 HydrophobicContact CG-CG 4.2Å; E128-W166 PolarHBondContact O-N 2.76Å; S130-W166 PolarHBondContact OG-NE1 3.08Å; Y164-W166 AromaticContact CD1-CD1 3.9Å; Y164-W166 AromaticContact CD1-CD2 3.8Å; Y164-W166 HydrophobicContact CD1-CD2 3.8Å; Y164-W166 AromaticContact CD1-CE2 3.72Å; Y164-W166 HydrophobicContact CD1-CE3 4.37Å; Y164-W166 AromaticContact CD1-CG 3.92Å; Y164-W166 HydrophobicContact CD1-CG 3.92Å; Y164-W166 HydrophobicContact CD1-CZ2 4.23Å; Y164-W166 AromaticContact CD1-NE1 3.76Å; Y164-W166 HydrophobicContact CE1-CB 4.34Å; Y164-W166 AromaticContact CE1-CD2 3.59Å; Y164-W166 HydrophobicContact CE1-CD2 3.59Å; Y164-W166 AromaticContact CE1-CE2 3.94Å; Y164-W166 AromaticContact CE1-CE3 3.75Å; Y164-W166 HydrophobicContact CE1-CE3 3.75Å; Y164-W166 AromaticContact CE1-CG 3.87Å; Y164-W166 HydrophobicContact CE1-CG 3.87Å; Y164-W166 HydrophobicContact CE1-CZ2 4.41Å; Y164-W166 HydrophobicContact CE1-CZ3 4.22Å
167	K	87.3	Confident	86.7	Confident	149 Å²	149	61 Å²	61	65%	0.648	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-45	179.9	-168.4	178.8	-173.5	170.5	0	112	Q127 N165	Q127-K167 HydrophobicContact CB-CB 4.23Å; Q127-K167 HydrophobicContact CB-CD 4.32Å; Q127-K167 HydrophobicContact CG-CB 4.46Å; Q127-K167 HydrophobicContact CG-CD 3.78Å; N165-K167 VanDerWaalsContact C-N 3.26Å; N165-K167 PolarHBondContact O-N 3.04Å; N165-K167 WeakPolarHBondContact OD1-CB 3.37Å; N165-K167 PolarHBondContact OD1-N 3.14Å
168	T	88.1	Confident	86.4	Confident	71 Å²	71	60.8 Å²	60.8	44%	0.436	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-6.5	-178.4	62	0	0	0	0	113.2	N165 M170	N165-T168 VanDerWaalsContact CB-OG1 3.31Å; N165-T168 WeakPolarHBondContact CB-OG1 3.49Å; N165-T168 PolarHBondContact OD1-N 2.92Å; N165-T168 VanDerWaalsContact OD1-N 3.07Å; N165-T168 PolarHBondContact OD1-OG1 3.37Å; T168-M170 PolarHBondContact O-N 2.93Å; T168-M170 VanDerWaalsContact O-N 3.14Å; T168-M170 WeakPolarHBondContact OG1-CB 3.41Å
169	Q	86.9	Confident	86.4	Confident	149 Å²	149	57.1 Å²	57.1	70%	0.696	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	21	-172.3	-56.2	-177.5	6.6	0	0	113.7	N165 S171	N165-Q169 WeakPolarHBondContact O-CA 3.09Å; N165-Q169 PolarHBondContact O-N 2.89Å; Q169-S171 PolarHBondContact O-N 3.09Å
170	M	86.3	Confident	86.4	Confident	109 Å²	109	56.3 Å²	56.3	54%	0.537	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	119.1	179.9	-171.1	-178.3	-57.8	0	0	109.7	Y164 N165 T168	Y164-M170 CarbonylContact C-O 3.48Å; Y164-M170 WeakPolarHBondContact CA-O 3.46Å; N165-M170 HydrophobicContact CB-CB 4.39Å; N165-M170 PolarHBondContact N-O 3.02Å; N165-M170 PolarHBondContact O-N 3.28Å; T168-M170 PolarHBondContact O-N 2.93Å; T168-M170 VanDerWaalsContact O-N 3.14Å; T168-M170 WeakPolarHBondContact OG1-CB 3.41Å
171	S	87.2	Confident	86.2	Confident	66 Å²	66	56.9 Å²	56.9	46%	0.462	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.8	175.2	-164.3	0	0	0	0	110.4	Y163 Q169	Y163-S171 CarbonylContact O-C 3.59Å; Y163-S171 VanDerWaalsContact O-CA 3.26Å; Y163-S171 WeakPolarHBondContact O-CA 3.14Å; Q169-S171 PolarHBondContact O-N 3.09Å
172	T	86.3	Confident	86	Confident	34 Å²	34	58.9 Å²	58.9	21%	0.209	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	147.9	167.9	67	0	0	0	0	110.1	P158 C162 Y163	P158-T172 WeakPolarHBondContact CA-OG1 3.46Å; P158-T172 HydrophobicContact CB-CG2 4.36Å; P158-T172 PolarHBondContact O-OG1 2.81Å; C162-T172 CarbonylContact C-O 3.6Å; C162-T172 VanDerWaalsContact CA-O 3.26Å; C162-T172 WeakPolarHBondContact CA-O 3.29Å; Y163-T172 PolarHBondContact N-O 3.45Å; Y163-T172 PolarHBondContact O-N 3.25Å
173	S	86.5	Confident	85.5	Confident	50 Å²	50	64.9 Å²	64.9	35%	0.35	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	113.4	-176.4	-43.2	0	0	0	0	108.2	L161 Y183	L161-S173 CarbonylContact O-C 3.51Å; L161-S173 WeakPolarHBondContact O-CA 3.3Å; S173-Y183 WeakPolarHBondContact CB-OH 3.43Å; S173-Y183 PolarHBondContact OG-OH 3.02Å
174	N	85.9	Confident	84.5	Confident	61 Å²	61	67 Å²	67	33%	0.326	34%	0.343	S	S	.	.			trans	-122.6	141.7	-176.5	-52.2	-79	0	0	0	110.3	P158 D160 L161 V181	P158-N174 PolarHBondContact O-ND2 2.85Å; D160-N174 WeakPolarHBondContact O-CB 3.42Å; D160-N174 PolarHBondContact O-ND2 3.42Å; L161-N174 WeakPolarHBondContact CA-O 3.32Å; L161-N174 PolarHBondContact O-N 2.6Å; N174-V181 WeakPolarHBondContact O-CG2 3.21Å
