A0A3Q0KFZ4_SCHMA Loading...

FCP1 homology domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KFZ4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 483 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	44.4	Very low	76.3	Confident	233 Å²	233	91 Å²	91	100%	1.148	49%	0.492	S	S	*	.				0	116.7	0	-67.8	-69.2	179.3	0	0	105.4	D3	M1-D3 PolarHBondContact O-N 3.31Å; M1-D3 VanDerWaalsContact O-N 3.15Å
2	S	51.1	Low	77.7	Confident	103 Å²	103	85.4 Å²	85.4	72%	0.72	46%	0.458	S	S	*	.			trans	-60.8	115.6	177.9	45.3	0	0	0	0	108.1	T4	S2-T4 VanDerWaalsContact C-N 3.28Å; S2-T4 PolarHBondContact O-N 3.11Å; S2-T4 PolarHBondContact O-OG1 3.47Å
3	D	56.3	Low	78.6	Confident	117 Å²	117	87.8 Å²	87.8	63%	0.626	47%	0.471	S	S	*	.			trans	-61.6	94.9	175	-153.7	0.4	0	0	0	106.9	M1 A5 S23	M1-D3 PolarHBondContact O-N 3.31Å; M1-D3 VanDerWaalsContact O-N 3.15Å; D3-A5 PolarHBondContact O-N 3.28Å; D3-A5 VanDerWaalsContact O-N 3.1Å; D3-S23 WeakPolarHBondContact OD1-CB 3.36Å; D3-S23 PolarHBondContact OD1-OG 2.85Å
4	T	68.6	Low	79.2	Confident	89 Å²	89	85.9 Å²	85.9	55%	0.546	48%	0.483	S	S	.	.			trans	-85.5	97.6	-167.2	-42.7	0	0	0	0	105.9	S2 I6	S2-T4 VanDerWaalsContact C-N 3.28Å; S2-T4 PolarHBondContact O-N 3.11Å; S2-T4 PolarHBondContact O-OG1 3.47Å; T4-I6 PolarHBondContact O-N 2.91Å
5	A	80.7	Confident	79.9	Confident	70 Å²	70	89.2 Å²	89.2	58%	0.579	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.2	126.7	177.2	0	0	0	0	0	109.7	D3	D3-A5 PolarHBondContact O-N 3.28Å; D3-A5 VanDerWaalsContact O-N 3.1Å
6	I	84.1	Confident	80.7	Confident	27 Å²	27	89.6 Å²	89.6	14%	0.138	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	119.3	176.4	-63.2	-174.7	0	0	0	107.5	T4 L8 L22 S24 L65 L70	T4-I6 PolarHBondContact O-N 2.91Å; I6-L8 HydrophobicContact CG2-CD1 4.48Å; I6-L8 HydrophobicContact CG2-CD2 3.8Å; I6-L8 HydrophobicContact CG2-CG 3.83Å; I6-L22 PolarHBondContact N-O 3.07Å; I6-S24 VanDerWaalsContact CD1-CA 3.48Å; I6-L65 HydrophobicContact CD1-CB 3.6Å; I6-L65 HydrophobicContact CD1-CD1 4.23Å; I6-L70 HydrophobicContact CD1-CD1 4.48Å; I6-L70 HydrophobicContact CG2-CD1 3.72Å
7	H	86.9	Confident	81.5	Confident	111 Å²	111	85.6 Å²	85.6	51%	0.514	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	107.6	175.4	177	-85.1	0	0	0	110.3	Q9 I18	H7-Q9 VanDerWaalsContact CE1-CG 3.49Å; H7-Q9 WeakPolarHBondContact CE1-CG 3.25Å; H7-Q9 PolarHBondContact CE1-NE2 3.29Å; H7-I18 VanDerWaalsContact NE2-CG2 3.33Å; H7-I18 WeakPolarHBondContact NE2-CG2 3.5Å
8	L	89.8	Confident	82.1	Confident	5 Å²	5	85.4 Å²	85.4	3%	0.026	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	133.6	178.1	-60.5	172.6	0	0	0	110.5	I6 L10 I18 I19 L31 L70 L76	I6-L8 HydrophobicContact CG2-CD1 4.48Å; I6-L8 HydrophobicContact CG2-CD2 3.8Å; I6-L8 HydrophobicContact CG2-CG 3.83Å; L8-L10 HydrophobicContact CB-CD1 3.91Å; L8-I18 WeakPolarHBondContact O-CA 3.45Å; L8-I19 HydrophobicContact CB-CB 4.3Å; L8-I19 PolarHBondContact N-O 3.02Å; L8-I19 PolarHBondContact O-N 3.08Å; L8-L31 HydrophobicContact CD1-CD1 3.7Å; L8-L31 HydrophobicContact CD1-CD2 3.96Å; L8-L31 HydrophobicContact CD1-CG 4.47Å; L8-L70 HydrophobicContact CD2-CD1 3.7Å; L8-L70 HydrophobicContact CD2-CD2 3.66Å; L8-L70 HydrophobicContact CD2-CG 4.27Å; L8-L76 HydrophobicContact CD2-CD1 4.09Å
9	Q	90.4	Very high	82.6	Confident	118 Å²	118	81.1 Å²	81.1	55%	0.551	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	121.8	169.9	-65.9	-170.9	-24.3	0	0	109.7	H7 I17 I18	H7-Q9 VanDerWaalsContact CE1-CG 3.49Å; H7-Q9 WeakPolarHBondContact CE1-CG 3.25Å; H7-Q9 PolarHBondContact CE1-NE2 3.29Å; Q9-I17 WeakPolarHBondContact CA-O 3.25Å; Q9-I18 HydrophobicContact CG-CG1 4.26Å
10	L	93.3	Very high	82.9	Confident	3 Å²	3	82.4 Å²	82.4	2%	0.016	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	161.6	179.4	-55.4	93.7	0	0	0	110	L8 P16 I17 I19 L35 I48 L76	L8-L10 HydrophobicContact CB-CD1 3.91Å; L10-P16 CarbonylContact O-C 3.54Å; L10-P16 WeakPolarHBondContact O-CA 3.37Å; L10-I17 PolarHBondContact N-O 3.36Å; L10-I17 PolarHBondContact O-N 2.95Å; L10-I19 HydrophobicContact CD1-CG1 4.06Å; L10-L35 HydrophobicContact CD1-CD2 4.25Å; L10-L35 HydrophobicContact CD2-CD1 4.18Å; L10-L35 HydrophobicContact CD2-CD2 4.22Å; L10-I48 HydrophobicContact CD2-CG2 3.88Å; L10-L76 CarbonylContact C-O 3.31Å; L10-L76 WeakPolarHBondContact CA-O 3.34Å; L10-L76 HydrophobicContact CB-CB 4.25Å; L10-L76 HydrophobicContact CD2-CB 3.97Å; L10-L76 HydrophobicContact CD2-CD1 4.43Å; L10-L76 HydrophobicContact CG-CB 3.74Å; L10-L76 HydrophobicContact CG-CD1 4.23Å
11	K	93.8	Very high	83.2	Confident	125 Å²	125	81.9 Å²	81.9	54%	0.543	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	138.5	165.1	-70.1	-173.3	176.8	-170.6	0	110.8	Q15 L76 M77 L78	K11-Q15 CarbonylContact C-O 3.59Å; K11-Q15 WeakPolarHBondContact CA-O 3.48Å; K11-L76 PolarHBondContact N-O 2.8Å; K11-M77 CarbonylContact O-C 3.59Å; K11-M77 WeakPolarHBondContact O-CA 3.41Å; K11-M77 WeakPolarHBondContact O-CG 3.4Å; K11-L78 PolarHBondContact O-N 3.22Å
12	Y	93.7	Very high	85.5	Confident	24 Å²	24	71 Å²	71	9%	0.094	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	127.1	172.3	174.6	-120.8	0	0	0	108.8	G14 Q15 I17 T39 V41 L78 G80	Y12-G14 PolarHBondContact O-N 3.16Å; Y12-G14 VanDerWaalsContact O-N 3.1Å; Y12-Q15 PolarHBondContact N-O 2.97Å; Y12-Q15 PolarHBondContact O-N 3.32Å; Y12-I17 VanDerWaalsContact CB-CD1 3.47Å; Y12-I17 HydrophobicContact CD1-CD1 4.11Å; Y12-I17 HydrophobicContact CG-CD1 4.17Å; Y12-T39 HydrophobicContact CD1-CG2 3.64Å; Y12-T39 HydrophobicContact CE1-CG2 4.02Å; Y12-T39 HydrophobicContact CG-CG2 4.15Å; Y12-V41 HydrophobicContact CE1-CG2 4.42Å; Y12-V41 HydrophobicContact CE2-CG2 4.01Å; Y12-V41 VanDerWaalsContact OH-CG2 3.3Å; Y12-V41 WeakPolarHBondContact OH-CG2 3.42Å; Y12-L78 HydrophobicContact CD2-CB 4.32Å; Y12-L78 HydrophobicContact CD2-CD2 4.06Å; Y12-L78 HydrophobicContact CD2-CG 4.06Å; Y12-L78 HydrophobicContact CG-CD2 4.23Å; Y12-G80 WeakPolarHBondContact CE2-O 3.5Å
13	N	89.4	Confident	87.4	Confident	117 Å²	117	66.5 Å²	66.5	63%	0.626	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	40.2	-175.5	-69.5	-12.6	0	0	0	113.7	Q15	N13-Q15 PolarHBondContact O-N 3.42Å
14	G	86.5	Confident	88.9	Confident	61 Å²	61	62.9 Å²	62.9	63%	0.629	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	-14.4	-178.7	0	0	0	0	0	115.3	Y12	Y12-G14 PolarHBondContact O-N 3.16Å; Y12-G14 VanDerWaalsContact O-N 3.1Å
15	Q	90.3	Very high	89.9	Confident	135 Å²	135	65.7 Å²	65.7	63%	0.631	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	138.3	-179.4	-60.8	-58.3	-30.5	0	0	111.6	K11 Y12 N13	K11-Q15 CarbonylContact C-O 3.59Å; K11-Q15 WeakPolarHBondContact CA-O 3.48Å; Y12-Q15 PolarHBondContact N-O 2.97Å; Y12-Q15 PolarHBondContact O-N 3.32Å; N13-Q15 PolarHBondContact O-N 3.42Å
16	P	92.7	Very high	90.6	Very high	95 Å²	95	65.5 Å²	65.5	62%	0.617	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.9	139.2	174.5	30.8	-33	0	0	0	111	L10	L10-P16 CarbonylContact O-C 3.54Å; L10-P16 WeakPolarHBondContact O-CA 3.37Å
17	I	93.3	Very high	91.2	Very high	22 Å²	22	66.3 Å²	66.3	11%	0.113	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	135.6	173.7	-59.8	-177.1	0	0	0	107.5	Q9 L10 Y12 I19 L35 L38 T39	Q9-I17 WeakPolarHBondContact CA-O 3.25Å; L10-I17 PolarHBondContact N-O 3.36Å; L10-I17 PolarHBondContact O-N 2.95Å; Y12-I17 VanDerWaalsContact CB-CD1 3.47Å; Y12-I17 HydrophobicContact CD1-CD1 4.11Å; Y12-I17 HydrophobicContact CG-CD1 4.17Å; I17-I19 HydrophobicContact CG2-CD1 4.36Å; I17-L35 HydrophobicContact CG2-CD2 4.38Å; I17-L38 HydrophobicContact CG2-CB 4.5Å; I17-L38 HydrophobicContact CG2-CD1 3.53Å; I17-T39 HydrophobicContact CD1-CG2 3.3Å
18	I	92.4	Very high	91.6	Very high	82 Å²	82	61.3 Å²	61.3	42%	0.421	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	132.4	178	-54.9	-176.6	0	0	0	108.1	H7 L8 Q9	H7-I18 VanDerWaalsContact NE2-CG2 3.33Å; H7-I18 WeakPolarHBondContact NE2-CG2 3.5Å; L8-I18 WeakPolarHBondContact O-CA 3.45Å; Q9-I18 HydrophobicContact CG-CG1 4.26Å
19	I	91.6	Very high	91.8	Very high	3 Å²	3	63.2 Å²	63.2	2%	0.015	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	116.3	171.5	-55.7	-66.6	0	0	0	107.1	L8 L10 I17 L22 L31 E34 L35 L38	L8-I19 HydrophobicContact CB-CB 4.3Å; L8-I19 PolarHBondContact N-O 3.02Å; L8-I19 PolarHBondContact O-N 3.08Å; L10-I19 HydrophobicContact CD1-CG1 4.06Å; I17-I19 HydrophobicContact CG2-CD1 4.36Å; I19-L22 HydrophobicContact CG2-CD1 3.61Å; I19-L22 HydrophobicContact CG2-CG 3.84Å; I19-L31 HydrophobicContact CG1-CD1 4.21Å; I19-L31 HydrophobicContact CG2-CD1 4.28Å; I19-E34 HydrophobicContact CD1-CB 4.11Å; I19-E34 HydrophobicContact CG2-CB 4.4Å; I19-L35 HydrophobicContact CD1-CD2 4.17Å; I19-L35 HydrophobicContact CG1-CD2 4.13Å; I19-L38 HydrophobicContact CD1-CD1 3.44Å; I19-L38 VanDerWaalsContact CD1-CD1 3.44Å
20	D	89.5	Confident	92.1	Very high	108 Å²	108	60.3 Å²	60.3	58%	0.578	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	2.6	-177.9	60.8	-8.6	0	0	0	113.1
21	C	88.7	Confident	92.2	Very high	71 Å²	71	60.2 Å²	60.2	48%	0.48	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-1.2	-178.6	58.6	0	0	0	0	114.6	E34	C21-E34 VanDerWaalsContact SG-CD 3.56Å; C21-E34 PolarHBondContact SG-OE2 3.45Å
22	L	91.9	Very high	92.4	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.026	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	148.3	-177	-61.7	174.3	0	0	0	111.1	I6 I19 H26 D30 L31 E34 L65	I6-L22 PolarHBondContact N-O 3.07Å; I19-L22 HydrophobicContact CG2-CD1 3.61Å; I19-L22 HydrophobicContact CG2-CG 3.84Å; L22-H26 HydrophobicContact CD2-CB 4.16Å; L22-D30 HydrophobicContact CD2-CB 4.3Å; L22-L31 HydrophobicContact CD1-CB 3.88Å; L22-L31 HydrophobicContact CD1-CD1 3.72Å; L22-L31 HydrophobicContact CD1-CG 4.41Å; L22-E34 HydrophobicContact CD1-CG 4.39Å; L22-E34 HydrophobicContact CD2-CG 3.84Å; L22-E34 HydrophobicContact CG-CG 4.22Å; L22-L65 HydrophobicContact CB-CD1 3.87Å; L22-L65 HydrophobicContact CD1-CD1 3.97Å
23	S	91.4	Very high	92.5	Very high	8 Å²	8	58.4 Å²	58.4	6%	0.056	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	172.5	172.1	74.9	0	0	0	0	111.7	D3 E25 H26	D3-S23 WeakPolarHBondContact OD1-CB 3.36Å; D3-S23 PolarHBondContact OD1-OG 2.85Å; S23-E25 PolarHBondContact O-N 3.06Å; S23-H26 PolarHBondContact N-ND1 3.45Å; S23-H26 WeakPolarHBondContact O-CB 3.4Å; S23-H26 PolarHBondContact O-N 3.27Å; S23-H26 PolarHBondContact O-ND1 3.49Å; S23-H26 PolarHBondContact OG-CE1 3Å; S23-H26 PolarHBondContact OG-ND1 2.96Å
24	S	88.1	Confident	92.9	Very high	41 Å²	41	55 Å²	55	29%	0.287	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-17	178.5	49.5	0	0	0	0	115.6	I6 S66	I6-S24 VanDerWaalsContact CD1-CA 3.48Å; S24-S66 WeakPolarHBondContact O-CB 3.31Å; S24-S66 PolarHBondContact O-N 3.44Å; S24-S66 PolarHBondContact O-OG 2.85Å
25	E	90.5	Very high	93.3	Very high	148 Å²	148	52 Å²	52	69%	0.692	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-19.3	-176	-42.8	-153.2	-158.3	0	0	112.2	S23	S23-E25 PolarHBondContact O-N 3.06Å
26	H	95	Very high	93.6	Very high	67 Å²	67	48.2 Å²	48.2	31%	0.31	26%	0.259	S	S	.	.			trans	-68.8	159.8	174.6	-66.4	88	0	0	0	111.1	L22 S23 D30 T64 L65	L22-H26 HydrophobicContact CD2-CB 4.16Å; S23-H26 PolarHBondContact N-ND1 3.45Å; S23-H26 WeakPolarHBondContact O-CB 3.4Å; S23-H26 PolarHBondContact O-N 3.27Å; S23-H26 PolarHBondContact O-ND1 3.49Å; S23-H26 PolarHBondContact OG-CE1 3Å; S23-H26 PolarHBondContact OG-ND1 2.96Å; H26-D30 WeakPolarHBondContact CA-OD2 3.48Å; H26-D30 HydrophobicContact CB-CB 4.07Å; H26-D30 IonicContact CD2-OD2 3.69Å; H26-T64 CarbonylContact O-C 3.52Å; H26-T64 WeakPolarHBondContact O-CA 3.26Å; H26-L65 HydrophobicContact CB-CD1 4.13Å; H26-L65 WeakPolarHBondContact O-CG 3.5Å; H26-L65 PolarHBondContact O-N 2.96Å
27	N	95.2	Very high	93.7	Very high	44 Å²	44	49.2 Å²	49.2	24%	0.235	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-112.9	178.8	179.5	63.3	52.8	0	0	0	112.5	S29 D30 L31 D61 T63	N27-S29 VanDerWaalsContact C-N 3.28Å; N27-S29 PolarHBondContact O-N 2.87Å; N27-S29 VanDerWaalsContact OD1-CA 3.29Å; N27-S29 WeakPolarHBondContact OD1-CA 3.4Å; N27-S29 WeakPolarHBondContact OD1-CB 3.46Å; N27-S29 PolarHBondContact OD1-N 2.62Å; N27-D30 PolarHBondContact N-OD2 3.08Å; N27-D30 PolarHBondContact ND2-OD2 3.03Å; N27-D30 PolarHBondContact O-N 2.74Å; N27-D30 PolarHBondContact OD1-N 3.44Å; N27-D30 PolarHBondContact OD1-OD2 3.48Å; N27-L31 PolarHBondContact O-N 3.16Å; N27-L31 VanDerWaalsContact O-N 3.14Å; N27-D61 PolarHBondContact OD1-O 3.47Å; N27-T63 CarbonylContact C-O 3.08Å; N27-T63 WeakPolarHBondContact CA-O 3.45Å; N27-T63 WeakPolarHBondContact CB-O 3.31Å
28	I	95.3	Very high	93.8	Very high	5 Å²	5	53.1 Å²	53.1	3%	0.026	27%	0.274	C	S	.	.	H	α-helix	trans	-63.3	-33.5	178.4	-66.6	-64.9	0	0	0	112.1	D30 L31 K32 L51 V59 D61 T63 L65 L68	I28-D30 VanDerWaalsContact C-N 3.34Å; I28-L31 HydrophobicContact CD1-CD2 4.36Å; I28-L31 PolarHBondContact O-N 3.15Å; I28-K32 HydrophobicContact CG2-CD 4.4Å; I28-K32 HydrophobicContact CG2-CG 4.44Å; I28-K32 WeakPolarHBondContact O-CG 3.43Å; I28-K32 PolarHBondContact O-N 3.08Å; I28-L51 HydrophobicContact CD1-CD1 3.78Å; I28-V59 HydrophobicContact CD1-CG1 3.82Å; I28-V59 HydrophobicContact CG1-CG1 3.65Å; I28-D61 PolarHBondContact N-O 3.07Å; I28-T63 WeakPolarHBondContact CG1-O 3.32Å; I28-T63 PolarHBondContact N-O 2.97Å; I28-L65 HydrophobicContact CD1-CD2 4.08Å; I28-L68 HydrophobicContact CD1-CD1 3.85Å
29	S	95.5	Very high	93.9	Very high	46 Å²	46	49.8 Å²	49.8	32%	0.322	26%	0.258	S	S	.	.	H	α-helix	trans	-60.7	-43.9	173.9	-165.2	0	0	0	0	111.4	N27 L31 K32 E33 D61	N27-S29 VanDerWaalsContact C-N 3.28Å; N27-S29 PolarHBondContact O-N 2.87Å; N27-S29 VanDerWaalsContact OD1-CA 3.29Å; N27-S29 WeakPolarHBondContact OD1-CA 3.4Å; N27-S29 WeakPolarHBondContact OD1-CB 3.46Å; N27-S29 PolarHBondContact OD1-N 2.62Å; S29-L31 VanDerWaalsContact C-N 3.35Å; S29-L31 PolarHBondContact O-N 3.36Å; S29-K32 WeakPolarHBondContact O-CB 3.23Å; S29-K32 PolarHBondContact O-N 3.25Å; S29-K32 VanDerWaalsContact O-N 3.16Å; S29-E33 PolarHBondContact O-N 3.17Å; S29-D61 PolarHBondContact N-O 3.38Å
30	D	96.2	Very high	94	Very high	57 Å²	57	57.3 Å²	57.3	31%	0.305	29%	0.286	S	S	.	.	H	α-helix	trans	-63.2	-42.2	177.4	-54.7	-43.7	0	0	0	111.2	L22 H26 N27 I28 K32 E33 E34	L22-D30 HydrophobicContact CD2-CB 4.3Å; H26-D30 WeakPolarHBondContact CA-OD2 3.48Å; H26-D30 HydrophobicContact CB-CB 4.07Å; H26-D30 IonicContact CD2-OD2 3.69Å; N27-D30 PolarHBondContact N-OD2 3.08Å; N27-D30 PolarHBondContact ND2-OD2 3.03Å; N27-D30 PolarHBondContact O-N 2.74Å; N27-D30 PolarHBondContact OD1-N 3.44Å; N27-D30 PolarHBondContact OD1-OD2 3.48Å; I28-D30 VanDerWaalsContact C-N 3.34Å; D30-K32 VanDerWaalsContact C-N 3.32Å; D30-K32 PolarHBondContact O-N 3.26Å; D30-E33 PolarHBondContact O-N 3.35Å; D30-E34 PolarHBondContact O-N 3.14Å
31	L	95.7	Very high	94.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59	-42.6	172.8	174.3	61.1	0	0	0	112.1	L8 I19 L22 N27 I28 S29 E33 E34 L35 I48 L65	L8-L31 HydrophobicContact CD1-CD1 3.7Å; L8-L31 HydrophobicContact CD1-CD2 3.96Å; L8-L31 HydrophobicContact CD1-CG 4.47Å; I19-L31 HydrophobicContact CG1-CD1 4.21Å; I19-L31 HydrophobicContact CG2-CD1 4.28Å; L22-L31 HydrophobicContact CD1-CB 3.88Å; L22-L31 HydrophobicContact CD1-CD1 3.72Å; L22-L31 HydrophobicContact CD1-CG 4.41Å; N27-L31 PolarHBondContact O-N 3.16Å; N27-L31 VanDerWaalsContact O-N 3.14Å; I28-L31 HydrophobicContact CD1-CD2 4.36Å; I28-L31 PolarHBondContact O-N 3.15Å; S29-L31 VanDerWaalsContact C-N 3.35Å; S29-L31 PolarHBondContact O-N 3.36Å; L31-E33 VanDerWaalsContact C-N 3.3Å; L31-E33 PolarHBondContact O-N 3.3Å; L31-E34 PolarHBondContact O-N 2.76Å; L31-L35 HydrophobicContact CD1-CD1 4.13Å; L31-L35 HydrophobicContact CD1-CG 4.15Å; L31-L35 HydrophobicContact CG-CD1 4.03Å; L31-L35 HydrophobicContact CG-CG 4.48Å; L31-L35 WeakPolarHBondContact O-CB 3.36Å; L31-L35 VanDerWaalsContact O-CG 3.3Å; L31-L35 WeakPolarHBondContact O-CG 3.32Å; L31-L35 PolarHBondContact O-N 2.8Å; L31-I48 HydrophobicContact CD2-CD1 3.87Å; L31-I48 HydrophobicContact CG-CD1 4.14Å; L31-L65 HydrophobicContact CD2-CD2 4.33Å
32	K	97.2	Very high	94.6	Very high	27 Å²	27	51 Å²	51	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-63.6	-37.6	177.3	-74.1	177.1	169.3	-177.4	0	111.7	I28 S29 D30 L35 F36 P43 Q46 I48 D61	I28-K32 HydrophobicContact CG2-CD 4.4Å; I28-K32 HydrophobicContact CG2-CG 4.44Å; I28-K32 WeakPolarHBondContact O-CG 3.43Å; I28-K32 PolarHBondContact O-N 3.08Å; S29-K32 WeakPolarHBondContact O-CB 3.23Å; S29-K32 PolarHBondContact O-N 3.25Å; S29-K32 VanDerWaalsContact O-N 3.16Å; D30-K32 VanDerWaalsContact C-N 3.32Å; D30-K32 PolarHBondContact O-N 3.26Å; K32-L35 PolarHBondContact O-N 2.8Å; K32-F36 WeakPolarHBondContact O-CB 3.2Å; K32-F36 PolarHBondContact O-N 3.01Å; K32-P43 HydrophobicContact CB-CB 3.91Å; K32-P43 HydrophobicContact CB-CG 4.35Å; K32-P43 HydrophobicContact CD-CB 4.31Å; K32-Q46 VanDerWaalsContact CA-OE1 3.25Å; K32-Q46 PolarHBondContact O-NE2 3.12Å; K32-Q46 PolarHBondContact O-OE1 3.25Å; K32-I48 HydrophobicContact CG-CD1 4.18Å; K32-D61 WeakPolarHBondContact CE-OD1 3.27Å; K32-D61 IonicContact NZ-OD1 2.66Å; K32-D61 PolarHBondContact NZ-OD1 3.29Å; K32-D61 IonicContact NZ-OD2 3.46Å; K32-D61 PolarHBondContact NZ-OD2 3.29Å
33	E	97.2	Very high	94.7	Very high	85 Å²	85	52 Å²	52	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-66.5	-41.5	175.6	-69.6	-63.4	167.6	0	0	112.1	S29 D30 L31 F36 K37 P43	S29-E33 PolarHBondContact O-N 3.17Å; D30-E33 PolarHBondContact O-N 3.35Å; L31-E33 VanDerWaalsContact C-N 3.3Å; L31-E33 PolarHBondContact O-N 3.3Å; E33-F36 WeakPolarHBondContact O-CB 3.26Å; E33-F36 PolarHBondContact O-N 3.43Å; E33-K37 WeakPolarHBondContact O-CG 3.41Å; E33-K37 PolarHBondContact O-N 3.02Å; E33-K37 VanDerWaalsContact O-N 3.11Å; E33-P43 WeakPolarHBondContact OE1-CG 2.94Å
34	E	96	Very high	94.7	Very high	44 Å²	44	59.5 Å²	59.5	21%	0.206	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-41.4	174.4	-69.1	-55.3	136.4	0	0	112.3	I19 C21 L22 D30 L31 F36 K37 L38	I19-E34 HydrophobicContact CD1-CB 4.11Å; I19-E34 HydrophobicContact CG2-CB 4.4Å; C21-E34 VanDerWaalsContact SG-CD 3.56Å; C21-E34 PolarHBondContact SG-OE2 3.45Å; L22-E34 HydrophobicContact CD1-CG 4.39Å; L22-E34 HydrophobicContact CD2-CG 3.84Å; L22-E34 HydrophobicContact CG-CG 4.22Å; D30-E34 PolarHBondContact O-N 3.14Å; L31-E34 PolarHBondContact O-N 2.76Å; E34-F36 VanDerWaalsContact C-N 3.28Å; E34-F36 PolarHBondContact O-N 2.83Å; E34-K37 WeakPolarHBondContact O-CB 3.48Å; E34-K37 PolarHBondContact O-N 2.78Å; E34-K37 IonicContact OE1-NZ 2.63Å; E34-K37 PolarHBondContact OE1-NZ 3.31Å; E34-K37 IonicContact OE2-NZ 3.65Å; E34-L38 PolarHBondContact O-N 2.84Å
35	L	96.2	Very high	94.9	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.9	-36.5	173.6	-72.1	171.6	0	0	0	111.8	L10 I17 I19 L31 K32 K37 L38 T39 I48 L78	L10-L35 HydrophobicContact CD1-CD2 4.25Å; L10-L35 HydrophobicContact CD2-CD1 4.18Å; L10-L35 HydrophobicContact CD2-CD2 4.22Å; I17-L35 HydrophobicContact CG2-CD2 4.38Å; I19-L35 HydrophobicContact CD1-CD2 4.17Å; I19-L35 HydrophobicContact CG1-CD2 4.13Å; L31-L35 HydrophobicContact CD1-CD1 4.13Å; L31-L35 HydrophobicContact CD1-CG 4.15Å; L31-L35 HydrophobicContact CG-CD1 4.03Å; L31-L35 HydrophobicContact CG-CG 4.48Å; L31-L35 WeakPolarHBondContact O-CB 3.36Å; L31-L35 VanDerWaalsContact O-CG 3.3Å; L31-L35 WeakPolarHBondContact O-CG 3.32Å; L31-L35 PolarHBondContact O-N 2.8Å; K32-L35 PolarHBondContact O-N 2.8Å; L35-K37 VanDerWaalsContact C-N 3.34Å; L35-K37 PolarHBondContact O-N 3.12Å; L35-L38 PolarHBondContact O-N 2.7Å; L35-T39 WeakPolarHBondContact O-CB 3.16Å; L35-T39 WeakPolarHBondContact O-CG2 3.3Å; L35-T39 PolarHBondContact O-N 3.27Å; L35-T39 PolarHBondContact O-OG1 2.98Å; L35-I48 HydrophobicContact CD1-CD1 3.6Å; L35-I48 HydrophobicContact CD1-CG1 4.04Å; L35-L78 HydrophobicContact CB-CD2 4.36Å; L35-L78 HydrophobicContact CD1-CD1 4.41Å; L35-L78 HydrophobicContact CD1-CD2 4.5Å; L35-L78 HydrophobicContact CD2-CD2 4.36Å
36	F	96.4	Very high	95.1	Very high	54 Å²	54	53.4 Å²	53.4	24%	0.237	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-40.2	175.8	169.9	-119.1	0	0	0	111.7	K32 E33 E34 L38 T39 R40 V41 L42 P43	K32-F36 WeakPolarHBondContact O-CB 3.2Å; K32-F36 PolarHBondContact O-N 3.01Å; E33-F36 WeakPolarHBondContact O-CB 3.26Å; E33-F36 PolarHBondContact O-N 3.43Å; E34-F36 VanDerWaalsContact C-N 3.28Å; E34-F36 PolarHBondContact O-N 2.83Å; F36-L38 VanDerWaalsContact C-N 3.27Å; F36-L38 PolarHBondContact O-N 2.86Å; F36-T39 PolarHBondContact O-N 3Å; F36-R40 VanDerWaalsContact O-CA 3.26Å; F36-R40 WeakPolarHBondContact O-CA 3.4Å; F36-R40 PolarHBondContact O-N 2.74Å; F36-V41 WeakPolarHBondContact CD2-O 3.24Å; F36-L42 HydrophobicContact CD2-CD2 4.25Å; F36-L42 HydrophobicContact CE2-CD2 3.66Å; F36-L42 HydrophobicContact CE2-CG 4.32Å; F36-L42 HydrophobicContact CZ-CD2 3.91Å; F36-P43 HydrophobicContact CB-CG 4.41Å
37	K	95.2	Very high	95	Very high	116 Å²	116	56.9 Å²	56.9	50%	0.504	27%	0.268	S	S	.	.	H	α-helix	trans	-59.3	-38.8	176.7	-66.7	171.2	-169.9	173.6	0	112.2	E33 E34 L35	E33-K37 WeakPolarHBondContact O-CG 3.41Å; E33-K37 PolarHBondContact O-N 3.02Å; E33-K37 VanDerWaalsContact O-N 3.11Å; E34-K37 WeakPolarHBondContact O-CB 3.48Å; E34-K37 PolarHBondContact O-N 2.78Å; E34-K37 IonicContact OE1-NZ 2.63Å; E34-K37 PolarHBondContact OE1-NZ 3.31Å; E34-K37 IonicContact OE2-NZ 3.65Å; L35-K37 VanDerWaalsContact C-N 3.34Å; L35-K37 PolarHBondContact O-N 3.12Å
38	L	94.6	Very high	94.9	Very high	104 Å²	104	56 Å²	56	55%	0.545	26%	0.263	S	S	.	.	H	α-helix	trans	-84.8	-32.4	-178.1	-63.6	-179.1	0	0	0	114	I17 I19 E34 L35 F36	I17-L38 HydrophobicContact CG2-CB 4.5Å; I17-L38 HydrophobicContact CG2-CD1 3.53Å; I19-L38 HydrophobicContact CD1-CD1 3.44Å; I19-L38 VanDerWaalsContact CD1-CD1 3.44Å; E34-L38 PolarHBondContact O-N 2.84Å; L35-L38 PolarHBondContact O-N 2.7Å; F36-L38 VanDerWaalsContact C-N 3.27Å; F36-L38 PolarHBondContact O-N 2.86Å
39	T	94.5	Very high	94.7	Very high	12 Å²	12	58.7 Å²	58.7	7%	0.074	28%	0.278	C	S	.	.	H	α-helix	trans	-112.8	-16.3	-169.8	66.3	0	0	0	0	114.7	Y12 I17 L35 F36 V41 L78 T82	Y12-T39 HydrophobicContact CD1-CG2 3.64Å; Y12-T39 HydrophobicContact CE1-CG2 4.02Å; Y12-T39 HydrophobicContact CG-CG2 4.15Å; I17-T39 HydrophobicContact CD1-CG2 3.3Å; L35-T39 WeakPolarHBondContact O-CB 3.16Å; L35-T39 WeakPolarHBondContact O-CG2 3.3Å; L35-T39 PolarHBondContact O-N 3.27Å; L35-T39 PolarHBondContact O-OG1 2.98Å; F36-T39 PolarHBondContact O-N 3Å; T39-V41 PolarHBondContact O-N 2.92Å; T39-V41 VanDerWaalsContact O-N 3.14Å; T39-V41 WeakPolarHBondContact OG1-CB 3.31Å; T39-V41 PolarHBondContact OG1-N 2.88Å; T39-L78 HydrophobicContact CG2-CD2 3.8Å; T39-T82 WeakPolarHBondContact O-CG2 3.44Å
40	R	94.9	Very high	94.4	Very high	161 Å²	161	58.6 Å²	58.6	61%	0.608	28%	0.284	S	S	*	.			trans	59.5	12.3	-170.2	-53.5	-59.4	-174.6	174.1	-0.7	114.7	F36 L42 T82	F36-R40 VanDerWaalsContact O-CA 3.26Å; F36-R40 WeakPolarHBondContact O-CA 3.4Å; F36-R40 PolarHBondContact O-N 2.74Å; R40-L42 PolarHBondContact O-N 2.89Å; R40-T82 HydrophobicContact CB-CG2 4.32Å
41	V	95.4	Very high	94.1	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.276	C	S	.	.			trans	-79.8	115	169.6	-178.3	0	0	0	0	108.4	Y12 F36 T39 N45 Q46 T82	Y12-V41 HydrophobicContact CE1-CG2 4.42Å; Y12-V41 HydrophobicContact CE2-CG2 4.01Å; Y12-V41 VanDerWaalsContact OH-CG2 3.3Å; Y12-V41 WeakPolarHBondContact OH-CG2 3.42Å; F36-V41 WeakPolarHBondContact CD2-O 3.24Å; T39-V41 PolarHBondContact O-N 2.92Å; T39-V41 VanDerWaalsContact O-N 3.14Å; T39-V41 WeakPolarHBondContact OG1-CB 3.31Å; T39-V41 PolarHBondContact OG1-N 2.88Å; V41-N45 HydrophobicContact CG1-CB 4.05Å; V41-Q46 HydrophobicContact CB-CG 4.15Å; V41-Q46 HydrophobicContact CG1-CG 3.61Å; V41-Q46 PolarHBondContact O-NE2 3.49Å; V41-T82 HydrophobicContact CG2-CG2 4.18Å
42	L	93.8	Very high	93.7	Very high	46 Å²	46	65.6 Å²	65.6	24%	0.241	31%	0.308	C	S	.	.			trans	-57.8	142.7	-179.9	-70.5	171.2	0	0	0	111.2	F36 R40 K44 N45 Q46 Q83	F36-L42 HydrophobicContact CD2-CD2 4.25Å; F36-L42 HydrophobicContact CE2-CD2 3.66Å; F36-L42 HydrophobicContact CE2-CG 4.32Å; F36-L42 HydrophobicContact CZ-CD2 3.91Å; R40-L42 PolarHBondContact O-N 2.89Å; L42-K44 HydrophobicContact CB-CG 4.1Å; L42-K44 PolarHBondContact O-N 3.12Å; L42-N45 WeakPolarHBondContact O-CA 3.27Å; L42-N45 WeakPolarHBondContact O-CB 3.49Å; L42-N45 PolarHBondContact O-N 2.9Å; L42-Q46 WeakPolarHBondContact O-CG 3.44Å; L42-Q46 PolarHBondContact O-N 3.02Å; L42-Q83 HydrophobicContact CD1-CB 4.4Å
