A0A060YCJ8_ONCMY Loading...

Inhibitor of growth protein

Component of an histone acetyltransferase complex.

AlphaFold DB (A0A673Z291), UniProt , Accession A0A060YCJ8, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 250 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	48.8	Very low	65.1	Low	220 Å²	220	98 Å²	98	100%	1.084	52%	0.524	S	S	*	.				0	-72.9	0	-72	-169.5	-83.2	0	0	111	A3 G4	M1-A3 PolarHBondContact O-N 2.71Å; M1-A3 VanDerWaalsContact O-N 3.08Å; M1-G4 PolarHBondContact O-N 3.46Å
2	A	57.2	Low	65.7	Low	47 Å²	47	99 Å²	99	39%	0.388	53%	0.529	S	S	.	.	H	α-helix	trans	-42.2	-49.5	-174.7	0	0	0	0	0	116.4	G4 M5 Y6	A2-G4 PolarHBondContact O-N 2.92Å; A2-G4 VanDerWaalsContact O-N 3.17Å; A2-M5 PolarHBondContact O-N 2.77Å; A2-M5 VanDerWaalsContact O-N 3.13Å; A2-Y6 HydrophobicContact CB-CE2 4.42Å; A2-Y6 VanDerWaalsContact O-CD2 3.29Å; A2-Y6 WeakPolarHBondContact O-CD2 3.29Å; A2-Y6 PolarHBondContact O-N 2.77Å; A2-Y6 VanDerWaalsContact O-N 3.17Å
3	A	57.7	Low	66.1	Low	77 Å²	77	91.5 Å²	91.5	64%	0.636	49%	0.489	S	S	*	.	H	α-helix	trans	-60.4	-25.1	-179.5	0	0	0	0	0	115.1	M1 L7	M1-A3 PolarHBondContact O-N 2.71Å; M1-A3 VanDerWaalsContact O-N 3.08Å; A3-L7 PolarHBondContact O-N 3.06Å
4	G	64.6	Low	66.9	Low	37 Å²	37	87.9 Å²	87.9	38%	0.381	47%	0.469	S	S	.	.	H	α-helix	trans	-71.3	-47.1	173.5	0	0	0	0	0	111.6	M1 A2 Y6 L7 E8	M1-G4 PolarHBondContact O-N 3.46Å; A2-G4 PolarHBondContact O-N 2.92Å; A2-G4 VanDerWaalsContact O-N 3.17Å; G4-Y6 VanDerWaalsContact C-N 3.29Å; G4-Y6 PolarHBondContact O-N 3.44Å; G4-L7 PolarHBondContact O-N 2.93Å; G4-E8 WeakPolarHBondContact O-CG 2.99Å; G4-E8 PolarHBondContact O-N 3.47Å
5	M	67.6	Low	67.7	Low	130 Å²	130	91.9 Å²	91.9	64%	0.64	48%	0.484	S	S	*	.	H	α-helix	trans	-62.5	-34.5	179.3	-60.8	176.9	68.8	0	0	112.6	A2 H9	A2-M5 PolarHBondContact O-N 2.77Å; A2-M5 VanDerWaalsContact O-N 3.13Å; M5-H9 WeakPolarHBondContact O-CB 3.36Å; M5-H9 PolarHBondContact O-N 3.02Å
6	Y	66.4	Low	68.6	Low	56 Å²	56	92.1 Å²	92.1	22%	0.22	49%	0.486	C	S	.	.	H	α-helix	trans	-68.2	-37.5	173.7	-75.7	-60.5	0	0	0	112.4	A2 G4 Y10 F107 D110	A2-Y6 HydrophobicContact CB-CE2 4.42Å; A2-Y6 VanDerWaalsContact O-CD2 3.29Å; A2-Y6 WeakPolarHBondContact O-CD2 3.29Å; A2-Y6 PolarHBondContact O-N 2.77Å; A2-Y6 VanDerWaalsContact O-N 3.17Å; G4-Y6 VanDerWaalsContact C-N 3.29Å; G4-Y6 PolarHBondContact O-N 3.44Å; Y6-Y10 WeakPolarHBondContact O-CB 3.31Å; Y6-Y10 PolarHBondContact O-N 2.99Å; Y6-Y10 VanDerWaalsContact O-N 3.08Å; Y6-F107 HydrophobicContact CD2-CD2 4Å; Y6-F107 HydrophobicContact CD2-CE2 4.41Å; Y6-F107 HydrophobicContact CE2-CD2 4.28Å; Y6-F107 HydrophobicContact CG-CD2 4.19Å; Y6-D110 PolarHBondContact OH-OD1 3.36Å; Y6-D110 PolarHBondContact OH-OD2 2.99Å; Y6-D110 VanDerWaalsContact OH-OD2 3.05Å
7	L	68.2	Low	69.7	Low	105 Å²	105	88.2 Å²	88.2	55%	0.55	47%	0.465	S	S	.	.	H	α-helix	trans	-70.7	-41.5	175.3	-174.3	64.3	0	0	0	111.7	A3 G4 Y10 L11	A3-L7 PolarHBondContact O-N 3.06Å; G4-L7 PolarHBondContact O-N 2.93Å; L7-Y10 PolarHBondContact O-N 3.2Å; L7-L11 HydrophobicContact CD1-CD1 4.42Å; L7-L11 HydrophobicContact CG-CD1 4.03Å; L7-L11 WeakPolarHBondContact O-CB 3.47Å; L7-L11 VanDerWaalsContact O-CG 3.25Å; L7-L11 WeakPolarHBondContact O-CG 3.25Å; L7-L11 PolarHBondContact O-N 3.02Å
8	E	70.8	Confident	70.8	Confident	122 Å²	122	87.5 Å²	87.5	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-59.8	-49	174.5	-71.7	165.5	167.3	0	0	110.9	G4 Y10 L11 D12	G4-E8 WeakPolarHBondContact O-CG 2.99Å; G4-E8 PolarHBondContact O-N 3.47Å; E8-Y10 VanDerWaalsContact C-N 3.32Å; E8-Y10 PolarHBondContact O-N 3.39Å; E8-L11 PolarHBondContact O-N 3.35Å; E8-D12 WeakPolarHBondContact O-CB 3.43Å; E8-D12 PolarHBondContact O-N 3.41Å
9	H	69	Low	71.9	Confident	72 Å²	72	90.2 Å²	90.2	33%	0.333	47%	0.474	S	S	.	.	H	α-helix	trans	-63.9	-34.9	177.8	-168.3	-104.1	0	0	0	113.1	M5 S13 R99 D103	M5-H9 WeakPolarHBondContact O-CB 3.36Å; M5-H9 PolarHBondContact O-N 3.02Å; H9-S13 WeakPolarHBondContact O-CB 3.49Å; H9-S13 PolarHBondContact O-N 3.03Å; H9-S13 PolarHBondContact O-OG 3.05Å; H9-R99 PolarHBondContact CE1-NH2 3.5Å; H9-R99 PolarHBondContact NE2-NH2 3.25Å; H9-D103 IonicContact CE1-OD1 3.31Å; H9-D103 PolarHBondContact CE1-OD1 2.87Å; H9-D103 VanDerWaalsContact CE1-OD1 3.25Å; H9-D103 IonicContact CE1-OD2 2.73Å; H9-D103 PolarHBondContact CE1-OD2 3.01Å; H9-D103 VanDerWaalsContact ND1-CG 3.32Å; H9-D103 IonicContact ND1-OD1 3.12Å; H9-D103 PolarHBondContact ND1-OD1 3.18Å; H9-D103 IonicContact ND1-OD2 2.72Å; H9-D103 PolarHBondContact ND1-OD2 3.31Å
10	Y	71.3	Confident	72.8	Confident	116 Å²	116	89.9 Å²	89.9	46%	0.455	47%	0.47	S	S	.	.	H	α-helix	trans	-66	-42.4	173.6	177	-90.5	0	0	0	112	Y6 L7 E8 S13 I14 L100	Y6-Y10 WeakPolarHBondContact O-CB 3.31Å; Y6-Y10 PolarHBondContact O-N 2.99Å; Y6-Y10 VanDerWaalsContact O-N 3.08Å; L7-Y10 PolarHBondContact O-N 3.2Å; E8-Y10 VanDerWaalsContact C-N 3.32Å; E8-Y10 PolarHBondContact O-N 3.39Å; Y10-S13 WeakPolarHBondContact O-CB 3.44Å; Y10-S13 PolarHBondContact O-N 3.32Å; Y10-I14 HydrophobicContact CD1-CD1 4.11Å; Y10-I14 HydrophobicContact CD2-CD1 4.18Å; Y10-I14 HydrophobicContact CE1-CD1 3.59Å; Y10-I14 HydrophobicContact CE2-CD1 3.68Å; Y10-I14 HydrophobicContact CG-CD1 4.38Å; Y10-I14 WeakPolarHBondContact O-CG1 3.24Å; Y10-I14 PolarHBondContact O-N 3.31Å; Y10-L100 HydrophobicContact CD2-CD2 3.58Å; Y10-L100 HydrophobicContact CE2-CD2 3.72Å
11	L	75.1	Confident	73.8	Confident	96 Å²	96	87.4 Å²	87.4	50%	0.503	46%	0.457	S	S	.	.	H	α-helix	trans	-68.5	-48.9	178.1	-69.7	169.6	0	0	0	111.7	L7 E8 S13 I14 E15	L7-L11 HydrophobicContact CD1-CD1 4.42Å; L7-L11 HydrophobicContact CG-CD1 4.03Å; L7-L11 WeakPolarHBondContact O-CB 3.47Å; L7-L11 VanDerWaalsContact O-CG 3.25Å; L7-L11 WeakPolarHBondContact O-CG 3.25Å; L7-L11 PolarHBondContact O-N 3.02Å; E8-L11 PolarHBondContact O-N 3.35Å; L11-S13 PolarHBondContact O-N 3.3Å; L11-S13 VanDerWaalsContact O-N 3.14Å; L11-I14 PolarHBondContact O-N 3.27Å; L11-E15 WeakPolarHBondContact O-CB 3.38Å; L11-E15 PolarHBondContact O-N 2.97Å
12	D	72.2	Confident	76	Confident	110 Å²	110	83 Å²	83	59%	0.588	43%	0.433	S	S	*	.	H	α-helix	trans	-53.7	-32.4	171.3	-82.8	17.2	0	0	0	112.1	E8 I14	E8-D12 WeakPolarHBondContact O-CB 3.43Å; E8-D12 PolarHBondContact O-N 3.41Å; D12-I14 VanDerWaalsContact C-N 3.32Å
13	S	70.5	Confident	77.8	Confident	1 Å²	1	86.7 Å²	86.7	1%	0.007	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-8.8	178.7	-62.3	0	0	0	0	114.2	H9 Y10 L11 H96 R99	H9-S13 WeakPolarHBondContact O-CB 3.49Å; H9-S13 PolarHBondContact O-N 3.03Å; H9-S13 PolarHBondContact O-OG 3.05Å; Y10-S13 WeakPolarHBondContact O-CB 3.44Å; Y10-S13 PolarHBondContact O-N 3.32Å; L11-S13 PolarHBondContact O-N 3.3Å; L11-S13 VanDerWaalsContact O-N 3.14Å; S13-H96 PolarHBondContact O-CE1 3.32Å; S13-H96 PolarHBondContact O-ND1 2.94Å; S13-R99 WeakPolarHBondContact OG-CD 3.15Å; S13-R99 PolarHBondContact OG-NE 2.93Å; S13-R99 PolarHBondContact OG-NH1 3.21Å; S13-R99 PolarHBondContact OG-NH2 3.26Å
14	I	77.8	Confident	79.6	Confident	41 Å²	41	83.3 Å²	83.3	21%	0.21	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.1	-27.5	-175.4	-66.6	176.8	0	0	0	112.7	Y10 L11 D12 N16 L17 P18 L100	Y10-I14 HydrophobicContact CD1-CD1 4.11Å; Y10-I14 HydrophobicContact CD2-CD1 4.18Å; Y10-I14 HydrophobicContact CE1-CD1 3.59Å; Y10-I14 HydrophobicContact CE2-CD1 3.68Å; Y10-I14 HydrophobicContact CG-CD1 4.38Å; Y10-I14 WeakPolarHBondContact O-CG1 3.24Å; Y10-I14 PolarHBondContact O-N 3.31Å; L11-I14 PolarHBondContact O-N 3.27Å; D12-I14 VanDerWaalsContact C-N 3.32Å; I14-N16 VanDerWaalsContact C-N 3.27Å; I14-N16 PolarHBondContact O-N 3.4Å; I14-L17 WeakPolarHBondContact O-CB 3.45Å; I14-L17 PolarHBondContact O-N 2.72Å; I14-P18 WeakPolarHBondContact O-CD 3.32Å; I14-L100 HydrophobicContact CD1-CD1 4.01Å; I14-L100 HydrophobicContact CD1-CD2 4.04Å; I14-L100 HydrophobicContact CG1-CD1 4.37Å; I14-L100 HydrophobicContact CG1-CD2 4.3Å
15	E	78.9	Confident	81.1	Confident	149 Å²	149	87.3 Å²	87.3	70%	0.696	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	-42.1	-168.7	-172.7	173.2	-133.5	0	0	114.4	L11	L11-E15 WeakPolarHBondContact O-CB 3.38Å; L11-E15 PolarHBondContact O-N 2.97Å
16	N	81.9	Confident	82.5	Confident	95 Å²	95	83.9 Å²	83.9	51%	0.508	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-23.5	-179.1	-63.8	-71	0	0	0	114.1	I14 F19 E20	I14-N16 VanDerWaalsContact C-N 3.27Å; I14-N16 PolarHBondContact O-N 3.4Å; N16-F19 PolarHBondContact O-N 3.49Å; N16-F19 VanDerWaalsContact O-N 3.14Å; N16-E20 PolarHBondContact O-N 2.84Å
17	L	87.3	Confident	84	Confident	25 Å²	25	84.5 Å²	84.5	13%	0.131	41%	0.407	C	S	.	.	H	α-helix	trans	-61.5	-45.1	-170.7	174.3	63.3	0	0	0	113.4	I14 F19 E20 L21 M92 V93 H96	I14-L17 WeakPolarHBondContact O-CB 3.45Å; I14-L17 PolarHBondContact O-N 2.72Å; L17-F19 VanDerWaalsContact C-N 3.28Å; L17-F19 PolarHBondContact O-N 2.9Å; L17-E20 PolarHBondContact O-N 3.03Å; L17-L21 HydrophobicContact CD1-CD1 3.77Å; L17-L21 HydrophobicContact CD1-CG 3.85Å; L17-L21 HydrophobicContact CG-CD1 3.86Å; L17-L21 HydrophobicContact CG-CG 4.39Å; L17-L21 VanDerWaalsContact O-CB 3.31Å; L17-L21 WeakPolarHBondContact O-CB 3.36Å; L17-L21 WeakPolarHBondContact O-CG 3.28Å; L17-L21 PolarHBondContact O-N 3.08Å; L17-M92 HydrophobicContact CD1-CE 3.81Å; L17-M92 HydrophobicContact CD1-CG 4.12Å; L17-M92 HydrophobicContact CD1-SD 4.22Å; L17-V93 HydrophobicContact CD1-CG2 4.3Å; L17-H96 HydrophobicContact CD2-CB 3.88Å
18	P	89.9	Confident	85.4	Confident	76 Å²	76	81 Å²	81	49%	0.494	39%	0.388	S	S	.	.	H	α-helix	trans	-60	-36.3	175.2	-25.5	34.7	0	0	0	113.4	I14 Q22	I14-P18 WeakPolarHBondContact O-CD 3.32Å; P18-Q22 VanDerWaalsContact O-CB 3.24Å; P18-Q22 WeakPolarHBondContact O-CB 3.2Å; P18-Q22 PolarHBondContact O-N 2.91Å
19	F	90.2	Very high	86.7	Confident	138 Å²	138	82.3 Å²	82.3	61%	0.605	39%	0.388	S	S	*	.	H	α-helix	trans	-72.5	-44.7	179.8	179.8	-100.3	0	0	0	111.6	N16 L17 Q22 R23	N16-F19 PolarHBondContact O-N 3.49Å; N16-F19 VanDerWaalsContact O-N 3.14Å; L17-F19 VanDerWaalsContact C-N 3.28Å; L17-F19 PolarHBondContact O-N 2.9Å; F19-Q22 PolarHBondContact O-N 3.47Å; F19-R23 VanDerWaalsContact O-CB 3.29Å; F19-R23 WeakPolarHBondContact O-CB 3.27Å; F19-R23 PolarHBondContact O-N 2.88Å
20	E	91.1	Very high	88	Confident	85 Å²	85	82.1 Å²	82.1	40%	0.397	39%	0.389	S	S	.	.	H	α-helix	trans	-66.2	-40	176.5	-66.7	-169.9	166.7	0	0	111.7	N16 L17 R23 N24 M92	N16-E20 PolarHBondContact O-N 2.84Å; L17-E20 PolarHBondContact O-N 3.03Å; E20-R23 PolarHBondContact O-N 3.15Å; E20-N24 WeakPolarHBondContact O-CB 3.4Å; E20-N24 PolarHBondContact O-N 2.91Å; E20-N24 PolarHBondContact O-OD1 3.4Å; E20-M92 HydrophobicContact CB-CE 4.41Å; E20-M92 HydrophobicContact CB-SD 3.65Å
21	L	93.1	Very high	89.3	Confident	38 Å²	38	77.5 Å²	77.5	20%	0.199	37%	0.372	C	S	.	.	H	α-helix	trans	-59.5	-51.6	170.2	-78.4	169.6	0	0	0	112	L17 R23 N24 F25 T89 M92 V93	L17-L21 HydrophobicContact CD1-CD1 3.77Å; L17-L21 HydrophobicContact CD1-CG 3.85Å; L17-L21 HydrophobicContact CG-CD1 3.86Å; L17-L21 HydrophobicContact CG-CG 4.39Å; L17-L21 VanDerWaalsContact O-CB 3.31Å; L17-L21 WeakPolarHBondContact O-CB 3.36Å; L17-L21 WeakPolarHBondContact O-CG 3.28Å; L17-L21 PolarHBondContact O-N 3.08Å; L21-R23 VanDerWaalsContact C-N 3.28Å; L21-R23 PolarHBondContact O-N 3.06Å; L21-N24 PolarHBondContact O-N 3.27Å; L21-F25 HydrophobicContact CB-CD2 4.3Å; L21-F25 HydrophobicContact CB-CE2 4.16Å; L21-F25 HydrophobicContact CD2-CE2 3.84Å; L21-F25 HydrophobicContact CD2-CZ 4.3Å; L21-F25 WeakPolarHBondContact O-CD2 3.48Å; L21-F25 PolarHBondContact O-N 2.87Å; L21-T89 HydrophobicContact CD2-CG2 3.68Å; L21-M92 HydrophobicContact CD2-CE 3.54Å; L21-M92 HydrophobicContact CG-CE 3.68Å; L21-V93 HydrophobicContact CD1-CG2 4.45Å; L21-V93 HydrophobicContact CD2-CG2 3.78Å
22	Q	94.6	Very high	90.3	Very high	126 Å²	126	76.1 Å²	76.1	59%	0.589	37%	0.365	S	S	*	.	H	α-helix	trans	-61	-39.4	-179.5	-173.4	179	16.9	0	0	111.5	P18 F19 N26	P18-Q22 VanDerWaalsContact O-CB 3.24Å; P18-Q22 WeakPolarHBondContact O-CB 3.2Å; P18-Q22 PolarHBondContact O-N 2.91Å; F19-Q22 PolarHBondContact O-N 3.47Å; Q22-N26 PolarHBondContact O-N 3Å; Q22-N26 VanDerWaalsContact O-N 3.16Å; Q22-N26 PolarHBondContact O-ND2 3.39Å
23	R	95.4	Very high	91.5	Very high	126 Å²	126	76.2 Å²	76.2	48%	0.475	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-51.2	173	177.5	-177.6	170	-79.8	2.1	111.1	F19 E20 L21 N26 L27	F19-R23 VanDerWaalsContact O-CB 3.29Å; F19-R23 WeakPolarHBondContact O-CB 3.27Å; F19-R23 PolarHBondContact O-N 2.88Å; E20-R23 PolarHBondContact O-N 3.15Å; L21-R23 VanDerWaalsContact C-N 3.28Å; L21-R23 PolarHBondContact O-N 3.06Å; R23-N26 PolarHBondContact O-N 3.22Å; R23-L27 HydrophobicContact CG-CD1 4.25Å; R23-L27 WeakPolarHBondContact O-CD1 3.42Å; R23-L27 PolarHBondContact O-N 3.49Å
24	N	95.8	Very high	92.8	Very high	5 Å²	5	82.1 Å²	82.1	3%	0.027	38%	0.384	C	S	.	.	H	α-helix	trans	-67.5	-39.8	-175.6	-67.6	2.2	0	0	0	112.1	E20 L21 N26 L27 M28 L85 T89	E20-N24 WeakPolarHBondContact O-CB 3.4Å; E20-N24 PolarHBondContact O-N 2.91Å; E20-N24 PolarHBondContact O-OD1 3.4Å; L21-N24 PolarHBondContact O-N 3.27Å; N24-N26 VanDerWaalsContact C-N 3.35Å; N24-N26 PolarHBondContact O-N 3.2Å; N24-L27 PolarHBondContact O-N 3.01Å; N24-M28 WeakPolarHBondContact O-CB 3.29Å; N24-M28 PolarHBondContact O-N 3.46Å; N24-L85 HydrophobicContact CB-CD1 4.03Å; N24-T89 HydrophobicContact CB-CG2 4.3Å; N24-T89 WeakPolarHBondContact CB-OG1 3.31Å; N24-T89 PolarHBondContact ND2-OG1 3.41Å
25	F	96.3	Very high	93.7	Very high	122 Å²	122	80.8 Å²	80.8	54%	0.535	38%	0.378	S	S	.	.	H	α-helix	trans	-64.5	-35.9	174	-72.9	-55.7	0	0	0	112.9	L21 M28 R29	L21-F25 HydrophobicContact CB-CD2 4.3Å; L21-F25 HydrophobicContact CB-CE2 4.16Å; L21-F25 HydrophobicContact CD2-CE2 3.84Å; L21-F25 HydrophobicContact CD2-CZ 4.3Å; L21-F25 WeakPolarHBondContact O-CD2 3.48Å; L21-F25 PolarHBondContact O-N 2.87Å; F25-M28 PolarHBondContact O-N 3.35Å; F25-R29 PolarHBondContact O-N 3.04Å
26	N	96.9	Very high	94.6	Very high	57 Å²	57	78.6 Å²	78.6	31%	0.305	37%	0.368	S	S	.	.	H	α-helix	trans	-64.8	-48.5	172.3	-79.8	-59	0	0	0	111.3	Q22 R23 N24 M28 R29 D30	Q22-N26 PolarHBondContact O-N 3Å; Q22-N26 VanDerWaalsContact O-N 3.16Å; Q22-N26 PolarHBondContact O-ND2 3.39Å; R23-N26 PolarHBondContact O-N 3.22Å; N24-N26 VanDerWaalsContact C-N 3.35Å; N24-N26 PolarHBondContact O-N 3.2Å; N26-M28 VanDerWaalsContact C-N 3.27Å; N26-M28 PolarHBondContact O-N 2.97Å; N26-R29 PolarHBondContact O-N 2.85Å; N26-R29 PolarHBondContact OD1-NH2 3.03Å; N26-D30 VanDerWaalsContact O-CG 3.29Å; N26-D30 PolarHBondContact O-N 2.92Å