175	S	84.5	Confident	82.6	Confident	72 Å²	72	70.9 Å²	70.9	50%	0.503	37%	0.369	S	S	.	.			trans	-81.9	136.9	169.4	-70.7	0	0	0	0	110.3	V181	S175-V181 PolarHBondContact OG-N 2.87Å
176	S	82.2	Confident	81.3	Confident	10 Å²	10	75.6 Å²	75.6	7%	0.07	40%	0.4	C	S	.	.			trans	-96.4	174.2	171.8	70.9	0	0	0	0	110.8	D134 L161 N178 F179 K194	D134-S176 PolarHBondContact OD2-OG 2.73Å; L161-S176 WeakPolarHBondContact CD2-OG 3.38Å; S176-N178 PolarHBondContact O-N 3.47Å; S176-N178 PolarHBondContact OG-N 2.99Å; S176-F179 PolarHBondContact N-O 3.17Å; S176-F179 VanDerWaalsContact O-O 3.09Å; S176-F179 PolarHBondContact OG-N 3.44Å; S176-F179 PolarHBondContact OG-O 2.86Å; S176-K194 PolarHBondContact O-NZ 2.85Å
177	P	80.3	Confident	80.1	Confident	86 Å²	86	73.1 Å²	73.1	56%	0.558	40%	0.395	S	S	*	.	S	Bend	trans	-62.3	-26.8	170.4	-25.3	36.6	0	0	0	113.8	H137	H137-P177 VanDerWaalsContact CD2-CD 3.44Å; H137-P177 WeakPolarHBondContact CD2-CD 3.34Å
178	N	80.1	Confident	79.5	Confident	10 Å²	10	67.8 Å²	67.8	5%	0.053	38%	0.383	C	S	.	.	S	Bend	trans	-98.1	-28.8	-178.2	-53.2	-70.3	0	0	0	113.4	D134 S176 S193 K194 R195	D134-N178 WeakPolarHBondContact OD2-CB 3.44Å; D134-N178 PolarHBondContact OD2-ND2 3.2Å; S176-N178 PolarHBondContact O-N 3.47Å; S176-N178 PolarHBondContact OG-N 2.99Å; N178-S193 WeakPolarHBondContact O-CA 3.34Å; N178-K194 PolarHBondContact O-N 2.88Å; N178-R195 PolarHBondContact OD1-NH2 3.42Å
179	F	84.2	Confident	79.1	Confident	0 Å²	0	66 Å²	66	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	135.7	-174.9	-63	-82.5	0	0	0	112.2	V116 D134 L161 S176 F191 K192	V116-F179 HydrophobicContact CG2-CD2 4Å; V116-F179 HydrophobicContact CG2-CE1 4.16Å; V116-F179 HydrophobicContact CG2-CE2 3.54Å; V116-F179 HydrophobicContact CG2-CG 4.49Å; V116-F179 HydrophobicContact CG2-CZ 3.63Å; D134-F179 HydrophobicContact CB-CD2 4.42Å; L161-F179 HydrophobicContact CD1-CB 4.45Å; L161-F179 HydrophobicContact CD1-CD2 4.44Å; L161-F179 HydrophobicContact CD2-CB 3.96Å; S176-F179 PolarHBondContact N-O 3.17Å; S176-F179 VanDerWaalsContact O-O 3.09Å; S176-F179 PolarHBondContact OG-N 3.44Å; S176-F179 PolarHBondContact OG-O 2.86Å; F179-F191 HydrophobicContact CD1-CB 4.14Å; F179-K192 CarbonylContact C-O 3.56Å; F179-K192 WeakPolarHBondContact CA-O 3.13Å
180	E	85.1	Confident	78.8	Confident	75 Å²	75	59.5 Å²	59.5	35%	0.35	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	129.9	167.2	-179.5	177.2	-156.4	0	0	108.6	I182 K192 K194	E180-I182 HydrophobicContact CG-CG1 4.2Å; E180-K192 HydrophobicContact CB-CB 4.29Å; E180-K192 PolarHBondContact N-O 3.03Å; E180-K192 PolarHBondContact O-N 2.92Å; E180-K192 IonicContact OE2-NZ 3.83Å; E180-K194 HydrophobicContact CB-CG 4.35Å
181	V	83.9	Confident	78.6	Confident	21 Å²	21	54.3 Å²	54.3	13%	0.127	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	122.4	179.8	-175	0	0	0	0	108.5	L161 N174 S175 Y183 L189 F191	L161-V181 HydrophobicContact CB-CG2 4.25Å; L161-V181 HydrophobicContact CD2-CG2 4.15Å; N174-V181 WeakPolarHBondContact O-CG2 3.21Å; S175-V181 PolarHBondContact OG-N 2.87Å; V181-Y183 HydrophobicContact CG1-CE2 4.06Å; V181-L189 HydrophobicContact CG1-CD1 3.45Å; V181-L189 VanDerWaalsContact CG1-CD1 3.45Å; V181-F191 HydrophobicContact CB-CE1 4.49Å; V181-F191 HydrophobicContact CG1-CD1 4.44Å; V181-F191 HydrophobicContact CG1-CE1 4.11Å; V181-F191 HydrophobicContact CG2-CD1 3.92Å; V181-F191 HydrophobicContact CG2-CE1 3.81Å
182	I	82.3	Confident	78.4	Confident	44 Å²	44	53.9 Å²	53.9	23%	0.226	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	132.5	-177.7	-57.5	179.7	0	0	0	108.5	E180 D184 L190 K192 M199	E180-I182 HydrophobicContact CG-CG1 4.2Å; I182-D184 HydrophobicContact CG2-CB 4.48Å; I182-L190 HydrophobicContact CB-CB 4.46Å; I182-L190 PolarHBondContact N-O 2.93Å; I182-L190 PolarHBondContact O-N 3.47Å; I182-K192 HydrophobicContact CD1-CB 3.68Å; I182-K192 HydrophobicContact CD1-CD 3.67Å; I182-K192 HydrophobicContact CD1-CG 4.34Å; I182-K192 HydrophobicContact CG1-CB 4.4Å; I182-M199 HydrophobicContact CD1-CE 3.91Å; I182-M199 HydrophobicContact CD1-SD 4.26Å