43	P	94.5	Very high	93.3	Very high	26 Å²	26	64.8 Å²	64.8	17%	0.169	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-48	-39	-179.2	-33	37.4	0	0	0	115.1	K32 E33 F36 N45 Q46	K32-P43 HydrophobicContact CB-CB 3.91Å; K32-P43 HydrophobicContact CB-CG 4.35Å; K32-P43 HydrophobicContact CD-CB 4.31Å; E33-P43 WeakPolarHBondContact OE1-CG 2.94Å; F36-P43 HydrophobicContact CB-CG 4.41Å; P43-N45 PolarHBondContact O-N 3.39Å; P43-Q46 PolarHBondContact O-N 3.36Å
44	K	92	Very high	92.8	Very high	166 Å²	166	64.5 Å²	64.5	72%	0.722	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-64.7	-23.8	176.5	62.7	169.9	-172.7	-179	0	114.6	L42	L42-K44 HydrophobicContact CB-CG 4.1Å; L42-K44 PolarHBondContact O-N 3.12Å
45	N	91.7	Very high	92.3	Very high	49 Å²	49	68.1 Å²	68.1	26%	0.262	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-100.3	3.7	-179.8	-63.4	-11.2	0	0	0	112.1	V41 L42 P43 G80 I86	V41-N45 HydrophobicContact CG1-CB 4.05Å; L42-N45 WeakPolarHBondContact O-CA 3.27Å; L42-N45 WeakPolarHBondContact O-CB 3.49Å; L42-N45 PolarHBondContact O-N 2.9Å; P43-N45 PolarHBondContact O-N 3.39Å; N45-G80 VanDerWaalsContact O-CA 3.23Å; N45-G80 WeakPolarHBondContact O-CA 3.31Å; N45-I86 VanDerWaalsContact ND2-CD1 3.25Å; N45-I86 WeakPolarHBondContact ND2-CD1 3.47Å
46	Q	94.3	Very high	91.6	Very high	13 Å²	13	74.6 Å²	74.6	6%	0.061	37%	0.365	C	S	.	.			trans	-91.7	130.1	-180	-64.9	-178.7	24.8	0	0	111.3	K32 V41 L42 P43 L78	K32-Q46 VanDerWaalsContact CA-OE1 3.25Å; K32-Q46 PolarHBondContact O-NE2 3.12Å; K32-Q46 PolarHBondContact O-OE1 3.25Å; V41-Q46 HydrophobicContact CB-CG 4.15Å; V41-Q46 HydrophobicContact CG1-CG 3.61Å; V41-Q46 PolarHBondContact O-NE2 3.49Å; L42-Q46 WeakPolarHBondContact O-CG 3.44Å; L42-Q46 PolarHBondContact O-N 3.02Å; P43-Q46 PolarHBondContact O-N 3.36Å; Q46-L78 HydrophobicContact CB-CD1 3.7Å; Q46-L78 HydrophobicContact CG-CD1 3.85Å
47	K	93.1	Very high	91.1	Very high	140 Å²	140	76.7 Å²	76.7	61%	0.609	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	108.9	167.7	-170.3	173.6	-172.7	174.3	0	109.1	L49 I79	K47-L49 HydrophobicContact CD-CD2 4.24Å; K47-L49 HydrophobicContact CG-CD2 4Å; K47-I79 HydrophobicContact CB-CB 4.39Å; K47-I79 PolarHBondContact N-O 2.89Å; K47-I79 PolarHBondContact O-N 3.35Å
48	I	93.5	Very high	90.7	Very high	25 Å²	25	76.3 Å²	76.3	13%	0.128	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	111.1	-179.2	-49.4	170.8	0	0	0	108.5	L10 L31 K32 L35 L51 M77 L78	L10-I48 HydrophobicContact CD2-CG2 3.88Å; L31-I48 HydrophobicContact CD2-CD1 3.87Å; L31-I48 HydrophobicContact CG-CD1 4.14Å; K32-I48 HydrophobicContact CG-CD1 4.18Å; L35-I48 HydrophobicContact CD1-CD1 3.6Å; L35-I48 HydrophobicContact CD1-CG1 4.04Å; I48-L51 HydrophobicContact CB-CD1 3.81Å; I48-L51 HydrophobicContact CB-CG 4.42Å; I48-L51 HydrophobicContact CD1-CD1 4.39Å; I48-L51 HydrophobicContact CG2-CD1 3.61Å; I48-L51 HydrophobicContact CG2-CD2 4.49Å; I48-L51 HydrophobicContact CG2-CG 3.83Å; I48-M77 CarbonylContact C-O 3.54Å; I48-L78 HydrophobicContact CG1-CD1 4.17Å
49	L	91	Very high	90.4	Very high	62 Å²	62	73.8 Å²	73.8	33%	0.325	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	149.1	179.6	-59.3	-174.4	0	0	0	111.5	K47 L76 M77 I79	K47-L49 HydrophobicContact CD-CD2 4.24Å; K47-L49 HydrophobicContact CG-CD2 4Å; L49-L76 WeakPolarHBondContact O-CA 3.17Å; L49-M77 HydrophobicContact CB-CB 4.4Å; L49-M77 HydrophobicContact CD1-CE 3.72Å; L49-M77 PolarHBondContact N-O 3.4Å; L49-M77 PolarHBondContact O-N 3.26Å; L49-M77 VanDerWaalsContact O-N 3.11Å; L49-I79 HydrophobicContact CD1-CD1 3.42Å; L49-I79 VanDerWaalsContact CD1-CD1 3.42Å; L49-I79 HydrophobicContact CD1-CG1 4.13Å; L49-I79 HydrophobicContact CG-CD1 4.16Å; L49-I79 HydrophobicContact CG-CG1 4.49Å
50	G	88.9	Confident	90.3	Very high	44 Å²	44	76.9 Å²	76.9	45%	0.454	40%	0.395	S	S	.	.	S	Bend	trans	92.3	-4.5	177.6	0	0	0	0	0	114.5
51	L	90.2	Very high	90.2	Very high	27 Å²	27	72.9 Å²	72.9	14%	0.141	39%	0.386	C	S	.	.			trans	-73.9	138.6	173.3	-63.3	178.6	0	0	0	111.1	I28 I48 V59 L68 L76	I28-L51 HydrophobicContact CD1-CD1 3.78Å; I48-L51 HydrophobicContact CB-CD1 3.81Å; I48-L51 HydrophobicContact CB-CG 4.42Å; I48-L51 HydrophobicContact CD1-CD1 4.39Å; I48-L51 HydrophobicContact CG2-CD1 3.61Å; I48-L51 HydrophobicContact CG2-CD2 4.49Å; I48-L51 HydrophobicContact CG2-CG 3.83Å; L51-V59 HydrophobicContact CB-CG2 4.09Å; L51-V59 HydrophobicContact CD1-CG1 4.29Å; L51-L68 HydrophobicContact CD2-CD1 4.18Å; L51-L76 HydrophobicContact CD2-CD1 4Å; L51-L76 HydrophobicContact CD2-CD2 3.66Å; L51-L76 HydrophobicContact CD2-CG 4.49Å; L51-L76 HydrophobicContact CG-CD2 4.17Å
52	R	87.3	Confident	90.1	Very high	176 Å²	176	77.4 Å²	77.4	66%	0.664	42%	0.418	S	S	*	.			trans	-143.5	137.8	173.8	-65.7	-173.8	-179.3	-161	-1.7	109.5	L68 V69	R52-L68 WeakPolarHBondContact O-CA 3.45Å; R52-V69 PolarHBondContact O-N 3.11Å
53	T	89.3	Confident	90	Very high	10 Å²	10	76.2 Å²	76.2	6%	0.061	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-79.2	156.9	171.4	62.1	0	0	0	0	110.3	N55 N56 D57 V59 T63 C67 L68	T53-N55 PolarHBondContact O-N 3.31Å; T53-N56 PolarHBondContact O-N 3.39Å; T53-N56 WeakPolarHBondContact OG1-CA 3.29Å; T53-N56 PolarHBondContact OG1-N 3.37Å; T53-N56 VanDerWaalsContact OG1-N 3.16Å; T53-D57 VanDerWaalsContact CG2-O 3.28Å; T53-D57 WeakPolarHBondContact CG2-O 3.42Å; T53-D57 PolarHBondContact OG1-N 3.12Å; T53-D57 PolarHBondContact OG1-O 3.33Å; T53-V59 HydrophobicContact CG2-CG2 3.79Å; T53-T63 HydrophobicContact CG2-CG2 4.02Å; T53-C67 CarbonylContact C-O 3.56Å; T53-C67 VanDerWaalsContact CA-O 3.27Å; T53-C67 WeakPolarHBondContact CA-O 3.4Å; T53-L68 HydrophobicContact CG2-CD2 4.47Å
54	T	86.2	Confident	90	Very high	80 Å²	80	77.3 Å²	77.3	49%	0.491	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-29.7	175.1	46.8	0	0	0	0	113	C67 V69	T54-C67 PolarHBondContact N-O 3.07Å; T54-C67 PolarHBondContact OG1-O 3.29Å; T54-V69 HydrophobicContact CG2-CG2 3.92Å
55	N	85	Confident	89.9	Confident	120 Å²	120	69.5 Å²	69.5	64%	0.642	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	0.1	-179.6	-61.4	-14.3	0	0	0	113.5	T53 D57	T53-N55 PolarHBondContact O-N 3.31Å; N55-D57 PolarHBondContact O-N 2.96Å
56	N	82	Confident	89.8	Confident	135 Å²	135	70.7 Å²	70.7	72%	0.722	40%	0.397	S	S	*	.			trans	63.9	11	-171.6	-58.1	-50.8	0	0	0	116	T53	T53-N56 PolarHBondContact O-N 3.39Å; T53-N56 WeakPolarHBondContact OG1-CA 3.29Å; T53-N56 PolarHBondContact OG1-N 3.37Å; T53-N56 VanDerWaalsContact OG1-N 3.16Å
57	D	85.5	Confident	89.7	Confident	99 Å²	99	72.4 Å²	72.4	53%	0.529	41%	0.41	S	S	.	.			trans	-65.9	153	170	-64.4	-42.3	0	0	0	111.7	T53 N55	T53-D57 VanDerWaalsContact CG2-O 3.28Å; T53-D57 WeakPolarHBondContact CG2-O 3.42Å; T53-D57 PolarHBondContact OG1-N 3.12Å; T53-D57 PolarHBondContact OG1-O 3.33Å; N55-D57 PolarHBondContact O-N 2.96Å
58	P	86.5	Confident	89.5	Confident	108 Å²	108	66.3 Å²	66.3	70%	0.701	38%	0.384	S	S	*	.			trans	-56.6	139.4	174.6	-23.6	33.5	0	0	0	112.4	V60	P58-V60 PolarHBondContact O-N 3.49Å
59	V	89.6	Confident	89.2	Confident	51 Å²	51	67.9 Å²	67.9	31%	0.309	39%	0.394	S	S	.	.			trans	-79.5	115	176.2	-178.7	0	0	0	0	109.1	I28 L51 T53 L68	I28-V59 HydrophobicContact CD1-CG1 3.82Å; I28-V59 HydrophobicContact CG1-CG1 3.65Å; L51-V59 HydrophobicContact CB-CG2 4.09Å; L51-V59 HydrophobicContact CD1-CG1 4.29Å; T53-V59 HydrophobicContact CG2-CG2 3.79Å; V59-L68 HydrophobicContact CG1-CD2 4.45Å; V59-L68 HydrophobicContact CG2-CD2 4.2Å
60	V	91.5	Very high	88.9	Confident	76 Å²	76	67.7 Å²	67.7	46%	0.461	39%	0.393	S	S	.	.			trans	-112.1	166.4	174.9	-62.6	0	0	0	0	111.3	P58 S62 T63	P58-V60 PolarHBondContact O-N 3.49Å; V60-S62 WeakPolarHBondContact CG2-OG 3.45Å; V60-S62 PolarHBondContact O-N 3.45Å; V60-T63 WeakPolarHBondContact CG2-OG1 3.39Å; V60-T63 PolarHBondContact N-OG1 3.39Å; V60-T63 WeakPolarHBondContact O-CB 3.45Å; V60-T63 PolarHBondContact O-N 3.03Å; V60-T63 PolarHBondContact O-OG1 2.92Å
61	D	92.4	Very high	88.5	Confident	78 Å²	78	72.6 Å²	72.6	42%	0.417	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-29.2	-174.1	-70.9	-6.1	0	0	0	113.9	N27 I28 S29 K32 T63	N27-D61 PolarHBondContact OD1-O 3.47Å; I28-D61 PolarHBondContact N-O 3.07Å; S29-D61 PolarHBondContact N-O 3.38Å; K32-D61 WeakPolarHBondContact CE-OD1 3.27Å; K32-D61 IonicContact NZ-OD1 2.66Å; K32-D61 PolarHBondContact NZ-OD1 3.29Å; K32-D61 IonicContact NZ-OD2 3.46Å; K32-D61 PolarHBondContact NZ-OD2 3.29Å; D61-T63 VanDerWaalsContact C-N 3.31Å; D61-T63 PolarHBondContact O-N 3.43Å
62	S	92.8	Very high	87.8	Confident	95 Å²	95	78 Å²	78	66%	0.664	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-4.3	175.6	55.9	0	0	0	0	114.6	V60 T64	V60-S62 WeakPolarHBondContact CG2-OG 3.45Å; V60-S62 PolarHBondContact O-N 3.45Å; S62-T64 PolarHBondContact O-N 3.31Å
63	T	92.6	Very high	87.3	Confident	21 Å²	21	73 Å²	73	13%	0.129	44%	0.442	C	S	.	.			trans	-67	126.3	-179.7	-47.8	0	0	0	0	109.7	N27 I28 T53 V60 D61 C67 L68	N27-T63 CarbonylContact C-O 3.08Å; N27-T63 WeakPolarHBondContact CA-O 3.45Å; N27-T63 WeakPolarHBondContact CB-O 3.31Å; I28-T63 WeakPolarHBondContact CG1-O 3.32Å; I28-T63 PolarHBondContact N-O 2.97Å; T53-T63 HydrophobicContact CG2-CG2 4.02Å; V60-T63 WeakPolarHBondContact CG2-OG1 3.39Å; V60-T63 PolarHBondContact N-OG1 3.39Å; V60-T63 WeakPolarHBondContact O-CB 3.45Å; V60-T63 PolarHBondContact O-N 3.03Å; V60-T63 PolarHBondContact O-OG1 2.92Å; D61-T63 VanDerWaalsContact C-N 3.31Å; D61-T63 PolarHBondContact O-N 3.43Å; T63-C67 HydrophobicContact CG2-CB 4.24Å; T63-L68 HydrophobicContact CG2-CD2 4.38Å
64	T	93.7	Very high	87	Confident	49 Å²	49	74.7 Å²	74.7	30%	0.301	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-74.3	147.4	176.4	52.2	0	0	0	0	111.4	H26 S62 S66 C67	H26-T64 CarbonylContact O-C 3.52Å; H26-T64 WeakPolarHBondContact O-CA 3.26Å; S62-T64 PolarHBondContact O-N 3.31Å; T64-S66 WeakPolarHBondContact CB-OG 3.32Å; T64-S66 PolarHBondContact O-N 3.36Å; T64-S66 PolarHBondContact OG1-OG 3.25Å; T64-C67 WeakPolarHBondContact O-CB 3.3Å; T64-C67 PolarHBondContact O-N 2.93Å; T64-C67 PolarHBondContact OG1-SG 3.17Å
65	L	90.9	Very high	86.9	Confident	2 Å²	2	80.1 Å²	80.1	1%	0.01	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-63.5	-27.6	179.7	-63.1	-177.1	0	0	0	112.3	I6 L22 H26 I28 L31 C67 L68	I6-L65 HydrophobicContact CD1-CB 3.6Å; I6-L65 HydrophobicContact CD1-CD1 4.23Å; L22-L65 HydrophobicContact CB-CD1 3.87Å; L22-L65 HydrophobicContact CD1-CD1 3.97Å; H26-L65 HydrophobicContact CB-CD1 4.13Å; H26-L65 WeakPolarHBondContact O-CG 3.5Å; H26-L65 PolarHBondContact O-N 2.96Å; I28-L65 HydrophobicContact CD1-CD2 4.08Å; L31-L65 HydrophobicContact CD2-CD2 4.33Å; L65-C67 PolarHBondContact O-N 3.33Å; L65-L68 HydrophobicContact CB-CD1 4.44Å; L65-L68 HydrophobicContact CD2-CD1 3.56Å; L65-L68 WeakPolarHBondContact O-CB 3.48Å; L65-L68 PolarHBondContact O-N 3.44Å; L65-L68 VanDerWaalsContact O-N 3.15Å
66	S	90.3	Very high	87.3	Confident	73 Å²	73	74.8 Å²	74.8	51%	0.51	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-59.1	-25.8	172	54.8	0	0	0	0	114.5	S24 T64 L68	S24-S66 WeakPolarHBondContact O-CB 3.31Å; S24-S66 PolarHBondContact O-N 3.44Å; S24-S66 PolarHBondContact O-OG 2.85Å; T64-S66 WeakPolarHBondContact CB-OG 3.32Å; T64-S66 PolarHBondContact O-N 3.36Å; T64-S66 PolarHBondContact OG1-OG 3.25Å; S66-L68 VanDerWaalsContact C-N 3.3Å
67	C	91.3	Very high	87.8	Confident	50 Å²	50	72.5 Å²	72.5	34%	0.338	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-85.8	-0.5	179.2	-66.8	0	0	0	0	113.1	T53 T54 T63 T64 L65	T53-C67 CarbonylContact C-O 3.56Å; T53-C67 VanDerWaalsContact CA-O 3.27Å; T53-C67 WeakPolarHBondContact CA-O 3.4Å; T54-C67 PolarHBondContact N-O 3.07Å; T54-C67 PolarHBondContact OG1-O 3.29Å; T63-C67 HydrophobicContact CG2-CB 4.24Å; T64-C67 WeakPolarHBondContact O-CB 3.3Å; T64-C67 PolarHBondContact O-N 2.93Å; T64-C67 PolarHBondContact OG1-SG 3.17Å; L65-C67 PolarHBondContact O-N 3.33Å
68	L	89.6	Confident	88.3	Confident	12 Å²	12	67.9 Å²	67.9	6%	0.063	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-93.3	143.3	-176.4	-58.9	172.9	0	0	0	111.9	I28 L51 R52 T53 V59 T63 L65 S66 L70	I28-L68 HydrophobicContact CD1-CD1 3.85Å; L51-L68 HydrophobicContact CD2-CD1 4.18Å; R52-L68 WeakPolarHBondContact O-CA 3.45Å; T53-L68 HydrophobicContact CG2-CD2 4.47Å; V59-L68 HydrophobicContact CG1-CD2 4.45Å; V59-L68 HydrophobicContact CG2-CD2 4.2Å; T63-L68 HydrophobicContact CG2-CD2 4.38Å; L65-L68 HydrophobicContact CB-CD1 4.44Å; L65-L68 HydrophobicContact CD2-CD1 3.56Å; L65-L68 WeakPolarHBondContact O-CB 3.48Å; L65-L68 PolarHBondContact O-N 3.44Å; L65-L68 VanDerWaalsContact O-N 3.15Å; S66-L68 VanDerWaalsContact C-N 3.3Å; L68-L70 HydrophobicContact CB-CD1 4.26Å; L68-L70 HydrophobicContact CB-CD2 4.21Å; L68-L70 HydrophobicContact CB-CG 3.87Å; L68-L70 PolarHBondContact O-N 2.95Å
69	V	87.3	Confident	88.6	Confident	57 Å²	57	66.7 Å²	66.7	35%	0.345	39%	0.389	S	S	.	.			trans	-82.3	83.7	173.6	-175.3	0	0	0	0	109.5	R52 T54 K71	R52-V69 PolarHBondContact O-N 3.11Å; T54-V69 HydrophobicContact CG2-CG2 3.92Å; V69-K71 HydrophobicContact CG1-CD 4.36Å; V69-K71 HydrophobicContact CG1-CG 4.13Å; V69-K71 PolarHBondContact O-N 3.18Å
70	L	83	Confident	88.6	Confident	59 Å²	59	65 Å²	65	31%	0.309	38%	0.382	S	S	.	.			trans	-98.2	75.8	-179.1	-60.7	173.5	0	0	0	111.1	I6 L8 L68	I6-L70 HydrophobicContact CD1-CD1 4.48Å; I6-L70 HydrophobicContact CG2-CD1 3.72Å; L8-L70 HydrophobicContact CD2-CD1 3.7Å; L8-L70 HydrophobicContact CD2-CD2 3.66Å; L8-L70 HydrophobicContact CD2-CG 4.27Å; L68-L70 HydrophobicContact CB-CD1 4.26Å; L68-L70 HydrophobicContact CB-CD2 4.21Å; L68-L70 HydrophobicContact CB-CG 3.87Å; L68-L70 PolarHBondContact O-N 2.95Å
71	K	81.2	Confident	88.6	Confident	147 Å²	147	64.1 Å²	64.1	64%	0.639	38%	0.379	S	S	*	.			trans	-78.1	150.3	175.9	-67.8	-179	-178.4	179.4	0	111.1	V69 G73 T74	V69-K71 HydrophobicContact CG1-CD 4.36Å; V69-K71 HydrophobicContact CG1-CG 4.13Å; V69-K71 PolarHBondContact O-N 3.18Å; K71-G73 PolarHBondContact O-N 2.75Å; K71-T74 PolarHBondContact N-OG1 2.83Å; K71-T74 VanDerWaalsContact N-OG1 3.09Å; K71-T74 WeakPolarHBondContact O-CB 3.37Å; K71-T74 PolarHBondContact O-N 2.76Å; K71-T74 PolarHBondContact O-OG1 3.42Å
72	P	76.5	Confident	88.5	Confident	140 Å²	140	61.3 Å²	61.3	91%	0.909	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	126	169.3	-23.5	33	0	0	0	110.7
73	G	76.5	Confident	88.4	Confident	71 Å²	71	60.5 Å²	60.5	73%	0.732	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	4.7	-176.7	0	0	0	0	0	115.8	K71 K75	K71-G73 PolarHBondContact O-N 2.75Å; G73-K75 PolarHBondContact O-N 3.41Å; G73-K75 VanDerWaalsContact O-N 3.17Å
74	T	83	Confident	88.1	Confident	46 Å²	46	67.2 Å²	67.2	28%	0.282	38%	0.38	S	S	.	.			trans	-58.5	118.7	171	-57.4	0	0	0	0	109.7	K71 L76	K71-T74 PolarHBondContact N-OG1 2.83Å; K71-T74 VanDerWaalsContact N-OG1 3.09Å; K71-T74 WeakPolarHBondContact O-CB 3.37Å; K71-T74 PolarHBondContact O-N 2.76Å; K71-T74 PolarHBondContact O-OG1 3.42Å; T74-L76 HydrophobicContact CG2-CD2 3.84Å; T74-L76 HydrophobicContact CG2-CG 4.24Å; T74-L76 PolarHBondContact O-N 3.09Å
75	K	83.9	Confident	87.8	Confident	194 Å²	194	68.8 Å²	68.8	84%	0.843	38%	0.384	S	S	*	.			trans	-88.4	101.8	-178.8	-65.5	-178.1	-177.3	176.4	0	109.4	G73	G73-K75 PolarHBondContact O-N 3.41Å; G73-K75 VanDerWaalsContact O-N 3.17Å
76	L	92.1	Very high	87.4	Confident	8 Å²	8	71 Å²	71	4%	0.042	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	145.3	174.2	-58.8	-179.8	0	0	0	110.4	L8 L10 K11 L49 L51 T74	L8-L76 HydrophobicContact CD2-CD1 4.09Å; L10-L76 CarbonylContact C-O 3.31Å; L10-L76 WeakPolarHBondContact CA-O 3.34Å; L10-L76 HydrophobicContact CB-CB 4.25Å; L10-L76 HydrophobicContact CD2-CB 3.97Å; L10-L76 HydrophobicContact CD2-CD1 4.43Å; L10-L76 HydrophobicContact CG-CB 3.74Å; L10-L76 HydrophobicContact CG-CD1 4.23Å; K11-L76 PolarHBondContact N-O 2.8Å; L49-L76 WeakPolarHBondContact O-CA 3.17Å; L51-L76 HydrophobicContact CD2-CD1 4Å; L51-L76 HydrophobicContact CD2-CD2 3.66Å; L51-L76 HydrophobicContact CD2-CG 4.49Å; L51-L76 HydrophobicContact CG-CD2 4.17Å; T74-L76 HydrophobicContact CG2-CD2 3.84Å; T74-L76 HydrophobicContact CG2-CG 4.24Å; T74-L76 PolarHBondContact O-N 3.09Å
77	M	94	Very high	87.1	Confident	86 Å²	86	71.3 Å²	71.3	42%	0.424	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	128.7	177.2	-169.8	168.4	68.4	0	0	110	K11 I48 L49 I79	K11-M77 CarbonylContact O-C 3.59Å; K11-M77 WeakPolarHBondContact O-CA 3.41Å; K11-M77 WeakPolarHBondContact O-CG 3.4Å; I48-M77 CarbonylContact C-O 3.54Å; L49-M77 HydrophobicContact CB-CB 4.4Å; L49-M77 HydrophobicContact CD1-CE 3.72Å; L49-M77 PolarHBondContact N-O 3.4Å; L49-M77 PolarHBondContact O-N 3.26Å; L49-M77 VanDerWaalsContact O-N 3.11Å; M77-I79 HydrophobicContact CE-CD1 3.92Å; M77-I79 HydrophobicContact CE-CG1 4.06Å
78	L	95.1	Very high	86.7	Confident	3 Å²	3	76.7 Å²	76.7	2%	0.016	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127	169.5	174.7	64.2	0	0	0	108.5	K11 Y12 L35 T39 Q46 I48	K11-L78 PolarHBondContact O-N 3.22Å; Y12-L78 HydrophobicContact CD2-CB 4.32Å; Y12-L78 HydrophobicContact CD2-CD2 4.06Å; Y12-L78 HydrophobicContact CD2-CG 4.06Å; Y12-L78 HydrophobicContact CG-CD2 4.23Å; L35-L78 HydrophobicContact CB-CD2 4.36Å; L35-L78 HydrophobicContact CD1-CD1 4.41Å; L35-L78 HydrophobicContact CD1-CD2 4.5Å; L35-L78 HydrophobicContact CD2-CD2 4.36Å; T39-L78 HydrophobicContact CG2-CD2 3.8Å; Q46-L78 HydrophobicContact CB-CD1 3.7Å; Q46-L78 HydrophobicContact CG-CD1 3.85Å; I48-L78 HydrophobicContact CG1-CD1 4.17Å
79	I	92.3	Very high	86.1	Confident	83 Å²	83	80.7 Å²	80.7	43%	0.426	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134	165.9	-58.4	-176.7	0	0	0	107.7	K47 L49 M77	K47-I79 HydrophobicContact CB-CB 4.39Å; K47-I79 PolarHBondContact N-O 2.89Å; K47-I79 PolarHBondContact O-N 3.35Å; L49-I79 HydrophobicContact CD1-CD1 3.42Å; L49-I79 VanDerWaalsContact CD1-CD1 3.42Å; L49-I79 HydrophobicContact CD1-CG1 4.13Å; L49-I79 HydrophobicContact CG-CD1 4.16Å; L49-I79 HydrophobicContact CG-CG1 4.49Å; M77-I79 HydrophobicContact CE-CD1 3.92Å; M77-I79 HydrophobicContact CE-CG1 4.06Å
80	G	90.6	Very high	85.5	Confident	15 Å²	15	83.5 Å²	83.5	16%	0.155	45%	0.447	C	S	.	.			trans	170.4	168.3	172.3	0	0	0	0	0	109.9	Y12 N45	Y12-G80 WeakPolarHBondContact CE2-O 3.5Å; N45-G80 VanDerWaalsContact O-CA 3.23Å; N45-G80 WeakPolarHBondContact O-CA 3.31Å
81	S	91	Very high	85.2	Confident	57 Å²	57	86.4 Å²	86.4	40%	0.399	46%	0.462	S	S	.	.			trans	-120.9	147.1	176.5	-60.9	0	0	0	0	109.7	E85	S81-E85 WeakPolarHBondContact CA-OE2 3.35Å
82	T	91.9	Very high	84.5	Confident	20 Å²	20	83 Å²	83	12%	0.123	45%	0.454	C	S	.	.			trans	-70.4	158.8	176.6	69.1	0	0	0	0	110.3	T39 R40 V41 E84 E85 I86	T39-T82 WeakPolarHBondContact O-CG2 3.44Å; R40-T82 HydrophobicContact CB-CG2 4.32Å; V41-T82 HydrophobicContact CG2-CG2 4.18Å; T82-E84 PolarHBondContact O-N 2.93Å; T82-E85 PolarHBondContact N-OE2 3.39Å; T82-E85 PolarHBondContact O-N 3.26Å; T82-E85 VanDerWaalsContact OG1-CG 3.27Å; T82-E85 WeakPolarHBondContact OG1-CG 3.44Å; T82-E85 PolarHBondContact OG1-N 3.33Å; T82-E85 PolarHBondContact OG1-OE2 2.87Å; T82-I86 WeakPolarHBondContact O-CG1 3.36Å; T82-I86 PolarHBondContact O-N 3.43Å; T82-I86 VanDerWaalsContact O-N 3.09Å
83	Q	88.8	Confident	83.7	Confident	77 Å²	77	85.3 Å²	85.3	36%	0.36	45%	0.453	S	S	.	.	H	α-helix	trans	-61.5	-34.3	177.1	-169.8	63.3	26.6	0	0	111.5	L42 I86 L87	L42-Q83 HydrophobicContact CD1-CB 4.4Å; Q83-I86 PolarHBondContact O-N 3.04Å; Q83-L87 HydrophobicContact CG-CD1 4.17Å; Q83-L87 WeakPolarHBondContact O-CB 3.46Å; Q83-L87 VanDerWaalsContact O-CG 3.23Å; Q83-L87 WeakPolarHBondContact O-CG 3.47Å; Q83-L87 PolarHBondContact O-N 2.9Å
84	E	87.8	Confident	82.8	Confident	162 Å²	162	89 Å²	89	76%	0.757	46%	0.456	S	S	*	.	H	α-helix	trans	-65.8	-43.5	176.6	-67.9	175.4	-171.5	0	0	112.2	T82 L87 K88	T82-E84 PolarHBondContact O-N 2.93Å; E84-L87 PolarHBondContact O-N 3.11Å; E84-K88 WeakPolarHBondContact O-CB 3.37Å; E84-K88 PolarHBondContact O-N 2.82Å
85	E	87.7	Confident	81.5	Confident	82 Å²	82	91 Å²	91	38%	0.383	47%	0.472	S	S	.	.	H	α-helix	trans	-62.5	-43.2	175.7	-74.2	166.4	170.6	0	0	111.7	S81 T82 K88 V89	S81-E85 WeakPolarHBondContact CA-OE2 3.35Å; T82-E85 PolarHBondContact N-OE2 3.39Å; T82-E85 PolarHBondContact O-N 3.26Å; T82-E85 VanDerWaalsContact OG1-CG 3.27Å; T82-E85 WeakPolarHBondContact OG1-CG 3.44Å; T82-E85 PolarHBondContact OG1-N 3.33Å; T82-E85 PolarHBondContact OG1-OE2 2.87Å; E85-K88 PolarHBondContact O-N 3.49Å; E85-V89 WeakPolarHBondContact O-CG2 3.41Å; E85-V89 PolarHBondContact O-N 2.92Å; E85-V89 VanDerWaalsContact O-N 3.09Å
86	I	82.6	Confident	80.3	Confident	48 Å²	48	86.6 Å²	86.6	25%	0.246	46%	0.463	C	S	.	.	H	α-helix	trans	-63	-45.3	177.4	-65.1	166	0	0	0	110.3	N45 T82 Q83 V89 N90	N45-I86 VanDerWaalsContact ND2-CD1 3.25Å; N45-I86 WeakPolarHBondContact ND2-CD1 3.47Å; T82-I86 WeakPolarHBondContact O-CG1 3.36Å; T82-I86 PolarHBondContact O-N 3.43Å; T82-I86 VanDerWaalsContact O-N 3.09Å; Q83-I86 PolarHBondContact O-N 3.04Å; I86-V89 PolarHBondContact O-N 2.95Å; I86-N90 WeakPolarHBondContact O-CB 3.29Å; I86-N90 PolarHBondContact O-N 3Å; I86-N90 PolarHBondContact O-ND2 2.96Å
87	L	82	Confident	78.8	Confident	80 Å²	80	93.7 Å²	93.7	42%	0.419	50%	0.501	S	S	.	.	H	α-helix	trans	-64.9	-39.2	177.9	-73	170	0	0	0	112.2	Q83 E84 V89 N90 N91	Q83-L87 HydrophobicContact CG-CD1 4.17Å; Q83-L87 WeakPolarHBondContact O-CB 3.46Å; Q83-L87 VanDerWaalsContact O-CG 3.23Å; Q83-L87 WeakPolarHBondContact O-CG 3.47Å; Q83-L87 PolarHBondContact O-N 2.9Å; E84-L87 PolarHBondContact O-N 3.11Å; L87-V89 VanDerWaalsContact C-N 3.34Å; L87-V89 PolarHBondContact O-N 3.48Å; L87-N90 PolarHBondContact O-N 3.18Å; L87-N91 VanDerWaalsContact O-CB 3.26Å; L87-N91 WeakPolarHBondContact O-CB 3.3Å; L87-N91 PolarHBondContact O-N 2.94Å; L87-N91 PolarHBondContact O-ND2 2.97Å
88	K	84.6	Confident	77.3	Confident	163 Å²	163	93.3 Å²	93.3	71%	0.709	50%	0.503	S	S	*	.	H	α-helix	trans	-61	-43.5	176.6	-173.4	179.4	-179.5	-178.6	0	111.6	E84 E85 T92	E84-K88 WeakPolarHBondContact O-CB 3.37Å; E84-K88 PolarHBondContact O-N 2.82Å; E85-K88 PolarHBondContact O-N 3.49Å; K88-T92 PolarHBondContact O-N 3.38Å; K88-T92 PolarHBondContact O-OG1 2.84Å
89	V	76.8	Confident	75.7	Confident	96 Å²	96	96.9 Å²	96.9	58%	0.582	53%	0.525	S	S	*	.	H	α-helix	trans	-67.4	-42.2	176.4	175.2	0	0	0	0	111.1	E85 I86 L87 T92	E85-V89 WeakPolarHBondContact O-CG2 3.41Å; E85-V89 PolarHBondContact O-N 2.92Å; E85-V89 VanDerWaalsContact O-N 3.09Å; I86-V89 PolarHBondContact O-N 2.95Å; L87-V89 VanDerWaalsContact C-N 3.34Å; L87-V89 PolarHBondContact O-N 3.48Å; V89-T92 PolarHBondContact O-N 3.08Å
90	N	75	Confident	74.6	Confident	117 Å²	117	97.2 Å²	97.2	63%	0.626	53%	0.528	S	S	*	.	H	α-helix	trans	-70.8	-29.9	-179.4	-70.3	-10.7	0	0	0	113.6	I86 L87	I86-N90 WeakPolarHBondContact O-CB 3.29Å; I86-N90 PolarHBondContact O-N 3Å; I86-N90 PolarHBondContact O-ND2 2.96Å; L87-N90 PolarHBondContact O-N 3.18Å
91	N	75.9	Confident	73.5	Confident	119 Å²	119	97.1 Å²	97.1	64%	0.636	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-0.5	178.5	-66.5	-11.1	0	0	0	113.1	L87 E93	L87-N91 VanDerWaalsContact O-CB 3.26Å; L87-N91 WeakPolarHBondContact O-CB 3.3Å; L87-N91 PolarHBondContact O-N 2.94Å; L87-N91 PolarHBondContact O-ND2 2.97Å; N91-E93 VanDerWaalsContact C-N 3.34Å; N91-E93 PolarHBondContact O-N 3.4Å
92	T	66.7	Low	72.3	Confident	76 Å²	76	96.6 Å²	96.6	47%	0.466	51%	0.514	S	S	.	.			trans	-70.8	96.1	172.3	-59.2	0	0	0	0	107.3	K88 V89 D94	K88-T92 PolarHBondContact O-N 3.38Å; K88-T92 PolarHBondContact O-OG1 2.84Å; V89-T92 PolarHBondContact O-N 3.08Å; T92-D94 HydrophobicContact CG2-CB 3.94Å; T92-D94 PolarHBondContact O-N 3.25Å
93	E	60.2	Low	71.4	Confident	189 Å²	189	98.8 Å²	98.8	88%	0.883	53%	0.525	S	S	*	.			trans	-65.6	-17.7	174.7	-69.4	-173.6	173.9	0	0	112.4	N91 S95	N91-E93 VanDerWaalsContact C-N 3.34Å; N91-E93 PolarHBondContact O-N 3.4Å; E93-S95 PolarHBondContact O-N 3.39Å
94	D	57.7	Low	70.6	Confident	148 Å²	148	95.8 Å²	95.8	79%	0.791	51%	0.511	S	S	*	.			trans	-72.6	57.9	166.7	-100.8	-16.2	0	0	0	110.7	T92 P96	T92-D94 HydrophobicContact CG2-CB 3.94Å; T92-D94 PolarHBondContact O-N 3.25Å; D94-P96 WeakPolarHBondContact O-CD 3.21Å
95	S	55.4	Low	69.8	Low	89 Å²	89	92.3 Å²	92.3	62%	0.622	49%	0.493	S	S	*	.			trans	-65.9	118.2	156.4	52.7	0	0	0	0	106.3	E93 D97	E93-S95 PolarHBondContact O-N 3.39Å; S95-D97 PolarHBondContact O-N 3.25Å
96	P	57.7	Low	69.1	Low	101 Å²	101	95.3 Å²	95.3	66%	0.656	51%	0.507	S	S	*	.			trans	-54.1	144.6	174.2	24.2	-33.1	0	0	0	108.3	D94 V98	D94-P96 WeakPolarHBondContact O-CD 3.21Å; P96-V98 WeakPolarHBondContact O-CG2 3.37Å; P96-V98 PolarHBondContact O-N 3.13Å