27	L	97.1	Very high	95.3	Very high	70 Å²	70	77.8 Å²	77.8	37%	0.366	36%	0.364	S	S	.	.	H	α-helix	trans	-58.1	-39.3	175.4	-94.1	66.5	0	0	0	112.2	R23 N24 D30 L31 L85	R23-L27 HydrophobicContact CG-CD1 4.25Å; R23-L27 WeakPolarHBondContact O-CD1 3.42Å; R23-L27 PolarHBondContact O-N 3.49Å; N24-L27 PolarHBondContact O-N 3.01Å; L27-D30 PolarHBondContact O-N 3.24Å; L27-L31 WeakPolarHBondContact O-CG 3.41Å; L27-L31 PolarHBondContact O-N 3.35Å; L27-L85 HydrophobicContact CB-CD2 3.64Å
28	M	97.4	Very high	95.8	Very high	30 Å²	30	77.6 Å²	77.6	15%	0.148	36%	0.363	C	S	.	.	H	α-helix	trans	-67.1	-40.3	179.5	-164.4	-179.2	-62.8	0	0	111.9	N24 F25 N26 L31 D32 K82 L85 A86	N24-M28 WeakPolarHBondContact O-CB 3.29Å; N24-M28 PolarHBondContact O-N 3.46Å; F25-M28 PolarHBondContact O-N 3.35Å; N26-M28 VanDerWaalsContact C-N 3.27Å; N26-M28 PolarHBondContact O-N 2.97Å; M28-L31 PolarHBondContact O-N 3.29Å; M28-D32 PolarHBondContact O-N 2.83Å; M28-K82 HydrophobicContact CG-CD 4.34Å; M28-K82 HydrophobicContact CG-CG 3.79Å; M28-L85 HydrophobicContact CB-CD2 3.88Å; M28-L85 HydrophobicContact CE-CG 4.31Å; M28-A86 HydrophobicContact CE-CB 3.83Å
29	R	97.9	Very high	96.1	Very high	150 Å²	150	78.3 Å²	78.3	57%	0.566	36%	0.358	S	S	*	.	H	α-helix	trans	-66.3	-38	172.8	-172	-172.2	64.5	-151.6	-14.3	112	F25 N26 L31 D32 Q33	F25-R29 PolarHBondContact O-N 3.04Å; N26-R29 PolarHBondContact O-N 2.85Å; N26-R29 PolarHBondContact OD1-NH2 3.03Å; R29-L31 VanDerWaalsContact C-N 3.35Å; R29-D32 PolarHBondContact O-N 2.94Å; R29-Q33 PolarHBondContact O-N 3.34Å
30	D	97.4	Very high	96.4	Very high	68 Å²	68	73.8 Å²	73.8	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-68.3	-35.2	177.6	-68.9	-0.1	0	0	0	111.6	N26 L27 R34	N26-D30 VanDerWaalsContact O-CG 3.29Å; N26-D30 PolarHBondContact O-N 2.92Å; L27-D30 PolarHBondContact O-N 3.24Å; D30-R34 WeakPolarHBondContact O-CD 3.47Å; D30-R34 WeakPolarHBondContact O-CG 3.44Å; D30-R34 PolarHBondContact O-N 3.05Å
31	L	97.3	Very high	96.7	Very high	19 Å²	19	74.6 Å²	74.6	10%	0.099	35%	0.354	C	S	.	.	H	α-helix	trans	-66.6	-43.5	169.9	-74.7	168.9	0	0	0	111.8	L27 M28 R29 R34 T35 F78 D81 K82 L85	L27-L31 WeakPolarHBondContact O-CG 3.41Å; L27-L31 PolarHBondContact O-N 3.35Å; M28-L31 PolarHBondContact O-N 3.29Å; R29-L31 VanDerWaalsContact C-N 3.35Å; L31-R34 PolarHBondContact O-N 2.96Å; L31-T35 WeakPolarHBondContact O-CB 3.3Å; L31-T35 PolarHBondContact O-N 3.37Å; L31-T35 PolarHBondContact O-OG1 3.28Å; L31-F78 HydrophobicContact CD2-CB 4.19Å; L31-F78 HydrophobicContact CD2-CD1 3.84Å; L31-F78 HydrophobicContact CD2-CG 4.28Å; L31-D81 HydrophobicContact CD1-CB 4.04Å; L31-D81 HydrophobicContact CD2-CB 4.02Å; L31-K82 HydrophobicContact CD1-CB 4.31Å; L31-L85 HydrophobicContact CD1-CD2 4.02Å
32	D	97.3	Very high	96.8	Very high	68 Å²	68	73 Å²	73	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-59.5	-47.9	175.1	-88.6	-35.2	0	0	0	112	M28 R29 R34 T35 E36 K82	M28-D32 PolarHBondContact O-N 2.83Å; R29-D32 PolarHBondContact O-N 2.94Å; D32-R34 PolarHBondContact O-N 3Å; D32-T35 WeakPolarHBondContact O-CB 3.45Å; D32-T35 PolarHBondContact O-N 3.44Å; D32-T35 VanDerWaalsContact O-N 3.15Å; D32-E36 PolarHBondContact O-N 2.9Å; D32-K82 WeakPolarHBondContact OD1-CD 3.38Å; D32-K82 VanDerWaalsContact OD1-CE 3.31Å; D32-K82 WeakPolarHBondContact OD1-CE 3.5Å; D32-K82 IonicContact OD1-NZ 2.64Å; D32-K82 PolarHBondContact OD1-NZ 2.84Å; D32-K82 WeakPolarHBondContact OD2-CE 3.34Å; D32-K82 IonicContact OD2-NZ 2.64Å; D32-K82 PolarHBondContact OD2-NZ 3.17Å
33	Q	97.8	Very high	97	Very high	111 Å²	111	71.1 Å²	71.1	52%	0.519	34%	0.34	S	S	.	.	H	α-helix	trans	-60.3	-47.6	179.3	-173.4	62.4	59.7	0	0	111.4	R29 T35 E36 D37	R29-Q33 PolarHBondContact O-N 3.34Å; Q33-T35 PolarHBondContact O-N 3.13Å; Q33-E36 PolarHBondContact O-N 2.86Å; Q33-E36 VanDerWaalsContact O-N 3.17Å; Q33-D37 PolarHBondContact NE2-OD1 2.63Å; Q33-D37 WeakPolarHBondContact O-CB 3.47Å; Q33-D37 PolarHBondContact O-N 3.5Å
34	R	97.1	Very high	97	Very high	125 Å²	125	68 Å²	68	47%	0.472	34%	0.337	S	S	.	.	H	α-helix	trans	-61.3	-34.1	176.6	-68.7	167.5	-170	-176.4	6.1	112.8	D30 L31 D32 L38 F78	D30-R34 WeakPolarHBondContact O-CD 3.47Å; D30-R34 WeakPolarHBondContact O-CG 3.44Å; D30-R34 PolarHBondContact O-N 3.05Å; L31-R34 PolarHBondContact O-N 2.96Å; D32-R34 PolarHBondContact O-N 3Å; R34-L38 WeakPolarHBondContact O-CG 3.2Å; R34-L38 PolarHBondContact O-N 3.49Å; R34-L38 VanDerWaalsContact O-N 3.13Å; R34-F78 HydrophobicContact CB-CD2 3.83Å; R34-F78 HydrophobicContact CB-CE2 3.67Å; R34-F78 HydrophobicContact CB-CZ 4.3Å; R34-F78 HydrophobicContact CG-CE2 4.48Å
35	T	97.3	Very high	97	Very high	14 Å²	14	69.5 Å²	69.5	9%	0.086	35%	0.345	C	S	.	.	H	α-helix	trans	-69.6	-42.2	176.9	-57.6	0	0	0	0	110.5	L31 D32 Q33 L38 K39 F78	L31-T35 WeakPolarHBondContact O-CB 3.3Å; L31-T35 PolarHBondContact O-N 3.37Å; L31-T35 PolarHBondContact O-OG1 3.28Å; D32-T35 WeakPolarHBondContact O-CB 3.45Å; D32-T35 PolarHBondContact O-N 3.44Å; D32-T35 VanDerWaalsContact O-N 3.15Å; Q33-T35 PolarHBondContact O-N 3.13Å; T35-L38 PolarHBondContact O-N 3.36Å; T35-K39 WeakPolarHBondContact O-CG 3.25Å; T35-K39 PolarHBondContact O-N 2.84Å; T35-F78 WeakPolarHBondContact OG1-CB 3.42Å
36	E	97.1	Very high	97	Very high	102 Å²	102	65.4 Å²	65.4	48%	0.477	33%	0.333	S	S	.	.	H	α-helix	trans	-70.3	-38.9	177.2	-153.1	62.2	-150.7	0	0	112.3	D32 Q33 L38 K39 G40	D32-E36 PolarHBondContact O-N 2.9Å; Q33-E36 PolarHBondContact O-N 2.86Å; Q33-E36 VanDerWaalsContact O-N 3.17Å; E36-L38 VanDerWaalsContact C-N 3.31Å; E36-L38 PolarHBondContact O-N 3.43Å; E36-K39 WeakPolarHBondContact O-CB 3.43Å; E36-K39 PolarHBondContact O-N 3.46Å; E36-K39 WeakPolarHBondContact OE2-CD 3.2Å; E36-K39 IonicContact OE2-NZ 2.61Å; E36-K39 PolarHBondContact OE2-NZ 3.36Å; E36-G40 PolarHBondContact O-N 3.43Å
37	D	97	Very high	96.9	Very high	78 Å²	78	68.1 Å²	68.1	42%	0.417	34%	0.343	S	S	.	.	H	α-helix	trans	-58.8	-42.4	173.2	-65.1	-19.6	0	0	0	111.1	Q33 G40 Q41	Q33-D37 PolarHBondContact NE2-OD1 2.63Å; Q33-D37 WeakPolarHBondContact O-CB 3.47Å; Q33-D37 PolarHBondContact O-N 3.5Å; D37-G40 PolarHBondContact O-N 3.47Å; D37-Q41 WeakPolarHBondContact O-CG 3.36Å; D37-Q41 PolarHBondContact O-N 2.91Å
38	L	96.8	Very high	96.7	Very high	21 Å²	21	68.3 Å²	68.3	11%	0.11	34%	0.344	C	S	.	.	H	α-helix	trans	-68.3	-40.2	175.4	-77.4	177.3	0	0	0	112.6	R34 T35 E36 G40 Q41 I42 K74 F78	R34-L38 WeakPolarHBondContact O-CG 3.2Å; R34-L38 PolarHBondContact O-N 3.49Å; R34-L38 VanDerWaalsContact O-N 3.13Å; T35-L38 PolarHBondContact O-N 3.36Å; E36-L38 VanDerWaalsContact C-N 3.31Å; E36-L38 PolarHBondContact O-N 3.43Å; L38-G40 VanDerWaalsContact C-N 3.33Å; L38-G40 PolarHBondContact O-N 3.19Å; L38-Q41 PolarHBondContact O-N 2.96Å; L38-I42 WeakPolarHBondContact O-CD1 3.14Å; L38-I42 VanDerWaalsContact O-CG1 3.26Å; L38-I42 WeakPolarHBondContact O-CG1 3.18Å; L38-I42 PolarHBondContact O-N 3Å; L38-K74 HydrophobicContact CD1-CB 3.82Å; L38-K74 HydrophobicContact CD1-CG 3.78Å; L38-F78 HydrophobicContact CD1-CD2 3.77Å; L38-F78 HydrophobicContact CD1-CE2 3.65Å
39	K	96.1	Very high	96.5	Very high	91 Å²	91	70 Å²	70	40%	0.396	35%	0.349	S	S	.	.	H	α-helix	trans	-57.8	-47	171.5	-71	174.2	-158.9	155.6	0	110.6	T35 E36 Q41 I42 D43	T35-K39 WeakPolarHBondContact O-CG 3.25Å; T35-K39 PolarHBondContact O-N 2.84Å; E36-K39 WeakPolarHBondContact O-CB 3.43Å; E36-K39 PolarHBondContact O-N 3.46Å; E36-K39 WeakPolarHBondContact OE2-CD 3.2Å; E36-K39 IonicContact OE2-NZ 2.61Å; E36-K39 PolarHBondContact OE2-NZ 3.36Å; K39-Q41 VanDerWaalsContact C-N 3.31Å; K39-Q41 PolarHBondContact O-N 3.31Å; K39-I42 WeakPolarHBondContact O-CB 3.39Å; K39-I42 PolarHBondContact O-N 2.98Å; K39-D43 WeakPolarHBondContact O-CB 3.41Å; K39-D43 PolarHBondContact O-N 2.93Å
40	G	97.3	Very high	96.3	Very high	43 Å²	43	67.8 Å²	67.8	44%	0.443	35%	0.352	S	S	.	.	H	α-helix	trans	-58	-40.4	177.4	0	0	0	0	0	113.2	E36 D37 L38 D43 S44	E36-G40 PolarHBondContact O-N 3.43Å; D37-G40 PolarHBondContact O-N 3.47Å; L38-G40 VanDerWaalsContact C-N 3.33Å; L38-G40 PolarHBondContact O-N 3.19Å; G40-D43 PolarHBondContact O-N 3.26Å; G40-S44 PolarHBondContact O-N 3.47Å
41	Q	96.6	Very high	96.2	Very high	102 Å²	102	69.1 Å²	69.1	48%	0.477	37%	0.367	S	S	.	.	H	α-helix	trans	-66.7	-45	174.2	-70.1	170.1	38.6	0	0	112.6	D37 L38 K39 D43 S44 L45	D37-Q41 WeakPolarHBondContact O-CG 3.36Å; D37-Q41 PolarHBondContact O-N 2.91Å; L38-Q41 PolarHBondContact O-N 2.96Å; K39-Q41 VanDerWaalsContact C-N 3.31Å; K39-Q41 PolarHBondContact O-N 3.31Å; Q41-D43 VanDerWaalsContact C-N 3.31Å; Q41-D43 PolarHBondContact O-N 3.46Å; Q41-S44 PolarHBondContact O-N 3.18Å; Q41-L45 WeakPolarHBondContact O-CB 3.49Å; Q41-L45 WeakPolarHBondContact O-CG 3.43Å; Q41-L45 PolarHBondContact O-N 2.93Å
42	I	96.9	Very high	95.9	Very high	6 Å²	6	71.5 Å²	71.5	3%	0.031	38%	0.38	C	S	.	.	H	α-helix	trans	-56.8	-47.2	174.1	-71.3	161.9	0	0	0	110.2	L38 K39 S44 L45 A46 I68 Y72	L38-I42 WeakPolarHBondContact O-CD1 3.14Å; L38-I42 VanDerWaalsContact O-CG1 3.26Å; L38-I42 WeakPolarHBondContact O-CG1 3.18Å; L38-I42 PolarHBondContact O-N 3Å; K39-I42 WeakPolarHBondContact O-CB 3.39Å; K39-I42 PolarHBondContact O-N 2.98Å; I42-S44 PolarHBondContact O-N 2.84Å; I42-L45 PolarHBondContact O-N 3.41Å; I42-A46 VanDerWaalsContact O-CB 3.28Å; I42-A46 WeakPolarHBondContact O-CB 3.5Å; I42-A46 PolarHBondContact O-N 2.61Å; I42-I68 HydrophobicContact CG2-CG2 4.44Å; I42-Y72 HydrophobicContact CD1-CD1 4.07Å; I42-Y72 HydrophobicContact CD1-CD2 4.03Å; I42-Y72 HydrophobicContact CD1-CE1 4.31Å; I42-Y72 HydrophobicContact CD1-CE2 4.29Å; I42-Y72 HydrophobicContact CD1-CG 3.92Å; I42-Y72 HydrophobicContact CG1-CD2 4.37Å; I42-Y72 HydrophobicContact CG2-CD2 4.07Å; I42-Y72 HydrophobicContact CG2-CE2 3.46Å; I42-Y72 VanDerWaalsContact CG2-CE2 3.46Å
43	D	97.4	Very high	95.5	Very high	85 Å²	85	70 Å²	70	46%	0.455	38%	0.377	S	S	.	.	H	α-helix	trans	-63	-40.3	-179.6	-120.8	42.2	0	0	0	111.8	K39 G40 Q41 K47	K39-D43 WeakPolarHBondContact O-CB 3.41Å; K39-D43 PolarHBondContact O-N 2.93Å; G40-D43 PolarHBondContact O-N 3.26Å; Q41-D43 VanDerWaalsContact C-N 3.31Å; Q41-D43 PolarHBondContact O-N 3.46Å; D43-K47 WeakPolarHBondContact O-CB 3.32Å; D43-K47 WeakPolarHBondContact O-CD 3.47Å; D43-K47 WeakPolarHBondContact O-CE 3.26Å; D43-K47 WeakPolarHBondContact O-CG 3.28Å; D43-K47 PolarHBondContact O-N 3.44Å; D43-K47 VanDerWaalsContact OD2-CE 3.25Å; D43-K47 WeakPolarHBondContact OD2-CE 3.36Å; D43-K47 IonicContact OD2-NZ 2.63Å; D43-K47 PolarHBondContact OD2-NZ 2.94Å
44	S	96.5	Very high	95.1	Very high	60 Å²	60	76.7 Å²	76.7	42%	0.42	40%	0.398	S	S	.	.	H	α-helix	trans	-64.2	-52.4	174.4	-163	0	0	0	0	111	G40 Q41 I42 A46 K47 D48	G40-S44 PolarHBondContact O-N 3.47Å; Q41-S44 PolarHBondContact O-N 3.18Å; I42-S44 PolarHBondContact O-N 2.84Å; S44-A46 VanDerWaalsContact C-N 3.26Å; S44-A46 PolarHBondContact O-N 3.33Å; S44-K47 PolarHBondContact O-N 2.94Å; S44-K47 VanDerWaalsContact O-N 3.08Å; S44-D48 WeakPolarHBondContact O-CB 3.46Å; S44-D48 PolarHBondContact O-N 3.31Å
45	L	95.5	Very high	94.9	Very high	38 Å²	38	76 Å²	76	20%	0.199	41%	0.408	C	S	.	.	H	α-helix	trans	-59	-37.5	179.5	-70.4	170.5	0	0	0	112.1	Q41 I42 Y49 I64 Q67 I68	Q41-L45 WeakPolarHBondContact O-CB 3.49Å; Q41-L45 WeakPolarHBondContact O-CG 3.43Å; Q41-L45 PolarHBondContact O-N 2.93Å; I42-L45 PolarHBondContact O-N 3.41Å; L45-Y49 WeakPolarHBondContact O-CB 3.41Å; L45-Y49 PolarHBondContact O-N 2.77Å; L45-I64 HydrophobicContact CB-CG2 4.15Å; L45-I64 HydrophobicContact CD2-CG2 4.34Å; L45-Q67 HydrophobicContact CD1-CB 3.96Å; L45-I68 HydrophobicContact CB-CD1 3.93Å; L45-I68 HydrophobicContact CB-CG1 3.6Å; L45-I68 HydrophobicContact CD1-CG1 4.13Å
46	A	95.6	Very high	94.7	Very high	35 Å²	35	76.7 Å²	76.7	29%	0.289	41%	0.41	S	S	.	.	H	α-helix	trans	-68.3	-39.9	175.5	0	0	0	0	0	112.5	I42 S44 T50 I68	I42-A46 VanDerWaalsContact O-CB 3.28Å; I42-A46 WeakPolarHBondContact O-CB 3.5Å; I42-A46 PolarHBondContact O-N 2.61Å; S44-A46 VanDerWaalsContact C-N 3.26Å; S44-A46 PolarHBondContact O-N 3.33Å; A46-T50 VanDerWaalsContact O-CB 3.29Å; A46-T50 WeakPolarHBondContact O-CB 3.43Å; A46-T50 PolarHBondContact O-N 3.46Å; A46-T50 PolarHBondContact O-OG1 3.25Å; A46-I68 HydrophobicContact CB-CD1 4.45Å
47	K	95.7	Very high	94.6	Very high	115 Å²	115	74.4 Å²	74.4	50%	0.5	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-42.7	175	-71.7	159.5	-161	165.3	0	111.4	D43 S44 T50 S51	D43-K47 WeakPolarHBondContact O-CB 3.32Å; D43-K47 WeakPolarHBondContact O-CD 3.47Å; D43-K47 WeakPolarHBondContact O-CE 3.26Å; D43-K47 WeakPolarHBondContact O-CG 3.28Å; D43-K47 PolarHBondContact O-N 3.44Å; D43-K47 VanDerWaalsContact OD2-CE 3.25Å; D43-K47 WeakPolarHBondContact OD2-CE 3.36Å; D43-K47 IonicContact OD2-NZ 2.63Å; D43-K47 PolarHBondContact OD2-NZ 2.94Å; S44-K47 PolarHBondContact O-N 2.94Å; S44-K47 VanDerWaalsContact O-N 3.08Å; K47-T50 PolarHBondContact O-N 2.91Å; K47-S51 VanDerWaalsContact O-CB 3.27Å; K47-S51 WeakPolarHBondContact O-CB 3.46Å; K47-S51 PolarHBondContact O-N 3.12Å; K47-S51 PolarHBondContact O-OG 3.39Å
48	D	92.2	Very high	94.4	Very high	74 Å²	74	75.2 Å²	75.2	40%	0.396	42%	0.417	S	S	.	.	H	α-helix	trans	-65.2	-45.6	177.1	-70.2	-36.1	0	0	0	111.6	S44 T50 N52	S44-D48 WeakPolarHBondContact O-CB 3.46Å; S44-D48 PolarHBondContact O-N 3.31Å; D48-T50 PolarHBondContact O-N 2.93Å; D48-N52 WeakPolarHBondContact O-CB 3.37Å; D48-N52 PolarHBondContact O-N 2.87Å; D48-N52 PolarHBondContact O-ND2 2.84Å
49	Y	93.6	Very high	94.3	Very high	64 Å²	64	81.3 Å²	81.3	25%	0.251	45%	0.445	S	S	.	.	H	α-helix	trans	-57.5	-48.4	173.6	-179.4	-88.5	0	0	0	111.6	L45 A53 K61 I64 L65	L45-Y49 WeakPolarHBondContact O-CB 3.41Å; L45-Y49 PolarHBondContact O-N 2.77Å; Y49-A53 VanDerWaalsContact O-CA 3.24Å; Y49-A53 WeakPolarHBondContact O-CA 3.35Å; Y49-A53 VanDerWaalsContact O-CB 3.31Å; Y49-A53 WeakPolarHBondContact O-CB 3.46Å; Y49-A53 PolarHBondContact O-N 3.1Å; Y49-K61 HydrophobicContact CE2-CB 3.98Å; Y49-K61 HydrophobicContact CE2-CG 3.79Å; Y49-I64 HydrophobicContact CD2-CB 4.34Å; Y49-I64 HydrophobicContact CD2-CG2 4.21Å; Y49-L65 HydrophobicContact CD2-CG 4.48Å; Y49-L65 HydrophobicContact CE2-CD1 4.12Å; Y49-L65 HydrophobicContact CE2-CD2 4.14Å; Y49-L65 HydrophobicContact CE2-CG 3.9Å
50	T	93.8	Very high	94.1	Very high	104 Å²	104	81.8 Å²	81.8	64%	0.638	45%	0.449	S	S	*	.	H	α-helix	trans	-67.8	-45.1	-176.2	-57.5	0	0	0	0	111.5	A46 K47 D48 N52 A53	A46-T50 VanDerWaalsContact O-CB 3.29Å; A46-T50 WeakPolarHBondContact O-CB 3.43Å; A46-T50 PolarHBondContact O-N 3.46Å; A46-T50 PolarHBondContact O-OG1 3.25Å; K47-T50 PolarHBondContact O-N 2.91Å; D48-T50 PolarHBondContact O-N 2.93Å; T50-N52 VanDerWaalsContact C-N 3.33Å; T50-N52 PolarHBondContact O-N 2.99Å; T50-A53 WeakPolarHBondContact O-CB 3.5Å; T50-A53 PolarHBondContact O-N 3.25Å