183	Y	78.4	Confident	78	Confident	134 Å²	134	52.3 Å²	52.3	53%	0.525	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	116.5	168.9	-71.4	-85.3	0	0	0	108.2	S173 V181 L189	S173-Y183 WeakPolarHBondContact CB-OH 3.43Å; S173-Y183 PolarHBondContact OG-OH 3.02Å; V181-Y183 HydrophobicContact CG1-CE2 4.06Å; Y183-L189 HydrophobicContact CD1-CD1 4.19Å; Y183-L189 HydrophobicContact CE1-CB 4.46Å; Y183-L189 HydrophobicContact CE1-CD1 3.63Å; Y183-L189 HydrophobicContact CE2-CD1 4.15Å
184	D	72.1	Confident	77.7	Confident	73 Å²	73	54.9 Å²	54.9	39%	0.39	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	113.5	-179.5	-176.1	43.9	0	0	0	109.7	I182 N187 G188 L190	I182-D184 HydrophobicContact CG2-CB 4.48Å; D184-N187 CarbonylContact O-C 3.42Å; D184-N187 WeakPolarHBondContact O-CA 2.99Å; D184-N187 PolarHBondContact O-N 2.9Å; D184-N187 PolarHBondContact OD2-ND2 2.87Å; D184-G188 PolarHBondContact N-O 2.81Å; D184-G188 VanDerWaalsContact N-O 3.09Å; D184-G188 PolarHBondContact O-N 2.81Å; D184-L190 HydrophobicContact CB-CD1 3.94Å
185	D	49.4	Very low	77	Confident	153 Å²	153	57 Å²	57	82%	0.818	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	121.7	177.4	-170.7	-4	0	0	0	108.4
186	P	63	Low	76.2	Confident	102 Å²	102	56.6 Å²	56.6	66%	0.662	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	cis	-101	9.6	22.1	38.9	-36.2	0	0	0	116.2	R203	P186-R203 PolarHBondContact O-NH2 3.45Å; P186-R203 VanDerWaalsContact O-NH2 3.15Å
187	N	61.6	Low	75.5	Confident	66 Å²	66	64 Å²	64	35%	0.353	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-21.7	-174.5	-66.7	-48	0	0	0	113.5	D184 L190 R203	D184-N187 CarbonylContact O-C 3.42Å; D184-N187 WeakPolarHBondContact O-CA 2.99Å; D184-N187 PolarHBondContact O-N 2.9Å; D184-N187 PolarHBondContact OD2-ND2 2.87Å; N187-L190 HydrophobicContact CB-CD1 4.02Å; N187-L190 HydrophobicContact CB-CD2 4.45Å; N187-L190 HydrophobicContact CB-CG 4.42Å; N187-R203 PolarHBondContact O-NH2 3.16Å
188	G	74.5	Confident	75	Confident	37 Å²	37	62 Å²	62	38%	0.381	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.1	-144	-177.6	0	0	0	0	0	112.3	D184	D184-G188 PolarHBondContact N-O 2.81Å; D184-G188 VanDerWaalsContact N-O 3.09Å; D184-G188 PolarHBondContact O-N 2.81Å
189	L	79.8	Confident	74.6	Confident	33 Å²	33	66.4 Å²	66.4	17%	0.173	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	126.2	178.2	-179.5	67.4	0	0	0	110.5	Y132 V181 Y183 F191 P202	Y132-L189 HydrophobicContact CD2-CD2 3.83Å; Y132-L189 HydrophobicContact CE2-CD2 3.57Å; V181-L189 HydrophobicContact CG1-CD1 3.45Å; V181-L189 VanDerWaalsContact CG1-CD1 3.45Å; Y183-L189 HydrophobicContact CD1-CD1 4.19Å; Y183-L189 HydrophobicContact CE1-CB 4.46Å; Y183-L189 HydrophobicContact CE1-CD1 3.63Å; Y183-L189 HydrophobicContact CE2-CD1 4.15Å; L189-F191 HydrophobicContact CD1-CE1 4.47Å; L189-F191 HydrophobicContact CD2-CE1 4.41Å; L189-F191 HydrophobicContact CD2-CE2 4.16Å; L189-F191 HydrophobicContact CD2-CZ 3.69Å; L189-F191 HydrophobicContact CG-CE1 4.43Å; L189-F191 HydrophobicContact CG-CE2 4.39Å; L189-F191 HydrophobicContact CG-CZ 4.04Å; L189-P202 HydrophobicContact CD2-CG 4.46Å; L189-P202 HydrophobicContact CG-CG 4.45Å; L189-P202 WeakPolarHBondContact O-CD 3.36Å; L189-P202 WeakPolarHBondContact O-CG 3.26Å
190	L	81.4	Confident	74.2	Confident	13 Å²	13	67.1 Å²	67.1	7%	0.068	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144.6	177	-63.1	174.1	0	0	0	110.5	I182 D184 N187 N201	I182-L190 HydrophobicContact CB-CB 4.46Å; I182-L190 PolarHBondContact N-O 2.93Å; I182-L190 PolarHBondContact O-N 3.47Å; D184-L190 HydrophobicContact CB-CD1 3.94Å; N187-L190 HydrophobicContact CB-CD1 4.02Å; N187-L190 HydrophobicContact CB-CD2 4.45Å; N187-L190 HydrophobicContact CB-CG 4.42Å; L190-N201 HydrophobicContact CD2-CB 3.85Å