97	D	60.3	Low	68.7	Low	156 Å²	156	99 Å²	99	83%	0.834	52%	0.523	S	S	*	.			trans	-56.2	100.2	179.8	-152.6	7.2	0	0	0	108.3	S95 V99	S95-D97 PolarHBondContact O-N 3.25Å; D97-V99 PolarHBondContact O-N 3.47Å
98	V	63.8	Low	68.7	Low	78 Å²	78	95.6 Å²	95.6	47%	0.473	51%	0.505	S	S	.	.			trans	-80.6	93	-173.9	-176.3	0	0	0	0	106.6	P96 D100 V458	P96-V98 WeakPolarHBondContact O-CG2 3.37Å; P96-V98 PolarHBondContact O-N 3.13Å; V98-D100 PolarHBondContact O-N 2.99Å; V98-V458 HydrophobicContact CB-CG2 4.34Å; V98-V458 HydrophobicContact CG1-CG2 3.67Å
99	V	61.4	Low	68.4	Low	78 Å²	78	89.3 Å²	89.3	47%	0.473	48%	0.479	S	S	.	.			trans	-71.3	118.6	175.9	-171.4	0	0	0	0	108.9	D97 D101 H264	D97-V99 PolarHBondContact O-N 3.47Å; V99-D101 PolarHBondContact O-N 3.03Å; V99-D101 VanDerWaalsContact O-N 3.17Å; V99-H264 WeakPolarHBondContact CG1-CD2 3.23Å
100	D	69.4	Low	69	Low	91 Å²	91	90.4 Å²	90.4	49%	0.487	48%	0.478	S	S	.	.			trans	-68.7	106.3	168.5	-178.7	0.7	0	0	0	109.1	V98 F102 H264	V98-D100 PolarHBondContact O-N 2.99Å; D100-F102 WeakPolarHBondContact OD1-CB 3.32Å; D100-F102 VanDerWaalsContact OD1-CD2 3.28Å; D100-F102 WeakPolarHBondContact OD1-CD2 3.43Å; D100-F102 PolarHBondContact OD1-N 2.88Å; D100-H264 PolarHBondContact O-CD2 3.43Å; D100-H264 PolarHBondContact O-NE2 2.87Å
101	D	67.7	Low	69.7	Low	13 Å²	13	85.8 Å²	85.8	7%	0.07	45%	0.453	C	S	.	.			trans	-98.4	4.4	178.6	78.1	1.2	0	0	0	113.7	V99 H264 K267 R295	V99-D101 PolarHBondContact O-N 3.03Å; V99-D101 VanDerWaalsContact O-N 3.17Å; D101-H264 VanDerWaalsContact CA-CD2 3.45Å; D101-H264 WeakPolarHBondContact CA-CD2 3.34Å; D101-H264 HydrophobicContact CB-CB 4.34Å; D101-K267 IonicContact OD2-NZ 3.78Å; D101-K267 PolarHBondContact OD2-NZ 3.36Å; D101-R295 VanDerWaalsContact C-NH1 3.34Å; D101-R295 VanDerWaalsContact CG-NH1 3.34Å; D101-R295 WeakPolarHBondContact O-CD 3.34Å; D101-R295 PolarHBondContact O-NH1 3.07Å; D101-R295 IonicContact OD1-CZ 2.57Å; D101-R295 IonicContact OD1-NH1 3.27Å; D101-R295 PolarHBondContact OD1-NH1 3.24Å; D101-R295 IonicContact OD2-NH1 3.79Å
102	F	65.2	Low	70.5	Confident	46 Å²	46	81.3 Å²	81.3	20%	0.202	43%	0.431	C	S	.	.	S	Bend	trans	-76.1	-29.8	-174	-71	-78.3	0	0	0	113.8	D100 V293 R294 R457	D100-F102 WeakPolarHBondContact OD1-CB 3.32Å; D100-F102 VanDerWaalsContact OD1-CD2 3.28Å; D100-F102 WeakPolarHBondContact OD1-CD2 3.43Å; D100-F102 PolarHBondContact OD1-N 2.88Å; F102-V293 HydrophobicContact CD1-CG2 4.14Å; F102-R294 PolarHBondContact O-N 2.78Å; F102-R457 HydrophobicContact CE2-CB 4.43Å; F102-R457 HydrophobicContact CE2-CG 4.03Å; F102-R457 HydrophobicContact CZ-CB 4.26Å; F102-R457 HydrophobicContact CZ-CG 3.71Å
103	D	72	Confident	71.8	Confident	65 Å²	65	82.6 Å²	82.6	35%	0.348	44%	0.435	S	S	.	.	S	Bend	trans	-108.6	162.2	173.9	-136.2	-28.3	0	0	0	111	R294 R306	D103-R294 WeakPolarHBondContact OD1-CD 3.49Å; D103-R306 IonicContact OD2-NH2 2.69Å
104	F	71.9	Confident	73.4	Confident	15 Å²	15	76.3 Å²	76.3	7%	0.066	41%	0.409	C	S	.	.			trans	-123.5	152.1	171.2	63	-107.6	0	0	0	108.9	D108 I109 F261 R294 R295 I298	F104-D108 HydrophobicContact CB-CB 3.86Å; F104-D108 WeakPolarHBondContact CB-OD2 3.44Å; F104-D108 HydrophobicContact CD2-CB 4.08Å; F104-D108 HydrophobicContact CG-CB 4.3Å; F104-I109 HydrophobicContact CD2-CG1 4.24Å; F104-I109 HydrophobicContact CE2-CD1 4.21Å; F104-I109 HydrophobicContact CE2-CG1 3.53Å; F104-I109 HydrophobicContact CZ-CG1 4.41Å; F104-F261 HydrophobicContact CB-CE1 4.37Å; F104-R294 HydrophobicContact CD1-CB 3.71Å; F104-R294 HydrophobicContact CD1-CG 3.85Å; F104-R294 VanDerWaalsContact CE1-C 3.5Å; F104-R294 HydrophobicContact CE1-CB 3.62Å; F104-R294 VanDerWaalsContact CE1-CD 3.43Å; F104-R294 HydrophobicContact CE1-CG 3.28Å; F104-R294 WeakPolarHBondContact CE1-O 3.03Å; F104-R294 HydrophobicContact CZ-CG 3.78Å; F104-R295 HydrophobicContact CD1-CB 4.24Å; F104-I298 HydrophobicContact CB-CD1 4.48Å; F104-I298 HydrophobicContact CD1-CD1 3.62Å; F104-I298 HydrophobicContact CD2-CD1 3.6Å; F104-I298 HydrophobicContact CE1-CD1 3.47Å; F104-I298 VanDerWaalsContact CE1-CD1 3.47Å; F104-I298 HydrophobicContact CE2-CD1 3.55Å; F104-I298 HydrophobicContact CG-CD1 3.65Å; F104-I298 HydrophobicContact CZ-CD1 3.46Å; F104-I298 VanDerWaalsContact CZ-CD1 3.46Å
105	K	72.4	Confident	75.3	Confident	89 Å²	89	73 Å²	73	39%	0.387	40%	0.402	S	S	.	.			trans	-78.6	155.7	-179.8	-66.4	175.7	174.6	177.3	0	109.9	E107 D108 E263	K105-E107 HydrophobicContact CB-CG 3.64Å; K105-E107 HydrophobicContact CD-CG 4.4Å; K105-E107 WeakPolarHBondContact CD-OE1 3.34Å; K105-E107 PolarHBondContact O-N 2.8Å; K105-D108 PolarHBondContact N-OD2 3.37Å; K105-D108 WeakPolarHBondContact O-CA 3.34Å; K105-D108 VanDerWaalsContact O-CB 3.28Å; K105-D108 WeakPolarHBondContact O-CB 3.3Å; K105-D108 PolarHBondContact O-N 2.99Å; K105-E263 VanDerWaalsContact CE-OE2 3.24Å; K105-E263 WeakPolarHBondContact CE-OE2 3.39Å; K105-E263 IonicContact NZ-OE1 2.71Å; K105-E263 PolarHBondContact NZ-OE1 2.8Å; K105-E263 IonicContact NZ-OE2 2.7Å; K105-E263 PolarHBondContact NZ-OE2 2.98Å
106	E	73.2	Confident	77.3	Confident	145 Å²	145	74.4 Å²	74.4	68%	0.678	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-55.2	-28.8	178.5	-162.4	69.5	-164	0	0	112.3	D108 I109	E106-D108 VanDerWaalsContact C-N 3.35Å; E106-D108 PolarHBondContact O-N 2.84Å; E106-I109 HydrophobicContact CG-CD1 4.08Å; E106-I109 VanDerWaalsContact O-CB 3.3Å; E106-I109 WeakPolarHBondContact O-CB 3.15Å; E106-I109 WeakPolarHBondContact O-CG1 3.34Å; E106-I109 PolarHBondContact O-N 3.19Å; E106-I109 WeakPolarHBondContact OE1-CD1 3.4Å
107	E	73.9	Confident	79.1	Confident	125 Å²	125	69.9 Å²	69.9	58%	0.584	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-64.4	-32.4	172.7	60.4	-165.5	-170.1	0	0	113.9	K105 I109 Q110	K105-E107 HydrophobicContact CB-CG 3.64Å; K105-E107 HydrophobicContact CD-CG 4.4Å; K105-E107 WeakPolarHBondContact CD-OE1 3.34Å; K105-E107 PolarHBondContact O-N 2.8Å; E107-I109 PolarHBondContact O-N 3.11Å; E107-Q110 PolarHBondContact O-N 3.23Å
108	D	80.9	Confident	80.9	Confident	8 Å²	8	66.6 Å²	66.6	4%	0.043	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-68.3	-17.8	177.1	-65.2	-48.4	0	0	0	112.2	F104 K105 E106 Q110 L111 I298	F104-D108 HydrophobicContact CB-CB 3.86Å; F104-D108 WeakPolarHBondContact CB-OD2 3.44Å; F104-D108 HydrophobicContact CD2-CB 4.08Å; F104-D108 HydrophobicContact CG-CB 4.3Å; K105-D108 PolarHBondContact N-OD2 3.37Å; K105-D108 WeakPolarHBondContact O-CA 3.34Å; K105-D108 VanDerWaalsContact O-CB 3.28Å; K105-D108 WeakPolarHBondContact O-CB 3.3Å; K105-D108 PolarHBondContact O-N 2.99Å; E106-D108 VanDerWaalsContact C-N 3.35Å; E106-D108 PolarHBondContact O-N 2.84Å; D108-Q110 PolarHBondContact O-N 3.04Å; D108-Q110 VanDerWaalsContact O-N 3.1Å; D108-L111 HydrophobicContact CB-CD1 3.91Å; D108-L111 HydrophobicContact CB-CG 4.48Å; D108-L111 WeakPolarHBondContact O-CB 3.39Å; D108-L111 WeakPolarHBondContact O-CD1 3.5Å; D108-L111 WeakPolarHBondContact O-CG 3.49Å; D108-L111 PolarHBondContact O-N 2.96Å; D108-I298 HydrophobicContact CB-CD1 4.35Å
109	I	80	Confident	82.5	Confident	32 Å²	32	67.4 Å²	67.4	16%	0.164	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-57.9	-27.9	175.3	-64.5	176	0	0	0	110.8	F104 E106 E107 L111 C112 P301	F104-I109 HydrophobicContact CD2-CG1 4.24Å; F104-I109 HydrophobicContact CE2-CD1 4.21Å; F104-I109 HydrophobicContact CE2-CG1 3.53Å; F104-I109 HydrophobicContact CZ-CG1 4.41Å; E106-I109 HydrophobicContact CG-CD1 4.08Å; E106-I109 VanDerWaalsContact O-CB 3.3Å; E106-I109 WeakPolarHBondContact O-CB 3.15Å; E106-I109 WeakPolarHBondContact O-CG1 3.34Å; E106-I109 PolarHBondContact O-N 3.19Å; E106-I109 WeakPolarHBondContact OE1-CD1 3.4Å; E107-I109 PolarHBondContact O-N 3.11Å; I109-L111 PolarHBondContact O-N 2.84Å; I109-C112 PolarHBondContact O-N 2.74Å; I109-C112 PolarHBondContact O-SG 3.21Å; I109-P301 HydrophobicContact CG2-CG 4.25Å
110	Q	87.7	Confident	84.3	Confident	118 Å²	118	65.8 Å²	65.8	55%	0.551	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-67.3	-14.6	176.2	-59.5	-56.3	-34.4	0	0	113.4	E107 D108 C112 N113 V114	E107-Q110 PolarHBondContact O-N 3.23Å; D108-Q110 PolarHBondContact O-N 3.04Å; D108-Q110 VanDerWaalsContact O-N 3.1Å; Q110-C112 PolarHBondContact O-N 3.28Å; Q110-N113 WeakPolarHBondContact O-CB 3.33Å; Q110-N113 PolarHBondContact O-N 3.4Å; Q110-N113 PolarHBondContact OE1-ND2 3.33Å; Q110-N113 VanDerWaalsContact OE1-ND2 3.16Å; Q110-V114 PolarHBondContact O-N 3.18Å
111	L	91.3	Very high	85.7	Confident	21 Å²	21	62.1 Å²	62.1	11%	0.11	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-60.2	-26.3	177	-66.7	172.1	0	0	0	112.4	D108 I109 N113 V114 N117 V259 F261 I298	D108-L111 HydrophobicContact CB-CD1 3.91Å; D108-L111 HydrophobicContact CB-CG 4.48Å; D108-L111 WeakPolarHBondContact O-CB 3.39Å; D108-L111 WeakPolarHBondContact O-CD1 3.5Å; D108-L111 WeakPolarHBondContact O-CG 3.49Å; D108-L111 PolarHBondContact O-N 2.96Å; I109-L111 PolarHBondContact O-N 2.84Å; L111-N113 PolarHBondContact O-N 2.96Å; L111-V114 HydrophobicContact CD2-CG2 4.41Å; L111-V114 PolarHBondContact O-N 3.23Å; L111-N117 PolarHBondContact O-ND2 3.32Å; L111-V259 HydrophobicContact CB-CG1 4.23Å; L111-V259 HydrophobicContact CD1-CG1 3.96Å; L111-V259 HydrophobicContact CD2-CG1 4.4Å; L111-V259 HydrophobicContact CG-CG1 4.44Å; L111-F261 HydrophobicContact CD1-CD1 3.6Å; L111-F261 HydrophobicContact CD1-CE1 3.68Å; L111-F261 HydrophobicContact CD1-CG 4.11Å; L111-F261 HydrophobicContact CD1-CZ 4.24Å; L111-I298 HydrophobicContact CB-CG1 4.27Å; L111-I298 HydrophobicContact CD1-CG1 4.4Å
112	C	92	Very high	87.1	Confident	24 Å²	24	63 Å²	63	16%	0.162	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-69.4	-20.4	175.1	73.4	0	0	0	0	113.3	I109 Q110 I298 M299	I109-C112 PolarHBondContact O-N 2.74Å; I109-C112 PolarHBondContact O-SG 3.21Å; Q110-C112 PolarHBondContact O-N 3.28Å; C112-I298 WeakPolarHBondContact CB-O 3.36Å; C112-M299 HydrophobicContact CB-CE 4.37Å; C112-M299 HydrophobicContact CB-SD 4.35Å
113	N	93.4	Very high	88.6	Confident	103 Å²	103	67.6 Å²	67.6	55%	0.551	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-97.7	-5.3	-179.3	-60.9	-39.9	0	0	0	113.1	Q110 L111 A115	Q110-N113 WeakPolarHBondContact O-CB 3.33Å; Q110-N113 PolarHBondContact O-N 3.4Å; Q110-N113 PolarHBondContact OE1-ND2 3.33Å; Q110-N113 VanDerWaalsContact OE1-ND2 3.16Å; L111-N113 PolarHBondContact O-N 2.96Å; N113-A115 PolarHBondContact O-N 3.13Å
114	V	95.3	Very high	89.8	Confident	57 Å²	57	67.4 Å²	67.4	35%	0.345	34%	0.337	S	S	.	.			trans	-69	123.9	179.1	173.2	0	0	0	0	109.8	Q110 L111 E116 N117 I118	Q110-V114 PolarHBondContact O-N 3.18Å; L111-V114 HydrophobicContact CD2-CG2 4.41Å; L111-V114 PolarHBondContact O-N 3.23Å; V114-E116 VanDerWaalsContact C-N 3.25Å; V114-E116 HydrophobicContact CG1-CB 4.12Å; V114-E116 PolarHBondContact O-N 3.06Å; V114-E116 VanDerWaalsContact O-N 3.17Å; V114-N117 HydrophobicContact CB-CB 4.32Å; V114-N117 WeakPolarHBondContact O-CA 3.44Å; V114-N117 WeakPolarHBondContact O-CB 3.33Å; V114-N117 PolarHBondContact O-N 3.47Å; V114-I118 WeakPolarHBondContact O-CG1 3.47Å; V114-I118 PolarHBondContact O-N 3.25Å
115	A	96.3	Very high	91	Very high	78 Å²	78	67.2 Å²	67.2	65%	0.645	34%	0.337	S	S	*	.	H	α-helix	trans	-54.4	-38.5	-176	0	0	0	0	0	113.6	N113 N117 I118 E119	N113-A115 PolarHBondContact O-N 3.13Å; A115-N117 PolarHBondContact O-N 3.19Å; A115-I118 PolarHBondContact O-N 3.33Å; A115-E119 PolarHBondContact O-N 3.44Å
116	E	96.8	Very high	92.1	Very high	120 Å²	120	71.4 Å²	71.4	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-61.1	-43.9	175.1	-171.6	-167.1	147.9	0	0	111.9	V114 E119 K120	V114-E116 VanDerWaalsContact C-N 3.25Å; V114-E116 HydrophobicContact CG1-CB 4.12Å; V114-E116 PolarHBondContact O-N 3.06Å; V114-E116 VanDerWaalsContact O-N 3.17Å; E116-E119 PolarHBondContact O-N 3.21Å; E116-K120 WeakPolarHBondContact O-CG 3.35Å; E116-K120 PolarHBondContact O-N 3.44Å; E116-K120 WeakPolarHBondContact OE1-CE 2.88Å; E116-K120 IonicContact OE1-NZ 3.89Å; E116-K120 PolarHBondContact OE1-NZ 2.93Å
117	N	97.3	Very high	93.1	Very high	5 Å²	5	67.8 Å²	67.8	3%	0.027	35%	0.351	C	S	.	.	H	α-helix	trans	-68.9	-39.3	179.5	-65.1	-21.8	0	0	0	110.9	L111 V114 A115 E119 K120 V121 M299	L111-N117 PolarHBondContact O-ND2 3.32Å; V114-N117 HydrophobicContact CB-CB 4.32Å; V114-N117 WeakPolarHBondContact O-CA 3.44Å; V114-N117 WeakPolarHBondContact O-CB 3.33Å; V114-N117 PolarHBondContact O-N 3.47Å; A115-N117 PolarHBondContact O-N 3.19Å; N117-E119 VanDerWaalsContact C-N 3.34Å; N117-E119 PolarHBondContact O-N 3.49Å; N117-K120 WeakPolarHBondContact O-CB 3.42Å; N117-K120 PolarHBondContact O-N 3.17Å; N117-V121 WeakPolarHBondContact O-CG2 3.23Å; N117-V121 PolarHBondContact O-N 3.08Å; N117-M299 HydrophobicContact CB-CE 3.81Å; N117-M299 HydrophobicContact CB-SD 4.04Å
118	I	97.6	Very high	94	Very high	87 Å²	87	62.2 Å²	62.2	45%	0.446	32%	0.324	S	S	.	.	H	α-helix	trans	-59.2	-45	173.9	-64.8	169.7	0	0	0	110.8	V114 A115 V121 A122	V114-I118 WeakPolarHBondContact O-CG1 3.47Å; V114-I118 PolarHBondContact O-N 3.25Å; A115-I118 PolarHBondContact O-N 3.33Å; I118-V121 WeakPolarHBondContact O-CB 3.46Å; I118-V121 PolarHBondContact O-N 3.1Å; I118-A122 PolarHBondContact O-N 3.01Å
119	E	97.9	Very high	94.4	Very high	96 Å²	96	69.1 Å²	69.1	45%	0.449	36%	0.356	S	S	.	.	H	α-helix	trans	-67.5	-37.3	178.1	179.9	55.6	-149.5	0	0	112.1	A115 E116 N117 A122 R123	A115-E119 PolarHBondContact O-N 3.44Å; E116-E119 PolarHBondContact O-N 3.21Å; N117-E119 VanDerWaalsContact C-N 3.34Å; N117-E119 PolarHBondContact O-N 3.49Å; E119-A122 PolarHBondContact O-N 2.84Å; E119-R123 WeakPolarHBondContact O-CB 3.47Å; E119-R123 PolarHBondContact O-N 3.39Å; E119-R123 IonicContact OE1-NH2 3.35Å
120	K	98.2	Very high	94.8	Very high	43 Å²	43	70 Å²	70	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-59.8	-44.7	171.6	-74	171.8	-175.8	164.2	0	111.5	E116 N117 R123 R124 I257 S258	E116-K120 WeakPolarHBondContact O-CG 3.35Å; E116-K120 PolarHBondContact O-N 3.44Å; E116-K120 WeakPolarHBondContact OE1-CE 2.88Å; E116-K120 IonicContact OE1-NZ 3.89Å; E116-K120 PolarHBondContact OE1-NZ 2.93Å; N117-K120 WeakPolarHBondContact O-CB 3.42Å; N117-K120 PolarHBondContact O-N 3.17Å; K120-R123 PolarHBondContact O-N 2.88Å; K120-R124 WeakPolarHBondContact O-CB 3.41Å; K120-R124 PolarHBondContact O-N 3.24Å; K120-I257 HydrophobicContact CB-CB 4.36Å; K120-I257 HydrophobicContact CB-CD1 4.01Å; K120-I257 HydrophobicContact CB-CG2 4.38Å; K120-S258 VanDerWaalsContact CD-O 3.32Å; K120-S258 WeakPolarHBondContact CD-O 3.45Å; K120-S258 WeakPolarHBondContact CE-O 3.47Å; K120-S258 PolarHBondContact NZ-O 3.43Å
121	V	97.8	Very high	95	Very high	15 Å²	15	65.9 Å²	65.9	9%	0.091	34%	0.343	C	S	.	.	H	α-helix	trans	-59.6	-50.8	174.2	174	0	0	0	0	110.1	N117 I118 R123 R124 C125 I257 P271 A273 M299	N117-V121 WeakPolarHBondContact O-CG2 3.23Å; N117-V121 PolarHBondContact O-N 3.08Å; I118-V121 WeakPolarHBondContact O-CB 3.46Å; I118-V121 PolarHBondContact O-N 3.1Å; V121-R123 VanDerWaalsContact C-N 3.32Å; V121-R123 PolarHBondContact O-N 2.93Å; V121-R124 PolarHBondContact O-N 3.39Å; V121-C125 PolarHBondContact O-N 2.83Å; V121-C125 PolarHBondContact O-SG 3.3Å; V121-I257 HydrophobicContact CG2-CD1 3.49Å; V121-I257 VanDerWaalsContact CG2-CD1 3.49Å; V121-P271 HydrophobicContact CG1-CB 4.34Å; V121-P271 HydrophobicContact CG2-CB 3.7Å; V121-P271 HydrophobicContact CG2-CG 4.29Å; V121-A273 HydrophobicContact CG1-CB 3.64Å; V121-M299 HydrophobicContact CG2-CE 3.8Å
122	A	97.5	Very high	95	Very high	32 Å²	32	68.2 Å²	68.2	26%	0.264	35%	0.352	S	S	.	.	H	α-helix	trans	-58	-43	-179.3	0	0	0	0	0	112.4	I118 E119 C125 K126	I118-A122 PolarHBondContact O-N 3.01Å; E119-A122 PolarHBondContact O-N 2.84Å; A122-C125 PolarHBondContact O-N 3.08Å; A122-K126 WeakPolarHBondContact O-CG 3.32Å; A122-K126 PolarHBondContact O-N 3.17Å
123	R	97.6	Very high	94.9	Very high	141 Å²	141	68.8 Å²	68.8	53%	0.532	35%	0.354	S	S	.	.	H	α-helix	trans	-62.5	-42.9	174.4	-168.6	-176.7	-53.8	110.3	9.2	111.5	E119 K120 V121 K126 A127	E119-R123 WeakPolarHBondContact O-CB 3.47Å; E119-R123 PolarHBondContact O-N 3.39Å; E119-R123 IonicContact OE1-NH2 3.35Å; K120-R123 PolarHBondContact O-N 2.88Å; V121-R123 VanDerWaalsContact C-N 3.32Å; V121-R123 PolarHBondContact O-N 2.93Å; R123-K126 PolarHBondContact O-N 3.33Å; R123-A127 PolarHBondContact O-N 3.19Å
124	R	97.2	Very high	94.7	Very high	62 Å²	62	64.8 Å²	64.8	23%	0.234	33%	0.334	C	S	.	.	H	α-helix	trans	-66.5	-42.1	178.3	-173.1	56.3	56.4	70.6	-5.2	112.2	K120 V121 K126 A127 Y128 S254 D255 M256 I257 V274	K120-R124 WeakPolarHBondContact O-CB 3.41Å; K120-R124 PolarHBondContact O-N 3.24Å; V121-R124 PolarHBondContact O-N 3.39Å; R124-K126 PolarHBondContact O-N 3.04Å; R124-A127 PolarHBondContact O-N 3.34Å; R124-A127 VanDerWaalsContact O-N 3.08Å; R124-Y128 WeakPolarHBondContact O-CB 3.25Å; R124-Y128 PolarHBondContact O-N 2.96Å; R124-S254 PolarHBondContact NH1-O 3.36Å; R124-D255 PolarHBondContact NH1-O 2.85Å; R124-M256 VanDerWaalsContact CZ-O 3.26Å; R124-M256 PolarHBondContact NH1-O 3.25Å; R124-M256 PolarHBondContact NH2-O 3.46Å; R124-I257 HydrophobicContact CB-CG2 3.98Å; R124-I257 HydrophobicContact CG-CG2 4.37Å; R124-V274 HydrophobicContact CB-CG2 4.07Å; R124-V274 HydrophobicContact CG-CG2 3.6Å
125	C	96.3	Very high	94.5	Very high	10 Å²	10	68.9 Å²	68.9	7%	0.068	35%	0.349	C	S	.	.	H	α-helix	trans	-57.9	-34.6	176.6	-62.5	0	0	0	0	112.4	V121 A122 A273 N277 N278	V121-C125 PolarHBondContact O-N 2.83Å; V121-C125 PolarHBondContact O-SG 3.3Å; A122-C125 PolarHBondContact O-N 3.08Å; C125-A273 PolarHBondContact SG-O 3.48Å; C125-A273 VanDerWaalsContact SG-O 3.39Å; C125-N277 HydrophobicContact CB-CB 4.09Å; C125-N277 WeakPolarHBondContact CB-ND2 3.45Å; C125-N277 PolarHBondContact SG-ND2 3.23Å; C125-N278 PolarHBondContact O-ND2 2.78Å
126	K	95.8	Very high	94.4	Very high	177 Å²	177	67.3 Å²	67.3	77%	0.77	33%	0.328	S	S	*	.	H	α-helix	trans	-72.1	-35.5	175.7	-69.5	172.2	-177.1	173	0	113.3	A122 R123 R124	A122-K126 WeakPolarHBondContact O-CG 3.32Å; A122-K126 PolarHBondContact O-N 3.17Å; R123-K126 PolarHBondContact O-N 3.33Å; R124-K126 PolarHBondContact O-N 3.04Å
127	A	94.6	Very high	94.4	Very high	70 Å²	70	63.7 Å²	63.7	58%	0.579	31%	0.309	S	S	*	.	H	α-helix	trans	-84.8	-17.7	-179.3	0	0	0	0	0	113.2	R123 R124 H129	R123-A127 PolarHBondContact O-N 3.19Å; R124-A127 PolarHBondContact O-N 3.34Å; R124-A127 VanDerWaalsContact O-N 3.08Å; A127-H129 PolarHBondContact O-N 3.46Å
128	Y	92.9	Very high	94.4	Very high	7 Å²	7	71.4 Å²	71.4	3%	0.027	35%	0.35	C	S	.	.			trans	-61.3	129.2	-175.4	179.1	-117	0	0	0	111.9	R124 P130 L249 L251 D255 V274 N278	R124-Y128 WeakPolarHBondContact O-CB 3.25Å; R124-Y128 PolarHBondContact O-N 2.96Å; Y128-P130 HydrophobicContact CD1-CG 4.04Å; Y128-P130 HydrophobicContact CE1-CB 4.06Å; Y128-P130 HydrophobicContact CE1-CG 3.67Å; Y128-L249 WeakPolarHBondContact OH-CD1 3.5Å; Y128-L249 WeakPolarHBondContact OH-CD2 3.48Å; Y128-L251 HydrophobicContact CE2-CD2 3.7Å; Y128-L251 HydrophobicContact CE2-CG 4.11Å; Y128-D255 WeakPolarHBondContact CD2-OD1 3.42Å; Y128-V274 HydrophobicContact CD1-CG1 3.88Å; Y128-V274 WeakPolarHBondContact CD1-O 3.31Å; Y128-V274 HydrophobicContact CD2-CG1 3.33Å; Y128-V274 HydrophobicContact CE1-CG1 4.23Å; Y128-V274 HydrophobicContact CE2-CG1 3.78Å; Y128-V274 HydrophobicContact CG-CG1 3.38Å; Y128-N278 HydrophobicContact CD1-CB 4.05Å; Y128-N278 WeakPolarHBondContact CD1-ND2 3.15Å; Y128-N278 HydrophobicContact CE1-CB 4.2Å
129	H	89.6	Confident	94.3	Very high	153 Å²	153	70.6 Å²	70.6	71%	0.708	36%	0.364	S	S	*	.			trans	-114.1	111.4	169.9	-105.4	65	0	0	0	109	A127 R131	A127-H129 PolarHBondContact O-N 3.46Å; H129-R131 PolarHBondContact O-N 2.89Å
130	P	86.8	Confident	94.3	Very high	52 Å²	52	67.8 Å²	67.8	34%	0.338	35%	0.35	S	S	.	.			trans	-58.3	124	-179.9	-23.9	31.5	0	0	0	112.5	Y128 K132 L249 N278	Y128-P130 HydrophobicContact CD1-CG 4.04Å; Y128-P130 HydrophobicContact CE1-CB 4.06Å; Y128-P130 HydrophobicContact CE1-CG 3.67Å; P130-K132 PolarHBondContact O-N 3.45Å; P130-L249 HydrophobicContact CB-CD1 4.26Å; P130-N278 HydrophobicContact CG-CB 4.34Å
131	R	92.9	Very high	94.4	Very high	31 Å²	31	66.9 Å²	66.9	12%	0.117	35%	0.346	C	S	.	.			trans	-99.9	75.3	176.3	-77.7	-179.1	-54.5	-98.7	16.5	109.6	H129 F211 I250 D252 D255	H129-R131 PolarHBondContact O-N 2.89Å; R131-F211 HydrophobicContact CB-CE1 4.22Å; R131-F211 HydrophobicContact CB-CZ 3.56Å; R131-F211 HydrophobicContact CG-CE1 4.16Å; R131-F211 HydrophobicContact CG-CZ 3.74Å; R131-I250 VanDerWaalsContact CB-O 3.3Å; R131-I250 WeakPolarHBondContact CB-O 3.43Å; R131-I250 PolarHBondContact NE-O 3.41Å; R131-I250 PolarHBondContact O-N 3.31Å; R131-D252 VanDerWaalsContact NH2-N 3.13Å; R131-D252 IonicContact NH2-OD1 2.78Å; R131-D252 PolarHBondContact NH2-OD1 3.18Å; R131-D255 IonicContact CZ-OD2 2.62Å; R131-D255 IonicContact NH1-OD1 3.99Å; R131-D255 IonicContact NH1-OD2 3.26Å; R131-D255 IonicContact NH2-OD1 3.63Å; R131-D255 IonicContact NH2-OD2 3.84Å; R131-D255 PolarHBondContact NH2-OD2 2.9Å
132	K	91	Very high	94.4	Very high	69 Å²	69	66.2 Å²	66.2	30%	0.3	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-80.4	133.8	-175.2	-171.3	178.4	-177.3	-171.1	0	111	P130 C134 E135 F136 A248	P130-K132 PolarHBondContact O-N 3.45Å; K132-C134 WeakPolarHBondContact CE-O 3.44Å; K132-C134 WeakPolarHBondContact CG-O 3.2Å; K132-E135 VanDerWaalsContact CE-CA 3.48Å; K132-E135 WeakPolarHBondContact CE-OE1 3.41Å; K132-E135 IonicContact NZ-OE1 2.73Å; K132-E135 PolarHBondContact NZ-OE1 3.44Å; K132-E135 IonicContact NZ-OE2 2.68Å; K132-E135 PolarHBondContact NZ-OE2 3.2Å; K132-F136 HydrophobicContact CD-CE1 4.16Å; K132-F136 HydrophobicContact CD-CE2 4.38Å; K132-F136 HydrophobicContact CD-CZ 3.95Å; K132-F136 HydrophobicContact CG-CE1 4.02Å; K132-F136 HydrophobicContact CG-CZ 4.14Å; K132-A248 WeakPolarHBondContact CA-O 3.37Å
133	L	89.4	Confident	94.5	Very high	36 Å²	36	64.7 Å²	64.7	19%	0.188	33%	0.329	C	S	.	.	S	Bend	trans	-104.3	-28.2	176.3	-74.9	-168	0	0	0	113.3	I203 V207 F211 I247 A248 I250	L133-I203 HydrophobicContact CD1-CG2 4.03Å; L133-V207 HydrophobicContact CD2-CG1 4.02Å; L133-F211 HydrophobicContact CD2-CD2 3.44Å; L133-F211 VanDerWaalsContact CD2-CD2 3.44Å; L133-F211 HydrophobicContact CD2-CE2 3.71Å; L133-F211 HydrophobicContact CD2-CG 4.31Å; L133-I247 VanDerWaalsContact CB-O 3.26Å; L133-I247 WeakPolarHBondContact CB-O 3.5Å; L133-I247 HydrophobicContact CD1-CB 4.18Å; L133-I247 HydrophobicContact CD1-CG2 4.19Å; L133-A248 PolarHBondContact N-O 3.26Å; L133-I250 HydrophobicContact CD1-CD1 3.36Å; L133-I250 HydrophobicContact CD1-CG1 3.91Å; L133-I250 HydrophobicContact CD2-CD1 4.49Å; L133-I250 HydrophobicContact CG-CD1 3.97Å; L133-I250 HydrophobicContact CG-CG1 4.21Å
134	C	89.3	Confident	94.5	Very high	19 Å²	19	58 Å²	58	13%	0.128	30%	0.304	C	S	.	.	S	Bend	trans	-147.5	163.2	172.8	72.3	0	0	0	0	111.4	K132	K132-C134 WeakPolarHBondContact CE-O 3.44Å; K132-C134 WeakPolarHBondContact CG-O 3.2Å
135	E	91.8	Very high	94.6	Very high	143 Å²	143	55 Å²	55	67%	0.668	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-58.1	142.1	171.7	-68.3	-55.5	120.5	0	0	112	K132	K132-E135 VanDerWaalsContact CE-CA 3.48Å; K132-E135 WeakPolarHBondContact CE-OE1 3.41Å; K132-E135 IonicContact NZ-OE1 2.73Å; K132-E135 PolarHBondContact NZ-OE1 3.44Å; K132-E135 IonicContact NZ-OE2 2.68Å; K132-E135 PolarHBondContact NZ-OE2 3.2Å
136	F	95.1	Very high	94.7	Very high	46 Å²	46	54.9 Å²	54.9	20%	0.202	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-76.3	146.9	176.9	-52.2	-39.1	0	0	0	109.4	K132 D181 A248 H279 W282	K132-F136 HydrophobicContact CD-CE1 4.16Å; K132-F136 HydrophobicContact CD-CE2 4.38Å; K132-F136 HydrophobicContact CD-CZ 3.95Å; K132-F136 HydrophobicContact CG-CE1 4.02Å; K132-F136 HydrophobicContact CG-CZ 4.14Å; F136-D181 WeakPolarHBondContact CA-OD2 3.38Å; F136-A248 HydrophobicContact CD1-CB 4.07Å; F136-A248 HydrophobicContact CE1-CB 4.14Å; F136-H279 AromaticContact CE2-CE1 3.48Å; F136-H279 VanDerWaalsContact CE2-CE1 3.48Å; F136-H279 WeakPolarHBondContact CE2-CE1 3.32Å; F136-H279 AromaticContact CE2-CG 3.83Å; F136-H279 AromaticContact CE2-ND1 3.44Å; F136-H279 WeakPolarHBondContact CE2-ND1 3.36Å; F136-H279 AromaticContact CE2-NE2 3.88Å; F136-H279 AromaticContact CZ-CD2 3.95Å; F136-H279 AromaticContact CZ-CE1 3.7Å; F136-H279 AromaticContact CZ-NE2 3.64Å; F136-W282 HydrophobicContact CB-CH2 4.29Å; F136-W282 HydrophobicContact CB-CZ2 4.39Å; F136-W282 AromaticContact CD1-CH2 3.52Å; F136-W282 HydrophobicContact CD1-CH2 3.52Å; F136-W282 HydrophobicContact CD1-CZ2 4.32Å; F136-W282 HydrophobicContact CD1-CZ3 4.37Å; F136-W282 HydrophobicContact CD2-CH2 4.09Å; F136-W282 AromaticContact CE1-CH2 3.74Å; F136-W282 HydrophobicContact CE1-CH2 3.74Å; F136-W282 HydrophobicContact CE1-CZ3 4.19Å; F136-W282 HydrophobicContact CE2-CH2 4.29Å; F136-W282 HydrophobicContact CE2-CZ3 4.34Å; F136-W282 AromaticContact CG-CH2 3.7Å; F136-W282 HydrophobicContact CG-CH2 3.7Å; F136-W282 HydrophobicContact CG-CZ2 4.28Å; F136-W282 HydrophobicContact CZ-CH2 4.12Å; F136-W282 HydrophobicContact CZ-CZ3 4.17Å