51	S	94.4	Very high	94	Very high	97 Å²	97	82.2 Å²	82.2	68%	0.678	44%	0.438	S	S	*	.	H	α-helix	trans	-64.9	-37.6	-179.2	-56	0	0	0	0	112.2	K47	K47-S51 VanDerWaalsContact O-CB 3.27Å; K47-S51 WeakPolarHBondContact O-CB 3.46Å; K47-S51 PolarHBondContact O-N 3.12Å; K47-S51 PolarHBondContact O-OG 3.39Å
52	N	92.9	Very high	93.9	Very high	69 Å²	69	81.9 Å²	81.9	37%	0.369	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	13.2	-176.3	-58.3	-77.2	0	0	0	113.1	D48 T50 R54 T55 L56	D48-N52 WeakPolarHBondContact O-CB 3.37Å; D48-N52 PolarHBondContact O-N 2.87Å; D48-N52 PolarHBondContact O-ND2 2.84Å; T50-N52 VanDerWaalsContact C-N 3.33Å; T50-N52 PolarHBondContact O-N 2.99Å; N52-R54 PolarHBondContact O-N 3.04Å; N52-T55 PolarHBondContact O-N 2.8Å; N52-T55 PolarHBondContact O-OG1 3.07Å; N52-L56 HydrophobicContact CB-CD1 3.3Å; N52-L56 WeakPolarHBondContact O-CD1 3.32Å; N52-L56 PolarHBondContact O-N 2.9Å
53	A	87.8	Confident	93.7	Very high	36 Å²	36	84.4 Å²	84.4	30%	0.298	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.4	-173.7	0	0	0	0	0	114.1	Y49 T50 K61	Y49-A53 VanDerWaalsContact O-CA 3.24Å; Y49-A53 WeakPolarHBondContact O-CA 3.35Å; Y49-A53 VanDerWaalsContact O-CB 3.31Å; Y49-A53 WeakPolarHBondContact O-CB 3.46Å; Y49-A53 PolarHBondContact O-N 3.1Å; T50-A53 WeakPolarHBondContact O-CB 3.5Å; T50-A53 PolarHBondContact O-N 3.25Å; A53-K61 WeakPolarHBondContact O-CE 3.34Å; A53-K61 PolarHBondContact O-NZ 3.12Å
54	R	90.6	Very high	93.6	Very high	252 Å²	252	81.7 Å²	81.7	95%	0.951	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-20.8	178.3	-64	-175.1	-179.3	-131.1	0.2	114.1	N52	N52-R54 PolarHBondContact O-N 3.04Å
55	T	92.6	Very high	93.5	Very high	111 Å²	111	82.6 Å²	82.6	68%	0.681	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	-26.5	-175.1	49.4	0	0	0	0	113.5	N52	N52-T55 PolarHBondContact O-N 2.8Å; N52-T55 PolarHBondContact O-OG1 3.07Å
56	L	92.3	Very high	93.5	Very high	28 Å²	28	87.9 Å²	87.9	15%	0.147	46%	0.457	C	S	.	.	S	Bend	trans	-66.5	142.1	177.1	-94.4	70.8	0	0	0	113.4	N52 Q60 K61 I64	N52-L56 HydrophobicContact CB-CD1 3.3Å; N52-L56 WeakPolarHBondContact O-CD1 3.32Å; N52-L56 PolarHBondContact O-N 2.9Å; L56-Q60 HydrophobicContact CB-CB 4.15Å; L56-Q60 HydrophobicContact CD2-CB 3.77Å; L56-Q60 HydrophobicContact CG-CB 3.77Å; L56-K61 HydrophobicContact CB-CD 4.31Å; L56-K61 HydrophobicContact CB-CG 3.92Å; L56-K61 HydrophobicContact CD2-CG 4.28Å; L56-K61 WeakPolarHBondContact O-CE 3.3Å; L56-K61 PolarHBondContact O-NZ 3.36Å; L56-I64 HydrophobicContact CD2-CD1 3.62Å
57	S	94.8	Very high	93.5	Very high	54 Å²	54	90.4 Å²	90.4	38%	0.378	46%	0.463	S	S	.	.			trans	-67.2	162.2	165.6	84.9	0	0	0	0	112	E59 Q60 K61	S57-E59 PolarHBondContact O-N 3.27Å; S57-E59 PolarHBondContact OG-N 2.88Å; S57-Q60 PolarHBondContact O-N 3.37Å; S57-Q60 WeakPolarHBondContact OG-CG 3.21Å; S57-Q60 PolarHBondContact OG-N 2.82Å; S57-K61 WeakPolarHBondContact O-CD 3.27Å; S57-K61 WeakPolarHBondContact O-CG 3.1Å; S57-K61 PolarHBondContact O-N 2.9Å
58	S	92.9	Very high	93.6	Very high	94 Å²	94	86.1 Å²	86.1	66%	0.657	45%	0.446	S	S	*	.	H	α-helix	trans	-59.5	-33.6	175.7	-52.8	0	0	0	0	112.9	L62	S58-L62 VanDerWaalsContact O-CG 3.32Å; S58-L62 WeakPolarHBondContact O-CG 3.49Å; S58-L62 PolarHBondContact O-N 3.43Å
59	E	94.5	Very high	93.8	Very high	150 Å²	150	88.8 Å²	88.8	70%	0.701	46%	0.456	S	S	*	.	H	α-helix	trans	-72.3	-42.1	178.4	-177.5	174.1	-154.2	0	0	112.1	S57 K61 L62 T63	S57-E59 PolarHBondContact O-N 3.27Å; S57-E59 PolarHBondContact OG-N 2.88Å; E59-K61 VanDerWaalsContact C-N 3.34Å; E59-K61 PolarHBondContact O-N 2.81Å; E59-L62 PolarHBondContact O-N 2.64Å; E59-T63 WeakPolarHBondContact O-CB 3.34Å; E59-T63 PolarHBondContact O-N 3.22Å; E59-T63 PolarHBondContact O-OG1 3.41Å
60	Q	93.3	Very high	94	Very high	101 Å²	101	92.6 Å²	92.6	47%	0.472	48%	0.476	S	S	.	.	H	α-helix	trans	-62.6	-42.4	173.8	-69	169.7	-38.7	0	0	110.8	L56 S57 T63 I64	L56-Q60 HydrophobicContact CB-CB 4.15Å; L56-Q60 HydrophobicContact CD2-CB 3.77Å; L56-Q60 HydrophobicContact CG-CB 3.77Å; S57-Q60 PolarHBondContact O-N 3.37Å; S57-Q60 WeakPolarHBondContact OG-CG 3.21Å; S57-Q60 PolarHBondContact OG-N 2.82Å; Q60-T63 PolarHBondContact O-N 3.46Å; Q60-I64 PolarHBondContact O-N 2.89Å
61	K	93.4	Very high	94.1	Very high	51 Å²	51	88.5 Å²	88.5	22%	0.222	45%	0.451	C	S	.	.	H	α-helix	trans	-58.2	-49.2	174.2	-79.2	158.5	174.7	154.3	0	112.1	Y49 A53 L56 S57 E59 T63 I64 L65	Y49-K61 HydrophobicContact CE2-CB 3.98Å; Y49-K61 HydrophobicContact CE2-CG 3.79Å; A53-K61 WeakPolarHBondContact O-CE 3.34Å; A53-K61 PolarHBondContact O-NZ 3.12Å; L56-K61 HydrophobicContact CB-CD 4.31Å; L56-K61 HydrophobicContact CB-CG 3.92Å; L56-K61 HydrophobicContact CD2-CG 4.28Å; L56-K61 WeakPolarHBondContact O-CE 3.3Å; L56-K61 PolarHBondContact O-NZ 3.36Å; S57-K61 WeakPolarHBondContact O-CD 3.27Å; S57-K61 WeakPolarHBondContact O-CG 3.1Å; S57-K61 PolarHBondContact O-N 2.9Å; E59-K61 VanDerWaalsContact C-N 3.34Å; E59-K61 PolarHBondContact O-N 2.81Å; K61-T63 VanDerWaalsContact C-N 3.28Å; K61-T63 PolarHBondContact O-N 3.3Å; K61-I64 PolarHBondContact O-N 3.32Å; K61-L65 WeakPolarHBondContact O-CB 3.36Å; K61-L65 VanDerWaalsContact O-CG 3.25Å; K61-L65 WeakPolarHBondContact O-CG 3.45Å; K61-L65 PolarHBondContact O-N 2.81Å
62	L	94.3	Very high	94.2	Very high	96 Å²	96	90.7 Å²	90.7	50%	0.503	45%	0.446	S	S	.	.	H	α-helix	trans	-62.8	-35.4	176.8	-73.7	169.7	0	0	0	112.2	S58 E59 R66	S58-L62 VanDerWaalsContact O-CG 3.32Å; S58-L62 WeakPolarHBondContact O-CG 3.49Å; S58-L62 PolarHBondContact O-N 3.43Å; E59-L62 PolarHBondContact O-N 2.64Å; L62-R66 VanDerWaalsContact O-CG 3.29Å; L62-R66 WeakPolarHBondContact O-CG 3.41Å; L62-R66 PolarHBondContact O-N 3.41Å
63	T	94.6	Very high	94.5	Very high	59 Å²	59	90.1 Å²	90.1	36%	0.362	45%	0.447	S	S	.	.	H	α-helix	trans	-65.9	-49.8	178	-60	0	0	0	0	111.8	E59 Q60 K61 L65 R66 Q67	E59-T63 WeakPolarHBondContact O-CB 3.34Å; E59-T63 PolarHBondContact O-N 3.22Å; E59-T63 PolarHBondContact O-OG1 3.41Å; Q60-T63 PolarHBondContact O-N 3.46Å; K61-T63 VanDerWaalsContact C-N 3.28Å; K61-T63 PolarHBondContact O-N 3.3Å; T63-L65 PolarHBondContact O-N 3.28Å; T63-R66 PolarHBondContact O-N 3.48Å; T63-Q67 WeakPolarHBondContact O-CG 3.32Å; T63-Q67 PolarHBondContact O-N 3Å
64	I	93.8	Very high	94.9	Very high	27 Å²	27	92.2 Å²	92.2	14%	0.138	45%	0.45	C	S	.	.	H	α-helix	trans	-64.3	-41.1	178	-63.9	179.8	0	0	0	111.1	L45 Y49 L56 Q60 K61 R66 Q67 I68	L45-I64 HydrophobicContact CB-CG2 4.15Å; L45-I64 HydrophobicContact CD2-CG2 4.34Å; Y49-I64 HydrophobicContact CD2-CB 4.34Å; Y49-I64 HydrophobicContact CD2-CG2 4.21Å; L56-I64 HydrophobicContact CD2-CD1 3.62Å; Q60-I64 PolarHBondContact O-N 2.89Å; K61-I64 PolarHBondContact O-N 3.32Å; I64-R66 VanDerWaalsContact C-N 3.33Å; I64-R66 PolarHBondContact O-N 3.44Å; I64-Q67 PolarHBondContact O-N 3.36Å; I64-Q67 VanDerWaalsContact O-N 3.15Å; I64-I68 HydrophobicContact CG2-CD1 3.77Å; I64-I68 HydrophobicContact CG2-CG1 4.24Å; I64-I68 WeakPolarHBondContact O-CG1 3.49Å; I64-I68 PolarHBondContact O-N 3.06Å
65	L	94.3	Very high	95.2	Very high	79 Å²	79	81 Å²	81	41%	0.414	41%	0.41	S	S	.	.	H	α-helix	trans	-62.6	-37.3	177.6	-70.6	170.8	0	0	0	112.6	Y49 K61 T63 Q69	Y49-L65 HydrophobicContact CD2-CG 4.48Å; Y49-L65 HydrophobicContact CE2-CD1 4.12Å; Y49-L65 HydrophobicContact CE2-CD2 4.14Å; Y49-L65 HydrophobicContact CE2-CG 3.9Å; K61-L65 WeakPolarHBondContact O-CB 3.36Å; K61-L65 VanDerWaalsContact O-CG 3.25Å; K61-L65 WeakPolarHBondContact O-CG 3.45Å; K61-L65 PolarHBondContact O-N 2.81Å; T63-L65 PolarHBondContact O-N 3.28Å; L65-Q69 WeakPolarHBondContact O-CB 3.34Å; L65-Q69 PolarHBondContact O-N 3.31Å
66	R	96.4	Very high	95.4	Very high	149 Å²	149	81.8 Å²	81.8	56%	0.562	40%	0.404	S	S	*	.	H	α-helix	trans	-65.7	-41.2	171.6	-72.6	174.5	-164.6	145.5	1.4	112.4	L62 T63 I64 Q69 Q70	L62-R66 VanDerWaalsContact O-CG 3.29Å; L62-R66 WeakPolarHBondContact O-CG 3.41Å; L62-R66 PolarHBondContact O-N 3.41Å; T63-R66 PolarHBondContact O-N 3.48Å; I64-R66 VanDerWaalsContact C-N 3.33Å; I64-R66 PolarHBondContact O-N 3.44Å; R66-Q69 PolarHBondContact O-N 3.13Å; R66-Q70 WeakPolarHBondContact O-CB 3.38Å; R66-Q70 PolarHBondContact O-N 3.25Å
67	Q	96.4	Very high	95.7	Very high	88 Å²	88	84.5 Å²	84.5	41%	0.411	42%	0.416	S	S	.	.	H	α-helix	trans	-63.5	-45.8	177.1	-72.8	174.8	-41.6	0	0	111.3	L45 T63 I64 Q69 Q70 S71	L45-Q67 HydrophobicContact CD1-CB 3.96Å; T63-Q67 WeakPolarHBondContact O-CG 3.32Å; T63-Q67 PolarHBondContact O-N 3Å; I64-Q67 PolarHBondContact O-N 3.36Å; I64-Q67 VanDerWaalsContact O-N 3.15Å; Q67-Q69 PolarHBondContact O-N 2.88Å; Q67-Q70 PolarHBondContact O-N 3.38Å; Q67-S71 PolarHBondContact O-N 3.22Å; Q67-S71 PolarHBondContact O-OG 3.31Å
68	I	96	Very high	95.8	Very high	25 Å²	25	83.2 Å²	83.2	13%	0.128	40%	0.403	C	S	.	.	H	α-helix	trans	-57.9	-47.2	173.7	-69.9	170.6	0	0	0	110.6	I42 L45 A46 I64 Q70 S71 Y72	I42-I68 HydrophobicContact CG2-CG2 4.44Å; L45-I68 HydrophobicContact CB-CD1 3.93Å; L45-I68 HydrophobicContact CB-CG1 3.6Å; L45-I68 HydrophobicContact CD1-CG1 4.13Å; A46-I68 HydrophobicContact CB-CD1 4.45Å; I64-I68 HydrophobicContact CG2-CD1 3.77Å; I64-I68 HydrophobicContact CG2-CG1 4.24Å; I64-I68 WeakPolarHBondContact O-CG1 3.49Å; I64-I68 PolarHBondContact O-N 3.06Å; I68-Q70 PolarHBondContact O-N 3.21Å; I68-S71 PolarHBondContact O-N 3.3Å; I68-Y72 HydrophobicContact CG2-CD2 3.76Å; I68-Y72 HydrophobicContact CG2-CE2 3.93Å; I68-Y72 WeakPolarHBondContact O-CB 3.49Å; I68-Y72 WeakPolarHBondContact O-CD2 3.44Å; I68-Y72 PolarHBondContact O-N 3.33Å
69	Q	97.3	Very high	95.9	Very high	130 Å²	130	80 Å²	80	61%	0.607	39%	0.385	S	S	*	.	H	α-helix	trans	-58.5	-47.1	176.2	-174.3	-163.8	-9.6	0	0	111.9	L65 R66 Q67 Y72 S73	L65-Q69 WeakPolarHBondContact O-CB 3.34Å; L65-Q69 PolarHBondContact O-N 3.31Å; R66-Q69 PolarHBondContact O-N 3.13Å; Q67-Q69 PolarHBondContact O-N 2.88Å; Q69-Y72 PolarHBondContact O-N 2.96Å; Q69-S73 PolarHBondContact O-N 2.64Å; Q69-S73 PolarHBondContact O-OG 3.39Å
70	Q	97.4	Very high	96	Very high	144 Å²	144	76.2 Å²	76.2	67%	0.673	37%	0.369	S	S	*	.	H	α-helix	trans	-64.4	-43.2	-178.2	-173.5	174.9	4.4	0	0	111.8	R66 Q67 I68 S73 K74	R66-Q70 WeakPolarHBondContact O-CB 3.38Å; R66-Q70 PolarHBondContact O-N 3.25Å; Q67-Q70 PolarHBondContact O-N 3.38Å; I68-Q70 PolarHBondContact O-N 3.21Å; Q70-S73 PolarHBondContact O-N 2.95Å; Q70-K74 WeakPolarHBondContact O-CB 3.44Å; Q70-K74 PolarHBondContact O-N 3.08Å
71	S	96.3	Very high	96.2	Very high	18 Å²	18	74.8 Å²	74.8	13%	0.126	37%	0.365	C	S	.	.	H	α-helix	trans	-65.8	-36.2	174.5	-64.7	0	0	0	0	112.2	Q67 I68 K74 S75	Q67-S71 PolarHBondContact O-N 3.22Å; Q67-S71 PolarHBondContact O-OG 3.31Å; I68-S71 PolarHBondContact O-N 3.3Å; S71-K74 PolarHBondContact O-N 2.85Å; S71-S75 VanDerWaalsContact O-CB 3.28Å; S71-S75 WeakPolarHBondContact O-CB 3.37Å; S71-S75 PolarHBondContact O-N 3.07Å
72	Y	96.9	Very high	96.4	Very high	143 Å²	143	75.4 Å²	75.4	56%	0.561	37%	0.368	S	S	*	.	H	α-helix	trans	-63.7	-45.9	172.8	-99.2	-65.3	0	0	0	112.3	I42 I68 Q69 K74 S75 K76	I42-Y72 HydrophobicContact CD1-CD1 4.07Å; I42-Y72 HydrophobicContact CD1-CD2 4.03Å; I42-Y72 HydrophobicContact CD1-CE1 4.31Å; I42-Y72 HydrophobicContact CD1-CE2 4.29Å; I42-Y72 HydrophobicContact CD1-CG 3.92Å; I42-Y72 HydrophobicContact CG1-CD2 4.37Å; I42-Y72 HydrophobicContact CG2-CD2 4.07Å; I42-Y72 HydrophobicContact CG2-CE2 3.46Å; I42-Y72 VanDerWaalsContact CG2-CE2 3.46Å; I68-Y72 HydrophobicContact CG2-CD2 3.76Å; I68-Y72 HydrophobicContact CG2-CE2 3.93Å; I68-Y72 WeakPolarHBondContact O-CB 3.49Å; I68-Y72 WeakPolarHBondContact O-CD2 3.44Å; I68-Y72 PolarHBondContact O-N 3.33Å; Q69-Y72 PolarHBondContact O-N 2.96Å; Y72-K74 VanDerWaalsContact C-N 3.33Å; Y72-K74 PolarHBondContact O-N 3.38Å; Y72-S75 PolarHBondContact O-N 3.16Å; Y72-K76 PolarHBondContact O-N 3.44Å
73	S	97.8	Very high	96.5	Very high	57 Å²	57	75 Å²	75	40%	0.399	37%	0.369	S	S	.	.	H	α-helix	trans	-58.1	-46.7	174.3	-64.6	0	0	0	0	111.1	Q69 Q70 S75 K76 E77	Q69-S73 PolarHBondContact O-N 2.64Å; Q69-S73 PolarHBondContact O-OG 3.39Å; Q70-S73 PolarHBondContact O-N 2.95Å; S73-S75 VanDerWaalsContact C-N 3.35Å; S73-S75 PolarHBondContact O-N 3.45Å; S73-K76 WeakPolarHBondContact O-CB 3.47Å; S73-K76 PolarHBondContact O-N 3.44Å; S73-K76 VanDerWaalsContact O-N 3.12Å; S73-E77 WeakPolarHBondContact O-CG 3.49Å; S73-E77 PolarHBondContact O-N 3.47Å
74	K	97.6	Very high	96.6	Very high	81 Å²	81	78.6 Å²	78.6	35%	0.352	38%	0.382	S	S	.	.	H	α-helix	trans	-66.9	-34.6	179.8	-163.5	71	-143.8	163	0	112.9	L38 Q70 S71 Y72 K76 E77 F78	L38-K74 HydrophobicContact CD1-CB 3.82Å; L38-K74 HydrophobicContact CD1-CG 3.78Å; Q70-K74 WeakPolarHBondContact O-CB 3.44Å; Q70-K74 PolarHBondContact O-N 3.08Å; S71-K74 PolarHBondContact O-N 2.85Å; Y72-K74 VanDerWaalsContact C-N 3.33Å; Y72-K74 PolarHBondContact O-N 3.38Å; K74-K76 VanDerWaalsContact C-N 3.33Å; K74-E77 WeakPolarHBondContact CD-OE2 3.22Å; K74-E77 WeakPolarHBondContact CE-OE2 3.44Å; K74-E77 IonicContact NZ-OE2 3.25Å; K74-E77 PolarHBondContact NZ-OE2 2.84Å; K74-E77 PolarHBondContact O-N 2.79Å; K74-F78 HydrophobicContact CD-CZ 4.48Å; K74-F78 VanDerWaalsContact CE-CZ 3.47Å; K74-F78 HydrophobicContact CG-CE2 4.05Å; K74-F78 HydrophobicContact CG-CZ 4.21Å; K74-F78 WeakPolarHBondContact O-CD2 3.44Å; K74-F78 PolarHBondContact O-N 3.17Å; K74-F78 VanDerWaalsContact O-N 3.16Å
75	S	97.1	Very high	96.7	Very high	16 Å²	16	78 Å²	78	11%	0.112	38%	0.379	C	S	.	.	H	α-helix	trans	-69.4	-30.3	172.8	-177.8	0	0	0	0	112.3	S71 Y72 S73 G79	S71-S75 VanDerWaalsContact O-CB 3.28Å; S71-S75 WeakPolarHBondContact O-CB 3.37Å; S71-S75 PolarHBondContact O-N 3.07Å; Y72-S75 PolarHBondContact O-N 3.16Å; S73-S75 VanDerWaalsContact C-N 3.35Å; S73-S75 PolarHBondContact O-N 3.45Å; S75-G79 PolarHBondContact O-N 3.05Å
76	K	96.6	Very high	96.8	Very high	127 Å²	127	76.2 Å²	76.2	55%	0.552	38%	0.376	S	S	*	.	H	α-helix	trans	-70.2	-46.6	171.7	-169.7	-162.2	178	-58.3	0	110.7	Y72 S73 K74 F78 G79 D80	Y72-K76 PolarHBondContact O-N 3.44Å; S73-K76 WeakPolarHBondContact O-CB 3.47Å; S73-K76 PolarHBondContact O-N 3.44Å; S73-K76 VanDerWaalsContact O-N 3.12Å; K74-K76 VanDerWaalsContact C-N 3.33Å; K76-F78 PolarHBondContact O-N 2.82Å; K76-G79 CarbonylContact O-C 3.54Å; K76-G79 WeakPolarHBondContact O-CA 3.29Å; K76-G79 PolarHBondContact O-N 2.88Å; K76-D80 IonicContact NZ-OD1 2.63Å; K76-D80 PolarHBondContact NZ-OD1 3.15Å; K76-D80 IonicContact NZ-OD2 2.77Å; K76-D80 PolarHBondContact NZ-OD2 3.4Å; K76-D80 PolarHBondContact O-N 2.99Å