191	F	82.6	Confident	73.7	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	111.2	174.3	-61.5	-65.9	0	0	0	110	Y132 L161 F179 V181 L189 M199 L200 P202	Y132-F191 AromaticContact CD1-CE2 3.65Å; Y132-F191 HydrophobicContact CD1-CE2 3.65Å; Y132-F191 AromaticContact CD1-CZ 3.94Å; Y132-F191 HydrophobicContact CD1-CZ 3.94Å; Y132-F191 HydrophobicContact CD2-CE2 4.07Å; Y132-F191 AromaticContact CD2-CZ 3.66Å; Y132-F191 HydrophobicContact CD2-CZ 3.66Å; Y132-F191 HydrophobicContact CE1-CE2 4.03Å; Y132-F191 HydrophobicContact CE2-CE2 4.42Å; Y132-F191 HydrophobicContact CE2-CZ 4.32Å; Y132-F191 AromaticContact CG-CE2 3.68Å; Y132-F191 HydrophobicContact CG-CE2 3.68Å; Y132-F191 AromaticContact CG-CZ 3.44Å; Y132-F191 HydrophobicContact CG-CZ 3.44Å; Y132-F191 VanDerWaalsContact CG-CZ 3.44Å; L161-F191 HydrophobicContact CB-CE1 3.91Å; L161-F191 HydrophobicContact CD1-CD1 4.28Å; L161-F191 HydrophobicContact CD1-CE1 4.18Å; F179-F191 HydrophobicContact CD1-CB 4.14Å; V181-F191 HydrophobicContact CB-CE1 4.49Å; V181-F191 HydrophobicContact CG1-CD1 4.44Å; V181-F191 HydrophobicContact CG1-CE1 4.11Å; V181-F191 HydrophobicContact CG2-CD1 3.92Å; V181-F191 HydrophobicContact CG2-CE1 3.81Å; L189-F191 HydrophobicContact CD1-CE1 4.47Å; L189-F191 HydrophobicContact CD2-CE1 4.41Å; L189-F191 HydrophobicContact CD2-CE2 4.16Å; L189-F191 HydrophobicContact CD2-CZ 3.69Å; L189-F191 HydrophobicContact CG-CE1 4.43Å; L189-F191 HydrophobicContact CG-CE2 4.39Å; L189-F191 HydrophobicContact CG-CZ 4.04Å; F191-M199 CarbonylContact O-C 3.59Å; F191-L200 HydrophobicContact CB-CB 4.2Å; F191-L200 HydrophobicContact CB-CD2 4.28Å; F191-L200 HydrophobicContact CD2-CD2 3.83Å; F191-L200 PolarHBondContact N-O 2.9Å; F191-L200 WeakPolarHBondContact O-CB 3.31Å; F191-L200 PolarHBondContact O-N 2.88Å; F191-P202 HydrophobicContact CD2-CB 4.09Å; F191-P202 HydrophobicContact CD2-CG 3.9Å; F191-P202 HydrophobicContact CE2-CB 3.77Å; F191-P202 HydrophobicContact CE2-CG 3.61Å
192	K	81.9	Confident	72.9	Confident	58 Å²	58	65.5 Å²	65.5	25%	0.252	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	120.7	176	-174.7	179.5	175.2	-169.7	0	109.8	F179 E180 I182 K194 M199	F179-K192 CarbonylContact C-O 3.56Å; F179-K192 WeakPolarHBondContact CA-O 3.13Å; E180-K192 HydrophobicContact CB-CB 4.29Å; E180-K192 PolarHBondContact N-O 3.03Å; E180-K192 PolarHBondContact O-N 2.92Å; E180-K192 IonicContact OE2-NZ 3.83Å; I182-K192 HydrophobicContact CD1-CB 3.68Å; I182-K192 HydrophobicContact CD1-CD 3.67Å; I182-K192 HydrophobicContact CD1-CG 4.34Å; I182-K192 HydrophobicContact CG1-CB 4.4Å; K192-K194 PolarHBondContact O-N 3.49Å; K192-M199 HydrophobicContact CB-CE 4.42Å; K192-M199 HydrophobicContact CB-SD 3.59Å; K192-M199 VanDerWaalsContact CB-SD 3.59Å; K192-M199 HydrophobicContact CD-CE 3.99Å; K192-M199 HydrophobicContact CD-SD 4.15Å; K192-M199 HydrophobicContact CG-CE 4.28Å; K192-M199 HydrophobicContact CG-SD 3.79Å
193	S	79.3	Confident	72	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.007	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	126.7	172.8	-176.2	0	0	0	0	110	N178 R195 K197 T198	N178-S193 WeakPolarHBondContact O-CA 3.34Å; S193-R195 VanDerWaalsContact C-N 3.27Å; S193-R195 PolarHBondContact O-N 2.82Å; S193-K197 WeakPolarHBondContact O-CA 3.33Å; S193-K197 PolarHBondContact O-N 2.75Å; S193-T198 PolarHBondContact N-O 3.35Å
194	K	79.4	Confident	71	Confident	103 Å²	103	63.8 Å²	63.8	45%	0.448	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-22.1	177.7	-71.6	-178.6	174.9	170.8	0	113.1	S176 N178 E180 K192	S176-K194 PolarHBondContact O-NZ 2.85Å; N178-K194 PolarHBondContact O-N 2.88Å; E180-K194 HydrophobicContact CB-CG 4.35Å; K192-K194 PolarHBondContact O-N 3.49Å
195	R	70.8	Confident	70.1	Confident	107 Å²	107	62.7 Å²	62.7	40%	0.404	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-52.2	178	-61.9	-165.5	-161.2	179.9	12.8	111.9	G111 N178 S193	G111-R195 PolarHBondContact O-NH1 2.83Å; N178-R195 PolarHBondContact OD1-NH2 3.42Å; S193-R195 VanDerWaalsContact C-N 3.27Å; S193-R195 PolarHBondContact O-N 2.82Å
196	D	67.5	Low	70.1	Confident	63 Å²	63	60.8 Å²	60.8	34%	0.337	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-2.8	-170.3	-58.2	-16.9	0	0	0	112.8	T198 R230	D196-T198 HydrophobicContact CB-CG2 4.05Å; D196-T198 WeakPolarHBondContact CB-OG1 3.37Å; D196-T198 PolarHBondContact O-N 2.9Å; D196-R230 IonicContact OD2-NE 2.67Å