137	R	96.4	Very high	94.8	Very high	43 Å²	43	46.5 Å²	46.5	16%	0.162	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-100.3	132	-178.4	-66.9	176.5	-61.8	148.7	8.8	109.6	K140 Y177 Y180 D181	R137-K140 HydrophobicContact CB-CB 4.33Å; R137-K140 HydrophobicContact CB-CG 3.47Å; R137-K140 VanDerWaalsContact CB-CG 3.47Å; R137-K140 WeakPolarHBondContact O-CB 3.42Å; R137-K140 PolarHBondContact O-N 3.03Å; R137-Y177 VanDerWaalsContact CZ-CE2 3.42Å; R137-Y177 VanDerWaalsContact CZ-CZ 3.46Å; R137-Y177 PolarHBondContact NH1-O 3.17Å; R137-Y177 PolarHBondContact NH2-O 3.38Å; R137-Y180 PolarHBondContact NH2-O 3.15Å; R137-D181 IonicContact CZ-OD1 2.74Å; R137-D181 VanDerWaalsContact CZ-OD1 3.26Å; R137-D181 PolarHBondContact N-OD2 3.39Å; R137-D181 IonicContact NE-OD1 3.61Å; R137-D181 PolarHBondContact NE-OD1 2.6Å; R137-D181 IonicContact NH2-OD1 3.11Å; R137-D181 PolarHBondContact NH2-OD1 2.95Å
138	D	96.2	Very high	94.9	Very high	167 Å²	167	44.1 Å²	44.1	89%	0.893	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	143.1	-176.9	-163.4	25.7	0	0	0	111.5	K140	D138-K140 PolarHBondContact O-N 2.8Å
139	G	96.5	Very high	95	Very high	71 Å²	71	44.3 Å²	44.3	73%	0.732	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.5	-1.8	-177.2	0	0	0	0	0	116.5
140	K	98.1	Very high	95.4	Very high	36 Å²	36	37 Å²	37	16%	0.157	20%	0.2	C	C	.	.			trans	-78.2	139	179.1	-58.4	-54.6	178.4	-175.6	0	111.9	R137 D138 V178 W282	R137-K140 HydrophobicContact CB-CB 4.33Å; R137-K140 HydrophobicContact CB-CG 3.47Å; R137-K140 VanDerWaalsContact CB-CG 3.47Å; R137-K140 WeakPolarHBondContact O-CB 3.42Å; R137-K140 PolarHBondContact O-N 3.03Å; D138-K140 PolarHBondContact O-N 2.8Å; K140-V178 PolarHBondContact NZ-O 3.25Å; K140-W282 PolarHBondContact O-NE1 2.98Å
141	K	98.7	Very high	95.9	Very high	24 Å²	24	34.6 Å²	34.6	10%	0.104	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	173.1	173.8	-58.8	-169.2	-173.6	-99.7	0	109.8	Y179 Y180 D181 N286 A334 E337 F340	K141-Y179 PolarHBondContact N-O 3.2Å; K141-Y180 HydrophobicContact CB-CD1 3.49Å; K141-Y180 VanDerWaalsContact CB-CD1 3.49Å; K141-Y180 HydrophobicContact CB-CE1 3.55Å; K141-Y180 HydrophobicContact CB-CG 4.29Å; K141-Y180 HydrophobicContact CD-CE1 4.34Å; K141-Y180 CarbonylContact O-C 3.5Å; K141-Y180 WeakPolarHBondContact O-CA 3.27Å; K141-D181 PolarHBondContact O-N 2.95Å; K141-N286 HydrophobicContact CB-CB 4.41Å; K141-N286 WeakPolarHBondContact CB-O 3.41Å; K141-N286 HydrophobicContact CD-CB 4.48Å; K141-N286 HydrophobicContact CG-CB 4.15Å; K141-A334 HydrophobicContact CD-CB 4.24Å; K141-A334 VanDerWaalsContact CE-O 3.23Å; K141-A334 WeakPolarHBondContact CE-O 3.4Å; K141-E337 PolarHBondContact NZ-O 2.89Å; K141-F340 HydrophobicContact CD-CE1 3.86Å; K141-F340 HydrophobicContact CD-CE2 4.04Å; K141-F340 HydrophobicContact CD-CZ 3.3Å
142	L	98.8	Very high	96.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.9	179.7	-177.3	65.1	0	0	0	111.6	V144 A183 I275 W282 N286 T287 I288	L142-V144 HydrophobicContact CD2-CG2 4Å; L142-V144 HydrophobicContact CG-CG2 4.02Å; L142-A183 HydrophobicContact CD1-CB 4.04Å; L142-I275 HydrophobicContact CD2-CD1 4.38Å; L142-I275 HydrophobicContact CD2-CG2 3.8Å; L142-W282 HydrophobicContact CB-CB 4.24Å; L142-W282 HydrophobicContact CB-CD2 3.87Å; L142-W282 HydrophobicContact CB-CG 3.69Å; L142-W282 HydrophobicContact CD1-CD2 4.14Å; L142-W282 HydrophobicContact CD1-CE3 4.12Å; L142-W282 HydrophobicContact CD1-CH2 4.17Å; L142-W282 HydrophobicContact CD1-CZ2 4.23Å; L142-W282 HydrophobicContact CD1-CZ3 4.13Å; L142-W282 HydrophobicContact CD2-CB 4.15Å; L142-W282 HydrophobicContact CD2-CD2 3.94Å; L142-W282 HydrophobicContact CD2-CE3 3.85Å; L142-W282 HydrophobicContact CD2-CG 4.1Å; L142-W282 HydrophobicContact CG-CD2 4.19Å; L142-W282 HydrophobicContact CG-CE3 4.39Å; L142-W282 HydrophobicContact CG-CG 4.4Å; L142-N286 PolarHBondContact N-O 3.24Å; L142-T287 HydrophobicContact CB-CG2 4.11Å; L142-T287 HydrophobicContact CD2-CG2 3.79Å; L142-T287 HydrophobicContact CG-CG2 4.07Å; L142-T287 WeakPolarHBondContact O-CA 3.49Å; L142-I288 PolarHBondContact O-N 2.69Å
143	L	98.9	Very high	96.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	120.3	169	173.8	64.2	0	0	0	108.7	L145 F172 A176 Y180 D181 I182 A183 I288 F290 L330	L143-L145 HydrophobicContact CD1-CD2 3.86Å; L143-L145 HydrophobicContact CD1-CG 4.46Å; L143-L145 HydrophobicContact CD2-CD1 4.22Å; L143-L145 HydrophobicContact CD2-CD2 4.05Å; L143-L145 HydrophobicContact CD2-CG 4.18Å; L143-L145 HydrophobicContact CG-CD2 3.92Å; L143-L145 HydrophobicContact CG-CG 4.01Å; L143-F172 HydrophobicContact CD2-CE1 3.97Å; L143-F172 HydrophobicContact CD2-CZ 3.97Å; L143-A176 HydrophobicContact CD2-CB 3.77Å; L143-Y180 HydrophobicContact CB-CD1 3.9Å; L143-Y180 HydrophobicContact CB-CG 3.97Å; L143-D181 PolarHBondContact N-O 3.01Å; L143-I182 CarbonylContact O-C 3.55Å; L143-I182 WeakPolarHBondContact O-CA 3.41Å; L143-A183 PolarHBondContact O-N 3.28Å; L143-I288 WeakPolarHBondContact CA-O 3.36Å; L143-I288 HydrophobicContact CD1-CG2 3.9Å; L143-F290 HydrophobicContact CD1-CD2 4.43Å; L143-F290 HydrophobicContact CD1-CG 4.45Å; L143-L330 HydrophobicContact CD1-CD1 4.05Å; L143-L330 HydrophobicContact CD1-CD2 4.38Å; L143-L330 HydrophobicContact CD2-CD1 3.86Å
144	V	98.9	Very high	96.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	126.1	175	180	0	0	0	0	108.3	L142 A183 W185 L272 I275 T287 I288 M289 F290	L142-V144 HydrophobicContact CD2-CG2 4Å; L142-V144 HydrophobicContact CG-CG2 4.02Å; V144-A183 CarbonylContact C-O 3.56Å; V144-A183 WeakPolarHBondContact CA-O 3.42Å; V144-A183 HydrophobicContact CG2-CB 4.06Å; V144-W185 HydrophobicContact CG1-CB 3.86Å; V144-W185 HydrophobicContact CG1-CE3 4.32Å; V144-L272 HydrophobicContact CB-CD2 4.32Å; V144-L272 HydrophobicContact CG1-CD2 4.36Å; V144-L272 HydrophobicContact CG2-CD2 3.79Å; V144-I275 HydrophobicContact CG2-CD1 4.02Å; V144-T287 HydrophobicContact CG2-CG2 4.29Å; V144-I288 PolarHBondContact N-O 2.94Å; V144-M289 HydrophobicContact CB-CB 3.98Å; V144-M289 HydrophobicContact CB-CG 3.95Å; V144-M289 HydrophobicContact CG1-CB 4.47Å; V144-M289 HydrophobicContact CG1-CG 3.91Å; V144-M289 HydrophobicContact CG1-SD 4.21Å; V144-M289 CarbonylContact O-C 3.6Å; V144-M289 VanDerWaalsContact O-CA 3.27Å; V144-M289 WeakPolarHBondContact O-CA 3.31Å; V144-F290 PolarHBondContact O-N 3.29Å
145	L	98.8	Very high	96.5	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.4	179.7	-60.3	173.9	0	0	0	110.6	L143 F172 L173 I182 A183 I184 W185 F290	L143-L145 HydrophobicContact CD1-CD2 3.86Å; L143-L145 HydrophobicContact CD1-CG 4.46Å; L143-L145 HydrophobicContact CD2-CD1 4.22Å; L143-L145 HydrophobicContact CD2-CD2 4.05Å; L143-L145 HydrophobicContact CD2-CG 4.18Å; L143-L145 HydrophobicContact CG-CD2 3.92Å; L143-L145 HydrophobicContact CG-CG 4.01Å; L145-F172 HydrophobicContact CD1-CE1 3.89Å; L145-F172 HydrophobicContact CD2-CE1 3.99Å; L145-F172 HydrophobicContact CD2-CZ 4.21Å; L145-L173 HydrophobicContact CD1-CD2 3.65Å; L145-I182 HydrophobicContact CD1-CG2 4.01Å; L145-A183 PolarHBondContact N-O 3.27Å; L145-I184 HydrophobicContact CB-CD1 4.05Å; L145-I184 HydrophobicContact CD1-CD1 4.48Å; L145-I184 WeakPolarHBondContact O-CA 3.47Å; L145-W185 PolarHBondContact O-N 3.13Å; L145-F290 HydrophobicContact CD2-CB 3.87Å; L145-F290 HydrophobicContact CD2-CD2 3.94Å; L145-F290 HydrophobicContact CD2-CG 4.17Å
146	D	98.4	Very high	96.4	Very high	7 Å²	7	30.7 Å²	30.7	4%	0.037	17%	0.169	C	C	.	.			trans	-70.6	163.5	157.9	-179.5	64.1	0	0	0	111.7	D148 T150 W185 K270 F290 D291	D146-D148 PolarHBondContact OD2-N 3.22Å; D146-D148 VanDerWaalsContact OD2-N 3.13Å; D146-D148 VanDerWaalsContact OD2-O 3.12Å; D146-T150 HydrophobicContact CB-CG2 4.11Å; D146-T150 WeakPolarHBondContact CB-OG1 3.3Å; D146-T150 WeakPolarHBondContact O-CB 3.29Å; D146-T150 WeakPolarHBondContact O-CG2 3.41Å; D146-T150 WeakPolarHBondContact OD2-CB 3.32Å; D146-T150 PolarHBondContact OD2-OG1 3.41Å; D146-W185 WeakPolarHBondContact CA-O 3.45Å; D146-K270 VanDerWaalsContact CG-NZ 3.29Å; D146-K270 IonicContact OD1-NZ 3.98Å; D146-K270 PolarHBondContact OD1-NZ 3.1Å; D146-F290 PolarHBondContact N-O 3.26Å; D146-D291 HydrophobicContact CB-CB 4.28Å; D146-D291 WeakPolarHBondContact CB-OD2 3.28Å
147	I	97.8	Very high	96	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.197	C	C	.	.			trans	-101	-61.6	179.5	-58.5	177	0	0	0	111.3	Y149 T150 I151 F152 I184 I193 K196 L197	I147-Y149 PolarHBondContact O-N 3.03Å; I147-T150 PolarHBondContact O-N 3.31Å; I147-I151 HydrophobicContact CG2-CG1 4.44Å; I147-I151 PolarHBondContact O-N 3.15Å; I147-F152 HydrophobicContact CG2-CB 3.94Å; I147-F152 PolarHBondContact O-N 3.32Å; I147-I184 HydrophobicContact CD1-CG2 3.56Å; I147-I184 HydrophobicContact CG1-CG2 3.61Å; I147-I193 HydrophobicContact CD1-CB 4.22Å; I147-I193 HydrophobicContact CD1-CG1 4.07Å; I147-I193 HydrophobicContact CD1-CG2 3.75Å; I147-K196 HydrophobicContact CG2-CD 3.97Å; I147-L197 HydrophobicContact CD1-CD2 4.36Å
148	D	96	Very high	95.5	Very high	20 Å²	20	34.5 Å²	34.5	11%	0.107	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-80.3	117.6	-159.9	-81.9	-25.2	0	0	0	110.6	D146 T150 H154 K196	D146-D148 PolarHBondContact OD2-N 3.22Å; D146-D148 VanDerWaalsContact OD2-N 3.13Å; D146-D148 VanDerWaalsContact OD2-O 3.12Å; D148-T150 PolarHBondContact O-N 3.31Å; D148-T150 VanDerWaalsContact O-N 3.14Å; D148-H154 WeakPolarHBondContact CB-ND1 3.44Å; D148-H154 VanDerWaalsContact CG-ND1 3.34Å; D148-H154 WeakPolarHBondContact OD1-CB 3.42Å; D148-H154 IonicContact OD1-CG 3.67Å; D148-H154 IonicContact OD1-ND1 3.96Å; D148-H154 PolarHBondContact OD1-ND1 3.25Å; D148-K196 IonicContact OD1-NZ 3.81Å; D148-K196 PolarHBondContact OD1-NZ 3.13Å; D148-K196 IonicContact OD2-NZ 3.24Å; D148-K196 PolarHBondContact OD2-NZ 3.38Å
149	Y	96.4	Very high	94.9	Very high	11 Å²	11	35.5 Å²	35.5	4%	0.043	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	0	-167	-47.1	-57	0	0	0	115.5	I147 F152 H154 L155 S309 Y310 R311	I147-Y149 PolarHBondContact O-N 3.03Å; Y149-F152 WeakPolarHBondContact CA-O 3.09Å; Y149-F152 PolarHBondContact N-O 3.47Å; Y149-H154 AromaticContact CD2-CE1 3.65Å; Y149-H154 AromaticContact CE1-CE1 3.65Å; Y149-H154 AromaticContact CE1-ND1 3.79Å; Y149-H154 AromaticContact CE2-CE1 3.12Å; Y149-H154 WeakPolarHBondContact CE2-CE1 3.38Å; Y149-H154 AromaticContact CE2-ND1 3.99Å; Y149-H154 AromaticContact CE2-NE2 3.85Å; Y149-H154 AromaticContact CZ-CE1 3.12Å; Y149-H154 AromaticContact CZ-ND1 3.75Å; Y149-H154 AromaticContact CZ-NE2 3.67Å; Y149-L155 WeakPolarHBondContact OH-CD1 3.48Å; Y149-L155 WeakPolarHBondContact OH-CG 3.48Å; Y149-S309 CarbonylContact O-C 3.53Å; Y149-S309 WeakPolarHBondContact O-CA 3.26Å; Y149-Y310 WeakPolarHBondContact CD1-O 3.35Å; Y149-Y310 PolarHBondContact O-N 2.96Å; Y149-R311 HydrophobicContact CD1-CG 3.58Å; Y149-R311 HydrophobicContact CE1-CG 3.81Å; Y149-R311 VanDerWaalsContact CE2-CZ 3.48Å; Y149-R311 HydrophobicContact CG-CG 4.23Å; Y149-R311 PolarHBondContact OH-NH1 2.88Å; Y149-R311 VanDerWaalsContact OH-NH1 3.12Å
150	T	97.6	Very high	94.4	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.006	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-56.9	171.7	-63.7	0	0	0	0	110.6	D146 I147 D148 R166 F290 D292 I307	D146-T150 HydrophobicContact CB-CG2 4.11Å; D146-T150 WeakPolarHBondContact CB-OG1 3.3Å; D146-T150 WeakPolarHBondContact O-CB 3.29Å; D146-T150 WeakPolarHBondContact O-CG2 3.41Å; D146-T150 WeakPolarHBondContact OD2-CB 3.32Å; D146-T150 PolarHBondContact OD2-OG1 3.41Å; I147-T150 PolarHBondContact O-N 3.31Å; D148-T150 PolarHBondContact O-N 3.31Å; D148-T150 VanDerWaalsContact O-N 3.14Å; T150-R166 WeakPolarHBondContact O-CD 3.36Å; T150-R166 PolarHBondContact O-NH1 2.98Å; T150-F290 HydrophobicContact CG2-CB 4.49Å; T150-D292 PolarHBondContact OG1-N 3.19Å; T150-I307 HydrophobicContact CG2-CG2 4.16Å
151	I	97.3	Very high	93.8	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120	-4.2	177.6	61	171.3	0	0	0	113.4	I147 R166 L169 I202	I147-I151 HydrophobicContact CG2-CG1 4.44Å; I147-I151 PolarHBondContact O-N 3.15Å; I151-R166 WeakPolarHBondContact O-CB 3.25Å; I151-R166 PolarHBondContact O-N 3.2Å; I151-L169 HydrophobicContact CB-CD1 3.78Å; I151-L169 HydrophobicContact CB-CD2 4.1Å; I151-L169 HydrophobicContact CD1-CD1 4.36Å; I151-L169 HydrophobicContact CD1-CD2 4.46Å; I151-L169 HydrophobicContact CG2-CD1 3.68Å; I151-I202 HydrophobicContact CD1-CD1 4.26Å
152	F	96.4	Very high	93.3	Very high	12 Å²	12	38.4 Å²	38.4	5%	0.053	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-148.9	130.2	-173.8	-177.8	-107.8	0	0	0	112.6	I147 Y149 H154 V161 L164 K196 L200	I147-F152 HydrophobicContact CG2-CB 3.94Å; I147-F152 PolarHBondContact O-N 3.32Å; Y149-F152 WeakPolarHBondContact CA-O 3.09Å; Y149-F152 PolarHBondContact N-O 3.47Å; F152-H154 HydrophobicContact CD1-CB 3.79Å; F152-H154 HydrophobicContact CE1-CB 3.67Å; F152-H154 PolarHBondContact O-N 3.41Å; F152-V161 HydrophobicContact CE2-CG1 4.1Å; F152-V161 HydrophobicContact CE2-CG2 4.15Å; F152-V161 HydrophobicContact CZ-CG2 4.11Å; F152-L164 WeakPolarHBondContact CA-O 3.49Å; F152-L164 HydrophobicContact CD2-CB 3.96Å; F152-L164 WeakPolarHBondContact CD2-O 3.34Å; F152-L164 HydrophobicContact CE2-CB 3.43Å; F152-L164 VanDerWaalsContact CE2-CB 3.43Å; F152-L164 HydrophobicContact CE2-CD1 4.17Å; F152-L164 HydrophobicContact CE2-CG 4.45Å; F152-L164 HydrophobicContact CZ-CB 3.98Å; F152-L164 HydrophobicContact CZ-CD1 3.92Å; F152-K196 HydrophobicContact CD1-CD 4.11Å; F152-K196 HydrophobicContact CE1-CD 4.18Å; F152-K196 HydrophobicContact CE1-CG 4.31Å; F152-L200 HydrophobicContact CB-CD1 4.4Å; F152-L200 HydrophobicContact CD2-CD1 3.89Å; F152-L200 HydrophobicContact CD2-CD2 3.87Å; F152-L200 HydrophobicContact CD2-CG 4.26Å; F152-L200 HydrophobicContact CE2-CD2 4.13Å; F152-L200 HydrophobicContact CE2-CG 4.49Å; F152-L200 HydrophobicContact CG-CD1 4.31Å
153	D	95.2	Very high	92.9	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	23%	0.231	C	C	.	.			trans	-86.3	102.8	170.9	-176.9	-9.8	0	0	0	110.1	L155 T156 L164 Y310 D312 A313	D153-L155 PolarHBondContact OD1-N 3.14Å; D153-L155 VanDerWaalsContact OD1-N 3.15Å; D153-T156 VanDerWaalsContact CG-OG1 3.29Å; D153-T156 PolarHBondContact OD1-N 3.4Å; D153-T156 PolarHBondContact OD1-OG1 2.86Å; D153-T156 WeakPolarHBondContact OD2-CB 3.5Å; D153-T156 PolarHBondContact OD2-OG1 3.49Å; D153-L164 HydrophobicContact CB-CD2 4.38Å; D153-L164 PolarHBondContact N-O 2.95Å; D153-L164 WeakPolarHBondContact O-CB 3.45Å; D153-Y310 HydrophobicContact CB-CD1 4.02Å; D153-Y310 HydrophobicContact CB-CE1 4.04Å; D153-D312 PolarHBondContact OD2-N 2.91Å; D153-A313 HydrophobicContact CB-CB 4.05Å; D153-A313 PolarHBondContact OD2-N 3.11Å
154	H	92.5	Very high	92.7	Very high	67 Å²	67	43.9 Å²	43.9	31%	0.31	24%	0.235	S	C	.	.	S	Bend	trans	-89.8	-5.9	-175.5	66.4	-85.8	0	0	0	115	D148 Y149 F152	D148-H154 WeakPolarHBondContact CB-ND1 3.44Å; D148-H154 VanDerWaalsContact CG-ND1 3.34Å; D148-H154 WeakPolarHBondContact OD1-CB 3.42Å; D148-H154 IonicContact OD1-CG 3.67Å; D148-H154 IonicContact OD1-ND1 3.96Å; D148-H154 PolarHBondContact OD1-ND1 3.25Å; Y149-H154 AromaticContact CD2-CE1 3.65Å; Y149-H154 AromaticContact CE1-CE1 3.65Å; Y149-H154 AromaticContact CE1-ND1 3.79Å; Y149-H154 AromaticContact CE2-CE1 3.12Å; Y149-H154 WeakPolarHBondContact CE2-CE1 3.38Å; Y149-H154 AromaticContact CE2-ND1 3.99Å; Y149-H154 AromaticContact CE2-NE2 3.85Å; Y149-H154 AromaticContact CZ-CE1 3.12Å; Y149-H154 AromaticContact CZ-ND1 3.75Å; Y149-H154 AromaticContact CZ-NE2 3.67Å; F152-H154 HydrophobicContact CD1-CB 3.79Å; F152-H154 HydrophobicContact CE1-CB 3.67Å; F152-H154 PolarHBondContact O-N 3.41Å
155	L	91.4	Very high	92.5	Very high	121 Å²	121	44.8 Å²	44.8	63%	0.634	24%	0.242	S	C	*	.	S	Bend	trans	-101.6	-35.1	-180	-75.6	-167.2	0	0	0	112.8	Y149 D153	Y149-L155 WeakPolarHBondContact OH-CD1 3.48Å; Y149-L155 WeakPolarHBondContact OH-CG 3.48Å; D153-L155 PolarHBondContact OD1-N 3.14Å; D153-L155 VanDerWaalsContact OD1-N 3.15Å
156	T	89.1	Confident	92.4	Very high	15 Å²	15	44.9 Å²	44.9	9%	0.092	24%	0.243	C	C	.	.	S	Bend	trans	-64.2	130.1	-178.6	-66.9	0	0	0	0	110.5	D153 L164 H314	D153-T156 VanDerWaalsContact CG-OG1 3.29Å; D153-T156 PolarHBondContact OD1-N 3.4Å; D153-T156 PolarHBondContact OD1-OG1 2.86Å; D153-T156 WeakPolarHBondContact OD2-CB 3.5Å; D153-T156 PolarHBondContact OD2-OG1 3.49Å; T156-L164 HydrophobicContact CG2-CD2 3.95Å; T156-L164 VanDerWaalsContact O-CD2 3.27Å; T156-L164 WeakPolarHBondContact O-CD2 3.33Å; T156-H314 WeakPolarHBondContact CG2-ND1 3.19Å
157	P	86.1	Confident	92.3	Very high	122 Å²	122	45.3 Å²	45.3	79%	0.792	25%	0.246	S	C	*	.			trans	-70.9	137.3	171.8	29.2	-33.4	0	0	0	110.3
158	A	86.2	Confident	92.2	Very high	46 Å²	46	48.5 Å²	48.5	38%	0.38	26%	0.261	S	S	.	.			trans	-145.4	157.9	176.5	0	0	0	0	0	111.2	S160 Q163 L164	A158-S160 VanDerWaalsContact C-N 3.3Å; A158-Q163 HydrophobicContact CB-CB 4.07Å; A158-L164 HydrophobicContact CB-CD1 3.9Å; A158-L164 HydrophobicContact CB-CD2 3.65Å; A158-L164 HydrophobicContact CB-CG 3.57Å
159	E	84.8	Confident	92.3	Very high	188 Å²	188	47.9 Å²	47.9	88%	0.879	26%	0.258	S	S	*	.	S	Bend	trans	-74.9	-25.6	174.4	-64.8	-177.5	166.2	0	0	111.9
160	S	85.7	Confident	92.2	Very high	45 Å²	45	51 Å²	51	32%	0.315	27%	0.274	S	S	.	.	S	Bend	trans	-140.8	140.2	179.7	175.5	0	0	0	0	111.1	A158 H162 Q163	A158-S160 VanDerWaalsContact C-N 3.3Å; S160-H162 PolarHBondContact O-N 2.9Å; S160-H162 PolarHBondContact OG-N 2.55Å; S160-Q163 WeakPolarHBondContact O-CB 3.5Å; S160-Q163 PolarHBondContact O-N 2.95Å
161	V	85.9	Confident	92.1	Very high	28 Å²	28	54.5 Å²	54.5	17%	0.17	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-58.8	-27.6	175.1	141.5	0	0	0	0	112.5	F152 Q163 L164 A165 Q199 L200	F152-V161 HydrophobicContact CE2-CG1 4.1Å; F152-V161 HydrophobicContact CE2-CG2 4.15Å; F152-V161 HydrophobicContact CZ-CG2 4.11Å; V161-Q163 PolarHBondContact O-N 3.48Å; V161-L164 WeakPolarHBondContact O-CB 3.42Å; V161-L164 PolarHBondContact O-N 3.14Å; V161-A165 PolarHBondContact O-N 3.31Å; V161-Q199 HydrophobicContact CB-CB 4.24Å; V161-Q199 HydrophobicContact CG1-CB 3.86Å; V161-Q199 HydrophobicContact CG2-CB 4.21Å; V161-L200 HydrophobicContact CG1-CB 4.39Å; V161-L200 HydrophobicContact CG1-CD2 3.42Å; V161-L200 VanDerWaalsContact CG1-CD2 3.42Å; V161-L200 HydrophobicContact CG1-CG 3.64Å
162	H	86.6	Confident	92.1	Very high	120 Å²	120	54.5 Å²	54.5	56%	0.556	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-65.5	-25.4	176.8	-59.9	-54.5	0	0	0	113	S160 L164 A165	S160-H162 PolarHBondContact O-N 2.9Å; S160-H162 PolarHBondContact OG-N 2.55Å; H162-L164 PolarHBondContact O-N 3.31Å; H162-A165 PolarHBondContact O-N 3.38Å
163	Q	90.3	Very high	92.2	Very high	100 Å²	100	54 Å²	54	47%	0.467	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-72.9	-17.5	174.5	-62.3	171	-9.2	0	0	112.1	A158 S160 V161 A313	A158-Q163 HydrophobicContact CB-CB 4.07Å; S160-Q163 WeakPolarHBondContact O-CB 3.5Å; S160-Q163 PolarHBondContact O-N 2.95Å; V161-Q163 PolarHBondContact O-N 3.48Å; Q163-A313 WeakPolarHBondContact O-CB 3.46Å
164	L	94.6	Very high	92.3	Very high	15 Å²	15	54.9 Å²	54.9	8%	0.079	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-9	179.7	-60.2	176.6	0	0	0	112.7	F152 D153 T156 A158 V161 H162 Y310 A313	F152-L164 WeakPolarHBondContact CA-O 3.49Å; F152-L164 HydrophobicContact CD2-CB 3.96Å; F152-L164 WeakPolarHBondContact CD2-O 3.34Å; F152-L164 HydrophobicContact CE2-CB 3.43Å; F152-L164 VanDerWaalsContact CE2-CB 3.43Å; F152-L164 HydrophobicContact CE2-CD1 4.17Å; F152-L164 HydrophobicContact CE2-CG 4.45Å; F152-L164 HydrophobicContact CZ-CB 3.98Å; F152-L164 HydrophobicContact CZ-CD1 3.92Å; D153-L164 HydrophobicContact CB-CD2 4.38Å; D153-L164 PolarHBondContact N-O 2.95Å; D153-L164 WeakPolarHBondContact O-CB 3.45Å; T156-L164 HydrophobicContact CG2-CD2 3.95Å; T156-L164 VanDerWaalsContact O-CD2 3.27Å; T156-L164 WeakPolarHBondContact O-CD2 3.33Å; A158-L164 HydrophobicContact CB-CD1 3.9Å; A158-L164 HydrophobicContact CB-CD2 3.65Å; A158-L164 HydrophobicContact CB-CG 3.57Å; V161-L164 WeakPolarHBondContact O-CB 3.42Å; V161-L164 PolarHBondContact O-N 3.14Å; H162-L164 PolarHBondContact O-N 3.31Å; L164-Y310 WeakPolarHBondContact O-CE1 3.27Å; L164-A313 HydrophobicContact CD2-CB 4.18Å
165	A	95.3	Very high	92.5	Very high	19 Å²	19	52.7 Å²	52.7	16%	0.157	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-68.2	137.7	173.7	0	0	0	0	0	109.7	V161 H162 L169 L200	V161-A165 PolarHBondContact O-N 3.31Å; H162-A165 PolarHBondContact O-N 3.38Å; A165-L169 HydrophobicContact CB-CD2 4.43Å; A165-L200 HydrophobicContact CB-CD2 3.55Å
166	R	97.4	Very high	92.8	Very high	3 Å²	3	47 Å²	47	1%	0.011	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-60.8	134	174.2	-169.2	166.4	-169	161.2	6.7	110	T150 I151 L169 R308 Y310 D320 E322 L323	T150-R166 WeakPolarHBondContact O-CD 3.36Å; T150-R166 PolarHBondContact O-NH1 2.98Å; I151-R166 WeakPolarHBondContact O-CB 3.25Å; I151-R166 PolarHBondContact O-N 3.2Å; R166-L169 WeakPolarHBondContact O-CB 3.33Å; R166-L169 PolarHBondContact O-N 2.86Å; R166-R308 PolarHBondContact NH1-O 3.08Å; R166-R308 PolarHBondContact NH2-O 2.92Å; R166-Y310 HydrophobicContact CB-CD1 3.85Å; R166-Y310 HydrophobicContact CB-CD2 4.43Å; R166-Y310 HydrophobicContact CB-CE1 4.15Å; R166-Y310 HydrophobicContact CB-CG 4.01Å; R166-Y310 HydrophobicContact CG-CD1 4.14Å; R166-Y310 HydrophobicContact CG-CD2 3.84Å; R166-Y310 HydrophobicContact CG-CE2 4.28Å; R166-Y310 HydrophobicContact CG-CG 3.77Å; R166-D320 IonicContact CZ-OD2 3.65Å; R166-D320 IonicContact NE-OD1 3.67Å; R166-D320 PolarHBondContact NE-OD1 2.9Å; R166-D320 IonicContact NE-OD2 3.88Å; R166-D320 PolarHBondContact NE-OD2 3.04Å; R166-D320 VanDerWaalsContact NE-OD2 3.11Å; R166-D320 IonicContact NH2-OD1 2.66Å; R166-D320 IonicContact NH2-OD2 2.9Å; R166-D320 PolarHBondContact NH2-OD2 2.65Å; R166-E322 IonicContact CZ-OE2 3.44Å; R166-E322 IonicContact NH2-OE2 3.97Å; R166-E322 PolarHBondContact NH2-OE2 2.89Å; R166-L323 HydrophobicContact CB-CD1 3.96Å; R166-L323 HydrophobicContact CG-CD1 3.81Å; R166-L323 HydrophobicContact CG-CG 4.09Å
167	P	95.8	Very high	93.3	Very high	16 Å²	16	47.4 Å²	47.4	10%	0.104	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	143.4	-177.9	-27.5	34.4	0	0	0	112	L169 Y310 C317 D320	P167-L169 PolarHBondContact O-N 2.86Å; P167-Y310 VanDerWaalsContact CD-CE2 3.47Å; P167-Y310 HydrophobicContact CG-CE2 4.3Å; P167-C317 HydrophobicContact CG-CB 4.21Å; P167-C317 WeakPolarHBondContact CG-O 3.46Å; P167-D320 WeakPolarHBondContact CB-O 3.41Å; P167-D320 HydrophobicContact CG-CB 4.13Å
168	H	96.2	Very high	93.8	Very high	68 Å²	68	43.1 Å²	43.1	32%	0.315	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	13.8	179.4	-42.4	-71.9	0	0	0	115.3	I170 E171 F172 H321 L324	H168-I170 PolarHBondContact O-N 3.47Å; H168-E171 PolarHBondContact O-N 2.79Å; H168-F172 WeakPolarHBondContact O-CB 3.4Å; H168-F172 PolarHBondContact O-N 2.98Å; H168-H321 AromaticContact CD2-ND1 3.99Å; H168-H321 AromaticContact CE1-ND1 3.99Å; H168-H321 AromaticContact NE2-CE1 3.75Å; H168-H321 AromaticContact NE2-ND1 3.21Å; H168-H321 PolarHBondContact NE2-ND1 3.02Å; H168-L324 HydrophobicContact CB-CD1 4.36Å; H168-L324 HydrophobicContact CB-CD2 3.79Å; H168-L324 HydrophobicContact CB-CG 3.65Å
169	L	96.7	Very high	94.3	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.037	22%	0.216	C	C	.	.	H	α-helix	trans	-56	-45.7	-179.6	179.2	57.9	0	0	0	113.9	I151 A165 R166 P167 F172 L173 I202 L323	I151-L169 HydrophobicContact CB-CD1 3.78Å; I151-L169 HydrophobicContact CB-CD2 4.1Å; I151-L169 HydrophobicContact CD1-CD1 4.36Å; I151-L169 HydrophobicContact CD1-CD2 4.46Å; I151-L169 HydrophobicContact CG2-CD1 3.68Å; A165-L169 HydrophobicContact CB-CD2 4.43Å; R166-L169 WeakPolarHBondContact O-CB 3.33Å; R166-L169 PolarHBondContact O-N 2.86Å; P167-L169 PolarHBondContact O-N 2.86Å; L169-F172 WeakPolarHBondContact O-CB 3.45Å; L169-F172 PolarHBondContact O-N 2.76Å; L169-L173 HydrophobicContact CD1-CD1 3.99Å; L169-L173 HydrophobicContact CD1-CG 4.04Å; L169-L173 HydrophobicContact CG-CD1 4.09Å; L169-L173 VanDerWaalsContact O-CG 3.32Å; L169-L173 WeakPolarHBondContact O-CG 3.2Å; L169-L173 PolarHBondContact O-N 3.29Å; L169-I202 HydrophobicContact CD2-CD1 3.91Å; L169-L323 HydrophobicContact CB-CD1 4.18Å; L169-L323 HydrophobicContact CD1-CD1 4.1Å