77	E	97.4	Very high	96.7	Very high	85 Å²	85	73.1 Å²	73.1	40%	0.397	37%	0.369	S	S	.	.	H	α-helix	trans	-54.1	-48.6	177.9	-72	166.1	-145.7	0	0	111.5	S73 K74 G79 D80 D81	S73-E77 WeakPolarHBondContact O-CG 3.49Å; S73-E77 PolarHBondContact O-N 3.47Å; K74-E77 WeakPolarHBondContact CD-OE2 3.22Å; K74-E77 WeakPolarHBondContact CE-OE2 3.44Å; K74-E77 IonicContact NZ-OE2 3.25Å; K74-E77 PolarHBondContact NZ-OE2 2.84Å; K74-E77 PolarHBondContact O-N 2.79Å; E77-G79 VanDerWaalsContact C-N 3.28Å; E77-G79 PolarHBondContact O-N 2.71Å; E77-D80 PolarHBondContact O-N 2.98Å; E77-D81 WeakPolarHBondContact O-CB 3.15Å; E77-D81 VanDerWaalsContact O-CG 3.27Å; E77-D81 PolarHBondContact O-N 3.46Å
78	F	97	Very high	96.6	Very high	28 Å²	28	74.4 Å²	74.4	12%	0.123	38%	0.375	C	S	.	.	H	α-helix	trans	-65.7	-27.6	175.6	-64.1	-35.1	0	0	0	113.9	L31 R34 T35 L38 K74 K76 K82	L31-F78 HydrophobicContact CD2-CB 4.19Å; L31-F78 HydrophobicContact CD2-CD1 3.84Å; L31-F78 HydrophobicContact CD2-CG 4.28Å; R34-F78 HydrophobicContact CB-CD2 3.83Å; R34-F78 HydrophobicContact CB-CE2 3.67Å; R34-F78 HydrophobicContact CB-CZ 4.3Å; R34-F78 HydrophobicContact CG-CE2 4.48Å; T35-F78 WeakPolarHBondContact OG1-CB 3.42Å; L38-F78 HydrophobicContact CD1-CD2 3.77Å; L38-F78 HydrophobicContact CD1-CE2 3.65Å; K74-F78 HydrophobicContact CD-CZ 4.48Å; K74-F78 VanDerWaalsContact CE-CZ 3.47Å; K74-F78 HydrophobicContact CG-CE2 4.05Å; K74-F78 HydrophobicContact CG-CZ 4.21Å; K74-F78 WeakPolarHBondContact O-CD2 3.44Å; K74-F78 PolarHBondContact O-N 3.17Å; K74-F78 VanDerWaalsContact O-N 3.16Å; K76-F78 PolarHBondContact O-N 2.82Å; F78-K82 VanDerWaalsContact O-CB 3.31Å; F78-K82 WeakPolarHBondContact O-CB 3.43Å; F78-K82 PolarHBondContact O-N 2.89Å
79	G	96.1	Very high	96.5	Very high	26 Å²	26	73.7 Å²	73.7	27%	0.268	37%	0.371	S	S	.	.	H	α-helix	trans	-69.6	-43.8	171.9	0	0	0	0	0	112.5	S75 K76 E77 K82 V83	S75-G79 PolarHBondContact O-N 3.05Å; K76-G79 CarbonylContact O-C 3.54Å; K76-G79 WeakPolarHBondContact O-CA 3.29Å; K76-G79 PolarHBondContact O-N 2.88Å; E77-G79 VanDerWaalsContact C-N 3.28Å; E77-G79 PolarHBondContact O-N 2.71Å; G79-K82 PolarHBondContact O-N 3.38Å; G79-V83 WeakPolarHBondContact O-CG2 3.17Å; G79-V83 PolarHBondContact O-N 3.02Å
80	D	96.6	Very high	96.3	Very high	70 Å²	70	72.7 Å²	72.7	37%	0.374	36%	0.363	S	S	.	.	H	α-helix	trans	-63.7	-45.8	175.2	-59	-33.1	0	0	0	110.4	K76 E77 K82 V83 Q84	K76-D80 IonicContact NZ-OD1 2.63Å; K76-D80 PolarHBondContact NZ-OD1 3.15Å; K76-D80 IonicContact NZ-OD2 2.77Å; K76-D80 PolarHBondContact NZ-OD2 3.4Å; K76-D80 PolarHBondContact O-N 2.99Å; E77-D80 PolarHBondContact O-N 2.98Å; D80-K82 VanDerWaalsContact C-N 3.31Å; D80-K82 PolarHBondContact O-N 3.24Å; D80-V83 PolarHBondContact O-N 2.69Å; D80-Q84 PolarHBondContact O-N 2.66Å; D80-Q84 VanDerWaalsContact O-N 3.08Å
81	D	97.3	Very high	96.1	Very high	72 Å²	72	71.4 Å²	71.4	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-55.3	-44	173.2	-71.7	-23.2	0	0	0	111.4	L31 E77 Q84 L85	L31-D81 HydrophobicContact CD1-CB 4.04Å; L31-D81 HydrophobicContact CD2-CB 4.02Å; E77-D81 WeakPolarHBondContact O-CB 3.15Å; E77-D81 VanDerWaalsContact O-CG 3.27Å; E77-D81 PolarHBondContact O-N 3.46Å; D81-Q84 PolarHBondContact O-N 3.31Å; D81-L85 WeakPolarHBondContact O-CB 3.38Å; D81-L85 PolarHBondContact O-N 2.7Å
82	K	97.1	Very high	95.9	Very high	63 Å²	63	71.6 Å²	71.6	27%	0.274	36%	0.356	S	S	.	.	H	α-helix	trans	-64.8	-41.6	-179.9	-168.9	-164.9	179.7	179.9	0	111.7	M28 L31 D32 F78 G79 D80 L85 A86	M28-K82 HydrophobicContact CG-CD 4.34Å; M28-K82 HydrophobicContact CG-CG 3.79Å; L31-K82 HydrophobicContact CD1-CB 4.31Å; D32-K82 WeakPolarHBondContact OD1-CD 3.38Å; D32-K82 VanDerWaalsContact OD1-CE 3.31Å; D32-K82 WeakPolarHBondContact OD1-CE 3.5Å; D32-K82 IonicContact OD1-NZ 2.64Å; D32-K82 PolarHBondContact OD1-NZ 2.84Å; D32-K82 WeakPolarHBondContact OD2-CE 3.34Å; D32-K82 IonicContact OD2-NZ 2.64Å; D32-K82 PolarHBondContact OD2-NZ 3.17Å; F78-K82 VanDerWaalsContact O-CB 3.31Å; F78-K82 WeakPolarHBondContact O-CB 3.43Å; F78-K82 PolarHBondContact O-N 2.89Å; G79-K82 PolarHBondContact O-N 3.38Å; D80-K82 VanDerWaalsContact C-N 3.31Å; D80-K82 PolarHBondContact O-N 3.24Å; K82-L85 PolarHBondContact O-N 3.32Å; K82-A86 WeakPolarHBondContact O-CB 3.25Å; K82-A86 PolarHBondContact O-N 2.96Å
83	V	96.9	Very high	95.6	Very high	88 Å²	88	66.9 Å²	66.9	53%	0.533	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-45.2	177	171.2	0	0	0	0	110.5	G79 D80 L85 A86 M87	G79-V83 WeakPolarHBondContact O-CG2 3.17Å; G79-V83 PolarHBondContact O-N 3.02Å; D80-V83 PolarHBondContact O-N 2.69Å; V83-L85 PolarHBondContact O-N 2.95Å; V83-A86 PolarHBondContact O-N 3.46Å; V83-M87 HydrophobicContact CG1-SD 4.13Å; V83-M87 WeakPolarHBondContact O-CG 3.39Å; V83-M87 PolarHBondContact O-N 3.34Å
84	Q	96.5	Very high	95.3	Very high	134 Å²	134	66 Å²	66	63%	0.626	33%	0.333	S	S	*	.	H	α-helix	trans	-61.1	-44	176.4	-68.5	-176.9	12.3	0	0	112.2	D80 D81 A86 M87 Q88	D80-Q84 PolarHBondContact O-N 2.66Å; D80-Q84 VanDerWaalsContact O-N 3.08Å; D81-Q84 PolarHBondContact O-N 3.31Å; Q84-A86 VanDerWaalsContact C-N 3.32Å; Q84-A86 PolarHBondContact O-N 3.19Å; Q84-M87 PolarHBondContact O-N 2.94Å; Q84-Q88 WeakPolarHBondContact O-CB 3.24Å; Q84-Q88 PolarHBondContact O-N 2.8Å
85	L	96.8	Very high	94.8	Very high	15 Å²	15	69.6 Å²	69.6	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-63.7	-36.9	176.5	-178.8	62.1	0	0	0	112.4	N24 L27 M28 L31 D81 K82 V83 T89	N24-L85 HydrophobicContact CB-CD1 4.03Å; L27-L85 HydrophobicContact CB-CD2 3.64Å; M28-L85 HydrophobicContact CB-CD2 3.88Å; M28-L85 HydrophobicContact CE-CG 4.31Å; L31-L85 HydrophobicContact CD1-CD2 4.02Å; D81-L85 WeakPolarHBondContact O-CB 3.38Å; D81-L85 PolarHBondContact O-N 2.7Å; K82-L85 PolarHBondContact O-N 3.32Å; V83-L85 PolarHBondContact O-N 2.95Å; L85-T89 VanDerWaalsContact O-CB 3.32Å; L85-T89 WeakPolarHBondContact O-CB 3.19Å; L85-T89 PolarHBondContact O-N 3.44Å; L85-T89 PolarHBondContact O-OG1 2.97Å
86	A	96.1	Very high	94.4	Very high	42 Å²	42	70.5 Å²	70.5	35%	0.347	35%	0.351	S	S	.	.	H	α-helix	trans	-66.6	-45.8	175	0	0	0	0	0	111.7	M28 K82 V83 Q84 T89 Y90	M28-A86 HydrophobicContact CE-CB 3.83Å; K82-A86 WeakPolarHBondContact O-CB 3.25Å; K82-A86 PolarHBondContact O-N 2.96Å; V83-A86 PolarHBondContact O-N 3.46Å; Q84-A86 VanDerWaalsContact C-N 3.32Å; Q84-A86 PolarHBondContact O-N 3.19Å; A86-T89 PolarHBondContact O-N 3.23Å; A86-Y90 PolarHBondContact O-N 2.91Å
87	M	94.7	Very high	94	Very high	84 Å²	84	68.6 Å²	68.6	41%	0.414	35%	0.346	S	S	.	.	H	α-helix	trans	-59.3	-50.3	174.9	-69.9	176.6	67.2	0	0	111.6	V83 Q84 T89 Y90 E91	V83-M87 HydrophobicContact CG1-SD 4.13Å; V83-M87 WeakPolarHBondContact O-CG 3.39Å; V83-M87 PolarHBondContact O-N 3.34Å; Q84-M87 PolarHBondContact O-N 2.94Å; M87-T89 PolarHBondContact O-N 2.93Å; M87-Y90 PolarHBondContact O-N 3.39Å; M87-Y90 VanDerWaalsContact O-N 3.09Å; M87-E91 WeakPolarHBondContact O-CG 3.39Å; M87-E91 PolarHBondContact O-N 3.32Å
88	Q	93.1	Very high	93.6	Very high	115 Å²	115	71 Å²	71	54%	0.537	35%	0.351	S	S	.	.	H	α-helix	trans	-56.8	-39.5	176.7	-174.1	-175.6	13.8	0	0	112.2	Q84 M92	Q84-Q88 WeakPolarHBondContact O-CB 3.24Å; Q84-Q88 PolarHBondContact O-N 2.8Å; Q88-M92 VanDerWaalsContact O-CB 3.25Å; Q88-M92 WeakPolarHBondContact O-CB 3.25Å; Q88-M92 PolarHBondContact O-N 3.09Å
89	T	94.3	Very high	93.1	Very high	10 Å²	10	74.6 Å²	74.6	6%	0.061	36%	0.364	C	S	.	.	H	α-helix	trans	-70.9	-35.5	179.3	-56.4	0	0	0	0	111.9	L21 N24 L85 A86 M87 M92 V93	L21-T89 HydrophobicContact CD2-CG2 3.68Å; N24-T89 HydrophobicContact CB-CG2 4.3Å; N24-T89 WeakPolarHBondContact CB-OG1 3.31Å; N24-T89 PolarHBondContact ND2-OG1 3.41Å; L85-T89 VanDerWaalsContact O-CB 3.32Å; L85-T89 WeakPolarHBondContact O-CB 3.19Å; L85-T89 PolarHBondContact O-N 3.44Å; L85-T89 PolarHBondContact O-OG1 2.97Å; A86-T89 PolarHBondContact O-N 3.23Å; M87-T89 PolarHBondContact O-N 2.93Å; T89-M92 HydrophobicContact CG2-CE 3.96Å; T89-V93 WeakPolarHBondContact O-CG2 3.46Å; T89-V93 PolarHBondContact O-N 3.46Å
90	Y	93.5	Very high	92.6	Very high	108 Å²	108	75 Å²	75	42%	0.424	36%	0.36	S	S	.	.	H	α-helix	trans	-68.6	-50.3	174	-179.5	-92.2	0	0	0	112	A86 M87 M92 V93 D94 M190	A86-Y90 PolarHBondContact O-N 2.91Å; M87-Y90 PolarHBondContact O-N 3.39Å; M87-Y90 VanDerWaalsContact O-N 3.09Å; Y90-M92 VanDerWaalsContact C-N 3.26Å; Y90-M92 PolarHBondContact O-N 3.01Å; Y90-V93 PolarHBondContact O-N 3Å; Y90-D94 WeakPolarHBondContact O-CB 3.41Å; Y90-D94 PolarHBondContact O-N 2.9Å; Y90-M190 HydrophobicContact CE1-SD 4.03Å; Y90-M190 HydrophobicContact CE2-SD 3.97Å
91	E	92.5	Very high	92.2	Very high	117 Å²	117	75.9 Å²	75.9	55%	0.547	36%	0.364	S	S	.	.	H	α-helix	trans	-57.9	-38.4	177.3	-71.6	172.9	-165	0	0	112.4	M87 K95	M87-E91 WeakPolarHBondContact O-CG 3.39Å; M87-E91 PolarHBondContact O-N 3.32Å; E91-K95 VanDerWaalsContact O-CB 3.25Å; E91-K95 WeakPolarHBondContact O-CB 3.47Å; E91-K95 PolarHBondContact O-N 3.03Å
92	M	91.4	Very high	91.7	Very high	22 Å²	22	76.8 Å²	76.8	11%	0.108	37%	0.373	C	S	.	.	H	α-helix	trans	-58.6	-54	171.8	177	-173.3	71.6	0	0	110.8	L17 E20 L21 Q88 T89 Y90 K95 H96	L17-M92 HydrophobicContact CD1-CE 3.81Å; L17-M92 HydrophobicContact CD1-CG 4.12Å; L17-M92 HydrophobicContact CD1-SD 4.22Å; E20-M92 HydrophobicContact CB-CE 4.41Å; E20-M92 HydrophobicContact CB-SD 3.65Å; L21-M92 HydrophobicContact CD2-CE 3.54Å; L21-M92 HydrophobicContact CG-CE 3.68Å; Q88-M92 VanDerWaalsContact O-CB 3.25Å; Q88-M92 WeakPolarHBondContact O-CB 3.25Å; Q88-M92 PolarHBondContact O-N 3.09Å; T89-M92 HydrophobicContact CG2-CE 3.96Å; Y90-M92 VanDerWaalsContact C-N 3.26Å; Y90-M92 PolarHBondContact O-N 3.01Å; M92-K95 WeakPolarHBondContact O-CB 3.43Å; M92-K95 PolarHBondContact O-N 3.23Å; M92-H96 PolarHBondContact O-CD2 2.85Å; M92-H96 PolarHBondContact O-N 3.46Å; M92-H96 VanDerWaalsContact O-N 3.12Å
93	V	92.2	Very high	91	Very high	45 Å²	45	75 Å²	75	27%	0.273	37%	0.367	S	S	.	.	H	α-helix	trans	-61.9	-46.1	-179.7	171.3	0	0	0	0	112	L17 L21 T89 Y90 K95 H96 I97	L17-V93 HydrophobicContact CD1-CG2 4.3Å; L21-V93 HydrophobicContact CD1-CG2 4.45Å; L21-V93 HydrophobicContact CD2-CG2 3.78Å; T89-V93 WeakPolarHBondContact O-CG2 3.46Å; T89-V93 PolarHBondContact O-N 3.46Å; Y90-V93 PolarHBondContact O-N 3Å; V93-K95 VanDerWaalsContact C-N 3.32Å; V93-K95 PolarHBondContact O-N 3.43Å; V93-H96 PolarHBondContact O-N 2.86Å; V93-I97 HydrophobicContact CG1-CD1 3.8Å; V93-I97 HydrophobicContact CG1-CG1 4.35Å; V93-I97 WeakPolarHBondContact O-CG1 3.33Å; V93-I97 PolarHBondContact O-N 2.94Å
94	D	90.8	Very high	90.4	Very high	39 Å²	39	75.8 Å²	75.8	21%	0.209	37%	0.367	C	S	.	.	H	α-helix	trans	-54.8	-45.9	175.3	170.9	94.3	0	0	0	111.8	Y90 H96 I97 R98	Y90-D94 WeakPolarHBondContact O-CB 3.41Å; Y90-D94 PolarHBondContact O-N 2.9Å; D94-H96 VanDerWaalsContact C-N 3.3Å; D94-H96 PolarHBondContact O-N 3.02Å; D94-I97 PolarHBondContact O-N 2.74Å; D94-R98 VanDerWaalsContact CG-NE 3.31Å; D94-R98 WeakPolarHBondContact O-CG 3.44Å; D94-R98 PolarHBondContact O-N 3.18Å; D94-R98 IonicContact OD1-CZ 2.66Å; D94-R98 VanDerWaalsContact OD1-CZ 3.29Å; D94-R98 IonicContact OD1-NE 2.69Å; D94-R98 PolarHBondContact OD1-NE 3.03Å; D94-R98 IonicContact OD1-NH2 3.29Å; D94-R98 PolarHBondContact OD1-NH2 3.31Å; D94-R98 IonicContact OD2-CZ 2.69Å; D94-R98 IonicContact OD2-NE 3.5Å; D94-R98 PolarHBondContact OD2-NE 3.07Å; D94-R98 IonicContact OD2-NH2 3.55Å
95	K	87.8	Confident	90	Very high	155 Å²	155	72.3 Å²	72.3	67%	0.674	36%	0.361	S	S	*	.	H	α-helix	trans	-61.8	-35.3	176.4	-179.7	-174.8	176	-170	0	112.8	E91 M92 V93 R99	E91-K95 VanDerWaalsContact O-CB 3.25Å; E91-K95 WeakPolarHBondContact O-CB 3.47Å; E91-K95 PolarHBondContact O-N 3.03Å; M92-K95 WeakPolarHBondContact O-CB 3.43Å; M92-K95 PolarHBondContact O-N 3.23Å; V93-K95 VanDerWaalsContact C-N 3.32Å; V93-K95 PolarHBondContact O-N 3.43Å; K95-R99 PolarHBondContact O-N 3.05Å
96	H	87.6	Confident	89.5	Confident	35 Å²	35	79 Å²	79	16%	0.162	39%	0.386	C	S	.	.	H	α-helix	trans	-71.4	-43.5	173.4	-78.4	-83.4	0	0	0	111.7	S13 L17 M92 V93 D94 R99 L100	S13-H96 PolarHBondContact O-CE1 3.32Å; S13-H96 PolarHBondContact O-ND1 2.94Å; L17-H96 HydrophobicContact CD2-CB 3.88Å; M92-H96 PolarHBondContact O-CD2 2.85Å; M92-H96 PolarHBondContact O-N 3.46Å; M92-H96 VanDerWaalsContact O-N 3.12Å; V93-H96 PolarHBondContact O-N 2.86Å; D94-H96 VanDerWaalsContact C-N 3.3Å; D94-H96 PolarHBondContact O-N 3.02Å; H96-R99 PolarHBondContact O-N 2.88Å; H96-L100 WeakPolarHBondContact O-CG 3.31Å; H96-L100 PolarHBondContact O-N 3.33Å
97	I	88.9	Confident	88.9	Confident	87 Å²	87	81.1 Å²	81.1	45%	0.446	39%	0.387	S	S	.	.	H	α-helix	trans	-55.4	-55.7	175.1	-68.4	167.1	0	0	0	110.3	V93 D94 R99 L100 D101	V93-I97 HydrophobicContact CG1-CD1 3.8Å; V93-I97 HydrophobicContact CG1-CG1 4.35Å; V93-I97 WeakPolarHBondContact O-CG1 3.33Å; V93-I97 PolarHBondContact O-N 2.94Å; D94-I97 PolarHBondContact O-N 2.74Å; I97-R99 PolarHBondContact O-N 3.09Å; I97-R99 VanDerWaalsContact O-N 3.13Å; I97-L100 PolarHBondContact O-N 2.69Å; I97-D101 WeakPolarHBondContact CG2-OD2 3.34Å; I97-D101 VanDerWaalsContact O-CG 3.31Å; I97-D101 PolarHBondContact O-N 2.74Å
98	R	88.6	Confident	88.5	Confident	137 Å²	137	82 Å²	82	52%	0.517	39%	0.39	S	S	.	.	H	α-helix	trans	-58	-32.2	-180	-66.3	-179.8	-163.7	-79.3	-12.1	113.7	D94 T102	D94-R98 VanDerWaalsContact CG-NE 3.31Å; D94-R98 WeakPolarHBondContact O-CG 3.44Å; D94-R98 PolarHBondContact O-N 3.18Å; D94-R98 IonicContact OD1-CZ 2.66Å; D94-R98 VanDerWaalsContact OD1-CZ 3.29Å; D94-R98 IonicContact OD1-NE 2.69Å; D94-R98 PolarHBondContact OD1-NE 3.03Å; D94-R98 IonicContact OD1-NH2 3.29Å; D94-R98 PolarHBondContact OD1-NH2 3.31Å; D94-R98 IonicContact OD2-CZ 2.69Å; D94-R98 IonicContact OD2-NE 3.5Å; D94-R98 PolarHBondContact OD2-NE 3.07Å; D94-R98 IonicContact OD2-NH2 3.55Å; R98-T102 WeakPolarHBondContact O-CB 3.4Å; R98-T102 PolarHBondContact O-N 3.04Å; R98-T102 VanDerWaalsContact O-N 3.11Å; R98-T102 PolarHBondContact O-OG1 2.86Å
99	R	85.8	Confident	88.1	Confident	102 Å²	102	79.1 Å²	79.1	39%	0.385	39%	0.386	S	S	.	.	H	α-helix	trans	-70.2	-45.5	175.8	-172.4	173.5	-176.5	-169.4	-6.2	111.1	H9 S13 K95 H96 I97 T102 D103	H9-R99 PolarHBondContact CE1-NH2 3.5Å; H9-R99 PolarHBondContact NE2-NH2 3.25Å; S13-R99 WeakPolarHBondContact OG-CD 3.15Å; S13-R99 PolarHBondContact OG-NE 2.93Å; S13-R99 PolarHBondContact OG-NH1 3.21Å; S13-R99 PolarHBondContact OG-NH2 3.26Å; K95-R99 PolarHBondContact O-N 3.05Å; H96-R99 PolarHBondContact O-N 2.88Å; I97-R99 PolarHBondContact O-N 3.09Å; I97-R99 VanDerWaalsContact O-N 3.13Å; R99-T102 WeakPolarHBondContact O-CB 3.45Å; R99-T102 PolarHBondContact O-N 2.67Å; R99-D103 PolarHBondContact O-N 2.9Å