197	K	69	Low	69.3	Low	165 Å²	165	62 Å²	62	72%	0.717	32%	0.324	S	S	*	.			trans	55.8	14.9	-172.1	-59.8	-177.2	-179.7	178.7	0	114.8	S193	S193-K197 WeakPolarHBondContact O-CA 3.33Å; S193-K197 PolarHBondContact O-N 2.75Å
198	T	68.9	Low	68.4	Low	45 Å²	45	63.7 Å²	63.7	28%	0.276	33%	0.332	S	S	.	.			trans	-87.9	141.6	-175.4	43.2	0	0	0	0	111	S193 D196 R230	S193-T198 PolarHBondContact N-O 3.35Å; D196-T198 HydrophobicContact CB-CG2 4.05Å; D196-T198 WeakPolarHBondContact CB-OG1 3.37Å; D196-T198 PolarHBondContact O-N 2.9Å; T198-R230 VanDerWaalsContact CG2-NH2 3.31Å; T198-R230 PolarHBondContact OG1-NE 3.11Å; T198-R230 PolarHBondContact OG1-NH1 2.94Å; T198-R230 PolarHBondContact OG1-NH2 3.09Å
199	M	72.4	Confident	66.8	Low	101 Å²	101	66.9 Å²	66.9	50%	0.498	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	137	177.5	-59	-61.8	-168.5	0	0	110.4	I182 F191 K192	I182-M199 HydrophobicContact CD1-CE 3.91Å; I182-M199 HydrophobicContact CD1-SD 4.26Å; F191-M199 CarbonylContact O-C 3.59Å; K192-M199 HydrophobicContact CB-CE 4.42Å; K192-M199 HydrophobicContact CB-SD 3.59Å; K192-M199 VanDerWaalsContact CB-SD 3.59Å; K192-M199 HydrophobicContact CD-CE 3.99Å; K192-M199 HydrophobicContact CD-SD 4.15Å; K192-M199 HydrophobicContact CG-CE 4.28Å; K192-M199 HydrophobicContact CG-SD 3.79Å
200	L	74.5	Confident	64.9	Low	15 Å²	15	67.8 Å²	67.8	8%	0.079	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	117.7	169.1	-177.2	148.6	0	0	0	107	F191 P202 Y228	F191-L200 HydrophobicContact CB-CB 4.2Å; F191-L200 HydrophobicContact CB-CD2 4.28Å; F191-L200 HydrophobicContact CD2-CD2 3.83Å; F191-L200 PolarHBondContact N-O 2.9Å; F191-L200 WeakPolarHBondContact O-CB 3.31Å; F191-L200 PolarHBondContact O-N 2.88Å; L200-P202 HydrophobicContact CD2-CB 4.49Å; L200-P202 WeakPolarHBondContact O-CD 3.38Å; L200-Y228 HydrophobicContact CD2-CG 4.32Å
201	N	74.8	Confident	63	Low	56 Å²	56	79 Å²	79	30%	0.299	42%	0.424	S	S	.	.			trans	-96.3	111.9	177	-170.9	-21.1	0	0	0	108.5	L190 R203	L190-N201 HydrophobicContact CD2-CB 3.85Å; N201-R203 PolarHBondContact O-N 3.34Å; N201-R203 VanDerWaalsContact OD1-CG 3.25Å; N201-R203 WeakPolarHBondContact OD1-CG 3.48Å; N201-R203 PolarHBondContact OD1-N 2.99Å
202	P	67.2	Low	61.2	Low	7 Å²	7	81 Å²	81	5%	0.045	44%	0.438	C	S	.	.			trans	-79	28.9	-178.4	36.9	-38.6	0	0	0	113.4	Y132 L189 F191 L200 Y228	Y132-P202 HydrophobicContact CD1-CB 4.31Å; Y132-P202 HydrophobicContact CE1-CB 3.44Å; Y132-P202 VanDerWaalsContact CE1-CB 3.44Å; Y132-P202 HydrophobicContact CE1-CG 4.27Å; L189-P202 HydrophobicContact CD2-CG 4.46Å; L189-P202 HydrophobicContact CG-CG 4.45Å; L189-P202 WeakPolarHBondContact O-CD 3.36Å; L189-P202 WeakPolarHBondContact O-CG 3.26Å; F191-P202 HydrophobicContact CD2-CB 4.09Å; F191-P202 HydrophobicContact CD2-CG 3.9Å; F191-P202 HydrophobicContact CE2-CB 3.77Å; F191-P202 HydrophobicContact CE2-CG 3.61Å; L200-P202 HydrophobicContact CD2-CB 4.49Å; L200-P202 WeakPolarHBondContact O-CD 3.38Å; P202-Y228 HydrophobicContact CB-CE2 4.36Å; P202-Y228 PolarHBondContact O-OH 2.76Å
203	R	64.3	Low	60	Low	88 Å²	88	82.1 Å²	82.1	33%	0.332	45%	0.453	S	S	.	.			trans	-70.2	142.2	177.9	-88.3	177.8	-171.5	164.6	-2.7	111.5	P186 N187 N201	P186-R203 PolarHBondContact O-NH2 3.45Å; P186-R203 VanDerWaalsContact O-NH2 3.15Å; N187-R203 PolarHBondContact O-NH2 3.16Å; N201-R203 PolarHBondContact O-N 3.34Å; N201-R203 VanDerWaalsContact OD1-CG 3.25Å; N201-R203 WeakPolarHBondContact OD1-CG 3.48Å; N201-R203 PolarHBondContact OD1-N 2.99Å
204	P	56.4	Low	59.2	Low	53 Å²	53	82.6 Å²	82.6	34%	0.344	46%	0.458	S	S	.	.			trans	-61	141.5	175.9	23.2	-30.8	0	0	0	110.7	S206 L207	P204-S206 PolarHBondContact O-N 2.97Å; P204-S206 VanDerWaalsContact O-N 3.09Å; P204-L207 HydrophobicContact CG-CD1 4.36Å
205	P	52.5	Low	58.7	Low	51 Å²	51	80.5 Å²	80.5	33%	0.331	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-61	-23	-172.9	-24	33.4	0	0	0	115.1	L207 L208 S212	P205-L207 PolarHBondContact O-N 2.71Å; P205-L207 VanDerWaalsContact O-N 3.11Å; P205-L208 PolarHBondContact O-N 2.95Å; P205-S212 WeakPolarHBondContact CA-OG 3.44Å