170	I	94.9	Very high	95	Very high	75 Å²	75	34.3 Å²	34.3	39%	0.385	17%	0.174	S	C	.	.	H	α-helix	trans	-65.8	-41.4	-178.8	-62.1	-57.2	0	0	0	111.9	H168 T174 F245	H168-I170 PolarHBondContact O-N 3.47Å; I170-T174 VanDerWaalsContact O-CB 3.31Å; I170-T174 WeakPolarHBondContact O-CB 3.32Å; I170-T174 PolarHBondContact O-N 2.88Å; I170-T174 PolarHBondContact O-OG1 3.32Å; I170-F245 HydrophobicContact CD1-CE1 4.3Å; I170-F245 HydrophobicContact CD1-CZ 4.03Å; I170-F245 HydrophobicContact CG2-CE1 4.2Å
171	E	95.3	Very high	95.6	Very high	75 Å²	75	32.2 Å²	32.2	35%	0.35	16%	0.159	S	C	.	.	H	α-helix	trans	-65.4	-41.5	175.2	169.6	65.3	-179.5	0	0	111	H168 R175 L324 R366	H168-E171 PolarHBondContact O-N 2.79Å; E171-R175 PolarHBondContact O-N 2.8Å; E171-R175 VanDerWaalsContact O-N 3.09Å; E171-R175 WeakPolarHBondContact OE1-CD 3.44Å; E171-R175 IonicContact OE1-CZ 2.65Å; E171-R175 IonicContact OE1-NE 3.28Å; E171-R175 IonicContact OE1-NH1 2.78Å; E171-R175 PolarHBondContact OE1-NH1 3.35Å; E171-L324 HydrophobicContact CG-CD2 4.14Å; E171-R366 IonicContact OE1-NH1 3.45Å
172	F	98.4	Very high	96.2	Very high	1 Å²	1	30.9 Å²	30.9	0%	0.004	15%	0.151	C	C	.	.	H	α-helix	trans	-57.7	-53.1	174.5	172.9	-91.3	0	0	0	111.3	L143 L145 H168 L169 T174 R175 A176 F290 L323 L326 I327 L330	L143-F172 HydrophobicContact CD2-CE1 3.97Å; L143-F172 HydrophobicContact CD2-CZ 3.97Å; L145-F172 HydrophobicContact CD1-CE1 3.89Å; L145-F172 HydrophobicContact CD2-CE1 3.99Å; L145-F172 HydrophobicContact CD2-CZ 4.21Å; H168-F172 WeakPolarHBondContact O-CB 3.4Å; H168-F172 PolarHBondContact O-N 2.98Å; L169-F172 WeakPolarHBondContact O-CB 3.45Å; L169-F172 PolarHBondContact O-N 2.76Å; F172-T174 PolarHBondContact O-N 3.38Å; F172-R175 PolarHBondContact O-N 3.07Å; F172-A176 VanDerWaalsContact O-CB 3.25Å; F172-A176 WeakPolarHBondContact O-CB 3.38Å; F172-A176 PolarHBondContact O-N 3.19Å; F172-F290 HydrophobicContact CE2-CD2 4.44Å; F172-F290 AromaticContact CE2-CE2 3.85Å; F172-F290 HydrophobicContact CE2-CE2 3.85Å; F172-F290 AromaticContact CZ-CD2 3.91Å; F172-F290 HydrophobicContact CZ-CD2 3.91Å; F172-F290 AromaticContact CZ-CE2 3.65Å; F172-F290 HydrophobicContact CZ-CE2 3.65Å; F172-L323 HydrophobicContact CB-CB 4.14Å; F172-L323 HydrophobicContact CB-CD1 4.43Å; F172-L323 HydrophobicContact CD2-CB 4.03Å; F172-L323 HydrophobicContact CD2-CD2 4.17Å; F172-L323 WeakPolarHBondContact CD2-O 3.36Å; F172-L323 HydrophobicContact CE2-CD2 4.31Å; F172-L323 HydrophobicContact CG-CB 4.21Å; F172-L323 HydrophobicContact CG-CD1 4.48Å; F172-L323 HydrophobicContact CG-CD2 4.35Å; F172-L326 HydrophobicContact CE2-CB 4.2Å; F172-I327 HydrophobicContact CD2-CB 3.8Å; F172-I327 HydrophobicContact CE2-CB 4.31Å; F172-L330 HydrophobicContact CE2-CD1 3.8Å; F172-L330 HydrophobicContact CZ-CD1 3.72Å
173	L	98.2	Very high	96.8	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-43.6	-179.8	-67.6	172.5	0	0	0	112	L145 L169 R175 A176 Y177 I182 I202 F245	L145-L173 HydrophobicContact CD1-CD2 3.65Å; L169-L173 HydrophobicContact CD1-CD1 3.99Å; L169-L173 HydrophobicContact CD1-CG 4.04Å; L169-L173 HydrophobicContact CG-CD1 4.09Å; L169-L173 VanDerWaalsContact O-CG 3.32Å; L169-L173 WeakPolarHBondContact O-CG 3.2Å; L169-L173 PolarHBondContact O-N 3.29Å; L173-R175 VanDerWaalsContact C-N 3.35Å; L173-R175 PolarHBondContact O-N 3.01Å; L173-A176 PolarHBondContact O-N 2.92Å; L173-Y177 VanDerWaalsContact O-CB 3.3Å; L173-Y177 WeakPolarHBondContact O-CB 3.27Å; L173-Y177 PolarHBondContact O-N 3.26Å; L173-I182 HydrophobicContact CB-CD1 4.45Å; L173-I182 HydrophobicContact CD2-CD1 3.96Å; L173-I182 HydrophobicContact CD2-CG2 4.25Å; L173-I202 HydrophobicContact CD1-CD1 4.3Å; L173-I202 HydrophobicContact CD1-CG1 4.08Å; L173-I202 HydrophobicContact CD1-CG2 4.16Å; L173-F245 HydrophobicContact CB-CD1 3.77Å; L173-F245 HydrophobicContact CB-CD2 3.99Å; L173-F245 HydrophobicContact CB-CE1 3.78Å; L173-F245 HydrophobicContact CB-CE2 4.04Å; L173-F245 HydrophobicContact CB-CG 3.86Å; L173-F245 HydrophobicContact CB-CZ 3.93Å; L173-F245 HydrophobicContact CD1-CD2 4.39Å; L173-F245 HydrophobicContact CD1-CE1 4.33Å; L173-F245 HydrophobicContact CD1-CE2 3.73Å; L173-F245 HydrophobicContact CD1-CZ 3.68Å; L173-F245 HydrophobicContact CG-CE2 4.49Å; L173-F245 HydrophobicContact CG-CZ 4.48Å
174	T	96.4	Very high	97.1	Very high	21 Å²	21	20.4 Å²	20.4	13%	0.129	10%	0.102	C	C	.	.	H	α-helix	trans	-57.2	-47.4	178.6	-63.4	0	0	0	0	111.8	I170 F172 S244 F245	I170-T174 VanDerWaalsContact O-CB 3.31Å; I170-T174 WeakPolarHBondContact O-CB 3.32Å; I170-T174 PolarHBondContact O-N 2.88Å; I170-T174 PolarHBondContact O-OG1 3.32Å; F172-T174 PolarHBondContact O-N 3.38Å; T174-S244 WeakPolarHBondContact OG1-CB 3.44Å; T174-F245 WeakPolarHBondContact OG1-CD1 3.48Å
175	R	97.3	Very high	97.3	Very high	21 Å²	21	19.7 Å²	19.7	8%	0.079	10%	0.099	C	C	.	.	H	α-helix	trans	-76.7	-36.4	-178.8	-77.4	169.6	61.6	-167.6	-5.6	112.8	E171 F172 L173 Y177 V178 I327 E331 R366	E171-R175 PolarHBondContact O-N 2.8Å; E171-R175 VanDerWaalsContact O-N 3.09Å; E171-R175 WeakPolarHBondContact OE1-CD 3.44Å; E171-R175 IonicContact OE1-CZ 2.65Å; E171-R175 IonicContact OE1-NE 3.28Å; E171-R175 IonicContact OE1-NH1 2.78Å; E171-R175 PolarHBondContact OE1-NH1 3.35Å; F172-R175 PolarHBondContact O-N 3.07Å; L173-R175 VanDerWaalsContact C-N 3.35Å; L173-R175 PolarHBondContact O-N 3.01Å; R175-Y177 PolarHBondContact O-N 3.27Å; R175-V178 WeakPolarHBondContact O-CB 3.36Å; R175-V178 WeakPolarHBondContact O-CG2 3.33Å; R175-V178 PolarHBondContact O-N 2.56Å; R175-I327 HydrophobicContact CB-CD1 3.55Å; R175-I327 HydrophobicContact CB-CG1 3.46Å; R175-I327 VanDerWaalsContact CB-CG1 3.46Å; R175-I327 HydrophobicContact CG-CG1 4.44Å; R175-E331 IonicContact CZ-OE1 2.8Å; R175-E331 IonicContact CZ-OE2 3.47Å; R175-E331 IonicContact NE-OE1 3.66Å; R175-E331 PolarHBondContact NE-OE1 3.36Å; R175-E331 IonicContact NE-OE2 3.78Å; R175-E331 IonicContact NH2-OE1 3.7Å; R175-E331 PolarHBondContact NH2-OE1 2.88Å; R175-E331 IonicContact NH2-OE2 3.63Å; R175-E331 PolarHBondContact NH2-OE2 2.57Å; R175-R366 VanDerWaalsContact CD-NH1 3.32Å; R175-R366 VanDerWaalsContact CZ-NH2 3.25Å; R175-R366 VanDerWaalsContact NH2-NH2 3.12Å
176	A	98.4	Very high	97.4	Very high	1 Å²	1	18.9 Å²	18.9	1%	0.008	9%	0.091	C	C	.	.	H	α-helix	trans	-60.6	-41.2	175.2	0	0	0	0	0	109.7	L143 F172 L173 V178 Y179 Y180 I182 I327 L330	L143-A176 HydrophobicContact CD2-CB 3.77Å; F172-A176 VanDerWaalsContact O-CB 3.25Å; F172-A176 WeakPolarHBondContact O-CB 3.38Å; F172-A176 PolarHBondContact O-N 3.19Å; L173-A176 PolarHBondContact O-N 2.92Å; A176-V178 PolarHBondContact O-N 3.09Å; A176-Y179 PolarHBondContact O-N 2.91Å; A176-Y180 WeakPolarHBondContact O-CB 3.36Å; A176-Y180 WeakPolarHBondContact O-CD2 3.24Å; A176-Y180 PolarHBondContact O-N 3.28Å; A176-I182 HydrophobicContact CB-CD1 4.4Å; A176-I327 HydrophobicContact CB-CD1 3.94Å; A176-I327 VanDerWaalsContact N-CD1 3.29Å; A176-L330 HydrophobicContact CB-CD1 4.37Å
177	Y	97.7	Very high	97.4	Very high	23 Å²	23	21.3 Å²	21.3	9%	0.09	11%	0.112	C	C	.	.	H	α-helix	trans	-58.3	-24.2	-179	-168.6	-112	0	0	0	114	R137 L173 R175 Y179 Y180 I182 S244 F245 R246	R137-Y177 VanDerWaalsContact CZ-CE2 3.42Å; R137-Y177 VanDerWaalsContact CZ-CZ 3.46Å; R137-Y177 PolarHBondContact NH1-O 3.17Å; R137-Y177 PolarHBondContact NH2-O 3.38Å; L173-Y177 VanDerWaalsContact O-CB 3.3Å; L173-Y177 WeakPolarHBondContact O-CB 3.27Å; L173-Y177 PolarHBondContact O-N 3.26Å; R175-Y177 PolarHBondContact O-N 3.27Å; Y177-Y179 PolarHBondContact O-N 2.84Å; Y177-Y180 WeakPolarHBondContact CA-O 3.38Å; Y177-I182 HydrophobicContact CD2-CD1 4.31Å; Y177-S244 WeakPolarHBondContact CD1-O 3.06Å; Y177-F245 HydrophobicContact CD1-CB 4.08Å; Y177-F245 HydrophobicContact CD2-CB 4.1Å; Y177-F245 HydrophobicContact CG-CB 3.65Å; Y177-R246 HydrophobicContact CE2-CB 3.94Å; Y177-R246 VanDerWaalsContact CE2-N 3.35Å; Y177-R246 WeakPolarHBondContact CE2-O 3.33Å; Y177-R246 PolarHBondContact OH-NE 3.14Å; Y177-R246 VanDerWaalsContact OH-NE 3.12Å
178	V	96.7	Very high	97.3	Very high	32 Å²	32	22.1 Å²	22.1	19%	0.194	12%	0.117	C	C	.	.	H	α-helix	trans	-58.8	-36.4	175.2	-177.8	0	0	0	0	111.9	K140 R175 A176 V417	K140-V178 PolarHBondContact NZ-O 3.25Å; R175-V178 WeakPolarHBondContact O-CB 3.36Å; R175-V178 WeakPolarHBondContact O-CG2 3.33Å; R175-V178 PolarHBondContact O-N 2.56Å; A176-V178 PolarHBondContact O-N 3.09Å; V178-V417 HydrophobicContact CG1-CG1 4.3Å; V178-V417 HydrophobicContact CG2-CG1 3.99Å; V178-V417 HydrophobicContact CG2-CG2 4.25Å
179	Y	98.4	Very high	97.2	Very high	50 Å²	50	21 Å²	21	20%	0.196	12%	0.117	C	C	.	.	H	α-helix	trans	-114.5	-22.2	-171.6	-55.3	-81.9	0	0	0	113.6	K141 A176 Y177 E331 A334 L335	K141-Y179 PolarHBondContact N-O 3.2Å; A176-Y179 PolarHBondContact O-N 2.91Å; Y177-Y179 PolarHBondContact O-N 2.84Å; Y179-E331 HydrophobicContact CD2-CG 4.29Å; Y179-E331 HydrophobicContact CE2-CB 4.3Å; Y179-E331 HydrophobicContact CE2-CG 3.78Å; Y179-A334 HydrophobicContact CD1-CB 3.83Å; Y179-A334 HydrophobicContact CG-CB 3.76Å; Y179-L335 HydrophobicContact CE1-CD1 4.46Å; Y179-L335 HydrophobicContact CE1-CD2 3.74Å; Y179-L335 HydrophobicContact CE1-CG 3.9Å
180	Y	98.7	Very high	97	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	138	-170.7	-61.6	-94.3	0	0	0	111.7	R137 K141 L143 A176 Y177 I288 L330 I333 A334 F340	R137-Y180 PolarHBondContact NH2-O 3.15Å; K141-Y180 HydrophobicContact CB-CD1 3.49Å; K141-Y180 VanDerWaalsContact CB-CD1 3.49Å; K141-Y180 HydrophobicContact CB-CE1 3.55Å; K141-Y180 HydrophobicContact CB-CG 4.29Å; K141-Y180 HydrophobicContact CD-CE1 4.34Å; K141-Y180 CarbonylContact O-C 3.5Å; K141-Y180 WeakPolarHBondContact O-CA 3.27Å; L143-Y180 HydrophobicContact CB-CD1 3.9Å; L143-Y180 HydrophobicContact CB-CG 3.97Å; A176-Y180 WeakPolarHBondContact O-CB 3.36Å; A176-Y180 WeakPolarHBondContact O-CD2 3.24Å; A176-Y180 PolarHBondContact O-N 3.28Å; Y177-Y180 WeakPolarHBondContact CA-O 3.38Å; Y180-I288 HydrophobicContact CE1-CG2 4.07Å; Y180-L330 HydrophobicContact CE2-CB 3.86Å; Y180-L330 HydrophobicContact CE2-CD2 4.34Å; Y180-L330 PolarHBondContact OH-O 3.12Å; Y180-L330 VanDerWaalsContact OH-O 3.11Å; Y180-I333 WeakPolarHBondContact OH-CG1 3.49Å; Y180-A334 HydrophobicContact CE2-CB 3.86Å; Y180-F340 AromaticContact CE1-CE2 3.97Å; Y180-F340 HydrophobicContact CE1-CE2 3.97Å; Y180-F340 HydrophobicContact CE1-CZ 4.23Å; Y180-F340 WeakPolarHBondContact OH-CZ 3.43Å
181	D	98.3	Very high	96.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	141.7	150.9	-78.7	-18.9	0	0	0	109.2	F136 R137 K141 L143 A248 W282	F136-D181 WeakPolarHBondContact CA-OD2 3.38Å; R137-D181 IonicContact CZ-OD1 2.74Å; R137-D181 VanDerWaalsContact CZ-OD1 3.26Å; R137-D181 PolarHBondContact N-OD2 3.39Å; R137-D181 IonicContact NE-OD1 3.61Å; R137-D181 PolarHBondContact NE-OD1 2.6Å; R137-D181 IonicContact NH2-OD1 3.11Å; R137-D181 PolarHBondContact NH2-OD1 2.95Å; K141-D181 PolarHBondContact O-N 2.95Å; L143-D181 PolarHBondContact N-O 3.01Å; D181-A248 HydrophobicContact CB-CB 4.02Å; D181-W282 HydrophobicContact CB-CH2 4.31Å; D181-W282 HydrophobicContact CB-CZ2 3.79Å
182	I	98.5	Very high	96.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	119.5	-169.6	-54.9	173.9	0	0	0	108.8	L143 L145 L173 A176 Y177 I247 A248	L143-I182 CarbonylContact O-C 3.55Å; L143-I182 WeakPolarHBondContact O-CA 3.41Å; L145-I182 HydrophobicContact CD1-CG2 4.01Å; L173-I182 HydrophobicContact CB-CD1 4.45Å; L173-I182 HydrophobicContact CD2-CD1 3.96Å; L173-I182 HydrophobicContact CD2-CG2 4.25Å; A176-I182 HydrophobicContact CB-CD1 4.4Å; Y177-I182 HydrophobicContact CD2-CD1 4.31Å; I182-I247 HydrophobicContact CB-CD1 4.12Å; I182-I247 HydrophobicContact CG2-CD1 3.72Å; I182-A248 PolarHBondContact O-N 2.97Å
183	A	98.5	Very high	96.5	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	142.1	170.4	0	0	0	0	0	110.2	L142 L143 V144 L145 L249	L142-A183 HydrophobicContact CD1-CB 4.04Å; L143-A183 PolarHBondContact O-N 3.28Å; V144-A183 CarbonylContact C-O 3.56Å; V144-A183 WeakPolarHBondContact CA-O 3.42Å; V144-A183 HydrophobicContact CG2-CB 4.06Å; L145-A183 PolarHBondContact N-O 3.27Å; A183-L249 CarbonylContact C-O 3.31Å; A183-L249 VanDerWaalsContact CA-O 3.29Å; A183-L249 WeakPolarHBondContact CA-O 3.43Å; A183-L249 HydrophobicContact CB-CB 3.98Å; A183-L249 HydrophobicContact CB-CD2 4.46Å
184	I	98.2	Very high	96.3	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131	169.6	-60.6	-60.5	0	0	0	108.2	L145 I147 I193 L197 I247 L249 I250 L251	L145-I184 HydrophobicContact CB-CD1 4.05Å; L145-I184 HydrophobicContact CD1-CD1 4.48Å; L145-I184 WeakPolarHBondContact O-CA 3.47Å; I147-I184 HydrophobicContact CD1-CG2 3.56Å; I147-I184 HydrophobicContact CG1-CG2 3.61Å; I184-I193 HydrophobicContact CG2-CG2 4.11Å; I184-L197 HydrophobicContact CB-CD1 4.37Å; I184-L197 HydrophobicContact CD1-CD2 4.37Å; I184-L197 HydrophobicContact CG1-CD1 3.98Å; I184-L197 HydrophobicContact CG1-CD2 4.24Å; I184-L197 HydrophobicContact CG2-CD1 4.24Å; I184-I247 HydrophobicContact CD1-CD1 4.29Å; I184-I247 HydrophobicContact CG1-CD1 4.25Å; I184-I247 HydrophobicContact CG1-CG1 4.48Å; I184-I247 HydrophobicContact CG1-CG2 3.81Å; I184-L249 PolarHBondContact N-O 3.05Å; I184-I250 HydrophobicContact CB-CG1 4.46Å; I184-I250 CarbonylContact O-C 3.52Å; I184-I250 WeakPolarHBondContact O-CA 3.49Å; I184-L251 PolarHBondContact O-N 3.16Å
185	W	98.3	Very high	96	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	106	173.7	-165.3	-9.8	0	0	0	110.8	V144 L145 D146 L251 D252 D255 M256 K270 P271 L272 V274 I275	V144-W185 HydrophobicContact CG1-CB 3.86Å; V144-W185 HydrophobicContact CG1-CE3 4.32Å; L145-W185 PolarHBondContact O-N 3.13Å; D146-W185 WeakPolarHBondContact CA-O 3.45Å; W185-L251 WeakPolarHBondContact CA-O 3.39Å; W185-L251 HydrophobicContact CB-CB 3.99Å; W185-L251 VanDerWaalsContact CD1-CB 3.48Å; W185-L251 HydrophobicContact CD2-CB 3.71Å; W185-L251 HydrophobicContact CD2-CD2 3.89Å; W185-L251 HydrophobicContact CD2-CG 4.27Å; W185-L251 HydrophobicContact CE3-CB 4.43Å; W185-L251 HydrophobicContact CE3-CD2 3.87Å; W185-L251 HydrophobicContact CG-CB 3.5Å; W185-L251 VanDerWaalsContact CG-CB 3.5Å; W185-L251 HydrophobicContact CG-CG 4.44Å; W185-L251 HydrophobicContact CH2-CD2 3.96Å; W185-L251 HydrophobicContact CZ2-CD2 3.99Å; W185-L251 HydrophobicContact CZ3-CD2 3.9Å; W185-D252 PolarHBondContact NE1-O 3.23Å; W185-D255 HydrophobicContact CZ2-CB 3.84Å; W185-M256 HydrophobicContact CZ2-CG 4.48Å; W185-K270 HydrophobicContact CB-CD 4.35Å; W185-K270 HydrophobicContact CD2-CB 3.78Å; W185-K270 HydrophobicContact CD2-CD 4.05Å; W185-K270 HydrophobicContact CD2-CG 3.9Å; W185-K270 HydrophobicContact CE3-CB 3.9Å; W185-K270 HydrophobicContact CG-CB 4.47Å; W185-K270 HydrophobicContact CG-CD 3.84Å; W185-K270 HydrophobicContact CG-CG 4.12Å; W185-K270 HydrophobicContact CH2-CB 3.95Å; W185-K270 HydrophobicContact CZ2-CB 3.81Å; W185-K270 HydrophobicContact CZ2-CG 4.22Å; W185-K270 HydrophobicContact CZ3-CB 3.99Å; W185-K270 WeakPolarHBondContact O-CE 3.38Å; W185-K270 PolarHBondContact O-NZ 3.47Å; W185-P271 HydrophobicContact CH2-CG 4.44Å; W185-P271 WeakPolarHBondContact CH2-O 3.33Å; W185-L272 HydrophobicContact CE3-CD2 4.4Å; W185-L272 HydrophobicContact CZ3-CD2 4.2Å; W185-V274 HydrophobicContact CH2-CB 4.27Å; W185-I275 HydrophobicContact CE3-CD1 4.16Å; W185-I275 HydrophobicContact CZ3-CD1 4.16Å; W185-I275 HydrophobicContact CZ3-CG1 4.39Å
186	S	97.4	Very high	95.8	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.007	14%	0.138	C	C	.	.			trans	-116	147.6	178.9	175.1	0	0	0	0	111.6	T188 L251 D252 S253	S186-T188 PolarHBondContact O-N 3.46Å; S186-T188 PolarHBondContact OG-OG1 2.97Å; S186-L251 PolarHBondContact N-O 3.08Å; S186-D252 CarbonylContact O-C 3.57Å; S186-D252 VanDerWaalsContact O-C 3.31Å; S186-D252 WeakPolarHBondContact O-CA 3.36Å; S186-S253 PolarHBondContact O-N 2.96Å
187	A	96.3	Very high	95.5	Very high	54 Å²	54	25.3 Å²	25.3	45%	0.446	14%	0.137	S	C	.	.	S	Bend	trans	-77.8	33.2	173.8	0	0	0	0	0	113.4	M256	A187-M256 VanDerWaalsContact CA-SD 3.58Å; A187-M256 HydrophobicContact CB-CE 3.95Å; A187-M256 HydrophobicContact CB-SD 3.47Å; A187-M256 WeakPolarHBondContact CB-SD 3.32Å
188	T	94.4	Very high	95.2	Very high	33 Å²	33	24.5 Å²	24.5	20%	0.202	14%	0.135	C	C	.	.	S	Bend	trans	-126.2	170.1	177.8	60.2	0	0	0	0	109.7	S186 I193 D252 S253	S186-T188 PolarHBondContact O-N 3.46Å; S186-T188 PolarHBondContact OG-OG1 2.97Å; T188-I193 WeakPolarHBondContact OG1-CG1 3.27Å; T188-D252 WeakPolarHBondContact O-CB 3.48Å; T188-S253 PolarHBondContact O-N 3.48Å
189	S	93.9	Very high	94.9	Very high	45 Å²	45	28.1 Å²	28.1	32%	0.315	15%	0.15	S	C	.	.			trans	-71.2	151.7	177.8	73.5	0	0	0	0	111.9	T191 W192 I193	S189-T191 PolarHBondContact O-N 3.5Å; S189-W192 PolarHBondContact O-N 3.21Å; S189-W192 VanDerWaalsContact OG-CD1 3.24Å; S189-I193 PolarHBondContact O-N 3.08Å; S189-I193 VanDerWaalsContact O-N 3.15Å
190	M	93.4	Very high	94.5	Very high	8 Å²	8	26.2 Å²	26.2	4%	0.039	14%	0.143	C	C	.	.	H	α-helix	trans	-48.7	-38.1	177.2	-175.7	58.3	59.7	0	0	113.7	W192 I193 L194 F211 N215 I250 D252	M190-W192 VanDerWaalsContact C-N 3.33Å; M190-W192 PolarHBondContact O-N 3.39Å; M190-I193 PolarHBondContact O-N 2.99Å; M190-L194 HydrophobicContact CG-CD1 3.62Å; M190-L194 HydrophobicContact CG-CG 4.09Å; M190-L194 VanDerWaalsContact O-CG 3.31Å; M190-L194 WeakPolarHBondContact O-CG 3.38Å; M190-L194 PolarHBondContact O-N 3.17Å; M190-L194 HydrophobicContact SD-CD1 3.82Å; M190-L194 HydrophobicContact SD-CD2 4.13Å; M190-L194 HydrophobicContact SD-CG 3.72Å; M190-F211 HydrophobicContact CE-CE1 4.46Å; M190-F211 HydrophobicContact CG-CD1 4.29Å; M190-F211 HydrophobicContact CG-CE1 4.21Å; M190-F211 HydrophobicContact SD-CD1 4.33Å; M190-F211 HydrophobicContact SD-CE1 4.09Å; M190-N215 WeakPolarHBondContact CG-ND2 3.36Å; M190-I250 HydrophobicContact CE-CB 4Å; M190-I250 HydrophobicContact CE-CG2 3.47Å; M190-I250 VanDerWaalsContact CE-CG2 3.47Å; M190-I250 HydrophobicContact SD-CB 4.27Å; M190-I250 HydrophobicContact SD-CG2 3.61Å; M190-D252 HydrophobicContact CB-CB 4.38Å; M190-D252 WeakPolarHBondContact CB-OD2 3.34Å; M190-D252 HydrophobicContact CE-CB 4.1Å; M190-D252 PolarHBondContact N-OD2 3.38Å
191	T	91.6	Very high	94.1	Very high	69 Å²	69	27.1 Å²	27.1	42%	0.423	15%	0.153	S	C	.	.	H	α-helix	trans	-56.1	-46.5	177.5	-59.4	0	0	0	0	112.1	S189 A195 Q212	S189-T191 PolarHBondContact O-N 3.5Å; T191-A195 WeakPolarHBondContact O-CB 3.4Å; T191-A195 PolarHBondContact O-N 3.47Å; T191-Q212 PolarHBondContact O-NE2 3.38Å
192	W	92.2	Very high	93.9	Very high	163 Å²	163	27.6 Å²	27.6	62%	0.617	16%	0.155	S	C	*	.	H	α-helix	trans	-71.4	-37.5	179.4	-71	111.8	0	0	0	112.1	S189 M190 A195 K196	S189-W192 PolarHBondContact O-N 3.21Å; S189-W192 VanDerWaalsContact OG-CD1 3.24Å; M190-W192 VanDerWaalsContact C-N 3.33Å; M190-W192 PolarHBondContact O-N 3.39Å; W192-A195 PolarHBondContact O-N 3.41Å; W192-K196 WeakPolarHBondContact O-CB 3.44Å; W192-K196 WeakPolarHBondContact O-CG 3.5Å; W192-K196 PolarHBondContact O-N 3.02Å
193	I	94.7	Very high	93.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.9	-54.1	175.3	-64.3	174.2	0	0	0	110.2	I147 I184 T188 S189 M190 A195 K196 L197 I250 L251 D252	I147-I193 HydrophobicContact CD1-CB 4.22Å; I147-I193 HydrophobicContact CD1-CG1 4.07Å; I147-I193 HydrophobicContact CD1-CG2 3.75Å; I184-I193 HydrophobicContact CG2-CG2 4.11Å; T188-I193 WeakPolarHBondContact OG1-CG1 3.27Å; S189-I193 PolarHBondContact O-N 3.08Å; S189-I193 VanDerWaalsContact O-N 3.15Å; M190-I193 PolarHBondContact O-N 2.99Å; I193-A195 VanDerWaalsContact C-N 3.32Å; I193-A195 PolarHBondContact O-N 2.93Å; I193-K196 PolarHBondContact O-N 3.3Å; I193-L197 HydrophobicContact CG2-CD1 3.77Å; I193-L197 HydrophobicContact CG2-CG 4.19Å; I193-L197 VanDerWaalsContact O-CG 3.32Å; I193-L197 WeakPolarHBondContact O-CG 3.47Å; I193-L197 PolarHBondContact O-N 2.95Å; I193-I250 HydrophobicContact CB-CG2 4.49Å; I193-I250 HydrophobicContact CD1-CG2 4.34Å; I193-I250 HydrophobicContact CG2-CG2 3.55Å; I193-L251 VanDerWaalsContact CD1-O 3.3Å; I193-L251 WeakPolarHBondContact CD1-O 3.36Å; I193-D252 HydrophobicContact CD1-CB 3.56Å
194	L	93.4	Very high	92.9	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.1	-37.5	-178.2	-66.3	168.8	0	0	0	112.2	M190 G198 I203 A208 F211 Q212 I250	M190-L194 HydrophobicContact CG-CD1 3.62Å; M190-L194 HydrophobicContact CG-CG 4.09Å; M190-L194 VanDerWaalsContact O-CG 3.31Å; M190-L194 WeakPolarHBondContact O-CG 3.38Å; M190-L194 PolarHBondContact O-N 3.17Å; M190-L194 HydrophobicContact SD-CD1 3.82Å; M190-L194 HydrophobicContact SD-CD2 4.13Å; M190-L194 HydrophobicContact SD-CG 3.72Å; L194-G198 PolarHBondContact O-N 3.44Å; L194-I203 HydrophobicContact CD2-CD1 3.78Å; L194-A208 HydrophobicContact CB-CB 4.23Å; L194-F211 HydrophobicContact CD1-CB 3.89Å; L194-F211 HydrophobicContact CD1-CD1 3.62Å; L194-F211 HydrophobicContact CD1-CG 4.11Å; L194-F211 HydrophobicContact CD2-CB 4.29Å; L194-F211 HydrophobicContact CD2-CD1 4.36Å; L194-F211 HydrophobicContact CD2-CG 4.38Å; L194-Q212 HydrophobicContact CB-CG 4.33Å; L194-Q212 HydrophobicContact CD1-CG 3.65Å; L194-I250 HydrophobicContact CD2-CD1 3.77Å
195	A	90.3	Very high	92.2	Very high	29 Å²	29	34.8 Å²	34.8	24%	0.24	20%	0.195	C	C	.	.	H	α-helix	trans	-60.8	-49.1	174.4	0	0	0	0	0	111.3	T191 W192 I193 G198 Q199	T191-A195 WeakPolarHBondContact O-CB 3.4Å; T191-A195 PolarHBondContact O-N 3.47Å; W192-A195 PolarHBondContact O-N 3.41Å; I193-A195 VanDerWaalsContact C-N 3.32Å; I193-A195 PolarHBondContact O-N 2.93Å; A195-G198 PolarHBondContact O-N 3.39Å; A195-Q199 WeakPolarHBondContact O-CB 3.21Å; A195-Q199 VanDerWaalsContact O-CG 3.24Å; A195-Q199 WeakPolarHBondContact O-CG 3.17Å; A195-Q199 PolarHBondContact O-N 3.19Å
196	K	91.7	Very high	91.4	Very high	24 Å²	24	38.7 Å²	38.7	10%	0.104	21%	0.213	C	C	.	.	H	α-helix	trans	-63	-50.4	178.7	-71.9	175	-172.8	176.5	0	111.6	I147 D148 F152 W192 I193 G198 Q199 L200	I147-K196 HydrophobicContact CG2-CD 3.97Å; D148-K196 IonicContact OD1-NZ 3.81Å; D148-K196 PolarHBondContact OD1-NZ 3.13Å; D148-K196 IonicContact OD2-NZ 3.24Å; D148-K196 PolarHBondContact OD2-NZ 3.38Å; F152-K196 HydrophobicContact CD1-CD 4.11Å; F152-K196 HydrophobicContact CE1-CD 4.18Å; F152-K196 HydrophobicContact CE1-CG 4.31Å; W192-K196 WeakPolarHBondContact O-CB 3.44Å; W192-K196 WeakPolarHBondContact O-CG 3.5Å; W192-K196 PolarHBondContact O-N 3.02Å; I193-K196 PolarHBondContact O-N 3.3Å; K196-G198 VanDerWaalsContact C-N 3.3Å; K196-G198 PolarHBondContact O-N 3.24Å; K196-Q199 PolarHBondContact O-N 3.29Å; K196-L200 WeakPolarHBondContact O-CB 3.26Å; K196-L200 VanDerWaalsContact O-CG 3.27Å; K196-L200 WeakPolarHBondContact O-CG 3.49Å; K196-L200 PolarHBondContact O-N 3.42Å
197	L	93.9	Very high	90.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.3	-38.4	-179.6	-64.3	-179.2	0	0	0	112.1	I147 I184 I193 G201 I202 I203 I250	I147-L197 HydrophobicContact CD1-CD2 4.36Å; I184-L197 HydrophobicContact CB-CD1 4.37Å; I184-L197 HydrophobicContact CD1-CD2 4.37Å; I184-L197 HydrophobicContact CG1-CD1 3.98Å; I184-L197 HydrophobicContact CG1-CD2 4.24Å; I184-L197 HydrophobicContact CG2-CD1 4.24Å; I193-L197 HydrophobicContact CG2-CD1 3.77Å; I193-L197 HydrophobicContact CG2-CG 4.19Å; I193-L197 VanDerWaalsContact O-CG 3.32Å; I193-L197 WeakPolarHBondContact O-CG 3.47Å; I193-L197 PolarHBondContact O-N 2.95Å; L197-G201 PolarHBondContact O-N 3.05Å; L197-I202 HydrophobicContact CB-CB 4.43Å; L197-I202 HydrophobicContact CD2-CB 4.24Å; L197-I202 HydrophobicContact CD2-CD1 3.87Å; L197-I202 HydrophobicContact CD2-CG2 4.05Å; L197-I202 PolarHBondContact O-N 2.86Å; L197-I203 HydrophobicContact CB-CD1 3.78Å; L197-I203 HydrophobicContact CB-CG1 3.75Å; L197-I203 HydrophobicContact CB-CG2 4.44Å; L197-I203 HydrophobicContact CD1-CD1 4.35Å; L197-I203 PolarHBondContact O-N 3.4Å; L197-I250 HydrophobicContact CD1-CD1 3.79Å