100	L	86.1	Confident	87.7	Confident	35 Å²	35	80.2 Å²	80.2	18%	0.183	39%	0.391	C	S	.	.	H	α-helix	trans	-63.9	-41.9	176.4	-64.1	176.2	0	0	0	111.7	Y10 I14 H96 I97 T102 D103 L104	Y10-L100 HydrophobicContact CD2-CD2 3.58Å; Y10-L100 HydrophobicContact CE2-CD2 3.72Å; I14-L100 HydrophobicContact CD1-CD1 4.01Å; I14-L100 HydrophobicContact CD1-CD2 4.04Å; I14-L100 HydrophobicContact CG1-CD1 4.37Å; I14-L100 HydrophobicContact CG1-CD2 4.3Å; H96-L100 WeakPolarHBondContact O-CG 3.31Å; H96-L100 PolarHBondContact O-N 3.33Å; I97-L100 PolarHBondContact O-N 2.69Å; L100-T102 VanDerWaalsContact C-N 3.31Å; L100-T102 PolarHBondContact O-N 3.01Å; L100-D103 PolarHBondContact O-N 3.35Å; L100-L104 WeakPolarHBondContact O-CB 3.22Å; L100-L104 VanDerWaalsContact O-CG 3.24Å; L100-L104 WeakPolarHBondContact O-CG 3.49Å; L100-L104 PolarHBondContact O-N 3.46Å
101	D	87.5	Confident	87.1	Confident	88 Å²	88	79.4 Å²	79.4	47%	0.471	39%	0.394	S	S	.	.	H	α-helix	trans	-59.4	-41.7	174	-63.3	-30.5	0	0	0	111.9	I97 L104 A105	I97-D101 WeakPolarHBondContact CG2-OD2 3.34Å; I97-D101 VanDerWaalsContact O-CG 3.31Å; I97-D101 PolarHBondContact O-N 2.74Å; D101-L104 PolarHBondContact O-N 3.16Å; D101-A105 VanDerWaalsContact O-CB 3.28Å; D101-A105 WeakPolarHBondContact O-CB 3.32Å; D101-A105 PolarHBondContact O-N 3.4Å
102	T	86.9	Confident	86.7	Confident	92 Å²	92	79 Å²	79	56%	0.564	39%	0.39	S	S	*	.	H	α-helix	trans	-65.3	-43	177.7	-59.2	0	0	0	0	111.5	R98 R99 L100 R106	R98-T102 WeakPolarHBondContact O-CB 3.4Å; R98-T102 PolarHBondContact O-N 3.04Å; R98-T102 VanDerWaalsContact O-N 3.11Å; R98-T102 PolarHBondContact O-OG1 2.86Å; R99-T102 WeakPolarHBondContact O-CB 3.45Å; R99-T102 PolarHBondContact O-N 2.67Å; L100-T102 VanDerWaalsContact C-N 3.31Å; L100-T102 PolarHBondContact O-N 3.01Å; T102-R106 WeakPolarHBondContact O-CB 3.32Å; T102-R106 PolarHBondContact O-N 3.27Å
103	D	83.5	Confident	86.1	Confident	26 Å²	26	83.6 Å²	83.6	14%	0.139	41%	0.411	C	S	.	.	H	α-helix	trans	-68.4	-39.2	177.8	-73.2	-20.8	0	0	0	111.9	H9 R99 L100 R106 F107	H9-D103 IonicContact CE1-OD1 3.31Å; H9-D103 PolarHBondContact CE1-OD1 2.87Å; H9-D103 VanDerWaalsContact CE1-OD1 3.25Å; H9-D103 IonicContact CE1-OD2 2.73Å; H9-D103 PolarHBondContact CE1-OD2 3.01Å; H9-D103 VanDerWaalsContact ND1-CG 3.32Å; H9-D103 IonicContact ND1-OD1 3.12Å; H9-D103 PolarHBondContact ND1-OD1 3.18Å; H9-D103 IonicContact ND1-OD2 2.72Å; H9-D103 PolarHBondContact ND1-OD2 3.31Å; R99-D103 PolarHBondContact O-N 2.9Å; L100-D103 PolarHBondContact O-N 3.35Å; D103-R106 PolarHBondContact O-N 2.72Å; D103-F107 WeakPolarHBondContact O-CB 3.42Å; D103-F107 PolarHBondContact O-N 3.23Å
104	L	84.8	Confident	85.3	Confident	103 Å²	103	85.5 Å²	85.5	54%	0.539	42%	0.416	S	S	.	.	H	α-helix	trans	-64	-49.1	174.4	-74.5	169	0	0	0	111.7	L100 D101 R106 F107 E108	L100-L104 WeakPolarHBondContact O-CB 3.22Å; L100-L104 VanDerWaalsContact O-CG 3.24Å; L100-L104 WeakPolarHBondContact O-CG 3.49Å; L100-L104 PolarHBondContact O-N 3.46Å; D101-L104 PolarHBondContact O-N 3.16Å; L104-R106 VanDerWaalsContact C-N 3.25Å; L104-R106 PolarHBondContact O-N 3.13Å; L104-F107 PolarHBondContact O-N 3.28Å; L104-E108 PolarHBondContact O-N 3.11Å
105	A	87.9	Confident	84.4	Confident	62 Å²	62	90.1 Å²	90.1	51%	0.512	44%	0.437	S	S	.	.	H	α-helix	trans	-60.6	-36.7	177.4	0	0	0	0	0	112	D101 A109	D101-A105 VanDerWaalsContact O-CB 3.28Å; D101-A105 WeakPolarHBondContact O-CB 3.32Å; D101-A105 PolarHBondContact O-N 3.4Å; A105-A109 PolarHBondContact O-N 2.91Å; A105-A109 VanDerWaalsContact O-N 3.16Å
106	R	85.8	Confident	83.4	Confident	156 Å²	156	87.5 Å²	87.5	59%	0.589	43%	0.429	S	S	*	.	H	α-helix	trans	-67.1	-46.9	173.2	-175	177.7	-175.7	167.2	4.3	112	T102 D103 L104 E108 A109 D110	T102-R106 WeakPolarHBondContact O-CB 3.32Å; T102-R106 PolarHBondContact O-N 3.27Å; D103-R106 PolarHBondContact O-N 2.72Å; L104-R106 VanDerWaalsContact C-N 3.25Å; L104-R106 PolarHBondContact O-N 3.13Å; R106-E108 VanDerWaalsContact C-N 3.3Å; R106-E108 PolarHBondContact O-N 3.31Å; R106-A109 WeakPolarHBondContact O-CB 3.19Å; R106-A109 PolarHBondContact O-N 3.01Å; R106-A109 VanDerWaalsContact O-N 3.1Å; R106-D110 WeakPolarHBondContact O-CB 3.39Å; R106-D110 PolarHBondContact O-N 3.2Å
107	F	82.6	Confident	82.2	Confident	85 Å²	85	91.9 Å²	91.9	37%	0.373	45%	0.449	S	S	.	.	H	α-helix	trans	-60.8	-38.4	177.7	-179.8	-106.1	0	0	0	112.1	Y6 D103 L104 D110 L111	Y6-F107 HydrophobicContact CD2-CD2 4Å; Y6-F107 HydrophobicContact CD2-CE2 4.41Å; Y6-F107 HydrophobicContact CE2-CD2 4.28Å; Y6-F107 HydrophobicContact CG-CD2 4.19Å; D103-F107 WeakPolarHBondContact O-CB 3.42Å; D103-F107 PolarHBondContact O-N 3.23Å; L104-F107 PolarHBondContact O-N 3.28Å; F107-D110 WeakPolarHBondContact O-CB 3.49Å; F107-D110 PolarHBondContact O-N 2.89Å; F107-L111 HydrophobicContact CD1-CD1 3.89Å; F107-L111 HydrophobicContact CE1-CD1 3.49Å; F107-L111 VanDerWaalsContact CE1-CD1 3.49Å; F107-L111 HydrophobicContact CE1-CG 4.32Å; F107-L111 HydrophobicContact CZ-CD1 3.9Å; F107-L111 HydrophobicContact CZ-CG 4.33Å; F107-L111 WeakPolarHBondContact O-CG 3.25Å; F107-L111 PolarHBondContact O-N 3.07Å
108	E	86.2	Confident	80.8	Confident	104 Å²	104	91.1 Å²	91.1	49%	0.486	45%	0.452	S	S	.	.	H	α-helix	trans	-61.7	-41.7	171.2	-86.1	-160.1	-153.2	0	0	113.2	L104 R106 L111 K112	L104-E108 PolarHBondContact O-N 3.11Å; R106-E108 VanDerWaalsContact C-N 3.3Å; R106-E108 PolarHBondContact O-N 3.31Å; E108-L111 PolarHBondContact O-N 3.12Å; E108-K112 VanDerWaalsContact O-CD 3.29Å; E108-K112 WeakPolarHBondContact O-CD 3.42Å; E108-K112 WeakPolarHBondContact O-CG 3.25Å; E108-K112 PolarHBondContact O-N 3.15Å; E108-K112 IonicContact OE2-NZ 2.74Å; E108-K112 PolarHBondContact OE2-NZ 2.93Å
109	A	86.4	Confident	79.4	Confident	53 Å²	53	88.8 Å²	88.8	44%	0.438	45%	0.453	S	S	.	.	H	α-helix	trans	-65.5	-46.6	176.1	0	0	0	0	0	111.1	A105 R106 L111 K112 E113	A105-A109 PolarHBondContact O-N 2.91Å; A105-A109 VanDerWaalsContact O-N 3.16Å; R106-A109 WeakPolarHBondContact O-CB 3.19Å; R106-A109 PolarHBondContact O-N 3.01Å; R106-A109 VanDerWaalsContact O-N 3.1Å; A109-L111 PolarHBondContact O-N 2.87Å; A109-K112 PolarHBondContact O-N 3.26Å; A109-K112 VanDerWaalsContact O-N 3.13Å; A109-E113 WeakPolarHBondContact O-CB 3.38Å; A109-E113 PolarHBondContact O-N 3.37Å
110	D	84.5	Confident	77.9	Confident	34 Å²	34	89 Å²	89	18%	0.182	46%	0.461	C	S	.	.	H	α-helix	trans	-55.6	-33.7	174.8	-113.8	70.1	0	0	0	112.8	Y6 R106 F107 K114	Y6-D110 PolarHBondContact OH-OD1 3.36Å; Y6-D110 PolarHBondContact OH-OD2 2.99Å; Y6-D110 VanDerWaalsContact OH-OD2 3.05Å; R106-D110 WeakPolarHBondContact O-CB 3.39Å; R106-D110 PolarHBondContact O-N 3.2Å; F107-D110 WeakPolarHBondContact O-CB 3.49Å; F107-D110 PolarHBondContact O-N 2.89Å; D110-K114 VanDerWaalsContact CG-NZ 3.32Å; D110-K114 WeakPolarHBondContact O-CD 3.44Å; D110-K114 VanDerWaalsContact O-CG 3.29Å; D110-K114 WeakPolarHBondContact O-CG 3.32Å; D110-K114 PolarHBondContact O-N 3.44Å; D110-K114 PolarHBondContact O-NZ 3.03Å; D110-K114 IonicContact OD2-NZ 3.18Å; D110-K114 PolarHBondContact OD2-NZ 3.16Å
111	L	81.4	Confident	76.2	Confident	91 Å²	91	96.1 Å²	96.1	48%	0.476	49%	0.487	S	S	.	.	H	α-helix	trans	-75.7	-45.2	175.2	-80.5	170.8	0	0	0	112.1	F107 E108 A109 E113 K114 Q115	F107-L111 HydrophobicContact CD1-CD1 3.89Å; F107-L111 HydrophobicContact CE1-CD1 3.49Å; F107-L111 VanDerWaalsContact CE1-CD1 3.49Å; F107-L111 HydrophobicContact CE1-CG 4.32Å; F107-L111 HydrophobicContact CZ-CD1 3.9Å; F107-L111 HydrophobicContact CZ-CG 4.33Å; F107-L111 WeakPolarHBondContact O-CG 3.25Å; F107-L111 PolarHBondContact O-N 3.07Å; E108-L111 PolarHBondContact O-N 3.12Å; A109-L111 PolarHBondContact O-N 2.87Å; L111-E113 VanDerWaalsContact C-N 3.34Å; L111-E113 PolarHBondContact O-N 2.8Å; L111-K114 PolarHBondContact O-N 3.38Å; L111-Q115 WeakPolarHBondContact O-CB 3.41Å; L111-Q115 PolarHBondContact O-N 3.31Å
112	K	83.2	Confident	74.5	Confident	108 Å²	108	98.3 Å²	98.3	47%	0.47	50%	0.499	S	S	.	.	H	α-helix	trans	-62.9	-40.7	179	-69.2	159.1	-165.3	167.5	0	111.2	E108 A109 Q115 I116	E108-K112 VanDerWaalsContact O-CD 3.29Å; E108-K112 WeakPolarHBondContact O-CD 3.42Å; E108-K112 WeakPolarHBondContact O-CG 3.25Å; E108-K112 PolarHBondContact O-N 3.15Å; E108-K112 IonicContact OE2-NZ 2.74Å; E108-K112 PolarHBondContact OE2-NZ 2.93Å; A109-K112 PolarHBondContact O-N 3.26Å; A109-K112 VanDerWaalsContact O-N 3.13Å; K112-Q115 PolarHBondContact O-N 2.9Å; K112-I116 WeakPolarHBondContact O-CD1 3.4Å; K112-I116 VanDerWaalsContact O-CG1 3.32Å; K112-I116 WeakPolarHBondContact O-CG1 3.13Å; K112-I116 PolarHBondContact O-N 2.63Å; K112-I116 VanDerWaalsContact O-N 3.1Å
113	E	79.6	Confident	72.9	Confident	118 Å²	118	98.5 Å²	98.5	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-61.8	-52.4	175.7	-173.9	172.1	-129.5	0	0	111.8	A109 L111 Q115 I116 E117	A109-E113 WeakPolarHBondContact O-CB 3.38Å; A109-E113 PolarHBondContact O-N 3.37Å; L111-E113 VanDerWaalsContact C-N 3.34Å; L111-E113 PolarHBondContact O-N 2.8Å; E113-Q115 PolarHBondContact O-N 2.89Å; E113-I116 WeakPolarHBondContact O-CA 3.37Å; E113-I116 WeakPolarHBondContact O-CB 3.33Å; E113-I116 PolarHBondContact O-N 3.1Å; E113-E117 PolarHBondContact O-N 3.33Å
114	K	76	Confident	71.1	Confident	86 Å²	86	103 Å²	103	37%	0.374	53%	0.533	S	S	.	.	H	α-helix	trans	-62	-31.4	177.5	-69.7	169.3	-165.1	60.9	0	112.8	D110 L111 S118	D110-K114 VanDerWaalsContact CG-NZ 3.32Å; D110-K114 WeakPolarHBondContact O-CD 3.44Å; D110-K114 VanDerWaalsContact O-CG 3.29Å; D110-K114 WeakPolarHBondContact O-CG 3.32Å; D110-K114 PolarHBondContact O-N 3.44Å; D110-K114 PolarHBondContact O-NZ 3.03Å; D110-K114 IonicContact OD2-NZ 3.18Å; D110-K114 PolarHBondContact OD2-NZ 3.16Å; L111-K114 PolarHBondContact O-N 3.38Å; K114-S118 WeakPolarHBondContact O-CB 3.36Å; K114-S118 PolarHBondContact O-N 3.04Å
115	Q	71.7	Confident	68.9	Low	136 Å²	136	103.5 Å²	103.5	64%	0.636	55%	0.545	S	S	*	.	H	α-helix	trans	-65.6	-40.9	173.4	-170.7	173.3	2.5	0	0	111.4	L111 K112 E113 S118 T119	L111-Q115 WeakPolarHBondContact O-CB 3.41Å; L111-Q115 PolarHBondContact O-N 3.31Å; K112-Q115 PolarHBondContact O-N 2.9Å; E113-Q115 PolarHBondContact O-N 2.89Å; Q115-S118 PolarHBondContact O-N 3.44Å; Q115-S118 PolarHBondContact O-OG 3.17Å; Q115-T119 PolarHBondContact O-N 2.88Å; Q115-T119 PolarHBondContact O-OG1 3.27Å
116	I	66.8	Low	66.7	Low	100 Å²	100	106.6 Å²	106.6	51%	0.513	56%	0.562	S	S	.	*	H	α-helix	trans	-67.6	-48.4	176.2	-66	161.3	0	0	0	111.1	K112 E113 S118 T119 D120	K112-I116 WeakPolarHBondContact O-CD1 3.4Å; K112-I116 VanDerWaalsContact O-CG1 3.32Å; K112-I116 WeakPolarHBondContact O-CG1 3.13Å; K112-I116 PolarHBondContact O-N 2.63Å; K112-I116 VanDerWaalsContact O-N 3.1Å; E113-I116 WeakPolarHBondContact O-CA 3.37Å; E113-I116 WeakPolarHBondContact O-CB 3.33Å; E113-I116 PolarHBondContact O-N 3.1Å; I116-S118 PolarHBondContact O-N 2.9Å; I116-T119 PolarHBondContact O-N 3.49Å; I116-T119 PolarHBondContact O-OG1 2.97Å; I116-D120 PolarHBondContact O-N 3.15Å; I116-D120 VanDerWaalsContact O-N 3.13Å
117	E	62.5	Low	64.5	Low	127 Å²	127	109.5 Å²	109.5	59%	0.593	58%	0.579	S	S	*	*	H	α-helix	trans	-53.9	-40.1	175.3	-69.7	-172.5	126.1	0	0	111.7	E113 T119 Y121	E113-E117 PolarHBondContact O-N 3.33Å; E117-T119 VanDerWaalsContact C-N 3.26Å; E117-T119 PolarHBondContact O-N 2.85Å; E117-Y121 PolarHBondContact O-N 2.9Å
118	S	59.8	Low	62.2	Low	71 Å²	71	109 Å²	109	50%	0.497	60%	0.598	S	S	.	*	H	α-helix	trans	-67.2	-23.4	178.9	79.5	0	0	0	0	114.2	K114 Q115 I116	K114-S118 WeakPolarHBondContact O-CB 3.36Å; K114-S118 PolarHBondContact O-N 3.04Å; Q115-S118 PolarHBondContact O-N 3.44Å; Q115-S118 PolarHBondContact O-OG 3.17Å; I116-S118 PolarHBondContact O-N 2.9Å
119	T	58.8	Low	59.7	Low	87 Å²	87	114.5 Å²	114.5	53%	0.534	62%	0.62	S	S	.	*	H	α-helix	trans	-90.8	-31.9	178.4	42.2	0	0	0	0	114.3	Q115 I116 E117	Q115-T119 PolarHBondContact O-N 2.88Å; Q115-T119 PolarHBondContact O-OG1 3.27Å; I116-T119 PolarHBondContact O-N 3.49Å; I116-T119 PolarHBondContact O-OG1 2.97Å; E117-T119 VanDerWaalsContact C-N 3.26Å; E117-T119 PolarHBondContact O-N 2.85Å
120	D	54.7	Low	57.2	Low	106 Å²	106	122.1 Å²	122.1	57%	0.567	64%	0.643	S	S	*	*	H	α-helix	trans	-77	-26.7	-178.5	-76.6	-34.6	0	0	0	113	I116 D122 S123	I116-D120 PolarHBondContact O-N 3.15Å; I116-D120 VanDerWaalsContact O-N 3.13Å; D120-D122 VanDerWaalsContact C-N 3.31Å; D120-D122 PolarHBondContact O-N 2.72Å; D120-S123 PolarHBondContact O-N 3.43Å
121	Y	50.7	Low	54.6	Low	185 Å²	185	126.4 Å²	126.4	73%	0.725	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-64.4	-29.7	-179.3	123.9	-96.7	0	0	0	114	E117 S123	E117-Y121 PolarHBondContact O-N 2.9Å; Y121-S123 VanDerWaalsContact C-N 3.26Å; Y121-S123 PolarHBondContact O-N 3.35Å
122	D	51.6	Low	52.3	Low	135 Å²	135	130.9 Å²	130.9	72%	0.722	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-72.4	-18.1	179.2	-165.3	56.4	0	0	0	113	D120 T124	D120-D122 VanDerWaalsContact C-N 3.31Å; D120-D122 PolarHBondContact O-N 2.72Å; D122-T124 PolarHBondContact O-N 2.91Å
123	S	52.2	Low	49.8	Very low	95 Å²	95	130.9 Å²	130.9	66%	0.664	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-84.2	-3.3	-167.4	-69.9	0	0	0	0	116	D120 Y121	D120-S123 PolarHBondContact O-N 3.43Å; Y121-S123 VanDerWaalsContact C-N 3.26Å; Y121-S123 PolarHBondContact O-N 3.35Å
124	T	45.3	Very low	47.6	Very low	122 Å²	122	136.8 Å²	136.8	75%	0.748	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-130.6	26.9	-165.3	60	0	0	0	0	118.7	D122	D122-T124 PolarHBondContact O-N 2.91Å
125	S	40	Very low	45.4	Very low	113 Å²	113	136.3 Å²	136.3	79%	0.79	75%	0.745	S	S	*	*			trans	-155.2	95	155.9	-163.5	0	0	0	0	116.6
126	S	41.1	Very low	43.7	Very low	126 Å²	126	137.8 Å²	137.8	88%	0.881	76%	0.756	S	S	*	*			trans	-169	110	149.9	-93.5	0	0	0	0	112.7
127	K	39.4	Very low	42.3	Very low	218 Å²	218	141 Å²	141	95%	0.948	77%	0.767	S	S	*	*			trans	-147	70.1	169.8	-149.9	170.2	-171.4	174	0	115.5
128	G	34.2	Very low	41.1	Very low	73 Å²	73	141.3 Å²	141.3	75%	0.753	77%	0.768	S	S	*	*			trans	110.1	126.3	132.3	0	0	0	0	0	119.4
129	K	32.9	Very low	40	Very low	220 Å²	220	146 Å²	146	96%	0.957	78%	0.779	S	S	*	*			trans	-154.9	157.1	130.2	-107.2	164.4	-174.2	176.1	0	109.4
130	K	35.4	Very low	38.9	Very low	213 Å²	213	150.6 Å²	150.6	93%	0.926	79%	0.792	S	S	*	*			trans	-96.1	146.2	-175.9	-70.2	-177.8	175.8	-177.2	0	112.4
131	S	30	Very low	37.9	Very low	125 Å²	125	152.1 Å²	152.1	87%	0.874	81%	0.805	S	S	*	*			trans	-156.8	171.2	142.8	54	0	0	0	0	109.4
132	E	32.1	Very low	37	Very low	185 Å²	185	147.2 Å²	147.2	86%	0.864	80%	0.803	S	S	*	*			trans	-116.1	160.5	-163.5	-65.4	-179.8	72.5	0	0	115.1
133	S	31.4	Very low	36.1	Very low	108 Å²	108	151 Å²	151	76%	0.755	81%	0.812	S	S	*	*			trans	66.5	134.9	155.4	-118.3	0	0	0	0	117.4
134	R	32.4	Very low	35.3	Very low	241 Å²	241	152 Å²	152	91%	0.909	82%	0.815	S	S	*	*			cis	-138.3	160.2	14.8	-70.7	174	165.8	157.2	-5.3	110