206	S	50.4	Low	58.8	Low	113 Å²	113	80.5 Å²	80.5	79%	0.79	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-66.1	-11.2	-174.2	45.6	0	0	0	0	115.1	P204	P204-S206 PolarHBondContact O-N 2.97Å; P204-S206 VanDerWaalsContact O-N 3.09Å
207	L	45.6	Very low	59.1	Low	128 Å²	128	78.9 Å²	78.9	67%	0.67	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-100.9	-13.4	-176.5	-87.6	154.2	0	0	0	114.9	P204 P205	P204-L207 HydrophobicContact CG-CD1 4.36Å; P205-L207 PolarHBondContact O-N 2.71Å; P205-L207 VanDerWaalsContact O-N 3.11Å
208	L	44.2	Very low	59.2	Low	101 Å²	101	78.6 Å²	78.6	53%	0.529	45%	0.454	S	S	.	.			trans	-145.8	111.4	-174.9	-69.4	170.8	0	0	0	111.1	P205 G210	P205-L208 PolarHBondContact O-N 2.95Å; L208-G210 PolarHBondContact O-N 3.05Å
209	G	39.5	Very low	59.5	Low	104 Å²	104	77 Å²	77	100%	1.072	45%	0.445	S	S	*	.	S	Bend	trans	-66.3	44.4	172.7	0	0	0	0	0	114.8
210	G	40.3	Very low	59.7	Low	52 Å²	52	79.4 Å²	79.4	54%	0.536	46%	0.459	S	S	.	.	S	Bend	trans	-174.4	105.9	179.1	0	0	0	0	0	113.6	L208	L208-G210 PolarHBondContact O-N 3.05Å
211	R	41	Very low	59.9	Low	249 Å²	249	82 Å²	82	94%	0.94	47%	0.473	S	S	*	.			trans	65	42.6	158.9	-56.4	178.5	69.8	-162.3	3.1	117.8
212	S	46.3	Very low	60.5	Low	42 Å²	42	80 Å²	80	29%	0.294	46%	0.461	S	S	.	.			trans	-81.8	113.2	154.2	43.7	0	0	0	0	109	P205 G214	P205-S212 WeakPolarHBondContact CA-OG 3.44Å; S212-G214 PolarHBondContact O-N 2.73Å
213	S	56.3	Low	61.4	Low	80 Å²	80	83.9 Å²	83.9	56%	0.559	49%	0.485	S	S	*	.			trans	-73	19.2	177.1	-65.8	0	0	0	0	113.8	D229	S213-D229 PolarHBondContact O-N 3.22Å
214	G	61	Low	62.4	Low	11 Å²	11	82.3 Å²	82.3	11%	0.113	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	112.9	-178.2	0	0	0	0	0	111.1	S212 L227 Y228	S212-G214 PolarHBondContact O-N 2.73Å; G214-L227 CarbonylContact C-O 3.59Å; G214-L227 VanDerWaalsContact CA-O 3.31Å; G214-L227 WeakPolarHBondContact CA-O 3.39Å; G214-Y228 VanDerWaalsContact CA-CD1 3.42Å
215	T	70.1	Confident	63.9	Low	60 Å²	60	79.8 Å²	79.8	37%	0.368	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	110.6	167.8	-52.7	0	0	0	0	108.4	L217 M226 L227	T215-L217 HydrophobicContact CG2-CD2 3.85Å; T215-L217 HydrophobicContact CG2-CG 4.34Å; T215-M226 WeakPolarHBondContact O-CA 3.23Å; T215-L227 PolarHBondContact N-O 2.99Å; T215-L227 PolarHBondContact O-N 2.89Å
216	L	71.7	Confident	65.4	Low	107 Å²	107	77.8 Å²	77.8	56%	0.56	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	127.1	168.9	-178.6	68.6	0	0	0	108.7	H224 M226	L216-H224 WeakPolarHBondContact CD1-CD2 3.09Å; L216-H224 WeakPolarHBondContact CD1-NE2 3.44Å; L216-M226 HydrophobicContact CB-CG 4.49Å; L216-M226 HydrophobicContact CD1-CG 3.57Å; L216-M226 HydrophobicContact CD1-SD 4.18Å
217	L	75.4	Confident	67.1	Low	29 Å²	29	72.4 Å²	72.4	15%	0.152	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126	178	-66.5	178.8	0	0	0	110.2	F97 A100 T215 S219 V225 L227	F97-L217 HydrophobicContact CD2-CD1 4.14Å; A100-L217 HydrophobicContact CB-CD1 3.41Å; A100-L217 VanDerWaalsContact CB-CD1 3.41Å; A100-L217 HydrophobicContact CB-CD2 4.38Å; T215-L217 HydrophobicContact CG2-CD2 3.85Å; T215-L217 HydrophobicContact CG2-CG 4.34Å; L217-S219 PolarHBondContact O-N 2.63Å; L217-V225 PolarHBondContact N-O 2.82Å; L217-L227 HydrophobicContact CD1-CD1 3.4Å; L217-L227 HydrophobicContact CD1-CG 3.71Å
218	Q	70.2	Confident	68.9	Low	159 Å²	159	66.4 Å²	66.4	74%	0.743	38%	0.382	S	S	*	.			trans	-79.4	110.7	167.2	-172.5	174.1	-12.2	0	0	108.1	N96	N96-Q218 PolarHBondContact ND2-O 3.48Å
219	S	76.4	Confident	70.8	Confident	12 Å²	12	63 Å²	63	8%	0.084	36%	0.364	C	S	.	.			trans	-117.9	137.1	177	176.6	0	0	0	0	108.6	D95 L217 L221	D95-S219 PolarHBondContact OD1-OG 2.67Å; D95-S219 WeakPolarHBondContact OD2-CA 3.29Å; D95-S219 PolarHBondContact OD2-OG 2.85Å; L217-S219 PolarHBondContact O-N 2.63Å; S219-L221 PolarHBondContact O-N 2.92Å; S219-L221 PolarHBondContact OG-N 2.61Å
220	D	75.8	Confident	72.5	Confident	150 Å²	150	60.9 Å²	60.9	80%	0.802	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-14.6	174.8	-60.9	-38.1	0	0	0	110.9	D95	D95-D220 PolarHBondContact OD2-N 2.9Å