198	G	91.5	Very high	90	Very high	5 Å²	5	37.5 Å²	37.5	5%	0.052	20%	0.201	C	C	.	.	H	α-helix	trans	-67.5	-45.4	176.3	0	0	0	0	0	112.7	L194 A195 K196 L200 G201 L205	L194-G198 PolarHBondContact O-N 3.44Å; A195-G198 PolarHBondContact O-N 3.39Å; K196-G198 VanDerWaalsContact C-N 3.3Å; K196-G198 PolarHBondContact O-N 3.24Å; G198-L200 VanDerWaalsContact C-N 3.33Å; G198-L200 PolarHBondContact O-N 3.23Å; G198-G201 PolarHBondContact O-N 2.99Å; G198-G201 VanDerWaalsContact O-N 3.14Å; G198-L205 WeakPolarHBondContact O-CD2 3.39Å
199	Q	88.9	Confident	89.3	Confident	109 Å²	109	42.1 Å²	42.1	51%	0.509	22%	0.218	S	C	.	.	H	α-helix	trans	-66.8	-33.4	177.5	-72	174.6	-2.5	0	0	112.5	V161 A195 K196 G201	V161-Q199 HydrophobicContact CB-CB 4.24Å; V161-Q199 HydrophobicContact CG1-CB 3.86Å; V161-Q199 HydrophobicContact CG2-CB 4.21Å; A195-Q199 WeakPolarHBondContact O-CB 3.21Å; A195-Q199 VanDerWaalsContact O-CG 3.24Å; A195-Q199 WeakPolarHBondContact O-CG 3.17Å; A195-Q199 PolarHBondContact O-N 3.19Å; K196-Q199 PolarHBondContact O-N 3.29Å; Q199-G201 PolarHBondContact O-N 2.86Å
200	L	90.6	Very high	88.7	Confident	9 Å²	9	43.4 Å²	43.4	5%	0.047	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-10.8	174.4	-73.5	167.5	0	0	0	113.3	F152 V161 A165 K196 G198 I202	F152-L200 HydrophobicContact CB-CD1 4.4Å; F152-L200 HydrophobicContact CD2-CD1 3.89Å; F152-L200 HydrophobicContact CD2-CD2 3.87Å; F152-L200 HydrophobicContact CD2-CG 4.26Å; F152-L200 HydrophobicContact CE2-CD2 4.13Å; F152-L200 HydrophobicContact CE2-CG 4.49Å; F152-L200 HydrophobicContact CG-CD1 4.31Å; V161-L200 HydrophobicContact CG1-CB 4.39Å; V161-L200 HydrophobicContact CG1-CD2 3.42Å; V161-L200 VanDerWaalsContact CG1-CD2 3.42Å; V161-L200 HydrophobicContact CG1-CG 3.64Å; A165-L200 HydrophobicContact CB-CD2 3.55Å; K196-L200 WeakPolarHBondContact O-CB 3.26Å; K196-L200 VanDerWaalsContact O-CG 3.27Å; K196-L200 WeakPolarHBondContact O-CG 3.49Å; K196-L200 PolarHBondContact O-N 3.42Å; G198-L200 VanDerWaalsContact C-N 3.33Å; G198-L200 PolarHBondContact O-N 3.23Å; L200-I202 HydrophobicContact CB-CD1 3.83Å; L200-I202 HydrophobicContact CB-CG1 3.87Å; L200-I202 HydrophobicContact CD1-CD1 3.82Å; L200-I202 HydrophobicContact CG-CD1 4.45Å; L200-I202 PolarHBondContact O-N 3.27Å
201	G	90.4	Very high	87.9	Confident	19 Å²	19	44.1 Å²	44.1	20%	0.196	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.9	23.3	-173.5	0	0	0	0	0	113.4	L197 G198 Q199	L197-G201 PolarHBondContact O-N 3.05Å; G198-G201 PolarHBondContact O-N 2.99Å; G198-G201 VanDerWaalsContact O-N 3.14Å; Q199-G201 PolarHBondContact O-N 2.86Å
202	I	93	Very high	87.1	Confident	10 Å²	10	43.2 Å²	43.2	5%	0.051	22%	0.218	C	C	.	.	S	Bend	trans	-79	-34.1	174.7	-66.3	170.9	0	0	0	110.2	I151 L169 L173 L197 L200 F245 I247	I151-I202 HydrophobicContact CD1-CD1 4.26Å; L169-I202 HydrophobicContact CD2-CD1 3.91Å; L173-I202 HydrophobicContact CD1-CD1 4.3Å; L173-I202 HydrophobicContact CD1-CG1 4.08Å; L173-I202 HydrophobicContact CD1-CG2 4.16Å; L197-I202 HydrophobicContact CB-CB 4.43Å; L197-I202 HydrophobicContact CD2-CB 4.24Å; L197-I202 HydrophobicContact CD2-CD1 3.87Å; L197-I202 HydrophobicContact CD2-CG2 4.05Å; L197-I202 PolarHBondContact O-N 2.86Å; L200-I202 HydrophobicContact CB-CD1 3.83Å; L200-I202 HydrophobicContact CB-CG1 3.87Å; L200-I202 HydrophobicContact CD1-CD1 3.82Å; L200-I202 HydrophobicContact CG-CD1 4.45Å; L200-I202 PolarHBondContact O-N 3.27Å; I202-F245 HydrophobicContact CG2-CE2 4.14Å; I202-I247 HydrophobicContact CG2-CD1 3.77Å; I202-I247 HydrophobicContact CG2-CG1 3.68Å
203	I	91.4	Very high	86.1	Confident	5 Å²	5	41.5 Å²	41.5	3%	0.026	22%	0.217	C	C	.	.	S	Bend	trans	-126	151.1	169.6	66.4	179.2	0	0	0	109.6	L133 L194 L197 L205 A208 I247	L133-I203 HydrophobicContact CD1-CG2 4.03Å; L194-I203 HydrophobicContact CD2-CD1 3.78Å; L197-I203 HydrophobicContact CB-CD1 3.78Å; L197-I203 HydrophobicContact CB-CG1 3.75Å; L197-I203 HydrophobicContact CB-CG2 4.44Å; L197-I203 HydrophobicContact CD1-CD1 4.35Å; L197-I203 PolarHBondContact O-N 3.4Å; I203-L205 PolarHBondContact O-N 3.43Å; I203-A208 HydrophobicContact CD1-CB 3.89Å; I203-A208 HydrophobicContact CG1-CB 4.31Å; I203-I247 HydrophobicContact CG2-CB 4.22Å; I203-I247 HydrophobicContact CG2-CG1 3.87Å
204	P	85.3	Confident	85	Confident	41 Å²	41	49.4 Å²	49.4	27%	0.266	25%	0.247	S	C	.	.			trans	-59.2	139.7	174.6	-18.3	27.8	0	0	0	111.6	H206 V207 A208	P204-H206 PolarHBondContact O-N 3.21Å; P204-V207 HydrophobicContact CB-CB 4.37Å; P204-V207 HydrophobicContact CB-CG2 3.96Å; P204-V207 HydrophobicContact CG-CB 4.49Å; P204-V207 HydrophobicContact CG-CG2 3.85Å; P204-V207 WeakPolarHBondContact O-CB 3.49Å; P204-V207 PolarHBondContact O-N 3Å; P204-A208 PolarHBondContact O-N 3.46Å; P204-A208 VanDerWaalsContact O-N 3.08Å
205	L	83.3	Confident	83.6	Confident	107 Å²	107	51.3 Å²	51.3	56%	0.56	26%	0.257	S	S	*	.	H	α-helix	trans	-57.6	-32.9	179.8	-74.5	169.4	0	0	0	113	G198 I203 K209	G198-L205 WeakPolarHBondContact O-CD2 3.39Å; I203-L205 PolarHBondContact O-N 3.43Å; L205-K209 WeakPolarHBondContact O-CG 3.07Å; L205-K209 PolarHBondContact O-N 3.32Å; L205-K209 VanDerWaalsContact O-N 3.13Å
206	H	81.7	Confident	82.2	Confident	82 Å²	82	55 Å²	55	38%	0.38	27%	0.272	S	S	.	.	H	α-helix	trans	-70	-38.6	176.4	70	-102.7	0	0	0	111.7	P204 A208 K209 T210 D238	P204-H206 PolarHBondContact O-N 3.21Å; H206-A208 VanDerWaalsContact C-N 3.32Å; H206-A208 PolarHBondContact O-N 2.94Å; H206-K209 PolarHBondContact O-N 2.9Å; H206-T210 WeakPolarHBondContact O-CB 3.48Å; H206-T210 PolarHBondContact O-N 3.19Å; H206-T210 PolarHBondContact O-OG1 3.44Å; H206-D238 IonicContact ND1-OD2 3.45Å
207	V	81.8	Confident	80.3	Confident	24 Å²	24	59.6 Å²	59.6	15%	0.145	30%	0.297	C	S	.	.	H	α-helix	trans	-61.4	-45	174.9	175.4	0	0	0	0	109.6	L133 P204 K209 T210 F211	L133-V207 HydrophobicContact CD2-CG1 4.02Å; P204-V207 HydrophobicContact CB-CB 4.37Å; P204-V207 HydrophobicContact CB-CG2 3.96Å; P204-V207 HydrophobicContact CG-CB 4.49Å; P204-V207 HydrophobicContact CG-CG2 3.85Å; P204-V207 WeakPolarHBondContact O-CB 3.49Å; P204-V207 PolarHBondContact O-N 3Å; V207-K209 VanDerWaalsContact C-N 3.33Å; V207-K209 PolarHBondContact O-N 3.37Å; V207-T210 PolarHBondContact O-N 2.81Å; V207-F211 VanDerWaalsContact O-CB 3.3Å; V207-F211 WeakPolarHBondContact O-CB 3.47Å; V207-F211 PolarHBondContact O-N 3.38Å
208	A	82.4	Confident	78.3	Confident	5 Å²	5	64.6 Å²	64.6	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-56.5	-46.2	176.2	0	0	0	0	0	112.1	L194 I203 P204 H206 Q212	L194-A208 HydrophobicContact CB-CB 4.23Å; I203-A208 HydrophobicContact CD1-CB 3.89Å; I203-A208 HydrophobicContact CG1-CB 4.31Å; P204-A208 PolarHBondContact O-N 3.46Å; P204-A208 VanDerWaalsContact O-N 3.08Å; H206-A208 VanDerWaalsContact C-N 3.32Å; H206-A208 PolarHBondContact O-N 2.94Å; A208-Q212 WeakPolarHBondContact O-CG 3.5Å; A208-Q212 PolarHBondContact O-N 2.9Å
209	K	80.8	Confident	76.2	Confident	130 Å²	130	71.4 Å²	71.4	57%	0.565	36%	0.363	S	S	*	.	H	α-helix	trans	-68.8	-45.7	179.7	-71.3	175.8	-179	-178.3	0	113	L205 H206 V207 F211 Q212 H213	L205-K209 WeakPolarHBondContact O-CG 3.07Å; L205-K209 PolarHBondContact O-N 3.32Å; L205-K209 VanDerWaalsContact O-N 3.13Å; H206-K209 PolarHBondContact O-N 2.9Å; V207-K209 VanDerWaalsContact C-N 3.33Å; V207-K209 PolarHBondContact O-N 3.37Å; K209-F211 VanDerWaalsContact C-N 3.28Å; K209-F211 PolarHBondContact O-N 2.74Å; K209-Q212 PolarHBondContact O-N 3.22Å; K209-H213 PolarHBondContact O-CD2 2.87Å; K209-H213 VanDerWaalsContact O-CD2 3.23Å; K209-H213 PolarHBondContact O-N 3.12Å
210	T	80.3	Confident	73.9	Confident	73 Å²	73	69.1 Å²	69.1	45%	0.448	37%	0.369	S	S	.	.	H	α-helix	trans	-62.6	-39.1	179.6	-59.2	0	0	0	0	111.2	H206 V207 H213 R214 L234	H206-T210 WeakPolarHBondContact O-CB 3.48Å; H206-T210 PolarHBondContact O-N 3.19Å; H206-T210 PolarHBondContact O-OG1 3.44Å; V207-T210 PolarHBondContact O-N 2.81Å; T210-H213 PolarHBondContact O-N 3.14Å; T210-R214 PolarHBondContact O-N 3.27Å; T210-R214 VanDerWaalsContact O-N 3.13Å; T210-L234 HydrophobicContact CG2-CD2 4.25Å
211	F	77.6	Confident	71.3	Confident	23 Å²	23	73.4 Å²	73.4	10%	0.101	40%	0.395	C	S	.	.	H	α-helix	trans	-66.8	-39.4	178.2	-157.3	-76.8	0	0	0	112.3	R131 L133 M190 L194 V207 K209 H213 R214 N215	R131-F211 HydrophobicContact CB-CE1 4.22Å; R131-F211 HydrophobicContact CB-CZ 3.56Å; R131-F211 HydrophobicContact CG-CE1 4.16Å; R131-F211 HydrophobicContact CG-CZ 3.74Å; L133-F211 HydrophobicContact CD2-CD2 3.44Å; L133-F211 VanDerWaalsContact CD2-CD2 3.44Å; L133-F211 HydrophobicContact CD2-CE2 3.71Å; L133-F211 HydrophobicContact CD2-CG 4.31Å; M190-F211 HydrophobicContact CE-CE1 4.46Å; M190-F211 HydrophobicContact CG-CD1 4.29Å; M190-F211 HydrophobicContact CG-CE1 4.21Å; M190-F211 HydrophobicContact SD-CD1 4.33Å; M190-F211 HydrophobicContact SD-CE1 4.09Å; L194-F211 HydrophobicContact CD1-CB 3.89Å; L194-F211 HydrophobicContact CD1-CD1 3.62Å; L194-F211 HydrophobicContact CD1-CG 4.11Å; L194-F211 HydrophobicContact CD2-CB 4.29Å; L194-F211 HydrophobicContact CD2-CD1 4.36Å; L194-F211 HydrophobicContact CD2-CG 4.38Å; V207-F211 VanDerWaalsContact O-CB 3.3Å; V207-F211 WeakPolarHBondContact O-CB 3.47Å; V207-F211 PolarHBondContact O-N 3.38Å; K209-F211 VanDerWaalsContact C-N 3.28Å; K209-F211 PolarHBondContact O-N 2.74Å; F211-H213 VanDerWaalsContact C-N 3.34Å; F211-H213 PolarHBondContact O-N 3.45Å; F211-R214 PolarHBondContact O-N 3.42Å; F211-N215 PolarHBondContact O-N 3.15Å
212	Q	74.6	Confident	68.6	Low	50 Å²	50	79.1 Å²	79.1	23%	0.234	43%	0.432	C	S	.	.	H	α-helix	trans	-58.8	-43.3	173.3	-74.5	173.2	-16.4	0	0	112	T191 L194 A208 K209 N215 N216	T191-Q212 PolarHBondContact O-NE2 3.38Å; L194-Q212 HydrophobicContact CB-CG 4.33Å; L194-Q212 HydrophobicContact CD1-CG 3.65Å; A208-Q212 WeakPolarHBondContact O-CG 3.5Å; A208-Q212 PolarHBondContact O-N 2.9Å; K209-Q212 PolarHBondContact O-N 3.22Å; Q212-N215 PolarHBondContact O-N 2.96Å; Q212-N216 PolarHBondContact O-N 2.98Å
213	H	71.1	Confident	65.7	Low	127 Å²	127	82.9 Å²	82.9	59%	0.588	46%	0.459	S	S	*	.	H	α-helix	trans	-64.4	-41.5	177.9	-75.5	-60.9	0	0	0	112.8	K209 T210 F211 N215 N216 I217	K209-H213 PolarHBondContact O-CD2 2.87Å; K209-H213 VanDerWaalsContact O-CD2 3.23Å; K209-H213 PolarHBondContact O-N 3.12Å; T210-H213 PolarHBondContact O-N 3.14Å; F211-H213 VanDerWaalsContact C-N 3.34Å; F211-H213 PolarHBondContact O-N 3.45Å; H213-N215 PolarHBondContact O-N 2.95Å; H213-N216 PolarHBondContact O-N 3.07Å; H213-I217 WeakPolarHBondContact O-CG1 3.32Å; H213-I217 PolarHBondContact O-N 3.04Å
214	R	71.3	Confident	62.9	Low	166 Å²	166	88.4 Å²	88.4	63%	0.626	49%	0.494	S	S	*	.	H	α-helix	trans	-61.3	-43.7	179	-174.7	177.9	172.6	100.8	-0.2	112	T210 F211 I217 T218	T210-R214 PolarHBondContact O-N 3.27Å; T210-R214 VanDerWaalsContact O-N 3.13Å; F211-R214 PolarHBondContact O-N 3.42Å; R214-I217 PolarHBondContact O-N 2.82Å; R214-T218 PolarHBondContact O-N 3.26Å
215	N	64	Low	60.2	Low	39 Å²	39	93.6 Å²	93.6	21%	0.209	52%	0.519	C	S	.	.	H	α-helix	trans	-67.8	-33.3	179.2	-82.6	10.6	0	0	0	113.2	M190 F211 Q212 H213 I217 T218	M190-N215 WeakPolarHBondContact CG-ND2 3.36Å; F211-N215 PolarHBondContact O-N 3.15Å; Q212-N215 PolarHBondContact O-N 2.96Å; H213-N215 PolarHBondContact O-N 2.95Å; N215-I217 VanDerWaalsContact C-N 3.33Å; N215-T218 PolarHBondContact O-OG1 2.73Å
216	N	59.9	Low	57.7	Low	107 Å²	107	93.8 Å²	93.8	57%	0.572	53%	0.529	S	S	*	.	H	α-helix	trans	-71.1	-29.4	177.3	-69.6	-13.4	0	0	0	112.7	Q212 H213	Q212-N216 PolarHBondContact O-N 2.98Å; H213-N216 PolarHBondContact O-N 3.07Å
217	I	52.5	Low	55.2	Low	121 Å²	121	97.6 Å²	97.6	62%	0.621	55%	0.552	S	S	*	*	H	α-helix	trans	-71.7	-35.1	-179.5	-68.4	164.7	0	0	0	111	H213 R214 N215 D219 G220	H213-I217 WeakPolarHBondContact O-CG1 3.32Å; H213-I217 PolarHBondContact O-N 3.04Å; R214-I217 PolarHBondContact O-N 2.82Å; N215-I217 VanDerWaalsContact C-N 3.33Å; I217-D219 VanDerWaalsContact C-N 3.28Å; I217-D219 PolarHBondContact O-N 2.77Å; I217-G220 PolarHBondContact O-N 2.71Å
218	T	52	Low	52.7	Low	104 Å²	104	101.3 Å²	101.3	64%	0.638	58%	0.58	S	S	*	*	H	α-helix	trans	-67.9	-24.9	179.9	43.7	0	0	0	0	113.6	R214 N215	R214-T218 PolarHBondContact O-N 3.26Å; N215-T218 PolarHBondContact O-OG1 2.73Å
219	D	47.7	Very low	50.2	Low	149 Å²	149	106.8 Å²	106.8	80%	0.797	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-7.1	-179.4	-73.3	-13.6	0	0	0	113.9	I217	I217-D219 VanDerWaalsContact C-N 3.28Å; I217-D219 PolarHBondContact O-N 2.77Å
220	G	39.7	Very low	47.8	Very low	61 Å²	61	107.8 Å²	107.8	63%	0.629	62%	0.623	S	S	*	*	S	Bend	trans	-108.8	-11	-166.4	0	0	0	0	0	118.1	I217	I217-G220 PolarHBondContact O-N 2.71Å
221	T	36.9	Very low	45.4	Very low	98 Å²	98	110.3 Å²	110.3	60%	0.601	64%	0.644	S	S	*	*			trans	-138.2	90.9	-167.6	-42.7	0	0	0	0	113.7	S223	T221-S223 VanDerWaalsContact C-N 3.28Å; T221-S223 VanDerWaalsContact CG2-OG 3.24Å; T221-S223 WeakPolarHBondContact CG2-OG 3.5Å; T221-S223 PolarHBondContact O-N 3.33Å; T221-S223 VanDerWaalsContact O-N 3.12Å
222	S	33.6	Very low	43.1	Very low	139 Å²	139	117.4 Å²	117.4	97%	0.972	68%	0.677	S	S	*	*			trans	-74.8	79.9	155.9	-61.3	0	0	0	0	109.2
223	S	32.4	Very low	41.2	Very low	90 Å²	90	117.8 Å²	117.8	63%	0.629	69%	0.694	S	S	*	*			trans	-145.7	123	163.3	68.3	0	0	0	0	111.5	T221	T221-S223 VanDerWaalsContact C-N 3.28Å; T221-S223 VanDerWaalsContact CG2-OG 3.24Å; T221-S223 WeakPolarHBondContact CG2-OG 3.5Å; T221-S223 PolarHBondContact O-N 3.33Å; T221-S223 VanDerWaalsContact O-N 3.12Å
224	T	31.3	Very low	40	Very low	121 Å²	121	116.8 Å²	116.8	74%	0.742	69%	0.693	S	S	*	*			trans	-53.2	144.1	178.5	50.6	0	0	0	0	114.3
225	N	29.8	Very low	38.2	Very low	149 Å²	149	115.8 Å²	115.8	80%	0.797	70%	0.7	S	S	*	*			trans	115.5	140.2	145.9	-65.9	-22.6	0	0	0	118
226	S	29.9	Very low	37.1	Very low	111 Å²	111	118.8 Å²	118.8	78%	0.776	72%	0.72	S	S	*	*			trans	73.8	94.4	170.3	50.2	0	0	0	0	117.5	S228	S226-S228 PolarHBondContact O-N 3.02Å
227	D	29.9	Very low	36.1	Very low	162 Å²	162	120 Å²	120	87%	0.866	73%	0.731	S	S	*	*			trans	-27.5	117.2	130.9	-72.5	-43.6	0	0	0	111.7
228	S	28.9	Very low	35.6	Very low	103 Å²	103	119.7 Å²	119.7	72%	0.72	73%	0.731	S	S	*	*				159.1	135.5	128	59.3	0	0	0	0	110.7	S226	S226-S228 PolarHBondContact O-N 3.02Å
229	V	29.3	Very low	35.3	Very low	119 Å²	119	119.8 Å²	119.8	72%	0.721	73%	0.727	S	S	*	*			trans	67.3	94.5	162.5	-163.5	0	0	0	0	115.9
230	L	30.5	Very low	35.1	Very low	152 Å²	152	121.9 Å²	121.9	80%	0.796	73%	0.732	S	S	*	*			trans	-160.6	58.5	137.3	-76.3	-166.5	0	0	0	109.6	E232	L230-E232 VanDerWaalsContact C-N 3.35Å
231	S	30	Very low	35.5	Very low	126 Å²	126	123.8 Å²	123.8	88%	0.881	73%	0.725	S	S	*	*			trans	-103.2	48.7	160.5	68	0	0	0	0	109.1
232	E	30.3	Very low	36.4	Very low	172 Å²	172	120.9 Å²	120.9	80%	0.804	71%	0.705	S	S	*	*			trans	-91.7	108.5	173.5	-146.7	163.3	-155.6	0	0	106.8	L230	L230-E232 VanDerWaalsContact C-N 3.35Å
233	G	35.4	Very low	38	Very low	58 Å²	58	122 Å²	122	60%	0.598	69%	0.693	S	S	*	*			trans	-52	139.3	-174.7	0	0	0	0	0	111.2	N235	G233-N235 PolarHBondContact O-N 3.14Å
234	L	45.2	Very low	40.6	Very low	106 Å²	106	118.5 Å²	118.5	56%	0.555	67%	0.669	S	S	*	*			trans	-45.9	109.4	167.5	-79	147.7	0	0	0	108.6	T210 T236	T210-L234 HydrophobicContact CG2-CD2 4.25Å; L234-T236 PolarHBondContact O-N 3.17Å
235	N	34.3	Very low	43.7	Very low	144 Å²	144	113.2 Å²	113.2	77%	0.77	64%	0.635	S	S	*	*			trans	-50.5	111	-178.9	-79	-40.2	0	0	0	110.1	G233 T237	G233-N235 PolarHBondContact O-N 3.14Å; N235-T237 PolarHBondContact O-N 2.75Å
236	T	39.9	Very low	46.8	Very low	103 Å²	103	113.2 Å²	113.2	63%	0.632	62%	0.624	S	S	*	*			trans	-74.3	26.9	-175.1	50.2	0	0	0	0	113.6	L234 D239	L234-T236 PolarHBondContact O-N 3.17Å; T236-D239 WeakPolarHBondContact O-CB 3.09Å; T236-D239 VanDerWaalsContact O-CG 3.28Å
237	T	39.4	Very low	49.9	Very low	131 Å²	131	108.2 Å²	108.2	80%	0.804	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	2.7	-172.9	54.4	0	0	0	0	114.8	N235	N235-T237 PolarHBondContact O-N 2.75Å
238	D	42.4	Very low	53	Low	116 Å²	116	100.6 Å²	100.6	62%	0.62	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	27.4	173.5	-145.5	19.6	0	0	0	112.1	H206 Q240	H206-D238 IonicContact ND1-OD2 3.45Å; D238-Q240 PolarHBondContact O-N 3.15Å
239	D	45.3	Very low	56.1	Low	105 Å²	105	95.7 Å²	95.7	56%	0.561	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	23.2	-167.4	-114.9	7.8	0	0	0	116.2	T236 K243	T236-D239 WeakPolarHBondContact O-CB 3.09Å; T236-D239 VanDerWaalsContact O-CG 3.28Å; D239-K243 VanDerWaalsContact O-CE 3.25Å; D239-K243 WeakPolarHBondContact O-CE 3.35Å
240	Q	42.7	Very low	59.3	Low	194 Å²	194	90 Å²	90	91%	0.907	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	11.9	177.4	-126.2	146	26.8	0	0	113.4	D238	D238-Q240 PolarHBondContact O-N 3.15Å
241	H	47.7	Very low	62.5	Low	101 Å²	101	82.8 Å²	82.8	47%	0.468	44%	0.441	S	S	.	.	S	Bend	trans	-100.4	116.2	171.3	-163.2	34.1	0	0	0	111.6	K243	H241-K243 PolarHBondContact O-N 3.12Å
242	N	56.6	Low	65.7	Low	36 Å²	36	77.6 Å²	77.6	19%	0.193	40%	0.404	C	S	.	.			trans	29.5	72.4	171.7	-148.1	7	0	0	0	116.3	S244 F245	N242-S244 PolarHBondContact O-N 3.04Å; N242-S244 VanDerWaalsContact OD1-CB 3.29Å; N242-S244 WeakPolarHBondContact OD1-CB 3.44Å; N242-S244 PolarHBondContact OD1-OG 2.89Å; N242-F245 VanDerWaalsContact ND2-CE1 3.27Å; N242-F245 WeakPolarHBondContact ND2-CE1 3.48Å
243	K	66.7	Low	68.9	Low	162 Å²	162	71.9 Å²	71.9	70%	0.704	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-3.5	171.9	-69.9	-174.4	176.4	-177	0	115	D239 H241	D239-K243 VanDerWaalsContact O-CE 3.25Å; D239-K243 WeakPolarHBondContact O-CE 3.35Å; H241-K243 PolarHBondContact O-N 3.12Å
244	S	87.9	Confident	71.7	Confident	18 Å²	18	72.4 Å²	72.4	13%	0.126	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-30.2	-171.9	-43.5	0	0	0	0	113.2	T174 Y177 N242	T174-S244 WeakPolarHBondContact OG1-CB 3.44Å; Y177-S244 WeakPolarHBondContact CD1-O 3.06Å; N242-S244 PolarHBondContact O-N 3.04Å; N242-S244 VanDerWaalsContact OD1-CB 3.29Å; N242-S244 WeakPolarHBondContact OD1-CB 3.44Å; N242-S244 PolarHBondContact OD1-OG 2.89Å
245	F	94.8	Very high	74.2	Confident	9 Å²	9	67.6 Å²	67.6	4%	0.039	35%	0.352	C	S	.	.			trans	-157.1	163.9	176.3	63.5	-94.1	0	0	0	113.6	I170 L173 T174 Y177 I202 N242	I170-F245 HydrophobicContact CD1-CE1 4.3Å; I170-F245 HydrophobicContact CD1-CZ 4.03Å; I170-F245 HydrophobicContact CG2-CE1 4.2Å; L173-F245 HydrophobicContact CB-CD1 3.77Å; L173-F245 HydrophobicContact CB-CD2 3.99Å; L173-F245 HydrophobicContact CB-CE1 3.78Å; L173-F245 HydrophobicContact CB-CE2 4.04Å; L173-F245 HydrophobicContact CB-CG 3.86Å; L173-F245 HydrophobicContact CB-CZ 3.93Å; L173-F245 HydrophobicContact CD1-CD2 4.39Å; L173-F245 HydrophobicContact CD1-CE1 4.33Å; L173-F245 HydrophobicContact CD1-CE2 3.73Å; L173-F245 HydrophobicContact CD1-CZ 3.68Å; L173-F245 HydrophobicContact CG-CE2 4.49Å; L173-F245 HydrophobicContact CG-CZ 4.48Å; T174-F245 WeakPolarHBondContact OG1-CD1 3.48Å; Y177-F245 HydrophobicContact CD1-CB 4.08Å; Y177-F245 HydrophobicContact CD2-CB 4.1Å; Y177-F245 HydrophobicContact CG-CB 3.65Å; I202-F245 HydrophobicContact CG2-CE2 4.14Å; N242-F245 VanDerWaalsContact ND2-CE1 3.27Å; N242-F245 WeakPolarHBondContact ND2-CE1 3.48Å
246	R	94.7	Very high	77.3	Confident	150 Å²	150	61 Å²	61	57%	0.566	32%	0.317	S	S	*	.			trans	-137.9	145.9	172.1	-68.1	-177.1	-88.4	-171.6	-6	111	Y177	Y177-R246 HydrophobicContact CE2-CB 3.94Å; Y177-R246 VanDerWaalsContact CE2-N 3.35Å; Y177-R246 WeakPolarHBondContact CE2-O 3.33Å; Y177-R246 PolarHBondContact OH-NE 3.14Å; Y177-R246 VanDerWaalsContact OH-NE 3.12Å
247	I	95.4	Very high	80	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.031	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.9	168.4	-55.3	-53.7	0	0	0	107.9	L133 I182 I184 I202 I203 I250	L133-I247 VanDerWaalsContact CB-O 3.26Å; L133-I247 WeakPolarHBondContact CB-O 3.5Å; L133-I247 HydrophobicContact CD1-CB 4.18Å; L133-I247 HydrophobicContact CD1-CG2 4.19Å; I182-I247 HydrophobicContact CB-CD1 4.12Å; I182-I247 HydrophobicContact CG2-CD1 3.72Å; I184-I247 HydrophobicContact CD1-CD1 4.29Å; I184-I247 HydrophobicContact CG1-CD1 4.25Å; I184-I247 HydrophobicContact CG1-CG1 4.48Å; I184-I247 HydrophobicContact CG1-CG2 3.81Å; I202-I247 HydrophobicContact CG2-CD1 3.77Å; I202-I247 HydrophobicContact CG2-CG1 3.68Å; I203-I247 HydrophobicContact CG2-CB 4.22Å; I203-I247 HydrophobicContact CG2-CG1 3.87Å; I247-I250 HydrophobicContact CG2-CG1 4.05Å
248	A	95.1	Very high	82.8	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-40.8	-176.3	0	0	0	0	0	112.6	K132 L133 F136 D181 I182	K132-A248 WeakPolarHBondContact CA-O 3.37Å; L133-A248 PolarHBondContact N-O 3.26Å; F136-A248 HydrophobicContact CD1-CB 4.07Å; F136-A248 HydrophobicContact CE1-CB 4.14Å; D181-A248 HydrophobicContact CB-CB 4.02Å; I182-A248 PolarHBondContact O-N 2.97Å
249	L	95.6	Very high	85.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	142.8	-169.7	-170	67.4	0	0	0	111.1	Y128 P130 A183 I184 L251 I275	Y128-L249 WeakPolarHBondContact OH-CD1 3.5Å; Y128-L249 WeakPolarHBondContact OH-CD2 3.48Å; P130-L249 HydrophobicContact CB-CD1 4.26Å; A183-L249 CarbonylContact C-O 3.31Å; A183-L249 VanDerWaalsContact CA-O 3.29Å; A183-L249 WeakPolarHBondContact CA-O 3.43Å; A183-L249 HydrophobicContact CB-CB 3.98Å; A183-L249 HydrophobicContact CB-CD2 4.46Å; I184-L249 PolarHBondContact N-O 3.05Å; L249-L251 HydrophobicContact CD2-CD1 3.64Å; L249-L251 HydrophobicContact CG-CD1 3.72Å; L249-I275 HydrophobicContact CD2-CD1 4.19Å; L249-I275 HydrophobicContact CD2-CG1 4.09Å; L249-I275 HydrophobicContact CD2-CG2 3.97Å
250	I	96.2	Very high	87.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.9	174.5	-55.2	-177.8	0	0	0	111.3	R131 L133 I184 M190 I193 L194 L197 I247	R131-I250 VanDerWaalsContact CB-O 3.3Å; R131-I250 WeakPolarHBondContact CB-O 3.43Å; R131-I250 PolarHBondContact NE-O 3.41Å; R131-I250 PolarHBondContact O-N 3.31Å; L133-I250 HydrophobicContact CD1-CD1 3.36Å; L133-I250 HydrophobicContact CD1-CG1 3.91Å; L133-I250 HydrophobicContact CD2-CD1 4.49Å; L133-I250 HydrophobicContact CG-CD1 3.97Å; L133-I250 HydrophobicContact CG-CG1 4.21Å; I184-I250 HydrophobicContact CB-CG1 4.46Å; I184-I250 CarbonylContact O-C 3.52Å; I184-I250 WeakPolarHBondContact O-CA 3.49Å; M190-I250 HydrophobicContact CE-CB 4Å; M190-I250 HydrophobicContact CE-CG2 3.47Å; M190-I250 VanDerWaalsContact CE-CG2 3.47Å; M190-I250 HydrophobicContact SD-CB 4.27Å; M190-I250 HydrophobicContact SD-CG2 3.61Å; I193-I250 HydrophobicContact CB-CG2 4.49Å; I193-I250 HydrophobicContact CD1-CG2 4.34Å; I193-I250 HydrophobicContact CG2-CG2 3.55Å; L194-I250 HydrophobicContact CD2-CD1 3.77Å; L197-I250 HydrophobicContact CD1-CD1 3.79Å; I247-I250 HydrophobicContact CG2-CG1 4.05Å
251	L	97.5	Very high	89.8	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	147.4	174.3	-63.1	93	0	0	0	110.1	Y128 I184 W185 S186 I193 L249 D255 V274 I275	Y128-L251 HydrophobicContact CE2-CD2 3.7Å; Y128-L251 HydrophobicContact CE2-CG 4.11Å; I184-L251 PolarHBondContact O-N 3.16Å; W185-L251 WeakPolarHBondContact CA-O 3.39Å; W185-L251 HydrophobicContact CB-CB 3.99Å; W185-L251 VanDerWaalsContact CD1-CB 3.48Å; W185-L251 HydrophobicContact CD2-CB 3.71Å; W185-L251 HydrophobicContact CD2-CD2 3.89Å; W185-L251 HydrophobicContact CD2-CG 4.27Å; W185-L251 HydrophobicContact CE3-CB 4.43Å; W185-L251 HydrophobicContact CE3-CD2 3.87Å; W185-L251 HydrophobicContact CG-CB 3.5Å; W185-L251 VanDerWaalsContact CG-CB 3.5Å; W185-L251 HydrophobicContact CG-CG 4.44Å; W185-L251 HydrophobicContact CH2-CD2 3.96Å; W185-L251 HydrophobicContact CZ2-CD2 3.99Å; W185-L251 HydrophobicContact CZ3-CD2 3.9Å; S186-L251 PolarHBondContact N-O 3.08Å; I193-L251 VanDerWaalsContact CD1-O 3.3Å; I193-L251 WeakPolarHBondContact CD1-O 3.36Å; L249-L251 HydrophobicContact CD2-CD1 3.64Å; L249-L251 HydrophobicContact CG-CD1 3.72Å; L251-D255 VanDerWaalsContact CA-OD2 3.29Å; L251-D255 WeakPolarHBondContact CA-OD2 3.41Å; L251-D255 HydrophobicContact CB-CB 4.35Å; L251-D255 VanDerWaalsContact CB-OD2 3.28Å; L251-D255 WeakPolarHBondContact CB-OD2 3.35Å; L251-D255 HydrophobicContact CD2-CB 4.06Å; L251-V274 HydrophobicContact CD2-CG1 4.27Å; L251-I275 HydrophobicContact CD1-CD1 3.78Å; L251-I275 HydrophobicContact CD1-CG1 4.09Å; L251-I275 HydrophobicContact CD2-CD1 4.13Å; L251-I275 HydrophobicContact CD2-CG1 3.77Å