135	G	31.4	Very low	35	Very low	76 Å²	76	157.9 Å²	157.9	78%	0.784	82%	0.823	S	S	*	*			trans	-116.3	172.6	-178.5	0	0	0	0	0	114.8
136	L	35.9	Very low	34.9	Very low	167 Å²	167	157.3 Å²	157.3	87%	0.874	82%	0.819	S	S	*	*			trans	-148.8	148.4	161.1	-105.6	166.2	0	0	0	110.8
137	K	37	Very low	34.6	Very low	169 Å²	169	160.4 Å²	160.4	74%	0.735	82%	0.817	S	S	*	*			trans	-35.1	152.9	169.6	-63.2	169.5	168.1	-173.9	0	114.7
138	E	36.9	Very low	34.4	Very low	132 Å²	132	156.4 Å²	156.4	62%	0.617	81%	0.811	S	S	*	*			cis	-162.1	-171.9	0.9	-114.4	168.9	71.4	0	0	107.2
139	K	37.2	Very low	34.3	Very low	170 Å²	170	162.4 Å²	162.4	74%	0.739	82%	0.816	S	S	*	*			cis	-156.7	169	20.1	-143.1	171.5	-163.2	75.6	0	112.7
140	K	34.8	Very low	34.2	Very low	184 Å²	184	155.8 Å²	155.8	80%	0.8	80%	0.797	S	S	*	*			trans	-32	129.2	167.1	-78.4	-176.6	179.9	-173.2	0	118.1
141	V	34.6	Very low	33.9	Very low	138 Å²	138	151.4 Å²	151.4	84%	0.836	79%	0.793	S	S	*	*				83.3	136.6	82.5	156.1	0	0	0	0	114
142	A	31.2	Very low	34.2	Very low	82 Å²	82	151.7 Å²	151.7	68%	0.678	79%	0.785	S	S	*	*			cis	-166.8	167.9	-19.4	0	0	0	0	0	110.3
143	K	33.1	Very low	34.2	Very low	213 Å²	213	152.1 Å²	152.1	93%	0.926	79%	0.787	S	S	*	*			trans	-138.2	135.7	163.1	-134.7	178.1	-174	-179.2	0	108.6
144	T	34.2	Very low	34.2	Very low	118 Å²	118	154.3 Å²	154.3	72%	0.724	79%	0.791	S	S	*	*			trans	-136.5	122.1	-170.5	52.1	0	0	0	0	113.4
145	R	39.3	Very low	33.9	Very low	244 Å²	244	145.9 Å²	145.9	92%	0.921	78%	0.779	S	S	*	*			trans	59.7	157.9	151.6	-75.6	179.6	168.2	177.1	-5	116.6
146	S	38.8	Very low	33.8	Very low	101 Å²	101	147.5 Å²	147.5	71%	0.706	78%	0.778	S	S	*	*			cis	-161.9	178	-15.5	47.3	0	0	0	0	105.7
147	K	33.9	Very low	34.4	Very low	191 Å²	191	144.7 Å²	144.7	83%	0.83	77%	0.77	S	S	*	*			cis	-174.8	148.8	41.1	-173	173.6	174.7	178.4	0	110.1
148	V	34.9	Very low	33.9	Very low	134 Å²	134	146.9 Å²	146.9	81%	0.812	78%	0.779	S	S	*	*			trans	-78.1	157.2	171.4	-80.1	0	0	0	0	113.3
149	K	33.2	Very low	33.5	Very low	200 Å²	200	145.4 Å²	145.4	87%	0.87	78%	0.784	S	S	*	*			trans	-148.1	133	136.6	-161.3	-179.2	176.1	-168.9	0	110.5
150	S	29.8	Very low	33.1	Very low	80 Å²	80	142.3 Å²	142.3	56%	0.559	79%	0.789	S	S	*	*			trans	-90.5	164.1	171.9	-159.8	0	0	0	0	111.6	D152	S150-D152 PolarHBondContact OG-OD2 2.98Å
151	S	30	Very low	33	Very low	121 Å²	121	142.1 Å²	142.1	85%	0.846	79%	0.792	S	S	*	*			trans	-154.8	99.5	151.8	-106.9	0	0	0	0	108.9
152	D	36.8	Very low	32.7	Very low	132 Å²	132	145.6 Å²	145.6	71%	0.706	80%	0.795	S	S	*	*			trans	-79	160	172.4	-49.6	-112.5	0	0	0	111	S150	S150-D152 PolarHBondContact OG-OD2 2.98Å
153	E	31.5	Very low	32.6	Very low	194 Å²	194	150.8 Å²	150.8	91%	0.907	80%	0.803	S	S	*	*			trans	-165.1	155.8	140.7	-100.8	-59.2	81.9	0	0	110
154	D	30.9	Very low	32.6	Very low	154 Å²	154	146.9 Å²	146.9	82%	0.824	80%	0.796	S	S	*	*			trans	-91.9	163.9	-164.5	180	48.3	0	0	0	115.6
155	G	26	Very low	32.2	Very low	64 Å²	64	151.1 Å²	151.1	66%	0.66	81%	0.805	S	S	*	*			trans	168.5	91.4	166.3	0	0	0	0	0	116.6
156	S	29.4	Very low	31.7	Very low	109 Å²	109	146.7 Å²	146.7	76%	0.762	80%	0.799	S	S	*	*			trans	-164.5	169.2	170.8	-102.2	0	0	0	0	113.1
157	P	49	Very low	31.1	Very low	109 Å²	109	149.8 Å²	149.8	71%	0.708	81%	0.806	S	S	*	*			cis	-131.5	-173.3	-20.1	39.4	-24.5	0	0	0	112.1
158	K	27.3	Very low	31	Very low	214 Å²	214	149 Å²	149	93%	0.93	81%	0.805	S	S	*	*			trans	-161.2	144.1	136.8	-112.1	151.6	-169.8	169.3	0	115.8
159	S	27	Very low	31.3	Very low	102 Å²	102	148.4 Å²	148.4	71%	0.713	80%	0.804	S	S	*	*			trans	-81	150.1	-172	173.4	0	0	0	0	114.4
160	A	29.3	Very low	30.9	Very low	104 Å²	104	142.2 Å²	142.2	86%	0.86	80%	0.797	S	S	*	*			trans	-148.2	130	140.8	0	0	0	0	0	110.6
161	Q	32.6	Very low	30.6	Very low	181 Å²	181	147.8 Å²	147.8	85%	0.846	81%	0.814	S	S	*	*			trans	-106.9	149	178.6	-60.8	167.2	-39.9	0	0	110.9
162	K	29	Very low	31	Very low	210 Å²	210	152 Å²	152	91%	0.913	82%	0.818	S	S	*	*			trans	-153.9	136.9	148.6	-141.7	167.1	-174.2	174.9	0	113.5
163	K	28.3	Very low	30.6	Very low	192 Å²	192	152.6 Å²	152.6	84%	0.835	83%	0.826	S	S	*	*			trans	-95.1	138.1	175.4	-93.7	-175.2	172	-179.2	0	111.7
164	V	34.3	Very low	31.2	Very low	130 Å²	130	147.9 Å²	147.9	79%	0.788	82%	0.82	S	S	*	*				32.5	130.3	129.9	-172.3	0	0	0	0	118.7
165	K	24.4	Very low	31.5	Very low	208 Å²	208	146.3 Å²	146.3	90%	0.904	82%	0.819	S	S	*	*			trans	-138.8	138.2	138.4	-152.1	173	-174.7	-177	0	110.8
166	L	28.6	Very low	32.4	Very low	151 Å²	151	148.3 Å²	148.3	79%	0.791	83%	0.829	S	S	*	*			trans	-97.5	148.2	-177.1	-178.3	74	0	0	0	110.5
167	L	27	Very low	32.8	Very low	165 Å²	165	146.1 Å²	146.1	86%	0.864	82%	0.817	S	S	*	*			trans	-164.6	151.3	152.1	-104.9	164.7	0	0	0	110.9
168	Q	32.2	Very low	32.8	Very low	175 Å²	175	148.6 Å²	148.6	82%	0.818	83%	0.825	S	S	*	*			trans	-144.7	176.1	175.7	-113.6	-167.1	5.3	0	0	106.6
169	P	39.8	Very low	33.3	Very low	122 Å²	122	147.2 Å²	147.2	79%	0.792	82%	0.819	S	S	*	*			cis	-124.4	-176.2	-3.9	40.3	-24.9	0	0	0	113.5
170	G	25.1	Very low	33.9	Very low	69 Å²	69	145.1 Å²	145.1	71%	0.711	81%	0.814	S	S	*	*			trans	170.9	88.3	169.4	0	0	0	0	0	117.4
171	E	23.4	Very low	34.6	Very low	198 Å²	198	148 Å²	148	93%	0.925	82%	0.815	S	S	*	*			trans	48.4	163.9	146.4	-65.6	-177.3	104.6	0	0	123.9
172	F	38.6	Very low	35.1	Very low	210 Å²	210	143.7 Å²	143.7	92%	0.921	80%	0.801	S	S	*	*			trans	-79.4	132.7	-173.7	-83.3	-117.4	0	0	0	113.2
173	T	28.5	Very low	36	Very low	143 Å²	143	139 Å²	139	88%	0.877	78%	0.782	S	S	*	*			trans	-150.6	144.1	144.4	19.9	0	0	0	0	109.6
174	A	44.1	Very low	37.1	Very low	95 Å²	95	134.4 Å²	134.4	79%	0.785	77%	0.772	S	S	*	*			trans	-87.7	134	-178.9	0	0	0	0	0	111.5	A176	A174-A176 PolarHBondContact O-N 3.14Å
175	P	38.3	Very low	37.6	Very low	121 Å²	121	131.3 Å²	131.3	79%	0.786	76%	0.756	S	S	*	*			trans	-81.9	104.4	172.8	31.7	-31.5	0	0	0	110.6	A177	P175-A177 VanDerWaalsContact C-N 3.33Å; P175-A177 PolarHBondContact O-N 3.25Å
176	A	44.5	Very low	38.7	Very low	106 Å²	106	126.2 Å²	126.2	88%	0.876	74%	0.739	S	S	*	*			trans	-69.9	92.4	161.2	0	0	0	0	0	108.8	A174 N178	A174-A176 PolarHBondContact O-N 3.14Å; A176-N178 PolarHBondContact O-N 3.31Å
177	A	38.2	Very low	39.9	Very low	63 Å²	63	123.8 Å²	123.8	52%	0.521	73%	0.73	S	S	.	*			trans	-80.6	115.5	-177.2	0	0	0	0	0	111.1	P175 F179	P175-A177 VanDerWaalsContact C-N 3.33Å; P175-A177 PolarHBondContact O-N 3.25Å; A177-F179 VanDerWaalsContact C-N 3.34Å; A177-F179 HydrophobicContact CB-CD2 3.76Å; A177-F179 HydrophobicContact CB-CE2 3.4Å; A177-F179 VanDerWaalsContact CB-CE2 3.4Å; A177-F179 HydrophobicContact CB-CZ 4.27Å; A177-F179 PolarHBondContact O-N 3.36Å
178	N	49	Very low	40.9	Very low	162 Å²	162	122.9 Å²	122.9	87%	0.866	73%	0.725	S	S	*	*			trans	-79.7	71.7	-172	-175	68.7	0	0	0	112.6	A176 G180	A176-N178 PolarHBondContact O-N 3.31Å; N178-G180 PolarHBondContact O-N 2.98Å; N178-G180 VanDerWaalsContact O-N 3.1Å
179	F	37	Very low	41.9	Very low	184 Å²	184	121.5 Å²	121.5	81%	0.807	72%	0.723	S	S	*	*			trans	-82.6	76.9	178.7	-70.9	-69.3	0	0	0	112.6	A177	A177-F179 VanDerWaalsContact C-N 3.34Å; A177-F179 HydrophobicContact CB-CD2 3.76Å; A177-F179 HydrophobicContact CB-CE2 3.4Å; A177-F179 VanDerWaalsContact CB-CE2 3.4Å; A177-F179 HydrophobicContact CB-CZ 4.27Å; A177-F179 PolarHBondContact O-N 3.36Å
180	G	39.6	Very low	42.7	Very low	59 Å²	59	121 Å²	121	61%	0.608	71%	0.712	S	S	*	*			trans	-77.6	137.7	165.9	0	0	0	0	0	111.8	N178	N178-G180 PolarHBondContact O-N 2.98Å; N178-G180 VanDerWaalsContact O-N 3.1Å
181	N	43.1	Very low	44.5	Very low	163 Å²	163	122.1 Å²	122.1	87%	0.872	71%	0.706	S	S	*	*			trans	59.7	81.6	174.4	-61.5	-3.9	0	0	0	116.2
182	V	43.9	Very low	46.1	Very low	92 Å²	92	117.7 Å²	117.7	56%	0.558	69%	0.692	S	S	*	*			trans	-70.6	131.4	149.7	-175.9	0	0	0	0	107.8	D186	V182-D186 HydrophobicContact CG1-CB 4.22Å
183	H	48	Very low	47.2	Very low	110 Å²	110	112.2 Å²	112.2	51%	0.509	67%	0.673	S	S	.	*			trans	-91	143.9	-177.7	-179.3	-107.7	0	0	0	110.5	S185 D186	H183-S185 PolarHBondContact CE1-OG 3.1Å; H183-S185 WeakPolarHBondContact ND1-CB 3.37Å; H183-S185 PolarHBondContact ND1-N 2.9Å; H183-S185 PolarHBondContact ND1-OG 3.38Å; H183-S185 PolarHBondContact O-N 3.48Å; H183-D186 WeakPolarHBondContact CA-OD2 3.36Å; H183-D186 WeakPolarHBondContact CB-OD2 3.49Å; H183-D186 PolarHBondContact N-OD2 3.07Å; H183-D186 WeakPolarHBondContact O-CB 3.38Å; H183-D186 VanDerWaalsContact O-CG 3.29Å; H183-D186 PolarHBondContact O-N 3.13Å
184	P	50.3	Low	48.9	Very low	96 Å²	96	111.8 Å²	111.8	62%	0.623	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.3	-19.5	-174.9	-27.7	36.8	0	0	0	115.7
185	S	44.8	Very low	49.9	Very low	66 Å²	66	114 Å²	114	46%	0.462	67%	0.671	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.3	-25.5	173.7	-55.7	0	0	0	0	113.5	H183 V187 L188	H183-S185 PolarHBondContact CE1-OG 3.1Å; H183-S185 WeakPolarHBondContact ND1-CB 3.37Å; H183-S185 PolarHBondContact ND1-N 2.9Å; H183-S185 PolarHBondContact ND1-OG 3.38Å; H183-S185 PolarHBondContact O-N 3.48Å; S185-V187 PolarHBondContact O-N 2.98Å; S185-L188 PolarHBondContact O-N 3.44Å
186	D	47.6	Very low	51.7	Low	101 Å²	101	111.6 Å²	111.6	54%	0.54	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69	-17.9	-175.5	-48.7	-20.6	0	0	0	111.7	V182 H183	V182-D186 HydrophobicContact CG1-CB 4.22Å; H183-D186 WeakPolarHBondContact CA-OD2 3.36Å; H183-D186 WeakPolarHBondContact CB-OD2 3.49Å; H183-D186 PolarHBondContact N-OD2 3.07Å; H183-D186 WeakPolarHBondContact O-CB 3.38Å; H183-D186 VanDerWaalsContact O-CG 3.29Å; H183-D186 PolarHBondContact O-N 3.13Å
187	V	54.4	Low	53	Low	99 Å²	99	110 Å²	110	60%	0.6	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-14.1	175.7	-175.1	0	0	0	0	112.1	S185	S185-V187 PolarHBondContact O-N 2.98Å
188	L	47.9	Very low	55.3	Low	147 Å²	147	111 Å²	111	77%	0.77	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	-6.9	-173.9	-62.9	179	0	0	0	114.1	S185	S185-L188 PolarHBondContact O-N 3.44Å
189	D	54.7	Low	57.1	Low	146 Å²	146	106.5 Å²	106.5	78%	0.781	60%	0.601	S	S	*	*			trans	-106.6	41	176.6	-158.7	27.2	0	0	0	111.8
190	M	55.5	Low	59.6	Low	112 Å²	112	97.7 Å²	97.7	55%	0.552	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-70.1	124.6	161.5	-68.1	-153.3	-51.6	0	0	108.3	Y90 V192	Y90-M190 HydrophobicContact CE1-SD 4.03Å; Y90-M190 HydrophobicContact CE2-SD 3.97Å; M190-V192 PolarHBondContact O-N 3.23Å
191	P	63.4	Low	61.8	Low	91 Å²	91	98 Å²	98	59%	0.591	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-63.3	123.7	176.2	26.5	-33.4	0	0	0	109.3	D193	P191-D193 PolarHBondContact O-N 3.43Å
192	V	56.7	Low	64	Low	105 Å²	105	92.4 Å²	92.4	64%	0.636	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-56.8	125	172.7	178.7	0	0	0	0	108.3	M190 P194 V205	M190-V192 PolarHBondContact O-N 3.23Å; V192-P194 VanDerWaalsContact O-CD 3.25Å; V192-P194 WeakPolarHBondContact O-CD 3.29Å; V192-P194 VanDerWaalsContact O-N 3.11Å; V192-V205 HydrophobicContact CG1-CG1 3.7Å
193	D	60.5	Low	65.8	Low	96 Å²	96	93.3 Å²	93.3	51%	0.513	52%	0.521	S	S	.	.			trans	-54.8	115.9	-179.2	-175.4	-14.9	0	0	0	109.6	P191 N195 E196	P191-D193 PolarHBondContact O-N 3.43Å; D193-N195 PolarHBondContact O-N 3Å; D193-N195 WeakPolarHBondContact OD1-CA 3.35Å; D193-N195 VanDerWaalsContact OD1-CB 3.22Å; D193-N195 WeakPolarHBondContact OD1-CB 3.24Å; D193-N195 PolarHBondContact OD1-N 3.44Å; D193-E196 PolarHBondContact O-N 2.9Å; D193-E196 VanDerWaalsContact O-N 3.09Å
194	P	65.8	Low	67.4	Low	133 Å²	133	93 Å²	93	86%	0.864	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-12.6	178.8	-23.7	35.2	0	0	0	114	V192	V192-P194 VanDerWaalsContact O-CD 3.25Å; V192-P194 WeakPolarHBondContact O-CD 3.29Å; V192-P194 VanDerWaalsContact O-N 3.11Å
195	N	65	Low	69.1	Low	143 Å²	143	89.9 Å²	89.9	77%	0.765	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	-2.7	-178	-150	61.8	0	0	0	113.3	D193	D193-N195 PolarHBondContact O-N 3Å; D193-N195 WeakPolarHBondContact OD1-CA 3.35Å; D193-N195 VanDerWaalsContact OD1-CB 3.22Å; D193-N195 WeakPolarHBondContact OD1-CB 3.24Å; D193-N195 PolarHBondContact OD1-N 3.44Å
196	E	74.8	Confident	71	Confident	69 Å²	69	89.9 Å²	89.9	32%	0.322	50%	0.499	S	S	.	.	S	Bend	trans	-75	126.1	171.2	-165.8	-175.4	158.5	0	0	110.7	D193 T198 V205 S206	D193-E196 PolarHBondContact O-N 2.9Å; D193-E196 VanDerWaalsContact O-N 3.09Å; E196-T198 PolarHBondContact O-N 3.41Å; E196-V205 HydrophobicContact CB-CG1 4.09Å; E196-V205 VanDerWaalsContact CD-CB 3.48Å; E196-V205 HydrophobicContact CG-CB 4.47Å; E196-V205 HydrophobicContact CG-CG1 4.11Å; E196-V205 WeakPolarHBondContact OE1-CB 3.44Å; E196-V205 WeakPolarHBondContact OE2-CB 3.29Å; E196-V205 VanDerWaalsContact OE2-CG1 3.25Å; E196-V205 WeakPolarHBondContact OE2-CG1 3.45Å; E196-S206 PolarHBondContact OE1-N 2.93Å; E196-S206 PolarHBondContact OE1-OG 3.14Å
197	P	73.3	Confident	72.7	Confident	73 Å²	73	90.2 Å²	90.2	47%	0.474	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-62.9	130.1	177.6	24.9	-34.5	0	0	0	112	Y199	P197-Y199 HydrophobicContact CB-CE2 4.23Å; P197-Y199 HydrophobicContact CG-CE2 3.96Å; P197-Y199 WeakPolarHBondContact CG-OH 3.46Å; P197-Y199 VanDerWaalsContact O-CD2 3.24Å; P197-Y199 WeakPolarHBondContact O-CD2 3.24Å; P197-Y199 WeakPolarHBondContact O-CE2 3.31Å
198	T	84.9	Confident	74.3	Confident	83 Å²	83	89.2 Å²	89.2	51%	0.509	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-87.4	138.7	177.5	53.6	0	0	0	0	112.3	E196	E196-T198 PolarHBondContact O-N 3.41Å
199	Y	87.3	Confident	76.3	Confident	68 Å²	68	87.7 Å²	87.7	27%	0.267	49%	0.492	S	S	.	.	B	Isolated β-bridge	trans	-122.9	175.3	-174.5	-60.4	-72.9	0	0	0	112.2	P197 H203 Q204 M210 W222	P197-Y199 HydrophobicContact CB-CE2 4.23Å; P197-Y199 HydrophobicContact CG-CE2 3.96Å; P197-Y199 WeakPolarHBondContact CG-OH 3.46Å; P197-Y199 VanDerWaalsContact O-CD2 3.24Å; P197-Y199 WeakPolarHBondContact O-CD2 3.24Å; P197-Y199 WeakPolarHBondContact O-CE2 3.31Å; Y199-H203 WeakPolarHBondContact O-CA 3.49Å; Y199-H203 PolarHBondContact O-N 3.36Å; Y199-Q204 PolarHBondContact N-O 2.84Å; Y199-Q204 PolarHBondContact O-N 3.08Å; Y199-M210 HydrophobicContact CD2-CE 4.22Å; Y199-M210 HydrophobicContact CG-CE 4.08Å; Y199-W222 HydrophobicContact CD1-CB 3.93Å; Y199-W222 HydrophobicContact CD1-CG 4.45Å; Y199-W222 HydrophobicContact CG-CB 4.35Å
200	C	89.4	Confident	78	Confident	0 Å²	0	83 Å²	83	0%	0	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	-172	178.1	-158.6	0	0	0	0	114.7	C202 W222 F223 H224 C227	C200-C202 VanDerWaalsContact C-N 3.29Å; C200-W222 VanDerWaalsContact CA-O 3.27Å; C200-W222 WeakPolarHBondContact CA-O 3.28Å; C200-W222 PolarHBondContact N-O 2.87Å; C200-F223 HydrophobicContact CB-CB 4.43Å; C200-F223 HydrophobicContact CB-CD1 4.33Å; C200-F223 VanDerWaalsContact SG-CA 3.56Å; C200-H224 WeakPolarHBondContact CB-ND1 3.34Å; C200-H224 PolarHBondContact SG-N 3.31Å; C200-C227 WeakPolarHBondContact SG-CB 3.49Å