221	L	79.1	Confident	73.9	Confident	69 Å²	69	62.6 Å²	62.6	36%	0.361	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-16.6	-179	-64.3	176	0	0	0	113.5	D95 L98 R153 S219	D95-L221 HydrophobicContact CB-CD1 3.79Å; D95-L221 HydrophobicContact CB-CG 4.19Å; D95-L221 PolarHBondContact OD2-N 3.49Å; L98-L221 HydrophobicContact CD1-CD1 4.18Å; L98-L221 HydrophobicContact CG-CD1 4.44Å; R153-L221 PolarHBondContact NH2-O 3Å; S219-L221 PolarHBondContact O-N 2.92Å; S219-L221 PolarHBondContact OG-N 2.61Å
222	Y	86.2	Confident	75.1	Confident	15 Å²	15	51.8 Å²	51.8	6%	0.059	29%	0.289	C	S	.	.			trans	-143.1	146.4	-171.1	-63.6	-79.7	0	0	0	110.9	F97 I119 D121 L154 M155 H224 V225	F97-Y222 HydrophobicContact CD1-CD2 4.04Å; F97-Y222 AromaticContact CD1-CE2 3.61Å; F97-Y222 HydrophobicContact CD1-CE2 3.61Å; F97-Y222 HydrophobicContact CE1-CD2 4.33Å; F97-Y222 AromaticContact CE1-CE2 3.66Å; F97-Y222 HydrophobicContact CE1-CE2 3.66Å; I119-Y222 HydrophobicContact CD1-CE1 4.43Å; I119-Y222 HydrophobicContact CG2-CD1 3.6Å; I119-Y222 HydrophobicContact CG2-CE1 3.91Å; I119-Y222 HydrophobicContact CG2-CG 4.3Å; D121-Y222 HydrophobicContact CB-CD1 3.85Å; L154-Y222 WeakPolarHBondContact CA-OH 3.42Å; L154-Y222 WeakPolarHBondContact CB-OH 3.37Å; L154-Y222 PolarHBondContact N-OH 2.8Å; L154-Y222 WeakPolarHBondContact O-CE1 3.46Å; L154-Y222 VanDerWaalsContact O-CZ 3.25Å; L154-Y222 PolarHBondContact O-OH 2.9Å; M155-Y222 HydrophobicContact SD-CE1 3.98Å; Y222-H224 VanDerWaalsContact C-N 3.34Å; Y222-H224 PolarHBondContact O-N 3.35Å; Y222-V225 HydrophobicContact CD2-CG2 3.79Å; Y222-V225 HydrophobicContact CG-CG2 3.65Å
223	V	86.1	Confident	75.4	Confident	89 Å²	89	59.4 Å²	59.4	54%	0.539	31%	0.311	S	S	.	.	S	Bend	trans	-60.6	-45.3	177.8	178.9	0	0	0	0	111.1	R120 Y122	R120-V223 WeakPolarHBondContact O-CB 3.5Å; R120-V223 PolarHBondContact O-N 3.37Å; Y122-V223 HydrophobicContact CD2-CG2 4.11Å; Y122-V223 HydrophobicContact CE2-CG2 3.84Å
224	H	85.6	Confident	74.9	Confident	55 Å²	55	62.5 Å²	62.5	26%	0.255	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	127.5	179.3	-177.9	-169.1	0	0	0	111.1	F118 R120 L216 Y222 M226	F118-H224 AromaticContact CE1-ND1 3.83Å; R120-H224 HydrophobicContact CB-CB 4.21Å; R120-H224 PolarHBondContact N-O 3.43Å; R120-H224 PolarHBondContact O-N 3.07Å; R120-H224 VanDerWaalsContact O-N 3.16Å; L216-H224 WeakPolarHBondContact CD1-CD2 3.09Å; L216-H224 WeakPolarHBondContact CD1-NE2 3.44Å; Y222-H224 VanDerWaalsContact C-N 3.34Å; Y222-H224 PolarHBondContact O-N 3.35Å; H224-M226 WeakPolarHBondContact CE1-CE 3.26Å; H224-M226 VanDerWaalsContact NE2-CE 3.29Å; H224-M226 WeakPolarHBondContact NE2-CE 3.45Å; H224-M226 WeakPolarHBondContact NE2-CG 3.31Å
225	V	87.4	Confident	74	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	133.1	177.1	179.7	0	0	0	0	110.9	F97 I117 F118 I119 L217 Y222	F97-V225 HydrophobicContact CD2-CB 4.48Å; F97-V225 HydrophobicContact CD2-CG1 3.39Å; F97-V225 HydrophobicContact CE2-CG1 3.43Å; F97-V225 VanDerWaalsContact CE2-CG1 3.43Å; F97-V225 HydrophobicContact CG-CG1 4.08Å; F97-V225 HydrophobicContact CZ-CG1 4.16Å; I117-V225 HydrophobicContact CG2-CG1 4.37Å; F118-V225 VanDerWaalsContact O-CA 3.28Å; F118-V225 WeakPolarHBondContact O-CA 3.13Å; I119-V225 HydrophobicContact CG1-CG2 4.38Å; L217-V225 PolarHBondContact N-O 2.82Å; Y222-V225 HydrophobicContact CD2-CG2 3.79Å; Y222-V225 HydrophobicContact CG-CG2 3.65Å
226	M	85.6	Confident	74.2	Confident	9 Å²	9	75.2 Å²	75.2	4%	0.044	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	139.8	172	-66.3	-172.1	-92.2	0	0	110.4	F118 T215 L216 H224 Y228	F118-M226 HydrophobicContact CB-CB 4.13Å; F118-M226 HydrophobicContact CD1-CB 4.43Å; F118-M226 HydrophobicContact CD1-CE 3.77Å; F118-M226 HydrophobicContact CE1-CE 4.05Å; F118-M226 PolarHBondContact N-O 2.88Å; F118-M226 PolarHBondContact O-N 3.44Å; T215-M226 WeakPolarHBondContact O-CA 3.23Å; L216-M226 HydrophobicContact CB-CG 4.49Å; L216-M226 HydrophobicContact CD1-CG 3.57Å; L216-M226 HydrophobicContact CD1-SD 4.18Å; H224-M226 WeakPolarHBondContact CE1-CE 3.26Å; H224-M226 VanDerWaalsContact NE2-CE 3.29Å; H224-M226 WeakPolarHBondContact NE2-CE 3.45Å; H224-M226 WeakPolarHBondContact NE2-CG 3.31Å; M226-Y228 HydrophobicContact CB-CE2 3.89Å; M226-Y228 PolarHBondContact SD-OH 3.4Å