252	D	96.5	Very high	91.6	Very high	17 Å²	17	38.2 Å²	38.2	9%	0.091	20%	0.204	C	C	.	.			trans	-127.4	-173.5	-176.7	84.4	-8.5	0	0	0	111	R131 W185 S186 T188 M190 I193 S254 D255	R131-D252 VanDerWaalsContact NH2-N 3.13Å; R131-D252 IonicContact NH2-OD1 2.78Å; R131-D252 PolarHBondContact NH2-OD1 3.18Å; W185-D252 PolarHBondContact NE1-O 3.23Å; S186-D252 CarbonylContact O-C 3.57Å; S186-D252 VanDerWaalsContact O-C 3.31Å; S186-D252 WeakPolarHBondContact O-CA 3.36Å; T188-D252 WeakPolarHBondContact O-CB 3.48Å; M190-D252 HydrophobicContact CB-CB 4.38Å; M190-D252 WeakPolarHBondContact CB-OD2 3.34Å; M190-D252 HydrophobicContact CE-CB 4.1Å; M190-D252 PolarHBondContact N-OD2 3.38Å; I193-D252 HydrophobicContact CD1-CB 3.56Å; D252-S254 PolarHBondContact O-N 3.14Å; D252-S254 VanDerWaalsContact O-N 3.14Å; D252-S254 VanDerWaalsContact OD1-CB 3.26Å; D252-S254 WeakPolarHBondContact OD1-CB 3.32Å; D252-S254 PolarHBondContact OD1-N 3.42Å; D252-S254 PolarHBondContact OD1-OG 3.37Å; D252-D255 PolarHBondContact N-OD2 2.68Å; D252-D255 PolarHBondContact O-N 2.86Å; D252-D255 VanDerWaalsContact O-N 3.09Å
253	S	96.6	Very high	92.7	Very high	53 Å²	53	41.8 Å²	41.8	37%	0.371	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-58.6	-25.1	-179.5	56.6	0	0	0	0	113.6	S186 T188 D255 M256	S186-S253 PolarHBondContact O-N 2.96Å; T188-S253 PolarHBondContact O-N 3.48Å; S253-D255 PolarHBondContact O-N 2.94Å; S253-M256 WeakPolarHBondContact O-CB 3.41Å; S253-M256 PolarHBondContact O-N 2.93Å
254	S	95.9	Very high	93.5	Very high	68 Å²	68	35.6 Å²	35.6	48%	0.476	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-69.1	-17.8	179.2	73	0	0	0	0	113.1	R124 D252	R124-S254 PolarHBondContact NH1-O 3.36Å; D252-S254 PolarHBondContact O-N 3.14Å; D252-S254 VanDerWaalsContact O-N 3.14Å; D252-S254 VanDerWaalsContact OD1-CB 3.26Å; D252-S254 WeakPolarHBondContact OD1-CB 3.32Å; D252-S254 PolarHBondContact OD1-N 3.42Å; D252-S254 PolarHBondContact OD1-OG 3.37Å
255	D	97.5	Very high	93.5	Very high	5 Å²	5	36.1 Å²	36.1	3%	0.027	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-90.9	-4.2	177.2	-54.1	-46.4	0	0	0	113.4	R124 Y128 R131 W185 L251 D252 S253	R124-D255 PolarHBondContact NH1-O 2.85Å; Y128-D255 WeakPolarHBondContact CD2-OD1 3.42Å; R131-D255 IonicContact CZ-OD2 2.62Å; R131-D255 IonicContact NH1-OD1 3.99Å; R131-D255 IonicContact NH1-OD2 3.26Å; R131-D255 IonicContact NH2-OD1 3.63Å; R131-D255 IonicContact NH2-OD2 3.84Å; R131-D255 PolarHBondContact NH2-OD2 2.9Å; W185-D255 HydrophobicContact CZ2-CB 3.84Å; L251-D255 VanDerWaalsContact CA-OD2 3.29Å; L251-D255 WeakPolarHBondContact CA-OD2 3.41Å; L251-D255 HydrophobicContact CB-CB 4.35Å; L251-D255 VanDerWaalsContact CB-OD2 3.28Å; L251-D255 WeakPolarHBondContact CB-OD2 3.35Å; L251-D255 HydrophobicContact CD2-CB 4.06Å; D252-D255 PolarHBondContact N-OD2 2.68Å; D252-D255 PolarHBondContact O-N 2.86Å; D252-D255 VanDerWaalsContact O-N 3.09Å; S253-D255 PolarHBondContact O-N 2.94Å
256	M	98.1	Very high	93.4	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.025	23%	0.228	C	C	.	.			trans	-87.2	146	178	-62.5	-179.9	74.7	0	0	114.4	R124 W185 A187 S253 E268 V269 K270	R124-M256 VanDerWaalsContact CZ-O 3.26Å; R124-M256 PolarHBondContact NH1-O 3.25Å; R124-M256 PolarHBondContact NH2-O 3.46Å; W185-M256 HydrophobicContact CZ2-CG 4.48Å; A187-M256 VanDerWaalsContact CA-SD 3.58Å; A187-M256 HydrophobicContact CB-CE 3.95Å; A187-M256 HydrophobicContact CB-SD 3.47Å; A187-M256 WeakPolarHBondContact CB-SD 3.32Å; S253-M256 WeakPolarHBondContact O-CB 3.41Å; S253-M256 PolarHBondContact O-N 2.93Å; M256-E268 HydrophobicContact CB-CB 4.14Å; M256-E268 VanDerWaalsContact CE-C 3.41Å; M256-E268 HydrophobicContact CE-CB 3.69Å; M256-E268 VanDerWaalsContact CE-O 3.26Å; M256-E268 WeakPolarHBondContact CE-O 3.46Å; M256-E268 HydrophobicContact SD-CB 4.32Å; M256-V269 CarbonylContact C-O 3.58Å; M256-V269 WeakPolarHBondContact CA-O 3.27Å; M256-V269 WeakPolarHBondContact CB-O 3.41Å; M256-K270 HydrophobicContact CE-CG 3.78Å; M256-K270 HydrophobicContact CG-CG 3.99Å; M256-K270 HydrophobicContact SD-CG 4.19Å
257	I	97.8	Very high	93.3	Very high	4 Å²	4	36 Å²	36	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	148	177.9	66.3	166.4	0	0	0	111.9	K120 V121 R124 V259 E268 V269 P271 M299	K120-I257 HydrophobicContact CB-CB 4.36Å; K120-I257 HydrophobicContact CB-CD1 4.01Å; K120-I257 HydrophobicContact CB-CG2 4.38Å; V121-I257 HydrophobicContact CG2-CD1 3.49Å; V121-I257 VanDerWaalsContact CG2-CD1 3.49Å; R124-I257 HydrophobicContact CB-CG2 3.98Å; R124-I257 HydrophobicContact CG-CG2 4.37Å; I257-V259 HydrophobicContact CD1-CG2 4.2Å; I257-V259 HydrophobicContact CG1-CG2 4.26Å; I257-E268 CarbonylContact O-C 3.6Å; I257-E268 WeakPolarHBondContact O-CA 3.38Å; I257-V269 HydrophobicContact CD1-CG2 4.48Å; I257-V269 HydrophobicContact CG1-CG2 3.78Å; I257-V269 PolarHBondContact N-O 3.48Å; I257-V269 PolarHBondContact O-N 2.9Å; I257-P271 HydrophobicContact CD1-CG 4.3Å; I257-P271 HydrophobicContact CG1-CG 4Å; I257-P271 HydrophobicContact CG2-CG 4.1Å; I257-M299 HydrophobicContact CD1-CG 4.26Å
258	S	97.2	Very high	93.4	Very high	44 Å²	44	39.8 Å²	39.8	31%	0.308	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	121.7	174.7	-29.3	0	0	0	0	111.2	K120 K267 E268	K120-S258 VanDerWaalsContact CD-O 3.32Å; K120-S258 WeakPolarHBondContact CD-O 3.45Å; K120-S258 WeakPolarHBondContact CE-O 3.47Å; K120-S258 PolarHBondContact NZ-O 3.43Å; S258-K267 CarbonylContact C-O 3.52Å; S258-K267 WeakPolarHBondContact CA-O 3.14Å; S258-E268 VanDerWaalsContact CB-OE1 3.27Å; S258-E268 WeakPolarHBondContact CB-OE1 3.3Å; S258-E268 PolarHBondContact N-OE2 3.21Å; S258-E268 VanDerWaalsContact N-OE2 3.14Å; S258-E268 PolarHBondContact OG-OE1 3.21Å
259	V	95.5	Very high	93.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	137.6	174.8	172.6	0	0	0	0	108.9	L111 I257 F261 I266 K267 V269 M299	L111-V259 HydrophobicContact CB-CG1 4.23Å; L111-V259 HydrophobicContact CD1-CG1 3.96Å; L111-V259 HydrophobicContact CD2-CG1 4.4Å; L111-V259 HydrophobicContact CG-CG1 4.44Å; I257-V259 HydrophobicContact CD1-CG2 4.2Å; I257-V259 HydrophobicContact CG1-CG2 4.26Å; V259-F261 HydrophobicContact CB-CE2 3.93Å; V259-F261 HydrophobicContact CG1-CD2 4.21Å; V259-F261 HydrophobicContact CG1-CE2 3.81Å; V259-F261 HydrophobicContact CG1-CZ 4.24Å; V259-I266 WeakPolarHBondContact O-CA 3.12Å; V259-K267 PolarHBondContact N-O 3.23Å; V259-K267 PolarHBondContact O-N 3.17Å; V259-V269 HydrophobicContact CB-CG1 4.4Å; V259-V269 HydrophobicContact CB-CG2 4.33Å; V259-V269 HydrophobicContact CG2-CG1 4.49Å; V259-V269 HydrophobicContact CG2-CG2 3.56Å; V259-M299 HydrophobicContact CG2-SD 4.28Å
260	N	92.8	Very high	93.6	Very high	95 Å²	95	39.7 Å²	39.7	51%	0.508	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	113.4	177.3	-171	22.8	0	0	0	110.1	I266	N260-I266 HydrophobicContact CB-CG1 4.32Å
261	F	89.9	Confident	93.7	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.018	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.7	173.5	-67.2	-101.7	0	0	0	108.7	F104 L111 V259 E263 H264 G265 K267 V269 R295 I298	F104-F261 HydrophobicContact CB-CE1 4.37Å; L111-F261 HydrophobicContact CD1-CD1 3.6Å; L111-F261 HydrophobicContact CD1-CE1 3.68Å; L111-F261 HydrophobicContact CD1-CG 4.11Å; L111-F261 HydrophobicContact CD1-CZ 4.24Å; V259-F261 HydrophobicContact CB-CE2 3.93Å; V259-F261 HydrophobicContact CG1-CD2 4.21Å; V259-F261 HydrophobicContact CG1-CE2 3.81Å; V259-F261 HydrophobicContact CG1-CZ 4.24Å; F261-E263 VanDerWaalsContact C-N 3.32Å; F261-E263 PolarHBondContact O-N 3.5Å; F261-H264 HydrophobicContact CB-CB 3.97Å; F261-H264 PolarHBondContact O-N 3.14Å; F261-G265 WeakPolarHBondContact CB-O 3.49Å; F261-G265 PolarHBondContact N-O 3.09Å; F261-G265 WeakPolarHBondContact O-CA 3.41Å; F261-G265 PolarHBondContact O-N 3.01Å; F261-K267 HydrophobicContact CD2-CB 3.87Å; F261-K267 HydrophobicContact CD2-CG 3.83Å; F261-K267 HydrophobicContact CE2-CB 3.75Å; F261-K267 HydrophobicContact CE2-CG 4.15Å; F261-V269 HydrophobicContact CE2-CG1 4.02Å; F261-V269 HydrophobicContact CZ-CG1 4.04Å; F261-R295 HydrophobicContact CE1-CB 4.07Å; F261-R295 HydrophobicContact CZ-CB 3.85Å; F261-I298 HydrophobicContact CE1-CG1 4.22Å; F261-I298 HydrophobicContact CZ-CB 4.3Å; F261-I298 HydrophobicContact CZ-CG1 4.34Å; F261-I298 HydrophobicContact CZ-CG2 3.99Å
262	T	85	Confident	93.7	Very high	125 Å²	125	39.7 Å²	39.7	77%	0.767	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-43.5	-170.2	-53.2	0	0	0	0	112.9
263	E	80.2	Confident	93.8	Very high	112 Å²	112	39.7 Å²	39.7	52%	0.523	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-25.5	-177.1	-65.8	-178.5	171.1	0	0	113.2	K105 F261	K105-E263 VanDerWaalsContact CE-OE2 3.24Å; K105-E263 WeakPolarHBondContact CE-OE2 3.39Å; K105-E263 IonicContact NZ-OE1 2.71Å; K105-E263 PolarHBondContact NZ-OE1 2.8Å; K105-E263 IonicContact NZ-OE2 2.7Å; K105-E263 PolarHBondContact NZ-OE2 2.98Å; F261-E263 VanDerWaalsContact C-N 3.32Å; F261-E263 PolarHBondContact O-N 3.5Å
264	H	82.6	Confident	93.8	Very high	32 Å²	32	37.2 Å²	37.2	15%	0.148	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-4.7	-172.2	-51	86.8	0	0	0	113.8	V99 D100 D101 F261 K267	V99-H264 WeakPolarHBondContact CG1-CD2 3.23Å; D100-H264 PolarHBondContact O-CD2 3.43Å; D100-H264 PolarHBondContact O-NE2 2.87Å; D101-H264 VanDerWaalsContact CA-CD2 3.45Å; D101-H264 WeakPolarHBondContact CA-CD2 3.34Å; D101-H264 HydrophobicContact CB-CB 4.34Å; F261-H264 HydrophobicContact CB-CB 3.97Å; F261-H264 PolarHBondContact O-N 3.14Å; H264-K267 WeakPolarHBondContact O-CE 3.13Å
265	G	88.8	Confident	93.9	Very high	28 Å²	28	34 Å²	34	29%	0.289	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	72	-157.9	-177.4	0	0	0	0	0	113.4	F261 K267	F261-G265 WeakPolarHBondContact CB-O 3.49Å; F261-G265 PolarHBondContact N-O 3.09Å; F261-G265 WeakPolarHBondContact O-CA 3.41Å; F261-G265 PolarHBondContact O-N 3.01Å; G265-K267 PolarHBondContact O-N 3.28Å
266	I	93.1	Very high	93.9	Very high	119 Å²	119	35 Å²	35	61%	0.61	19%	0.191	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-76.3	126.6	-175.9	-59	173	0	0	0	110.3	V259 N260	V259-I266 WeakPolarHBondContact O-CA 3.12Å; N260-I266 HydrophobicContact CB-CG1 4.32Å
267	K	92.8	Very high	93.8	Very high	39 Å²	39	39.8 Å²	39.8	17%	0.17	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.9	176	-55.7	-70.2	172.7	171.7	0	110.7	D101 S258 V259 F261 H264 G265	D101-K267 IonicContact OD2-NZ 3.78Å; D101-K267 PolarHBondContact OD2-NZ 3.36Å; S258-K267 CarbonylContact C-O 3.52Å; S258-K267 WeakPolarHBondContact CA-O 3.14Å; V259-K267 PolarHBondContact N-O 3.23Å; V259-K267 PolarHBondContact O-N 3.17Å; F261-K267 HydrophobicContact CD2-CB 3.87Å; F261-K267 HydrophobicContact CD2-CG 3.83Å; F261-K267 HydrophobicContact CE2-CB 3.75Å; F261-K267 HydrophobicContact CE2-CG 4.15Å; H264-K267 WeakPolarHBondContact O-CE 3.13Å; G265-K267 PolarHBondContact O-N 3.28Å
268	E	96.2	Very high	93.6	Very high	84 Å²	84	42.5 Å²	42.5	39%	0.393	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	135.2	171.1	-63.8	-58.5	143.7	0	0	110.6	M256 I257 S258	M256-E268 HydrophobicContact CB-CB 4.14Å; M256-E268 VanDerWaalsContact CE-C 3.41Å; M256-E268 HydrophobicContact CE-CB 3.69Å; M256-E268 VanDerWaalsContact CE-O 3.26Å; M256-E268 WeakPolarHBondContact CE-O 3.46Å; M256-E268 HydrophobicContact SD-CB 4.32Å; I257-E268 CarbonylContact O-C 3.6Å; I257-E268 WeakPolarHBondContact O-CA 3.38Å; S258-E268 VanDerWaalsContact CB-OE1 3.27Å; S258-E268 WeakPolarHBondContact CB-OE1 3.3Å; S258-E268 PolarHBondContact N-OE2 3.21Å; S258-E268 VanDerWaalsContact N-OE2 3.14Å; S258-E268 PolarHBondContact OG-OE1 3.21Å
269	V	97	Very high	93.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	163.3	179.2	-52.7	0	0	0	0	111.6	M256 I257 V259 F261 P271 R295 I298 M299	M256-V269 CarbonylContact C-O 3.58Å; M256-V269 WeakPolarHBondContact CA-O 3.27Å; M256-V269 WeakPolarHBondContact CB-O 3.41Å; I257-V269 HydrophobicContact CD1-CG2 4.48Å; I257-V269 HydrophobicContact CG1-CG2 3.78Å; I257-V269 PolarHBondContact N-O 3.48Å; I257-V269 PolarHBondContact O-N 2.9Å; V259-V269 HydrophobicContact CB-CG1 4.4Å; V259-V269 HydrophobicContact CB-CG2 4.33Å; V259-V269 HydrophobicContact CG2-CG1 4.49Å; V259-V269 HydrophobicContact CG2-CG2 3.56Å; F261-V269 HydrophobicContact CE2-CG1 4.02Å; F261-V269 HydrophobicContact CZ-CG1 4.04Å; V269-P271 WeakPolarHBondContact O-CD 2.95Å; V269-R295 VanDerWaalsContact CG1-O 3.23Å; V269-R295 WeakPolarHBondContact CG1-O 3.37Å; V269-I298 HydrophobicContact CB-CG2 4.04Å; V269-I298 HydrophobicContact CG1-CG2 3.78Å; V269-I298 HydrophobicContact CG2-CG2 3.98Å; V269-M299 HydrophobicContact CG2-CG 3.96Å
270	K	97.9	Very high	93.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.254	C	S	.	.			trans	-106.2	88.1	-172.8	-60	172.8	-176.7	171.7	0	111	D146 W185 M256 L272 M289 D291 N296	D146-K270 VanDerWaalsContact CG-NZ 3.29Å; D146-K270 IonicContact OD1-NZ 3.98Å; D146-K270 PolarHBondContact OD1-NZ 3.1Å; W185-K270 HydrophobicContact CB-CD 4.35Å; W185-K270 HydrophobicContact CD2-CB 3.78Å; W185-K270 HydrophobicContact CD2-CD 4.05Å; W185-K270 HydrophobicContact CD2-CG 3.9Å; W185-K270 HydrophobicContact CE3-CB 3.9Å; W185-K270 HydrophobicContact CG-CB 4.47Å; W185-K270 HydrophobicContact CG-CD 3.84Å; W185-K270 HydrophobicContact CG-CG 4.12Å; W185-K270 HydrophobicContact CH2-CB 3.95Å; W185-K270 HydrophobicContact CZ2-CB 3.81Å; W185-K270 HydrophobicContact CZ2-CG 4.22Å; W185-K270 HydrophobicContact CZ3-CB 3.99Å; W185-K270 WeakPolarHBondContact O-CE 3.38Å; W185-K270 PolarHBondContact O-NZ 3.47Å; M256-K270 HydrophobicContact CE-CG 3.78Å; M256-K270 HydrophobicContact CG-CG 3.99Å; M256-K270 HydrophobicContact SD-CG 4.19Å; K270-L272 PolarHBondContact O-N 3.02Å; K270-M289 HydrophobicContact CB-CE 3.95Å; K270-M289 HydrophobicContact CB-SD 4.47Å; K270-M289 HydrophobicContact CD-CE 3.38Å; K270-M289 HydrophobicContact CG-CE 4.26Å; K270-D291 IonicContact NZ-OD2 3.25Å; K270-D291 PolarHBondContact NZ-OD2 3.34Å; K270-N296 WeakPolarHBondContact CA-O 3.09Å; K270-N296 WeakPolarHBondContact CB-O 3.4Å; K270-N296 HydrophobicContact CD-CB 4.19Å; K270-N296 HydrophobicContact CG-CB 4.48Å; K270-N296 PolarHBondContact N-O 2.86Å
271	P	97.9	Very high	93.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.249	C	C	.	.			trans	-75.8	105.5	-179.6	29.9	-35	0	0	0	111.6	V121 W185 I257 V269 A273 V274 M299	V121-P271 HydrophobicContact CG1-CB 4.34Å; V121-P271 HydrophobicContact CG2-CB 3.7Å; V121-P271 HydrophobicContact CG2-CG 4.29Å; W185-P271 HydrophobicContact CH2-CG 4.44Å; W185-P271 WeakPolarHBondContact CH2-O 3.33Å; I257-P271 HydrophobicContact CD1-CG 4.3Å; I257-P271 HydrophobicContact CG1-CG 4Å; I257-P271 HydrophobicContact CG2-CG 4.1Å; V269-P271 WeakPolarHBondContact O-CD 2.95Å; P271-A273 PolarHBondContact O-N 3.18Å; P271-V274 HydrophobicContact CB-CG2 4.48Å; P271-V274 HydrophobicContact CG-CG2 3.77Å; P271-V274 WeakPolarHBondContact O-CB 3.43Å; P271-V274 WeakPolarHBondContact O-CG2 3.44Å; P271-V274 PolarHBondContact O-N 3.21Å; P271-M299 HydrophobicContact CB-CB 4.16Å; P271-M299 HydrophobicContact CB-CG 4.26Å
272	L	98.4	Very high	94.1	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23.1	-179.1	-69.6	173.2	0	0	0	113.8	V144 W185 K270 V274 I275 W276 T287 M289 N300	V144-L272 HydrophobicContact CB-CD2 4.32Å; V144-L272 HydrophobicContact CG1-CD2 4.36Å; V144-L272 HydrophobicContact CG2-CD2 3.79Å; W185-L272 HydrophobicContact CE3-CD2 4.4Å; W185-L272 HydrophobicContact CZ3-CD2 4.2Å; K270-L272 PolarHBondContact O-N 3.02Å; L272-V274 PolarHBondContact O-N 3.43Å; L272-V274 VanDerWaalsContact O-N 3.1Å; L272-I275 HydrophobicContact CD2-CD1 4.33Å; L272-I275 WeakPolarHBondContact O-CB 3.19Å; L272-I275 PolarHBondContact O-N 3.01Å; L272-W276 HydrophobicContact CB-CD2 4.08Å; L272-W276 HydrophobicContact CB-CE3 4.34Å; L272-W276 HydrophobicContact CB-CH2 3.72Å; L272-W276 HydrophobicContact CB-CZ2 3.4Å; L272-W276 HydrophobicContact CB-CZ3 4.18Å; L272-W276 HydrophobicContact CD1-CH2 4.11Å; L272-W276 HydrophobicContact CD1-CZ2 3.64Å; L272-W276 HydrophobicContact CG-CZ2 4.15Å; L272-W276 PolarHBondContact O-N 3.45Å; L272-W276 VanDerWaalsContact O-N 3.08Å; L272-T287 HydrophobicContact CD1-CG2 4.1Å; L272-T287 HydrophobicContact CD2-CG2 4.38Å; L272-M289 HydrophobicContact CD1-CB 4.2Å; L272-M289 HydrophobicContact CD1-SD 4.46Å; L272-M289 HydrophobicContact CD2-CB 4.42Å; L272-M289 HydrophobicContact CD2-SD 3.94Å; L272-M289 HydrophobicContact CG-SD 4.24Å; L272-N300 HydrophobicContact CB-CB 4.3Å; L272-N300 HydrophobicContact CD1-CB 3.99Å; L272-N300 HydrophobicContact CG-CB 4.38Å; L272-N300 PolarHBondContact N-OD1 2.56Å
273	A	97.8	Very high	94.7	Very high	17 Å²	17	40.2 Å²	40.2	14%	0.14	21%	0.214	C	C	.	.	H	α-helix	trans	-55.3	-24.8	171.6	0	0	0	0	0	113.8	V121 C125 P271 I275 W276 N277	V121-A273 HydrophobicContact CG1-CB 3.64Å; C125-A273 PolarHBondContact SG-O 3.48Å; C125-A273 VanDerWaalsContact SG-O 3.39Å; P271-A273 PolarHBondContact O-N 3.18Å; A273-I275 VanDerWaalsContact C-N 3.28Å; A273-I275 PolarHBondContact O-N 3.29Å; A273-W276 HydrophobicContact CB-CE3 4.28Å; A273-W276 PolarHBondContact O-N 3.11Å; A273-N277 VanDerWaalsContact O-CB 3.31Å; A273-N277 WeakPolarHBondContact O-CB 3.27Å; A273-N277 PolarHBondContact O-N 3.43Å
274	V	97.6	Very high	95.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.3	-41.2	172.5	170.2	0	0	0	0	111.2	R124 Y128 W185 L251 P271 L272 N278	R124-V274 HydrophobicContact CB-CG2 4.07Å; R124-V274 HydrophobicContact CG-CG2 3.6Å; Y128-V274 HydrophobicContact CD1-CG1 3.88Å; Y128-V274 WeakPolarHBondContact CD1-O 3.31Å; Y128-V274 HydrophobicContact CD2-CG1 3.33Å; Y128-V274 HydrophobicContact CE1-CG1 4.23Å; Y128-V274 HydrophobicContact CE2-CG1 3.78Å; Y128-V274 HydrophobicContact CG-CG1 3.38Å; W185-V274 HydrophobicContact CH2-CB 4.27Å; L251-V274 HydrophobicContact CD2-CG1 4.27Å; P271-V274 HydrophobicContact CB-CG2 4.48Å; P271-V274 HydrophobicContact CG-CG2 3.77Å; P271-V274 WeakPolarHBondContact O-CB 3.43Å; P271-V274 WeakPolarHBondContact O-CG2 3.44Å; P271-V274 PolarHBondContact O-N 3.21Å; L272-V274 PolarHBondContact O-N 3.43Å; L272-V274 VanDerWaalsContact O-N 3.1Å; V274-N278 PolarHBondContact O-ND2 3Å; V274-N278 VanDerWaalsContact O-ND2 3.11Å
275	I	97.9	Very high	96.3	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-74	-52.9	174.9	-57.9	175.4	0	0	0	109.7	L142 V144 W185 L249 L251 L272 A273 N277 N278 H279 W282	L142-I275 HydrophobicContact CD2-CD1 4.38Å; L142-I275 HydrophobicContact CD2-CG2 3.8Å; V144-I275 HydrophobicContact CG2-CD1 4.02Å; W185-I275 HydrophobicContact CE3-CD1 4.16Å; W185-I275 HydrophobicContact CZ3-CD1 4.16Å; W185-I275 HydrophobicContact CZ3-CG1 4.39Å; L249-I275 HydrophobicContact CD2-CD1 4.19Å; L249-I275 HydrophobicContact CD2-CG1 4.09Å; L249-I275 HydrophobicContact CD2-CG2 3.97Å; L251-I275 HydrophobicContact CD1-CD1 3.78Å; L251-I275 HydrophobicContact CD1-CG1 4.09Å; L251-I275 HydrophobicContact CD2-CD1 4.13Å; L251-I275 HydrophobicContact CD2-CG1 3.77Å; L272-I275 HydrophobicContact CD2-CD1 4.33Å; L272-I275 WeakPolarHBondContact O-CB 3.19Å; L272-I275 PolarHBondContact O-N 3.01Å; A273-I275 VanDerWaalsContact C-N 3.28Å; A273-I275 PolarHBondContact O-N 3.29Å; I275-N277 VanDerWaalsContact C-N 3.34Å; I275-N277 PolarHBondContact O-N 2.85Å; I275-N278 PolarHBondContact O-N 2.91Å; I275-N278 VanDerWaalsContact O-N 3.07Å; I275-H279 PolarHBondContact O-N 2.96Å; I275-W282 HydrophobicContact CG2-CE3 4Å; I275-W282 HydrophobicContact CG2-CZ3 4.38Å
276	W	97.9	Very high	96.8	Very high	27 Å²	27	39.4 Å²	39.4	10%	0.102	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-38.1	-171.3	-55.3	-30.5	0	0	0	113.6	L272 A273 N278 H279 P284 T287 N300	L272-W276 HydrophobicContact CB-CD2 4.08Å; L272-W276 HydrophobicContact CB-CE3 4.34Å; L272-W276 HydrophobicContact CB-CH2 3.72Å; L272-W276 HydrophobicContact CB-CZ2 3.4Å; L272-W276 HydrophobicContact CB-CZ3 4.18Å; L272-W276 HydrophobicContact CD1-CH2 4.11Å; L272-W276 HydrophobicContact CD1-CZ2 3.64Å; L272-W276 HydrophobicContact CG-CZ2 4.15Å; L272-W276 PolarHBondContact O-N 3.45Å; L272-W276 VanDerWaalsContact O-N 3.08Å; A273-W276 HydrophobicContact CB-CE3 4.28Å; A273-W276 PolarHBondContact O-N 3.11Å; W276-N278 PolarHBondContact O-N 3.45Å; W276-H279 CarbonylContact O-C 3.52Å; W276-H279 VanDerWaalsContact O-C 3.31Å; W276-H279 PolarHBondContact O-N 3.04Å; W276-P284 HydrophobicContact CE3-CG 4.24Å; W276-P284 HydrophobicContact CH2-CB 4.22Å; W276-P284 HydrophobicContact CH2-CG 3.65Å; W276-P284 HydrophobicContact CZ2-CG 4.3Å; W276-P284 HydrophobicContact CZ3-CG 3.6Å; W276-T287 HydrophobicContact CZ2-CG2 4.21Å; W276-T287 PolarHBondContact NE1-OG1 3.39Å; W276-N300 HydrophobicContact CH2-CB 3.95Å; W276-N300 WeakPolarHBondContact CH2-ND2 3.34Å; W276-N300 HydrophobicContact CZ3-CB 4.5Å; W276-N300 WeakPolarHBondContact CZ3-ND2 3.5Å
277	N	95.9	Very high	97.1	Very high	105 Å²	105	33.8 Å²	33.8	56%	0.561	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-25.5	178.8	-76.3	4.8	0	0	0	113.1	C125 A273 I275	C125-N277 HydrophobicContact CB-CB 4.09Å; C125-N277 WeakPolarHBondContact CB-ND2 3.45Å; C125-N277 PolarHBondContact SG-ND2 3.23Å; A273-N277 VanDerWaalsContact O-CB 3.31Å; A273-N277 WeakPolarHBondContact O-CB 3.27Å; A273-N277 PolarHBondContact O-N 3.43Å; I275-N277 VanDerWaalsContact C-N 3.34Å; I275-N277 PolarHBondContact O-N 2.85Å
278	N	93.2	Very high	97.3	Very high	61 Å²	61	31.9 Å²	31.9	33%	0.326	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	-18.7	179.6	-73.6	-87.4	0	0	0	112.4	C125 Y128 P130 V274 I275 W276	C125-N278 PolarHBondContact O-ND2 2.78Å; Y128-N278 HydrophobicContact CD1-CB 4.05Å; Y128-N278 WeakPolarHBondContact CD1-ND2 3.15Å; Y128-N278 HydrophobicContact CE1-CB 4.2Å; P130-N278 HydrophobicContact CG-CB 4.34Å; V274-N278 PolarHBondContact O-ND2 3Å; V274-N278 VanDerWaalsContact O-ND2 3.11Å; I275-N278 PolarHBondContact O-N 2.91Å; I275-N278 VanDerWaalsContact O-N 3.07Å; W276-N278 PolarHBondContact O-N 3.45Å
279	H	95.6	Very high	97.5	Very high	21 Å²	21	27.9 Å²	27.9	10%	0.097	15%	0.152	C	C	.	.			trans	-134.2	76.4	-178.9	-59.9	-39.9	0	0	0	110.5	F136 I275 W276 Q281 W282	F136-H279 AromaticContact CE2-CE1 3.48Å; F136-H279 VanDerWaalsContact CE2-CE1 3.48Å; F136-H279 WeakPolarHBondContact CE2-CE1 3.32Å; F136-H279 AromaticContact CE2-CG 3.83Å; F136-H279 AromaticContact CE2-ND1 3.44Å; F136-H279 WeakPolarHBondContact CE2-ND1 3.36Å; F136-H279 AromaticContact CE2-NE2 3.88Å; F136-H279 AromaticContact CZ-CD2 3.95Å; F136-H279 AromaticContact CZ-CE1 3.7Å; F136-H279 AromaticContact CZ-NE2 3.64Å; I275-H279 PolarHBondContact O-N 2.96Å; W276-H279 CarbonylContact O-C 3.52Å; W276-H279 VanDerWaalsContact O-C 3.31Å; W276-H279 PolarHBondContact O-N 3.04Å; H279-Q281 PolarHBondContact O-N 2.82Å; H279-Q281 VanDerWaalsContact O-N 3.08Å; H279-Q281 PolarHBondContact O-OE1 3.46Å; H279-W282 HydrophobicContact CB-CE3 3.59Å; H279-W282 HydrophobicContact CB-CZ3 3.82Å; H279-W282 PolarHBondContact O-N 3.06Å
280	P	95.3	Very high	97.5	Very high	104 Å²	104	28 Å²	28	68%	0.675	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-10.7	-170.1	-22.4	34.8	0	0	0	115.5	W282	P280-W282 PolarHBondContact O-N 2.73Å
281	Q	96.9	Very high	97.5	Very high	86 Å²	86	28 Å²	28	40%	0.402	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16	170.2	74.1	-82.3	13.7	0	0	112.4	H279 N286	H279-Q281 PolarHBondContact O-N 2.82Å; H279-Q281 VanDerWaalsContact O-N 3.08Å; H279-Q281 PolarHBondContact O-OE1 3.46Å; Q281-N286 PolarHBondContact O-ND2 2.86Å
282	W	98.2	Very high	97.4	Very high	6 Å²	6	28.5 Å²	28.5	2%	0.023	16%	0.155	C	C	.	.			trans	-113.6	148.1	174.7	-57.3	-45.9	0	0	0	111.9	F136 K140 L142 D181 I275 H279 P280 N286	F136-W282 HydrophobicContact CB-CH2 4.29Å; F136-W282 HydrophobicContact CB-CZ2 4.39Å; F136-W282 AromaticContact CD1-CH2 3.52Å; F136-W282 HydrophobicContact CD1-CH2 3.52Å; F136-W282 HydrophobicContact CD1-CZ2 4.32Å; F136-W282 HydrophobicContact CD1-CZ3 4.37Å; F136-W282 HydrophobicContact CD2-CH2 4.09Å; F136-W282 AromaticContact CE1-CH2 3.74Å; F136-W282 HydrophobicContact CE1-CH2 3.74Å; F136-W282 HydrophobicContact CE1-CZ3 4.19Å; F136-W282 HydrophobicContact CE2-CH2 4.29Å; F136-W282 HydrophobicContact CE2-CZ3 4.34Å; F136-W282 AromaticContact CG-CH2 3.7Å; F136-W282 HydrophobicContact CG-CH2 3.7Å; F136-W282 HydrophobicContact CG-CZ2 4.28Å; F136-W282 HydrophobicContact CZ-CH2 4.12Å; F136-W282 HydrophobicContact CZ-CZ3 4.17Å; K140-W282 PolarHBondContact O-NE1 2.98Å; L142-W282 HydrophobicContact CB-CB 4.24Å; L142-W282 HydrophobicContact CB-CD2 3.87Å; L142-W282 HydrophobicContact CB-CG 3.69Å; L142-W282 HydrophobicContact CD1-CD2 4.14Å; L142-W282 HydrophobicContact CD1-CE3 4.12Å; L142-W282 HydrophobicContact CD1-CH2 4.17Å; L142-W282 HydrophobicContact CD1-CZ2 4.23Å; L142-W282 HydrophobicContact CD1-CZ3 4.13Å; L142-W282 HydrophobicContact CD2-CB 4.15Å; L142-W282 HydrophobicContact CD2-CD2 3.94Å; L142-W282 HydrophobicContact CD2-CE3 3.85Å; L142-W282 HydrophobicContact CD2-CG 4.1Å; L142-W282 HydrophobicContact CG-CD2 4.19Å; L142-W282 HydrophobicContact CG-CE3 4.39Å; L142-W282 HydrophobicContact CG-CG 4.4Å; D181-W282 HydrophobicContact CB-CH2 4.31Å; D181-W282 HydrophobicContact CB-CZ2 3.79Å; I275-W282 HydrophobicContact CG2-CE3 4Å; I275-W282 HydrophobicContact CG2-CZ3 4.38Å; H279-W282 HydrophobicContact CB-CE3 3.59Å; H279-W282 HydrophobicContact CB-CZ3 3.82Å; H279-W282 PolarHBondContact O-N 3.06Å; P280-W282 PolarHBondContact O-N 2.73Å; W282-N286 VanDerWaalsContact CA-OD1 3.3Å; W282-N286 WeakPolarHBondContact CA-OD1 3.38Å