201	L	86.6	Confident	79.8	Confident	64 Å²	64	78.5 Å²	78.5	34%	0.335	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.2	177	-60.4	173.7	0	0	0	112.8	I220 F223 P241	L201-I220 HydrophobicContact CD2-CD1 4.05Å; L201-F223 HydrophobicContact CD2-CE1 4.03Å; L201-F223 HydrophobicContact CG-CD1 4.15Å; L201-F223 HydrophobicContact CG-CE1 3.91Å; L201-P241 HydrophobicContact CD1-CG 4.38Å
202	C	88.2	Confident	81.1	Confident	47 Å²	47	75.5 Å²	75.5	32%	0.318	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-8.9	178.3	57.5	0	0	0	0	113.3	C200 Q204 H224	C200-C202 VanDerWaalsContact C-N 3.29Å; C202-Q204 VanDerWaalsContact C-N 3.33Å; C202-Q204 HydrophobicContact CB-CG 4.02Å; C202-Q204 PolarHBondContact O-N 3.32Å; C202-H224 VanDerWaalsContact SG-CE1 3.5Å; C202-H224 PolarHBondContact SG-ND1 3.34Å; C202-H224 VanDerWaalsContact SG-ND1 3.43Å
203	H	83.3	Confident	82.8	Confident	111 Å²	111	71.3 Å²	71.3	51%	0.514	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	51.2	-175.7	-62.8	-81.5	0	0	0	112	Y199	Y199-H203 WeakPolarHBondContact O-CA 3.49Å; Y199-H203 PolarHBondContact O-N 3.36Å
204	Q	80.6	Confident	84.2	Confident	102 Å²	102	70.2 Å²	70.2	48%	0.477	40%	0.399	S	S	.	.	B	Isolated β-bridge	trans	-118.6	161.7	178.3	-63.5	-62.4	-81.6	0	0	110.7	Y199 C202 Y207	Y199-Q204 PolarHBondContact N-O 2.84Å; Y199-Q204 PolarHBondContact O-N 3.08Å; C202-Q204 VanDerWaalsContact C-N 3.33Å; C202-Q204 HydrophobicContact CB-CG 4.02Å; C202-Q204 PolarHBondContact O-N 3.32Å; Q204-Y207 HydrophobicContact CB-CE1 3.98Å
205	V	86.9	Confident	85.2	Confident	32 Å²	32	65.2 Å²	65.2	19%	0.194	37%	0.365	C	S	.	.			trans	-54	169.1	171.9	-65.2	0	0	0	0	113.5	V192 E196 Y207 H224	V192-V205 HydrophobicContact CG1-CG1 3.7Å; E196-V205 HydrophobicContact CB-CG1 4.09Å; E196-V205 VanDerWaalsContact CD-CB 3.48Å; E196-V205 HydrophobicContact CG-CB 4.47Å; E196-V205 HydrophobicContact CG-CG1 4.11Å; E196-V205 WeakPolarHBondContact OE1-CB 3.44Å; E196-V205 WeakPolarHBondContact OE2-CB 3.29Å; E196-V205 VanDerWaalsContact OE2-CG1 3.25Å; E196-V205 WeakPolarHBondContact OE2-CG1 3.45Å; V205-Y207 WeakPolarHBondContact O-CD1 3.22Å; V205-Y207 PolarHBondContact O-N 3.04Å; V205-H224 PolarHBondContact O-NE2 3.34Å
206	S	83.4	Confident	86	Confident	65 Å²	65	64.4 Å²	64.4	46%	0.455	37%	0.365	S	S	.	.			trans	-71.3	123.4	177.7	60.6	0	0	0	0	111.6	E196	E196-S206 PolarHBondContact OE1-N 2.93Å; E196-S206 PolarHBondContact OE1-OG 3.14Å
207	Y	84.3	Confident	86.4	Confident	108 Å²	108	67.5 Å²	67.5	42%	0.424	38%	0.384	S	S	.	.			trans	-150	143.7	178.9	69.5	-101.7	0	0	0	114.1	Q204 V205 H224 C227	Q204-Y207 HydrophobicContact CB-CE1 3.98Å; V205-Y207 WeakPolarHBondContact O-CD1 3.22Å; V205-Y207 PolarHBondContact O-N 3.04Å; Y207-H224 AromaticContact CD1-CD2 3.52Å; Y207-H224 AromaticContact CD1-NE2 3.32Å; Y207-H224 VanDerWaalsContact CD1-NE2 3.32Å; Y207-H224 WeakPolarHBondContact CD1-NE2 3.34Å; Y207-H224 AromaticContact CD2-CD2 3.91Å; Y207-H224 AromaticContact CE1-CD2 3.53Å; Y207-H224 AromaticContact CE1-CE1 3.64Å; Y207-H224 AromaticContact CE1-CG 3.91Å; Y207-H224 AromaticContact CE1-NE2 3.34Å; Y207-H224 VanDerWaalsContact CE1-NE2 3.34Å; Y207-H224 WeakPolarHBondContact CE1-NE2 3.49Å; Y207-H224 HydrophobicContact CE2-CB 4.2Å; Y207-H224 AromaticContact CE2-CD2 3.92Å; Y207-H224 AromaticContact CG-CD2 3.71Å; Y207-H224 AromaticContact CG-NE2 3.96Å; Y207-H224 AromaticContact CZ-CD2 3.73Å; Y207-H224 AromaticContact CZ-CG 3.76Å; Y207-H224 AromaticContact CZ-NE2 3.99Å; Y207-H224 PolarHBondContact O-CD2 2.79Å; Y207-C227 PolarHBondContact OH-SG 3.46Å
208	G	87.1	Confident	87	Confident	78 Å²	78	64.5 Å²	64.5	80%	0.804	37%	0.365	S	S	*	.	S	Bend	trans	59.6	-147.7	176.7	0	0	0	0	0	113.9
209	E	89.8	Confident	86.9	Confident	116 Å²	116	66 Å²	66	54%	0.542	38%	0.379	S	S	.	.	S	Bend	trans	-78.2	129.3	174.9	-65.5	-167.5	111.3	0	0	111.5	F225	E209-F225 HydrophobicContact CB-CB 4.14Å; E209-F225 HydrophobicContact CB-CD1 3.75Å; E209-F225 HydrophobicContact CB-CD2 3.58Å; E209-F225 HydrophobicContact CB-CE1 3.92Å; E209-F225 HydrophobicContact CB-CE2 3.76Å; E209-F225 HydrophobicContact CB-CG 3.57Å; E209-F225 HydrophobicContact CB-CZ 3.93Å; E209-F225 VanDerWaalsContact CD-CE2 3.46Å; E209-F225 HydrophobicContact CG-CD2 4.3Å; E209-F225 HydrophobicContact CG-CE2 4.25Å; E209-F225 WeakPolarHBondContact O-CD1 3.2Å; E209-F225 PolarHBondContact O-N 3.33Å; E209-F225 WeakPolarHBondContact OE2-CD2 3.46Å; E209-F225 WeakPolarHBondContact OE2-CE2 3.34Å
210	M	92.1	Very high	86.8	Confident	48 Å²	48	64.1 Å²	64.1	24%	0.236	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.8	178.4	-61.2	-174.7	77.2	0	0	111.9	Y199 W222 F223	Y199-M210 HydrophobicContact CD2-CE 4.22Å; Y199-M210 HydrophobicContact CG-CE 4.08Å; M210-W222 HydrophobicContact CE-CB 4.01Å; M210-F223 CarbonylContact C-O 3.46Å; M210-F223 VanDerWaalsContact CA-O 3.3Å; M210-F223 WeakPolarHBondContact CA-O 3.47Å
211	I	91.6	Very high	86.8	Confident	17 Å²	17	69.3 Å²	69.3	9%	0.087	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.6	178	-170.5	159.2	0	0	0	111.4	W222 F223 F225 V228 L230 P234 W238	I211-W222 WeakPolarHBondContact O-CA 3.06Å; I211-F223 HydrophobicContact CG2-CB 4.19Å; I211-F223 PolarHBondContact N-O 2.97Å; I211-F223 PolarHBondContact O-N 3.05Å; I211-F225 HydrophobicContact CB-CD1 4.21Å; I211-F225 HydrophobicContact CB-CE1 3.85Å; I211-F225 HydrophobicContact CG2-CD1 4.38Å; I211-F225 HydrophobicContact CG2-CE1 4.5Å; I211-V228 HydrophobicContact CG2-CG2 4.17Å; I211-L230 HydrophobicContact CB-CD1 4.35Å; I211-L230 HydrophobicContact CD1-CD1 3.73Å; I211-L230 HydrophobicContact CG2-CD1 3.82Å; I211-P234 HydrophobicContact CD1-CG 3.39Å; I211-W238 HydrophobicContact CB-CE3 4.41Å; I211-W238 HydrophobicContact CD1-CB 3.68Å; I211-W238 HydrophobicContact CD1-CD2 3.61Å; I211-W238 HydrophobicContact CD1-CE3 3.91Å; I211-W238 HydrophobicContact CD1-CG 3.5Å; I211-W238 VanDerWaalsContact CD1-CG 3.5Å; I211-W238 HydrophobicContact CG1-CB 4.44Å; I211-W238 HydrophobicContact CG1-CD2 4Å; I211-W238 HydrophobicContact CG1-CE3 3.73Å; I211-W238 HydrophobicContact CG1-CG 4.31Å; I211-W238 HydrophobicContact CG1-CZ3 4.3Å; I211-W238 HydrophobicContact CG2-CD2 4.18Å; I211-W238 HydrophobicContact CG2-CE3 3.86Å; I211-W238 HydrophobicContact CG2-CH2 3.7Å; I211-W238 HydrophobicContact CG2-CZ2 4.04Å; I211-W238 HydrophobicContact CG2-CZ3 3.61Å
212	G	92.1	Very high	87.1	Confident	27 Å²	27	71.9 Å²	71.9	28%	0.278	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	142.1	169.8	0	0	0	0	0	111.6	E221	G212-E221 CarbonylContact C-O 3.53Å; G212-E221 WeakPolarHBondContact CA-O 3.46Å
213	C	91.9	Very high	87.3	Confident	17 Å²	17	69.7 Å²	69.7	12%	0.115	39%	0.387	C	S	.	.			trans	-85.1	123.4	174.7	178.5	0	0	0	0	111	N215 C218 E221 F223 W238 C240	C213-N215 PolarHBondContact O-N 3.12Å; C213-C218 HydrophobicContact CB-CB 4.3Å; C213-E221 PolarHBondContact N-O 3.07Å; C213-F223 HydrophobicContact CB-CD2 4.48Å; C213-F223 HydrophobicContact CB-CE2 3.99Å; C213-W238 HydrophobicContact CB-CE3 4.36Å; C213-W238 HydrophobicContact CB-CZ3 4.03Å; C213-C240 HydrophobicContact CB-CB 4.22Å; C213-C240 PolarHBondContact SG-N 3.19Å; C213-C240 VanDerWaalsContact SG-N 3.37Å
214	D	90.5	Very high	87.8	Confident	73 Å²	73	64.5 Å²	64.5	39%	0.39	36%	0.363	S	S	.	.	S	Bend	trans	-68.1	23.6	179.5	-80.1	-82.8	0	0	0	114.9	K237 W238 Y239	D214-K237 HydrophobicContact CB-CB 4.06Å; D214-K237 HydrophobicContact CB-CD 4.24Å; D214-K237 HydrophobicContact CB-CG 4.34Å; D214-K237 WeakPolarHBondContact OD2-CA 3.45Å; D214-K237 WeakPolarHBondContact OD2-CB 3.42Å; D214-W238 WeakPolarHBondContact CB-O 3.47Å; D214-W238 PolarHBondContact N-O 3.36Å; D214-W238 PolarHBondContact OD2-N 3.06Å; D214-Y239 HydrophobicContact CB-CD1 4.38Å; D214-Y239 HydrophobicContact CB-CE1 3.75Å; D214-Y239 HydrophobicContact CB-CE2 4.46Å; D214-Y239 WeakPolarHBondContact O-CE1 3.42Å; D214-Y239 PolarHBondContact O-OH 2.93Å
215	N	86.1	Confident	88.3	Confident	28 Å²	28	60.4 Å²	60.4	15%	0.15	34%	0.344	C	S	.	.			trans	-115.9	110.4	175.9	-163.3	82	0	0	0	108.8	C213 D217 C218 Y239 C243	C213-N215 PolarHBondContact O-N 3.12Å; N215-D217 PolarHBondContact ND2-N 2.73Å; N215-D217 PolarHBondContact O-N 3.48Å; N215-C218 HydrophobicContact CB-CB 4.4Å; N215-C218 WeakPolarHBondContact O-CB 3.32Å; N215-C218 PolarHBondContact O-N 3.28Å; N215-Y239 HydrophobicContact CB-CD1 3.97Å; N215-Y239 HydrophobicContact CB-CE1 3.95Å; N215-C243 HydrophobicContact CB-CB 4.12Å
216	T	82.5	Confident	88.4	Confident	127 Å²	127	62.9 Å²	62.9	78%	0.779	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-24.1	-179.3	47.2	0	0	0	0	114	C218	T216-C218 VanDerWaalsContact C-N 3.33Å
217	D	83	Confident	88.6	Confident	134 Å²	134	62.1 Å²	62.1	72%	0.717	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	19.7	-175.4	-35.6	-25.3	0	0	0	111.3	N215	N215-D217 PolarHBondContact ND2-N 2.73Å; N215-D217 PolarHBondContact O-N 3.48Å
218	C	85.9	Confident	88.8	Confident	10 Å²	10	58.4 Å²	58.4	7%	0.068	35%	0.35	C	S	.	.			trans	-88.5	106.8	-177.6	-168.1	0	0	0	0	111.6	C213 N215 T216 I220 E221 C240 C243	C213-C218 HydrophobicContact CB-CB 4.3Å; N215-C218 HydrophobicContact CB-CB 4.4Å; N215-C218 WeakPolarHBondContact O-CB 3.32Å; N215-C218 PolarHBondContact O-N 3.28Å; T216-C218 VanDerWaalsContact C-N 3.33Å; C218-I220 PolarHBondContact O-N 2.92Å; C218-E221 VanDerWaalsContact O-CG 3.29Å; C218-E221 WeakPolarHBondContact O-CG 3.46Å; C218-E221 PolarHBondContact O-N 2.61Å; C218-E221 VanDerWaalsContact O-N 3.17Å; C218-C240 VanDerWaalsContact SG-SG 3.66Å; C218-C243 VanDerWaalsContact SG-SG 3.68Å
219	S	82.6	Confident	88.8	Confident	115 Å²	115	57.9 Å²	57.9	80%	0.804	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	6.3	-174.5	76.3	0	0	0	0	117.4
220	I	84.9	Confident	88.7	Confident	28 Å²	28	54 Å²	54	14%	0.144	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-126.4	-28.5	-179.8	-64.5	174.4	0	0	0	110.6	L201 C218 W222 F223	L201-I220 HydrophobicContact CD2-CD1 4.05Å; C218-I220 PolarHBondContact O-N 2.92Å; I220-W222 PolarHBondContact O-N 2.72Å; I220-F223 HydrophobicContact CB-CE1 4.29Å; I220-F223 HydrophobicContact CB-CE2 4.36Å; I220-F223 HydrophobicContact CB-CZ 3.75Å; I220-F223 HydrophobicContact CD1-CE1 4.38Å; I220-F223 HydrophobicContact CD1-CZ 4.45Å; I220-F223 HydrophobicContact CG2-CD1 4.43Å; I220-F223 HydrophobicContact CG2-CE1 3.81Å; I220-F223 HydrophobicContact CG2-CE2 4.13Å; I220-F223 HydrophobicContact CG2-CZ 3.62Å
221	E	90.1	Very high	88.3	Confident	109 Å²	109	57.7 Å²	57.7	51%	0.509	35%	0.353	S	S	.	.			trans	56.1	-55.1	-176.3	-57.5	-171.5	163.2	0	0	116.4	G212 C213 C218 F223	G212-E221 CarbonylContact C-O 3.53Å; G212-E221 WeakPolarHBondContact CA-O 3.46Å; C213-E221 PolarHBondContact N-O 3.07Å; C218-E221 VanDerWaalsContact O-CG 3.29Å; C218-E221 WeakPolarHBondContact O-CG 3.46Å; C218-E221 PolarHBondContact O-N 2.61Å; C218-E221 VanDerWaalsContact O-N 3.17Å; E221-F223 WeakPolarHBondContact O-CE2 3.47Å
222	W	92.3	Very high	88.1	Confident	118 Å²	118	61.6 Å²	61.6	45%	0.447	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	140	-168.2	-63.2	91.8	0	0	0	113.5	Y199 C200 M210 I211 I220	Y199-W222 HydrophobicContact CD1-CB 3.93Å; Y199-W222 HydrophobicContact CD1-CG 4.45Å; Y199-W222 HydrophobicContact CG-CB 4.35Å; C200-W222 VanDerWaalsContact CA-O 3.27Å; C200-W222 WeakPolarHBondContact CA-O 3.28Å; C200-W222 PolarHBondContact N-O 2.87Å; M210-W222 HydrophobicContact CE-CB 4.01Å; I211-W222 WeakPolarHBondContact O-CA 3.06Å; I220-W222 PolarHBondContact O-N 2.72Å
223	F	93.3	Very high	87.9	Confident	1 Å²	1	68.5 Å²	68.5	0%	0.004	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	133	-174.5	-59.7	-98.7	0	0	0	111.5	C200 L201 M210 I211 C213 I220 E221 V228 W238 C240	C200-F223 HydrophobicContact CB-CB 4.43Å; C200-F223 HydrophobicContact CB-CD1 4.33Å; C200-F223 VanDerWaalsContact SG-CA 3.56Å; L201-F223 HydrophobicContact CD2-CE1 4.03Å; L201-F223 HydrophobicContact CG-CD1 4.15Å; L201-F223 HydrophobicContact CG-CE1 3.91Å; M210-F223 CarbonylContact C-O 3.46Å; M210-F223 VanDerWaalsContact CA-O 3.3Å; M210-F223 WeakPolarHBondContact CA-O 3.47Å; I211-F223 HydrophobicContact CG2-CB 4.19Å; I211-F223 PolarHBondContact N-O 2.97Å; I211-F223 PolarHBondContact O-N 3.05Å; C213-F223 HydrophobicContact CB-CD2 4.48Å; C213-F223 HydrophobicContact CB-CE2 3.99Å; I220-F223 HydrophobicContact CB-CE1 4.29Å; I220-F223 HydrophobicContact CB-CE2 4.36Å; I220-F223 HydrophobicContact CB-CZ 3.75Å; I220-F223 HydrophobicContact CD1-CE1 4.38Å; I220-F223 HydrophobicContact CD1-CZ 4.45Å; I220-F223 HydrophobicContact CG2-CD1 4.43Å; I220-F223 HydrophobicContact CG2-CE1 3.81Å; I220-F223 HydrophobicContact CG2-CE2 4.13Å; I220-F223 HydrophobicContact CG2-CZ 3.62Å; E221-F223 WeakPolarHBondContact O-CE2 3.47Å; F223-V228 HydrophobicContact CB-CG1 3.78Å; F223-V228 HydrophobicContact CB-CG2 4.41Å; F223-V228 HydrophobicContact CD1-CG1 3.98Å; F223-V228 HydrophobicContact CG-CG1 4.14Å; F223-W238 HydrophobicContact CB-CH2 4.05Å; F223-W238 AromaticContact CD2-CH2 3.9Å; F223-W238 HydrophobicContact CD2-CH2 3.9Å; F223-W238 AromaticContact CD2-CZ3 3.81Å; F223-W238 HydrophobicContact CD2-CZ3 3.81Å; F223-W238 HydrophobicContact CE2-CZ3 4.45Å; F223-W238 AromaticContact CG-CH2 3.97Å; F223-W238 HydrophobicContact CG-CH2 3.97Å; F223-W238 HydrophobicContact CG-CZ3 4.34Å; F223-C240 HydrophobicContact CD1-CB 4.29Å; F223-C240 HydrophobicContact CD2-CB 3.97Å; F223-C240 HydrophobicContact CE1-CB 3.8Å; F223-C240 HydrophobicContact CE2-CB 3.45Å; F223-C240 VanDerWaalsContact CE2-CB 3.45Å; F223-C240 HydrophobicContact CG-CB 4.4Å; F223-C240 HydrophobicContact CZ-CB 3.35Å
224	H	93	Very high	87.5	Confident	2 Å²	2	69.7 Å²	69.7	1%	0.009	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	137.2	173.3	-41.3	90.9	0	0	0	110.6	C200 C202 V205 Y207 A226 C227 V228	C200-H224 WeakPolarHBondContact CB-ND1 3.34Å; C200-H224 PolarHBondContact SG-N 3.31Å; C202-H224 VanDerWaalsContact SG-CE1 3.5Å; C202-H224 PolarHBondContact SG-ND1 3.34Å; C202-H224 VanDerWaalsContact SG-ND1 3.43Å; V205-H224 PolarHBondContact O-NE2 3.34Å; Y207-H224 AromaticContact CD1-CD2 3.52Å; Y207-H224 AromaticContact CD1-NE2 3.32Å; Y207-H224 VanDerWaalsContact CD1-NE2 3.32Å; Y207-H224 WeakPolarHBondContact CD1-NE2 3.34Å; Y207-H224 AromaticContact CD2-CD2 3.91Å; Y207-H224 AromaticContact CE1-CD2 3.53Å; Y207-H224 AromaticContact CE1-CE1 3.64Å; Y207-H224 AromaticContact CE1-CG 3.91Å; Y207-H224 AromaticContact CE1-NE2 3.34Å; Y207-H224 VanDerWaalsContact CE1-NE2 3.34Å; Y207-H224 WeakPolarHBondContact CE1-NE2 3.49Å; Y207-H224 HydrophobicContact CE2-CB 4.2Å; Y207-H224 AromaticContact CE2-CD2 3.92Å; Y207-H224 AromaticContact CG-CD2 3.71Å; Y207-H224 AromaticContact CG-NE2 3.96Å; Y207-H224 AromaticContact CZ-CD2 3.73Å; Y207-H224 AromaticContact CZ-CG 3.76Å; Y207-H224 AromaticContact CZ-NE2 3.99Å; Y207-H224 PolarHBondContact O-CD2 2.79Å; H224-A226 VanDerWaalsContact C-N 3.34Å; H224-A226 PolarHBondContact O-N 3.13Å; H224-C227 HydrophobicContact CB-CB 4.29Å; H224-C227 PolarHBondContact O-N 3.42Å; H224-V228 PolarHBondContact O-N 3.06Å