227	L	86.3	Confident	74.3	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.9	172.6	-67.5	-175.3	0	0	0	109.9	F97 A100 L101 I117 G214 T215 L217	F97-L227 HydrophobicContact CE2-CD2 4.02Å; A100-L227 HydrophobicContact CB-CD1 3.75Å; L101-L227 HydrophobicContact CD2-CD1 4.46Å; L101-L227 HydrophobicContact CD2-CD2 4.02Å; I117-L227 HydrophobicContact CB-CD2 4.03Å; I117-L227 HydrophobicContact CD1-CD2 4.5Å; I117-L227 HydrophobicContact CG1-CD2 3.61Å; I117-L227 HydrophobicContact CG2-CD2 3.84Å; G214-L227 CarbonylContact C-O 3.59Å; G214-L227 VanDerWaalsContact CA-O 3.31Å; G214-L227 WeakPolarHBondContact CA-O 3.39Å; T215-L227 PolarHBondContact N-O 2.99Å; T215-L227 PolarHBondContact O-N 2.89Å; L217-L227 HydrophobicContact CD1-CD1 3.4Å; L217-L227 HydrophobicContact CD1-CG 3.71Å
228	Y	83.6	Confident	74.3	Confident	2 Å²	2	76 Å²	76	1%	0.008	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	105.8	173.7	-58.7	-87.8	0	0	0	108.7	S115 V116 F118 Y132 L200 P202 G214 M226	S115-Y228 CarbonylContact C-O 3.53Å; S115-Y228 WeakPolarHBondContact CA-O 3.25Å; V116-Y228 PolarHBondContact N-O 2.8Å; V116-Y228 PolarHBondContact O-N 3.14Å; F118-Y228 HydrophobicContact CB-CE2 4.02Å; Y132-Y228 HydrophobicContact CE1-CE2 4.02Å; L200-Y228 HydrophobicContact CD2-CG 4.32Å; P202-Y228 HydrophobicContact CB-CE2 4.36Å; P202-Y228 PolarHBondContact O-OH 2.76Å; G214-Y228 VanDerWaalsContact CA-CD1 3.42Å; M226-Y228 HydrophobicContact CB-CE2 3.89Å; M226-Y228 PolarHBondContact SD-OH 3.4Å
229	D	82.1	Confident	74.5	Confident	30 Å²	30	71.1 Å²	71.1	16%	0.16	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	142.1	-177.4	-64	-48.1	0	0	0	111.7	R104 M113 S115 S213	R104-D229 VanDerWaalsContact CD-OD1 3.31Å; R104-D229 WeakPolarHBondContact CD-OD1 3.33Å; R104-D229 IonicContact CZ-OD2 3.49Å; R104-D229 IonicContact NE-OD1 3.15Å; R104-D229 PolarHBondContact NE-OD1 2.94Å; R104-D229 IonicContact NE-OD2 2.63Å; R104-D229 PolarHBondContact NE-OD2 3.09Å; R104-D229 IonicContact NH2-OD2 2.87Å; R104-D229 PolarHBondContact NH2-OD2 3.26Å; M113-D229 HydrophobicContact SD-CB 4.1Å; S115-D229 WeakPolarHBondContact CB-OD1 3.47Å; S115-D229 PolarHBondContact OG-OD1 3.18Å; S213-D229 PolarHBondContact O-N 3.22Å
230	R	75.5	Confident	74.4	Confident	59 Å²	59	74.8 Å²	74.8	22%	0.223	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	109.6	175	-170.1	174.4	-167.5	104.6	29.1	111.1	M113 T114 D196 T198 V232	M113-R230 CarbonylContact C-O 3.52Å; M113-R230 WeakPolarHBondContact CA-O 3.46Å; M113-R230 WeakPolarHBondContact CG-O 3.45Å; T114-R230 PolarHBondContact N-O 2.87Å; T114-R230 WeakPolarHBondContact O-CB 3.37Å; T114-R230 PolarHBondContact O-N 3.47Å; D196-R230 IonicContact OD2-NE 2.67Å; T198-R230 VanDerWaalsContact CG2-NH2 3.31Å; T198-R230 PolarHBondContact OG1-NE 3.11Å; T198-R230 PolarHBondContact OG1-NH1 2.94Å; T198-R230 PolarHBondContact OG1-NH2 3.09Å; R230-V232 PolarHBondContact O-N 3.15Å
231	S	71.2	Confident	74.3	Confident	88 Å²	88	69.8 Å²	69.8	62%	0.615	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	123.4	169.3	53	0	0	0	0	110.1	R233	S231-R233 PolarHBondContact O-N 3.02Å
232	V	65.1	Low	74	Confident	21 Å²	21	69.9 Å²	69.9	13%	0.127	33%	0.333	C	S	.	.			trans	-84.6	107.3	171.7	-176.9	0	0	0	0	106.5	K112 T114 R230 M234	K112-V232 PolarHBondContact O-N 3.02Å; T114-V232 HydrophobicContact CG2-CG2 4.21Å; R230-V232 PolarHBondContact O-N 3.15Å; V232-M234 PolarHBondContact O-N 2.74Å
233	R	53.8	Low	73	Confident	202 Å²	202	74.1 Å²	74.1	76%	0.762	35%	0.354	S	S	*	.			trans	-71	111	172.7	-81.3	-175.6	177.7	-178	-1.9	107.9	S231 F235	S231-R233 PolarHBondContact O-N 3.02Å; R233-F235 PolarHBondContact O-N 2.86Å
234	M	44.9	Very low	71.9	Confident	146 Å²	146	72.8 Å²	72.8	72%	0.719	34%	0.339	S	S	*	.			trans	-74.1	120.9	161.9	-63.9	-160.4	-179.3	0	0	107.2	V232	V232-M234 PolarHBondContact O-N 2.74Å
235	F	42	Very low	70.7	Confident	262 Å²	262	74.5 Å²	74.5	100%	1.149	35%	0.346	S	S	*	.			trans	-83.4	0	162.5	-74.9	-82	0	0	0	109	R233	R233-F235 PolarHBondContact O-N 2.86Å

Retrieved 235 of 235 residues in 382.9 ms (Link to these results)

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