225	F	91.9	Very high	87	Confident	16 Å²	16	78.1 Å²	78.1	7%	0.07	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-49.6	-176.2	-89.6	33.7	0	0	0	112.5	E209 I211 C227 V228 G229 L230 K233	E209-F225 HydrophobicContact CB-CB 4.14Å; E209-F225 HydrophobicContact CB-CD1 3.75Å; E209-F225 HydrophobicContact CB-CD2 3.58Å; E209-F225 HydrophobicContact CB-CE1 3.92Å; E209-F225 HydrophobicContact CB-CE2 3.76Å; E209-F225 HydrophobicContact CB-CG 3.57Å; E209-F225 HydrophobicContact CB-CZ 3.93Å; E209-F225 VanDerWaalsContact CD-CE2 3.46Å; E209-F225 HydrophobicContact CG-CD2 4.3Å; E209-F225 HydrophobicContact CG-CE2 4.25Å; E209-F225 WeakPolarHBondContact O-CD1 3.2Å; E209-F225 PolarHBondContact O-N 3.33Å; E209-F225 WeakPolarHBondContact OE2-CD2 3.46Å; E209-F225 WeakPolarHBondContact OE2-CE2 3.34Å; I211-F225 HydrophobicContact CB-CD1 4.21Å; I211-F225 HydrophobicContact CB-CE1 3.85Å; I211-F225 HydrophobicContact CG2-CD1 4.38Å; I211-F225 HydrophobicContact CG2-CE1 4.5Å; F225-C227 VanDerWaalsContact C-N 3.33Å; F225-C227 PolarHBondContact O-N 3.21Å; F225-V228 CarbonylContact O-C 3.56Å; F225-V228 PolarHBondContact O-N 2.91Å; F225-V228 VanDerWaalsContact O-N 3.13Å; F225-G229 PolarHBondContact O-N 3.25Å; F225-L230 CarbonylContact C-O 3.51Å; F225-L230 HydrophobicContact CB-CB 4.06Å; F225-L230 HydrophobicContact CD1-CB 4.46Å; F225-L230 HydrophobicContact CD1-CD1 4.39Å; F225-L230 HydrophobicContact CD2-CB 4.05Å; F225-L230 HydrophobicContact CG-CB 3.91Å; F225-L230 PolarHBondContact O-N 2.78Å; F225-K233 HydrophobicContact CZ-CB 4.24Å
226	A	88	Confident	87	Confident	83 Å²	83	80 Å²	80	69%	0.686	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-59.1	-40.6	179.1	0	0	0	0	0	112.9	H224 V228 G229	H224-A226 VanDerWaalsContact C-N 3.34Å; H224-A226 PolarHBondContact O-N 3.13Å; A226-V228 PolarHBondContact O-N 2.96Å; A226-G229 PolarHBondContact O-N 3.42Å
227	C	88.4	Confident	87.2	Confident	50 Å²	50	81.4 Å²	81.4	34%	0.338	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-70.7	-13.6	-179.9	-64.3	0	0	0	0	114	C200 Y207 H224 F225	C200-C227 WeakPolarHBondContact SG-CB 3.49Å; Y207-C227 PolarHBondContact OH-SG 3.46Å; H224-C227 HydrophobicContact CB-CB 4.29Å; H224-C227 PolarHBondContact O-N 3.42Å; F225-C227 VanDerWaalsContact C-N 3.33Å; F225-C227 PolarHBondContact O-N 3.21Å
228	V	88.6	Confident	87.6	Confident	29 Å²	29	76.7 Å²	76.7	18%	0.176	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-119	13.2	174.5	-63	0	0	0	0	113.6	I211 F223 H224 F225 A226 L230 W238 P241	I211-V228 HydrophobicContact CG2-CG2 4.17Å; F223-V228 HydrophobicContact CB-CG1 3.78Å; F223-V228 HydrophobicContact CB-CG2 4.41Å; F223-V228 HydrophobicContact CD1-CG1 3.98Å; F223-V228 HydrophobicContact CG-CG1 4.14Å; H224-V228 PolarHBondContact O-N 3.06Å; F225-V228 CarbonylContact O-C 3.56Å; F225-V228 PolarHBondContact O-N 2.91Å; F225-V228 VanDerWaalsContact O-N 3.13Å; A226-V228 PolarHBondContact O-N 2.96Å; V228-L230 VanDerWaalsContact C-N 3.32Å; V228-L230 HydrophobicContact CG2-CB 4.48Å; V228-L230 HydrophobicContact CG2-CD1 3.86Å; V228-L230 HydrophobicContact CG2-CG 3.99Å; V228-L230 PolarHBondContact O-N 3Å; V228-W238 HydrophobicContact CB-CH2 4.33Å; V228-W238 HydrophobicContact CB-CZ2 3.88Å; V228-W238 HydrophobicContact CG1-CH2 4.08Å; V228-W238 HydrophobicContact CG1-CZ2 4.1Å; V228-W238 HydrophobicContact CG2-CH2 4.13Å; V228-W238 HydrophobicContact CG2-CZ2 3.73Å; V228-P241 HydrophobicContact CG1-CG 4.45Å
229	G	87.1	Confident	87.8	Confident	68 Å²	68	78.5 Å²	78.5	70%	0.701	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	21.9	175.7	0	0	0	0	0	115	F225 A226	F225-G229 PolarHBondContact O-N 3.25Å; A226-G229 PolarHBondContact O-N 3.42Å
230	L	85.9	Confident	88.2	Confident	35 Å²	35	73.1 Å²	73.1	18%	0.183	40%	0.396	C	S	.	.			trans	-90.8	145.2	172.8	-66	173.9	0	0	0	110.7	I211 F225 V228 P234 W238	I211-L230 HydrophobicContact CB-CD1 4.35Å; I211-L230 HydrophobicContact CD1-CD1 3.73Å; I211-L230 HydrophobicContact CG2-CD1 3.82Å; F225-L230 CarbonylContact C-O 3.51Å; F225-L230 HydrophobicContact CB-CB 4.06Å; F225-L230 HydrophobicContact CD1-CB 4.46Å; F225-L230 HydrophobicContact CD1-CD1 4.39Å; F225-L230 HydrophobicContact CD2-CB 4.05Å; F225-L230 HydrophobicContact CG-CB 3.91Å; F225-L230 PolarHBondContact O-N 2.78Å; V228-L230 VanDerWaalsContact C-N 3.32Å; V228-L230 HydrophobicContact CG2-CB 4.48Å; V228-L230 HydrophobicContact CG2-CD1 3.86Å; V228-L230 HydrophobicContact CG2-CG 3.99Å; V228-L230 PolarHBondContact O-N 3Å; L230-P234 HydrophobicContact CD1-CG 4.33Å; L230-P234 HydrophobicContact CD2-CG 4.42Å; L230-W238 HydrophobicContact CD1-CZ2 4.48Å
231	T	85.3	Confident	88.2	Confident	124 Å²	124	74.3 Å²	74.3	76%	0.761	41%	0.405	S	S	*	.	S	Bend	trans	-126.2	-6.6	173.8	54.8	0	0	0	0	112.9
232	T	86.3	Confident	88	Confident	100 Å²	100	75.5 Å²	75.5	61%	0.613	41%	0.405	S	S	*	.	S	Bend	trans	-152.4	155.2	176.4	50.6	0	0	0	0	108.8	P234	T232-P234 WeakPolarHBondContact O-CD 3.4Å
233	K	87.8	Confident	87.8	Confident	171 Å²	171	70.4 Å²	70.4	74%	0.743	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-63.1	117.6	177.6	-176.1	171.5	-177.1	169	0	111	F225	F225-K233 HydrophobicContact CZ-CB 4.24Å
234	P	84.3	Confident	87.5	Confident	42 Å²	42	72.6 Å²	72.6	27%	0.273	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-66.3	151.7	178.2	28.2	-34.3	0	0	0	111.3	I211 L230 T232 W238	I211-P234 HydrophobicContact CD1-CG 3.39Å; L230-P234 HydrophobicContact CD1-CG 4.33Å; L230-P234 HydrophobicContact CD2-CG 4.42Å; T232-P234 WeakPolarHBondContact O-CD 3.4Å; P234-W238 HydrophobicContact CG-CB 4.08Å; P234-W238 HydrophobicContact CG-CG 4.15Å
235	R	80.6	Confident	87	Confident	251 Å²	251	77.9 Å²	77.9	95%	0.947	43%	0.427	S	S	*	.	S	Bend	trans	-95.2	122.1	179.6	-62.7	-173.3	70.1	-177.6	1.6	110.6
236	G	85.5	Confident	86.5	Confident	68 Å²	68	81.7 Å²	81.7	70%	0.701	45%	0.449	S	S	*	.	S	Bend	trans	96.9	-160.7	-176.3	0	0	0	0	0	112
237	K	86.8	Confident	85.9	Confident	155 Å²	155	84.1 Å²	84.1	67%	0.674	44%	0.44	S	S	*	.			trans	-76.7	138.6	-177.1	-64	-165.4	175.6	-163.6	0	112.1	D214 Y239	D214-K237 HydrophobicContact CB-CB 4.06Å; D214-K237 HydrophobicContact CB-CD 4.24Å; D214-K237 HydrophobicContact CB-CG 4.34Å; D214-K237 WeakPolarHBondContact OD2-CA 3.45Å; D214-K237 WeakPolarHBondContact OD2-CB 3.42Å; K237-Y239 HydrophobicContact CB-CE2 4.08Å
238	W	91.4	Very high	85	Confident	36 Å²	36	89.9 Å²	89.9	14%	0.136	46%	0.46	C	S	.	.			trans	-122.2	144.2	178	-179	89.4	0	0	0	111.8	I211 C213 D214 F223 V228 L230 P234 C240	I211-W238 HydrophobicContact CB-CE3 4.41Å; I211-W238 HydrophobicContact CD1-CB 3.68Å; I211-W238 HydrophobicContact CD1-CD2 3.61Å; I211-W238 HydrophobicContact CD1-CE3 3.91Å; I211-W238 HydrophobicContact CD1-CG 3.5Å; I211-W238 VanDerWaalsContact CD1-CG 3.5Å; I211-W238 HydrophobicContact CG1-CB 4.44Å; I211-W238 HydrophobicContact CG1-CD2 4Å; I211-W238 HydrophobicContact CG1-CE3 3.73Å; I211-W238 HydrophobicContact CG1-CG 4.31Å; I211-W238 HydrophobicContact CG1-CZ3 4.3Å; I211-W238 HydrophobicContact CG2-CD2 4.18Å; I211-W238 HydrophobicContact CG2-CE3 3.86Å; I211-W238 HydrophobicContact CG2-CH2 3.7Å; I211-W238 HydrophobicContact CG2-CZ2 4.04Å; I211-W238 HydrophobicContact CG2-CZ3 3.61Å; C213-W238 HydrophobicContact CB-CE3 4.36Å; C213-W238 HydrophobicContact CB-CZ3 4.03Å; D214-W238 WeakPolarHBondContact CB-O 3.47Å; D214-W238 PolarHBondContact N-O 3.36Å; D214-W238 PolarHBondContact OD2-N 3.06Å; F223-W238 HydrophobicContact CB-CH2 4.05Å; F223-W238 AromaticContact CD2-CH2 3.9Å; F223-W238 HydrophobicContact CD2-CH2 3.9Å; F223-W238 AromaticContact CD2-CZ3 3.81Å; F223-W238 HydrophobicContact CD2-CZ3 3.81Å; F223-W238 HydrophobicContact CE2-CZ3 4.45Å; F223-W238 AromaticContact CG-CH2 3.97Å; F223-W238 HydrophobicContact CG-CH2 3.97Å; F223-W238 HydrophobicContact CG-CZ3 4.34Å; V228-W238 HydrophobicContact CB-CH2 4.33Å; V228-W238 HydrophobicContact CB-CZ2 3.88Å; V228-W238 HydrophobicContact CG1-CH2 4.08Å; V228-W238 HydrophobicContact CG1-CZ2 4.1Å; V228-W238 HydrophobicContact CG2-CH2 4.13Å; V228-W238 HydrophobicContact CG2-CZ2 3.73Å; L230-W238 HydrophobicContact CD1-CZ2 4.48Å; P234-W238 HydrophobicContact CG-CB 4.08Å; P234-W238 HydrophobicContact CG-CG 4.15Å; W238-C240 VanDerWaalsContact CH2-CA 3.46Å; W238-C240 HydrophobicContact CH2-CB 3.7Å; W238-C240 HydrophobicContact CZ3-CB 3.93Å
239	Y	89.5	Confident	83.9	Confident	48 Å²	48	98.6 Å²	98.6	19%	0.188	49%	0.489	C	S	.	.			trans	-131	132	-177.1	-67	-75.9	0	0	0	110.1	D214 N215 K237 R247	D214-Y239 HydrophobicContact CB-CD1 4.38Å; D214-Y239 HydrophobicContact CB-CE1 3.75Å; D214-Y239 HydrophobicContact CB-CE2 4.46Å; D214-Y239 WeakPolarHBondContact O-CE1 3.42Å; D214-Y239 PolarHBondContact O-OH 2.93Å; N215-Y239 HydrophobicContact CB-CD1 3.97Å; N215-Y239 HydrophobicContact CB-CE1 3.95Å; K237-Y239 HydrophobicContact CB-CE2 4.08Å; Y239-R247 PolarHBondContact OH-NH1 3.08Å; Y239-R247 PolarHBondContact OH-NH2 3.32Å
240	C	90.4	Very high	82.3	Confident	1 Å²	1	107.2 Å²	107.2	1%	0.007	51%	0.507	C	S	.	.			trans	-64.4	162.3	179.6	78.4	0	0	0	0	112.1	C213 C218 F223 W238 R242 C243 S244	C213-C240 HydrophobicContact CB-CB 4.22Å; C213-C240 PolarHBondContact SG-N 3.19Å; C213-C240 VanDerWaalsContact SG-N 3.37Å; C218-C240 VanDerWaalsContact SG-SG 3.66Å; F223-C240 HydrophobicContact CD1-CB 4.29Å; F223-C240 HydrophobicContact CD2-CB 3.97Å; F223-C240 HydrophobicContact CE1-CB 3.8Å; F223-C240 HydrophobicContact CE2-CB 3.45Å; F223-C240 VanDerWaalsContact CE2-CB 3.45Å; F223-C240 HydrophobicContact CG-CB 4.4Å; F223-C240 HydrophobicContact CZ-CB 3.35Å; W238-C240 VanDerWaalsContact CH2-CA 3.46Å; W238-C240 HydrophobicContact CH2-CB 3.7Å; W238-C240 HydrophobicContact CZ3-CB 3.93Å; C240-R242 PolarHBondContact O-N 2.87Å; C240-C243 PolarHBondContact O-N 2.72Å; C240-S244 WeakPolarHBondContact O-CB 3.5Å; C240-S244 PolarHBondContact O-N 3.13Å
241	P	86	Confident	82.1	Confident	53 Å²	53	110.8 Å²	110.8	34%	0.344	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.8	-175.4	-28.6	36.3	0	0	0	115.5	L201 V228 Q245	L201-P241 HydrophobicContact CD1-CG 4.38Å; V228-P241 HydrophobicContact CG1-CG 4.45Å; P241-Q245 VanDerWaalsContact O-CG 3.3Å; P241-Q245 WeakPolarHBondContact O-CG 3.35Å; P241-Q245 PolarHBondContact O-NE2 3.37Å
242	R	85.7	Confident	82	Confident	135 Å²	135	110.1 Å²	110.1	51%	0.509	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-64.5	173.8	-63	-176.3	-177.3	174.5	2.9	110.7	C240 S244 Q245 D246	C240-R242 PolarHBondContact O-N 2.87Å; R242-S244 PolarHBondContact O-N 3.17Å; R242-S244 VanDerWaalsContact O-N 3.07Å; R242-Q245 WeakPolarHBondContact O-CA 3.4Å; R242-Q245 WeakPolarHBondContact O-CB 3.29Å; R242-Q245 PolarHBondContact O-N 2.97Å; R242-D246 VanDerWaalsContact C-OD2 3.31Å; R242-D246 PolarHBondContact O-N 3.23Å; R242-D246 VanDerWaalsContact O-OD2 3.08Å
243	C	88.4	Confident	81.7	Confident	10 Å²	10	110.7 Å²	110.7	7%	0.068	51%	0.505	C	S	.	.	H	α-helix	trans	-59.6	-27	-178.4	-58.6	0	0	0	0	113.9	N215 C218 C240 R247	N215-C243 HydrophobicContact CB-CB 4.12Å; C218-C243 VanDerWaalsContact SG-SG 3.68Å; C240-C243 PolarHBondContact O-N 2.72Å; C243-R247 WeakPolarHBondContact O-CB 3.29Å; C243-R247 VanDerWaalsContact O-CG 3.32Å; C243-R247 WeakPolarHBondContact O-CG 3.25Å; C243-R247 PolarHBondContact O-N 3.5Å; C243-R247 VanDerWaalsContact O-N 3.12Å
244	S	86	Confident	81.4	Confident	47 Å²	47	107.1 Å²	107.1	33%	0.329	49%	0.491	S	S	.	.	H	α-helix	trans	-71.1	-28.2	172.9	-171.4	0	0	0	0	113.4	C240 R242 K248	C240-S244 WeakPolarHBondContact O-CB 3.5Å; C240-S244 PolarHBondContact O-N 3.13Å; R242-S244 PolarHBondContact O-N 3.17Å; R242-S244 VanDerWaalsContact O-N 3.07Å; S244-K248 WeakPolarHBondContact O-CD 3.41Å; S244-K248 WeakPolarHBondContact O-CG 3.46Å
245	Q	83.1	Confident	81.2	Confident	113 Å²	113	111.2 Å²	111.2	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-80.6	-41.8	171.3	-72.6	175.4	56.9	0	0	111.8	P241 R242 R247 K248 R249	P241-Q245 VanDerWaalsContact O-CG 3.3Å; P241-Q245 WeakPolarHBondContact O-CG 3.35Å; P241-Q245 PolarHBondContact O-NE2 3.37Å; R242-Q245 WeakPolarHBondContact O-CA 3.4Å; R242-Q245 WeakPolarHBondContact O-CB 3.29Å; R242-Q245 PolarHBondContact O-N 2.97Å; Q245-R247 VanDerWaalsContact C-N 3.29Å; Q245-R247 PolarHBondContact O-N 2.87Å; Q245-K248 PolarHBondContact O-N 3.4Å; Q245-R249 PolarHBondContact O-N 2.91Å
246	D	80.8	Confident	81.2	Confident	97 Å²	97	101.9 Å²	101.9	52%	0.519	48%	0.475	S	S	.	.	H	α-helix	trans	-60.3	-41	178.9	-58.3	-45.4	0	0	0	111.4	R242 K248 R249	R242-D246 VanDerWaalsContact C-OD2 3.31Å; R242-D246 PolarHBondContact O-N 3.23Å; R242-D246 VanDerWaalsContact O-OD2 3.08Å; D246-K248 PolarHBondContact O-N 3.33Å; D246-R249 PolarHBondContact O-N 3.17Å
247	R	75.9	Confident	80.9	Confident	134 Å²	134	104.3 Å²	104.3	51%	0.506	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-7.7	173.2	-76.4	176.2	165.2	-115.6	-2.8	115.4	Y239 C243 Q245	Y239-R247 PolarHBondContact OH-NH1 3.08Å; Y239-R247 PolarHBondContact OH-NH2 3.32Å; C243-R247 WeakPolarHBondContact O-CB 3.29Å; C243-R247 VanDerWaalsContact O-CG 3.32Å; C243-R247 WeakPolarHBondContact O-CG 3.25Å; C243-R247 PolarHBondContact O-N 3.5Å; C243-R247 VanDerWaalsContact O-N 3.12Å; Q245-R247 VanDerWaalsContact C-N 3.29Å; Q245-R247 PolarHBondContact O-N 2.87Å
248	K	70.4	Confident	80.5	Confident	171 Å²	171	100.4 Å²	100.4	74%	0.743	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-2.7	174.6	-73.1	176.6	-178.7	180	0	113.2	S244 Q245 D246	S244-K248 WeakPolarHBondContact O-CD 3.41Å; S244-K248 WeakPolarHBondContact O-CG 3.46Å; Q245-K248 PolarHBondContact O-N 3.4Å; D246-K248 PolarHBondContact O-N 3.33Å
249	R	65.4	Low	79.6	Confident	211 Å²	211	105.8 Å²	105.8	80%	0.796	47%	0.468	S	S	*	.			trans	-107.9	13.3	179.5	-69.5	179.8	170.9	-148.1	-1	112.6	Q245 D246	Q245-R249 PolarHBondContact O-N 2.91Å; D246-R249 PolarHBondContact O-N 3.17Å
250	K	53.3	Low	78.7	Confident	249 Å²	249	111 Å²	111	100%	1.083	49%	0.494	S	S	*	.			trans	-148.3	0	-166.7	-166.4	175.4	-174.1	177.6	0	110.5

Retrieved 250 of 250 residues in 1058.8 ms (Link to these results)

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