283	G	98.3	Very high	97.2	Very high	4 Å²	4	28.7 Å²	28.7	4%	0.041	16%	0.157	C	C	.	.	S	Bend	trans	-165.3	-167.5	173.8	0	0	0	0	0	111.2	H285 N286 T287	G283-H285 PolarHBondContact O-N 3.02Å; G283-H285 VanDerWaalsContact O-N 3.11Å; G283-N286 PolarHBondContact N-OD1 3.25Å; G283-N286 PolarHBondContact O-N 3.28Å; G283-N286 PolarHBondContact O-OD1 3.14Å; G283-N286 VanDerWaalsContact O-OD1 3.12Å; G283-T287 WeakPolarHBondContact O-CB 2.96Å; G283-T287 PolarHBondContact O-N 3.2Å; G283-T287 PolarHBondContact O-OG1 3.13Å
284	P	98.2	Very high	97	Very high	55 Å²	55	29.6 Å²	29.6	36%	0.357	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-30.9	178.1	-25.3	32.2	0	0	0	114	W276 N286 T341	W276-P284 HydrophobicContact CE3-CG 4.24Å; W276-P284 HydrophobicContact CH2-CB 4.22Å; W276-P284 HydrophobicContact CH2-CG 3.65Å; W276-P284 HydrophobicContact CZ2-CG 4.3Å; W276-P284 HydrophobicContact CZ3-CG 3.6Å; P284-N286 VanDerWaalsContact C-N 3.3Å; P284-N286 PolarHBondContact O-N 2.65Å; P284-T341 HydrophobicContact CB-CG2 3.51Å
285	H	98.2	Very high	96.8	Very high	83 Å²	83	30.8 Å²	30.8	38%	0.384	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-17.9	-175.9	66.2	-84	0	0	0	114.2	G283 D339 F340	G283-H285 PolarHBondContact O-N 3.02Å; G283-H285 VanDerWaalsContact O-N 3.11Å; H285-D339 WeakPolarHBondContact CA-OD1 3.12Å; H285-D339 HydrophobicContact CB-CB 4.4Å; H285-D339 WeakPolarHBondContact CB-OD1 3.08Å; H285-D339 WeakPolarHBondContact O-CA 3.45Å; H285-F340 PolarHBondContact O-N 3.4Å
286	N	98.5	Very high	96.7	Very high	17 Å²	17	31.4 Å²	31.4	9%	0.091	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-144.3	15.6	-176	68.9	-4.8	0	0	0	114	K141 L142 Q281 W282 G283 P284	K141-N286 HydrophobicContact CB-CB 4.41Å; K141-N286 WeakPolarHBondContact CB-O 3.41Å; K141-N286 HydrophobicContact CD-CB 4.48Å; K141-N286 HydrophobicContact CG-CB 4.15Å; L142-N286 PolarHBondContact N-O 3.24Å; Q281-N286 PolarHBondContact O-ND2 2.86Å; W282-N286 VanDerWaalsContact CA-OD1 3.3Å; W282-N286 WeakPolarHBondContact CA-OD1 3.38Å; G283-N286 PolarHBondContact N-OD1 3.25Å; G283-N286 PolarHBondContact O-N 3.28Å; G283-N286 PolarHBondContact O-OD1 3.14Å; G283-N286 VanDerWaalsContact O-OD1 3.12Å; P284-N286 VanDerWaalsContact C-N 3.3Å; P284-N286 PolarHBondContact O-N 2.65Å
287	T	98.8	Very high	96.6	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	135.1	176.8	-57.2	0	0	0	0	110.2	L142 V144 L272 W276 G283	L142-T287 HydrophobicContact CB-CG2 4.11Å; L142-T287 HydrophobicContact CD2-CG2 3.79Å; L142-T287 HydrophobicContact CG-CG2 4.07Å; L142-T287 WeakPolarHBondContact O-CA 3.49Å; V144-T287 HydrophobicContact CG2-CG2 4.29Å; L272-T287 HydrophobicContact CD1-CG2 4.1Å; L272-T287 HydrophobicContact CD2-CG2 4.38Å; W276-T287 HydrophobicContact CZ2-CG2 4.21Å; W276-T287 PolarHBondContact NE1-OG1 3.39Å; G283-T287 WeakPolarHBondContact O-CB 2.96Å; G283-T287 PolarHBondContact O-N 3.2Å; G283-T287 PolarHBondContact O-OG1 3.13Å
288	I	98.8	Very high	96.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	139.5	168.6	-168	168.2	0	0	0	110.2	L142 L143 V144 Y180 F290 S303 L305 Y329 L330 I333 F340	L142-I288 PolarHBondContact O-N 2.69Å; L143-I288 WeakPolarHBondContact CA-O 3.36Å; L143-I288 HydrophobicContact CD1-CG2 3.9Å; V144-I288 PolarHBondContact N-O 2.94Å; Y180-I288 HydrophobicContact CE1-CG2 4.07Å; I288-F290 HydrophobicContact CD1-CE1 3.7Å; I288-F290 HydrophobicContact CG1-CD1 4.28Å; I288-F290 HydrophobicContact CG1-CE1 3.87Å; I288-S303 CarbonylContact C-O 3.57Å; I288-S303 WeakPolarHBondContact CA-O 3.4Å; I288-L305 HydrophobicContact CD1-CB 4.37Å; I288-L305 HydrophobicContact CD1-CD1 4.28Å; I288-L305 HydrophobicContact CG1-CB 4.49Å; I288-Y329 HydrophobicContact CD1-CE1 3.94Å; I288-L330 HydrophobicContact CD1-CD2 4.21Å; I288-L330 HydrophobicContact CG2-CD2 3.59Å; I288-I333 HydrophobicContact CD1-CD1 3.92Å; I288-F340 HydrophobicContact CB-CD2 4.39Å; I288-F340 HydrophobicContact CB-CE2 4.47Å; I288-F340 HydrophobicContact CG2-CE2 4.46Å
289	M	98.7	Very high	96.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.8	-178.1	177.8	176.1	157.9	0	0	110.5	V144 K270 L272 D291 N296 F297 S303 L305	V144-M289 HydrophobicContact CB-CB 3.98Å; V144-M289 HydrophobicContact CB-CG 3.95Å; V144-M289 HydrophobicContact CG1-CB 4.47Å; V144-M289 HydrophobicContact CG1-CG 3.91Å; V144-M289 HydrophobicContact CG1-SD 4.21Å; V144-M289 CarbonylContact O-C 3.6Å; V144-M289 VanDerWaalsContact O-CA 3.27Å; V144-M289 WeakPolarHBondContact O-CA 3.31Å; K270-M289 HydrophobicContact CB-CE 3.95Å; K270-M289 HydrophobicContact CB-SD 4.47Å; K270-M289 HydrophobicContact CD-CE 3.38Å; K270-M289 HydrophobicContact CG-CE 4.26Å; L272-M289 HydrophobicContact CD1-CB 4.2Å; L272-M289 HydrophobicContact CD1-SD 4.46Å; L272-M289 HydrophobicContact CD2-CB 4.42Å; L272-M289 HydrophobicContact CD2-SD 3.94Å; L272-M289 HydrophobicContact CG-SD 4.24Å; M289-D291 HydrophobicContact CE-CB 3.99Å; M289-D291 WeakPolarHBondContact CE-OD2 3.5Å; M289-N296 HydrophobicContact CE-CB 4.23Å; M289-F297 HydrophobicContact CE-CB 4.3Å; M289-F297 HydrophobicContact CE-CD1 4.44Å; M289-F297 HydrophobicContact SD-CB 4.06Å; M289-S303 PolarHBondContact N-O 3.04Å; M289-L305 PolarHBondContact O-N 3.45Å
290	F	98.6	Very high	96.8	Very high	1 Å²	1	23.4 Å²	23.4	0%	0.004	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	128.9	173.6	-66.3	-3.4	0	0	0	110.3	L143 V144 L145 D146 T150 F172 I288 L305 L326 L330	L143-F290 HydrophobicContact CD1-CD2 4.43Å; L143-F290 HydrophobicContact CD1-CG 4.45Å; V144-F290 PolarHBondContact O-N 3.29Å; L145-F290 HydrophobicContact CD2-CB 3.87Å; L145-F290 HydrophobicContact CD2-CD2 3.94Å; L145-F290 HydrophobicContact CD2-CG 4.17Å; D146-F290 PolarHBondContact N-O 3.26Å; T150-F290 HydrophobicContact CG2-CB 4.49Å; F172-F290 HydrophobicContact CE2-CD2 4.44Å; F172-F290 AromaticContact CE2-CE2 3.85Å; F172-F290 HydrophobicContact CE2-CE2 3.85Å; F172-F290 AromaticContact CZ-CD2 3.91Å; F172-F290 HydrophobicContact CZ-CD2 3.91Å; F172-F290 AromaticContact CZ-CE2 3.65Å; F172-F290 HydrophobicContact CZ-CE2 3.65Å; I288-F290 HydrophobicContact CD1-CE1 3.7Å; I288-F290 HydrophobicContact CG1-CD1 4.28Å; I288-F290 HydrophobicContact CG1-CE1 3.87Å; F290-L305 HydrophobicContact CD1-CB 3.76Å; F290-L305 HydrophobicContact CD1-CD2 4.04Å; F290-L305 HydrophobicContact CD1-CG 4.33Å; F290-L305 HydrophobicContact CE1-CB 3.8Å; F290-L305 HydrophobicContact CE1-CD1 3.83Å; F290-L305 HydrophobicContact CE1-CD2 3.97Å; F290-L305 HydrophobicContact CE1-CG 4.08Å; F290-L305 HydrophobicContact CZ-CD1 4.39Å; F290-L326 HydrophobicContact CD2-CD1 4.12Å; F290-L326 HydrophobicContact CE2-CB 3.79Å; F290-L326 HydrophobicContact CE2-CD1 3.82Å; F290-L326 HydrophobicContact CE2-CD2 4.24Å; F290-L326 HydrophobicContact CE2-CG 4.19Å; F290-L326 HydrophobicContact CZ-CB 4.15Å; F290-L326 HydrophobicContact CZ-CD1 4.41Å; F290-L326 HydrophobicContact CZ-CD2 4.02Å; F290-L326 HydrophobicContact CZ-CG 4.44Å; F290-L330 HydrophobicContact CE1-CD2 4.2Å; F290-L330 HydrophobicContact CE2-CD1 4.01Å; F290-L330 HydrophobicContact CE2-CG 4.33Å; F290-L330 HydrophobicContact CZ-CD1 4Å; F290-L330 HydrophobicContact CZ-CD2 3.7Å; F290-L330 HydrophobicContact CZ-CG 3.86Å
291	D	97.9	Very high	96.7	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	143.5	-179.3	-156.3	-64.7	0	0	0	108.6	D146 K270 M289 V293 N296 F297 L305 R306 I307	D146-D291 HydrophobicContact CB-CB 4.28Å; D146-D291 WeakPolarHBondContact CB-OD2 3.28Å; K270-D291 IonicContact NZ-OD2 3.25Å; K270-D291 PolarHBondContact NZ-OD2 3.34Å; M289-D291 HydrophobicContact CE-CB 3.99Å; M289-D291 WeakPolarHBondContact CE-OD2 3.5Å; D291-V293 PolarHBondContact OD1-N 2.83Å; D291-N296 PolarHBondContact OD1-ND2 2.81Å; D291-N296 WeakPolarHBondContact OD2-CB 3.41Å; D291-N296 PolarHBondContact OD2-ND2 2.88Å; D291-F297 HydrophobicContact CB-CD1 4.09Å; D291-F297 HydrophobicContact CB-CE1 4.19Å; D291-L305 PolarHBondContact N-O 2.96Å; D291-R306 WeakPolarHBondContact O-CA 3.28Å; D291-I307 PolarHBondContact O-N 3.34Å
292	D	95.8	Very high	96.5	Very high	11 Å²	11	20.1 Å²	20.1	6%	0.059	10%	0.103	C	C	.	.	S	Bend	trans	-73.2	-21.6	175.4	72.5	-53.5	0	0	0	111.8	T150 R306 I307 R311	T150-D292 PolarHBondContact OG1-N 3.19Å; D292-R306 WeakPolarHBondContact O-CG 3.49Å; D292-I307 HydrophobicContact CB-CG2 4.36Å; D292-R311 IonicContact OD2-NH2 3.49Å
293	V	93.6	Very high	96.5	Very high	4 Å²	4	20 Å²	20	2%	0.024	10%	0.102	C	C	.	.			trans	-107.7	117.8	-177.2	-170.8	0	0	0	0	111	F102 D291 R295 N296	F102-V293 HydrophobicContact CD1-CG2 4.14Å; D291-V293 PolarHBondContact OD1-N 2.83Å; V293-R295 VanDerWaalsContact C-N 3.32Å; V293-R295 HydrophobicContact CG1-CB 4.4Å; V293-R295 HydrophobicContact CG1-CG 3.63Å; V293-R295 PolarHBondContact O-N 2.93Å; V293-N296 WeakPolarHBondContact O-CB 2.87Å; V293-N296 PolarHBondContact O-N 3.29Å
294	R	92.8	Very high	96.5	Very high	37 Å²	37	19.9 Å²	19.9	14%	0.14	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-58.9	-43	-177.4	-147.6	-171.2	160.4	92.6	-11.5	112.2	F102 D103 F104 N296 F297 N346	F102-R294 PolarHBondContact O-N 2.78Å; D103-R294 WeakPolarHBondContact OD1-CD 3.49Å; F104-R294 HydrophobicContact CD1-CB 3.71Å; F104-R294 HydrophobicContact CD1-CG 3.85Å; F104-R294 VanDerWaalsContact CE1-C 3.5Å; F104-R294 HydrophobicContact CE1-CB 3.62Å; F104-R294 VanDerWaalsContact CE1-CD 3.43Å; F104-R294 HydrophobicContact CE1-CG 3.28Å; F104-R294 WeakPolarHBondContact CE1-O 3.03Å; F104-R294 HydrophobicContact CZ-CG 3.78Å; R294-N296 PolarHBondContact O-N 3.36Å; R294-F297 HydrophobicContact CB-CE2 4.49Å; R294-F297 HydrophobicContact CB-CZ 4.17Å; R294-F297 HydrophobicContact CG-CE2 3.63Å; R294-F297 HydrophobicContact CG-CZ 3.56Å; R294-F297 VanDerWaalsContact O-CD2 3.27Å; R294-F297 WeakPolarHBondContact O-CD2 3.33Å; R294-F297 WeakPolarHBondContact O-CE2 3.45Å; R294-F297 WeakPolarHBondContact O-CG 3.28Å; R294-F297 PolarHBondContact O-N 3.1Å; R294-F297 VanDerWaalsContact O-N 3.14Å; R294-N346 PolarHBondContact NH1-OD1 3.39Å
295	R	93.1	Very high	96.4	Very high	25 Å²	25	17.3 Å²	17.3	9%	0.094	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-58.9	-25.6	-175.5	86.1	-164	169.5	-118.9	-1.9	113.5	D101 F104 F261 V269 V293 F297 I298	D101-R295 VanDerWaalsContact C-NH1 3.34Å; D101-R295 VanDerWaalsContact CG-NH1 3.34Å; D101-R295 WeakPolarHBondContact O-CD 3.34Å; D101-R295 PolarHBondContact O-NH1 3.07Å; D101-R295 IonicContact OD1-CZ 2.57Å; D101-R295 IonicContact OD1-NH1 3.27Å; D101-R295 PolarHBondContact OD1-NH1 3.24Å; D101-R295 IonicContact OD2-NH1 3.79Å; F104-R295 HydrophobicContact CD1-CB 4.24Å; F261-R295 HydrophobicContact CE1-CB 4.07Å; F261-R295 HydrophobicContact CZ-CB 3.85Å; V269-R295 VanDerWaalsContact CG1-O 3.23Å; V269-R295 WeakPolarHBondContact CG1-O 3.37Å; V293-R295 VanDerWaalsContact C-N 3.32Å; V293-R295 HydrophobicContact CG1-CB 4.4Å; V293-R295 HydrophobicContact CG1-CG 3.63Å; V293-R295 PolarHBondContact O-N 2.93Å; R295-F297 PolarHBondContact O-N 3.25Å; R295-F297 VanDerWaalsContact O-N 3.17Å; R295-I298 WeakPolarHBondContact O-CB 3.43Å; R295-I298 WeakPolarHBondContact O-CG2 3.24Å; R295-I298 PolarHBondContact O-N 3.25Å
296	N	95.5	Very high	96.3	Very high	12 Å²	12	18.3 Å²	18.3	6%	0.064	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-60.6	-28.5	-178.9	-80.2	-12.5	0	0	0	111.7	K270 M289 D291 V293 R294	K270-N296 WeakPolarHBondContact CA-O 3.09Å; K270-N296 WeakPolarHBondContact CB-O 3.4Å; K270-N296 HydrophobicContact CD-CB 4.19Å; K270-N296 HydrophobicContact CG-CB 4.48Å; K270-N296 PolarHBondContact N-O 2.86Å; M289-N296 HydrophobicContact CE-CB 4.23Å; D291-N296 PolarHBondContact OD1-ND2 2.81Å; D291-N296 WeakPolarHBondContact OD2-CB 3.41Å; D291-N296 PolarHBondContact OD2-ND2 2.88Å; V293-N296 WeakPolarHBondContact O-CB 2.87Å; V293-N296 PolarHBondContact O-N 3.29Å; R294-N296 PolarHBondContact O-N 3.36Å
297	F	95.9	Very high	96.2	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.009	8%	0.081	C	C	.	.	G	3₁₀ helix	trans	-108.8	24.2	176.5	52.2	-104.6	0	0	0	113.2	M289 D291 R294 R295 M299 N300 R306	M289-F297 HydrophobicContact CE-CB 4.3Å; M289-F297 HydrophobicContact CE-CD1 4.44Å; M289-F297 HydrophobicContact SD-CB 4.06Å; D291-F297 HydrophobicContact CB-CD1 4.09Å; D291-F297 HydrophobicContact CB-CE1 4.19Å; R294-F297 HydrophobicContact CB-CE2 4.49Å; R294-F297 HydrophobicContact CB-CZ 4.17Å; R294-F297 HydrophobicContact CG-CE2 3.63Å; R294-F297 HydrophobicContact CG-CZ 3.56Å; R294-F297 VanDerWaalsContact O-CD2 3.27Å; R294-F297 WeakPolarHBondContact O-CD2 3.33Å; R294-F297 WeakPolarHBondContact O-CE2 3.45Å; R294-F297 WeakPolarHBondContact O-CG 3.28Å; R294-F297 PolarHBondContact O-N 3.1Å; R294-F297 VanDerWaalsContact O-N 3.14Å; R295-F297 PolarHBondContact O-N 3.25Å; R295-F297 VanDerWaalsContact O-N 3.17Å; F297-M299 PolarHBondContact O-N 3.2Å; F297-M299 VanDerWaalsContact O-N 3.12Å; F297-N300 CarbonylContact O-C 3.57Å; F297-N300 WeakPolarHBondContact O-CA 3.15Å; F297-N300 PolarHBondContact O-N 3.4Å; F297-R306 HydrophobicContact CZ-CB 4.22Å
298	I	95.3	Very high	96	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-29.8	-177.7	-166.2	63.1	0	0	0	113.7	F104 D108 L111 C112 F261 V269 R295 N300 P301	F104-I298 HydrophobicContact CB-CD1 4.48Å; F104-I298 HydrophobicContact CD1-CD1 3.62Å; F104-I298 HydrophobicContact CD2-CD1 3.6Å; F104-I298 HydrophobicContact CE1-CD1 3.47Å; F104-I298 VanDerWaalsContact CE1-CD1 3.47Å; F104-I298 HydrophobicContact CE2-CD1 3.55Å; F104-I298 HydrophobicContact CG-CD1 3.65Å; F104-I298 HydrophobicContact CZ-CD1 3.46Å; F104-I298 VanDerWaalsContact CZ-CD1 3.46Å; D108-I298 HydrophobicContact CB-CD1 4.35Å; L111-I298 HydrophobicContact CB-CG1 4.27Å; L111-I298 HydrophobicContact CD1-CG1 4.4Å; C112-I298 WeakPolarHBondContact CB-O 3.36Å; F261-I298 HydrophobicContact CE1-CG1 4.22Å; F261-I298 HydrophobicContact CZ-CB 4.3Å; F261-I298 HydrophobicContact CZ-CG1 4.34Å; F261-I298 HydrophobicContact CZ-CG2 3.99Å; V269-I298 HydrophobicContact CB-CG2 4.04Å; V269-I298 HydrophobicContact CG1-CG2 3.78Å; V269-I298 HydrophobicContact CG2-CG2 3.98Å; R295-I298 WeakPolarHBondContact O-CB 3.43Å; R295-I298 WeakPolarHBondContact O-CG2 3.24Å; R295-I298 PolarHBondContact O-N 3.25Å; I298-N300 PolarHBondContact O-N 3.29Å; I298-P301 WeakPolarHBondContact O-CD 3.28Å
299	M	97.1	Very high	95.8	Very high	18 Å²	18	24.6 Å²	24.6	9%	0.089	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-16	177.9	-65	-53.9	-64.3	0	0	112.7	C112 N117 V121 I257 V259 V269 P271 F297	C112-M299 HydrophobicContact CB-CE 4.37Å; C112-M299 HydrophobicContact CB-SD 4.35Å; N117-M299 HydrophobicContact CB-CE 3.81Å; N117-M299 HydrophobicContact CB-SD 4.04Å; V121-M299 HydrophobicContact CG2-CE 3.8Å; I257-M299 HydrophobicContact CD1-CG 4.26Å; V259-M299 HydrophobicContact CG2-SD 4.28Å; V269-M299 HydrophobicContact CG2-CG 3.96Å; P271-M299 HydrophobicContact CB-CB 4.16Å; P271-M299 HydrophobicContact CB-CG 4.26Å; F297-M299 PolarHBondContact O-N 3.2Å; F297-M299 VanDerWaalsContact O-N 3.12Å
300	N	96.4	Very high	95.7	Very high	27 Å²	27	24.7 Å²	24.7	14%	0.144	12%	0.116	C	C	.	.	S	Bend	trans	-143.7	57.8	-176.7	-54.9	106.2	0	0	0	110.4	L272 W276 F297 I298 Q302 S303	L272-N300 HydrophobicContact CB-CB 4.3Å; L272-N300 HydrophobicContact CD1-CB 3.99Å; L272-N300 HydrophobicContact CG-CB 4.38Å; L272-N300 PolarHBondContact N-OD1 2.56Å; W276-N300 HydrophobicContact CH2-CB 3.95Å; W276-N300 WeakPolarHBondContact CH2-ND2 3.34Å; W276-N300 HydrophobicContact CZ3-CB 4.5Å; W276-N300 WeakPolarHBondContact CZ3-ND2 3.5Å; F297-N300 CarbonylContact O-C 3.57Å; F297-N300 WeakPolarHBondContact O-CA 3.15Å; F297-N300 PolarHBondContact O-N 3.4Å; I298-N300 PolarHBondContact O-N 3.29Å; N300-Q302 PolarHBondContact O-N 2.81Å; N300-Q302 VanDerWaalsContact O-N 3.15Å; N300-S303 PolarHBondContact O-N 2.86Å
301	P	94.1	Very high	95.5	Very high	36 Å²	36	27.2 Å²	27.2	23%	0.234	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-61.7	-32.8	-166.5	25.1	-33.5	0	0	0	112.6	I109 I298 S303 G304	I109-P301 HydrophobicContact CG2-CG 4.25Å; I298-P301 WeakPolarHBondContact O-CD 3.28Å; P301-S303 VanDerWaalsContact C-N 3.26Å; P301-S303 PolarHBondContact O-N 3.34Å; P301-G304 PolarHBondContact O-N 3.28Å
302	Q	93.6	Very high	95.2	Very high	85 Å²	85	30.1 Å²	30.1	40%	0.397	14%	0.141	S	C	.	.	G	3₁₀ helix	trans	-72.6	-14.9	179.8	-165	59.2	8.5	0	0	114	N300 T341 L343 H345	N300-Q302 PolarHBondContact O-N 2.81Å; N300-Q302 VanDerWaalsContact O-N 3.15Å; Q302-T341 PolarHBondContact NE2-O 3Å; Q302-L343 PolarHBondContact NE2-O 2.98Å; Q302-H345 PolarHBondContact O-CD2 3.15Å; Q302-H345 PolarHBondContact O-NE2 3.09Å
303	S	97.8	Very high	94.8	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.014	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-99.4	-4.8	175.1	-61	0	0	0	0	112.5	I288 M289 N300 P301	I288-S303 CarbonylContact C-O 3.57Å; I288-S303 WeakPolarHBondContact CA-O 3.4Å; M289-S303 PolarHBondContact N-O 3.04Å; N300-S303 PolarHBondContact O-N 2.86Å; P301-S303 VanDerWaalsContact C-N 3.26Å; P301-S303 PolarHBondContact O-N 3.34Å
304	G	97.2	Very high	94.5	Very high	3 Å²	3	36.3 Å²	36.3	3%	0.031	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	140.3	-179.8	0	0	0	0	0	112.9	P301	P301-G304 PolarHBondContact O-N 3.28Å
305	L	97.3	Very high	94.3	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.4	168.6	-175.8	155.6	0	0	0	108.1	I288 M289 F290 D291 I307 L326 Y329 H345 W348	I288-L305 HydrophobicContact CD1-CB 4.37Å; I288-L305 HydrophobicContact CD1-CD1 4.28Å; I288-L305 HydrophobicContact CG1-CB 4.49Å; M289-L305 PolarHBondContact O-N 3.45Å; F290-L305 HydrophobicContact CD1-CB 3.76Å; F290-L305 HydrophobicContact CD1-CD2 4.04Å; F290-L305 HydrophobicContact CD1-CG 4.33Å; F290-L305 HydrophobicContact CE1-CB 3.8Å; F290-L305 HydrophobicContact CE1-CD1 3.83Å; F290-L305 HydrophobicContact CE1-CD2 3.97Å; F290-L305 HydrophobicContact CE1-CG 4.08Å; F290-L305 HydrophobicContact CZ-CD1 4.39Å; D291-L305 PolarHBondContact N-O 2.96Å; L305-I307 PolarHBondContact O-N 3.23Å; L305-L326 HydrophobicContact CD1-CD2 4.08Å; L305-L326 HydrophobicContact CD2-CD2 3.72Å; L305-Y329 HydrophobicContact CD1-CD1 3.92Å; L305-Y329 HydrophobicContact CD1-CE1 3.67Å; L305-H345 HydrophobicContact CB-CB 4.09Å; L305-H345 HydrophobicContact CD1-CB 4.2Å; L305-H345 HydrophobicContact CG-CB 4.24Å; L305-W348 HydrophobicContact CD1-CB 3.97Å; L305-W348 HydrophobicContact CD1-CG 3.89Å
306	R	95.9	Very high	94	Very high	104 Å²	104	40.4 Å²	40.4	39%	0.392	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	123.7	174.1	-175	168.3	69.1	85.6	-10.7	110	D103 D291 D292 F297	D103-R306 IonicContact OD2-NH2 2.69Å; D291-R306 WeakPolarHBondContact O-CA 3.28Å; D292-R306 WeakPolarHBondContact O-CG 3.49Å; F297-R306 HydrophobicContact CZ-CB 4.22Å
307	I	95.9	Very high	93.7	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-101.1	162.1	173.4	-166.2	172.1	0	0	0	110.2	T150 D291 D292 L305 E322 L323 L326	T150-I307 HydrophobicContact CG2-CG2 4.16Å; D291-I307 PolarHBondContact O-N 3.34Å; D292-I307 HydrophobicContact CB-CG2 4.36Å; L305-I307 PolarHBondContact O-N 3.23Å; I307-E322 HydrophobicContact CD1-CG 4.15Å; I307-E322 HydrophobicContact CG1-CG 3.92Å; I307-E322 WeakPolarHBondContact CG1-OE2 3.34Å; I307-L323 HydrophobicContact CD1-CD2 3.9Å; I307-L326 HydrophobicContact CB-CD1 4.48Å; I307-L326 HydrophobicContact CD1-CD1 3.18Å; I307-L326 HydrophobicContact CG1-CD1 3.72Å
308	R	94.6	Very high	93.4	Very high	98 Å²	98	46.8 Å²	46.8	37%	0.37	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-67.6	139.8	169.3	-55.9	-170.6	-85.5	-152.4	13.3	110.2	R166 Y310 E322 D465	R166-R308 PolarHBondContact NH1-O 3.08Å; R166-R308 PolarHBondContact NH2-O 2.92Å; R308-Y310 PolarHBondContact O-N 2.98Å; R308-E322 WeakPolarHBondContact CB-OE2 3.4Å; R308-E322 WeakPolarHBondContact CG-OE2 3.36Å; R308-E322 PolarHBondContact N-OE1 2.89Å; R308-E322 PolarHBondContact N-OE2 3.43Å; R308-E322 IonicContact NE-OE2 3.8Å; R308-D465 IonicContact CZ-OD2 3.43Å; R308-D465 IonicContact NH1-OD1 2.74Å; R308-D465 IonicContact NH1-OD2 3.79Å; R308-D465 PolarHBondContact NH1-OD2 3.47Å; R308-D465 IonicContact NH2-OD2 2.7Å; R308-D465 PolarHBondContact NH2-OD2 2.79Å
309	S	95.3	Very high	93.3	Very high	50 Å²	50	56.1 Å²	56.1	35%	0.35	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-66.4	127.6	175.7	73.2	0	0	0	0	110.3	Y149 R311	Y149-S309 CarbonylContact O-C 3.53Å; Y149-S309 WeakPolarHBondContact O-CA 3.26Å; S309-R311 PolarHBondContact O-N 3.1Å; S309-R311 PolarHBondContact OG-NE 3.25Å; S309-R311 VanDerWaalsContact OG-NE 3.08Å
310	Y	96.6	Very high	93.3	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.008	28%	0.28	C	S	.	.			trans	-88.5	102.3	176.6	-177	-110.8	0	0	0	110.4	Y149 D153 L164 R166 P167 R308 A313 D320	Y149-Y310 WeakPolarHBondContact CD1-O 3.35Å; Y149-Y310 PolarHBondContact O-N 2.96Å; D153-Y310 HydrophobicContact CB-CD1 4.02Å; D153-Y310 HydrophobicContact CB-CE1 4.04Å; L164-Y310 WeakPolarHBondContact O-CE1 3.27Å; R166-Y310 HydrophobicContact CB-CD1 3.85Å; R166-Y310 HydrophobicContact CB-CD2 4.43Å; R166-Y310 HydrophobicContact CB-CE1 4.15Å; R166-Y310 HydrophobicContact CB-CG 4.01Å; R166-Y310 HydrophobicContact CG-CD1 4.14Å; R166-Y310 HydrophobicContact CG-CD2 3.84Å; R166-Y310 HydrophobicContact CG-CE2 4.28Å; R166-Y310 HydrophobicContact CG-CG 3.77Å; P167-Y310 VanDerWaalsContact CD-CE2 3.47Å; P167-Y310 HydrophobicContact CG-CE2 4.3Å; R308-Y310 PolarHBondContact O-N 2.98Å; Y310-A313 HydrophobicContact CE1-CB 3.9Å; Y310-A313 VanDerWaalsContact OH-CB 3.31Å; Y310-A313 WeakPolarHBondContact OH-CB 3.48Å; Y310-D320 HydrophobicContact CD2-CB 4.46Å; Y310-D320 HydrophobicContact CE2-CB 4.31Å
311	R	93.5	Very high	93.2	Very high	53 Å²	53	58.8 Å²	58.8	20%	0.2	29%	0.291	C	S	.	.			trans	-131.2	164.7	-177	-60.8	172.7	-175.1	-79.3	-15.2	110	Y149 D292 S309 A313 N316	Y149-R311 HydrophobicContact CD1-CG 3.58Å; Y149-R311 HydrophobicContact CE1-CG 3.81Å; Y149-R311 VanDerWaalsContact CE2-CZ 3.48Å; Y149-R311 HydrophobicContact CG-CG 4.23Å; Y149-R311 PolarHBondContact OH-NH1 2.88Å; Y149-R311 VanDerWaalsContact OH-NH1 3.12Å; D292-R311 IonicContact OD2-NH2 3.49Å; S309-R311 PolarHBondContact O-N 3.1Å; S309-R311 PolarHBondContact OG-NE 3.25Å; S309-R311 VanDerWaalsContact OG-NE 3.08Å; R311-A313 VanDerWaalsContact C-N 3.29Å; R311-A313 PolarHBondContact O-N 3.28Å; R311-N316 PolarHBondContact O-ND2 2.58Å
312	D	91.5	Very high	93.4	Very high	62 Å²	62	57.6 Å²	57.6	33%	0.332	28%	0.282	S	S	.	.			trans	50.4	51.6	177.5	-55.9	-55.4	0	0	0	111	D153 H314 V315 N316	D153-D312 PolarHBondContact OD2-N 2.91Å; D312-H314 PolarHBondContact O-N 2.78Å; D312-V315 HydrophobicContact CB-CG2 4.46Å; D312-V315 PolarHBondContact O-N 2.66Å; D312-N316 PolarHBondContact O-N 3.31Å
313	A	88.8	Confident	93.6	Very high	2 Å²	2	53.7 Å²	53.7	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-50	-38.3	-171.3	0	0	0	0	0	113.3	D153 Q163 L164 Y310 R311 V315 N316 C317	D153-A313 HydrophobicContact CB-CB 4.05Å; D153-A313 PolarHBondContact OD2-N 3.11Å; Q163-A313 WeakPolarHBondContact O-CB 3.46Å; L164-A313 HydrophobicContact CD2-CB 4.18Å; Y310-A313 HydrophobicContact CE1-CB 3.9Å; Y310-A313 VanDerWaalsContact OH-CB 3.31Å; Y310-A313 WeakPolarHBondContact OH-CB 3.48Å; R311-A313 VanDerWaalsContact C-N 3.29Å; R311-A313 PolarHBondContact O-N 3.28Å; A313-V315 PolarHBondContact O-N 3.24Å; A313-N316 PolarHBondContact O-N 2.85Å; A313-C317 WeakPolarHBondContact O-CB 3.39Å; A313-C317 PolarHBondContact O-N 3.4Å
314	H	87	Confident	93.6	Very high	143 Å²	143	55.7 Å²	55.7	66%	0.662	27%	0.274	S	S	*	.	H	α-helix	trans	-59.2	-27.3	177.1	64.6	-77.3	0	0	0	114.4	T156 D312	T156-H314 WeakPolarHBondContact CG2-ND1 3.19Å; D312-H314 PolarHBondContact O-N 2.78Å
315	V	87.7	Confident	93.6	Very high	82 Å²	82	59.5 Å²	59.5	50%	0.497	29%	0.288	S	S	.	.	H	α-helix	trans	-94.6	-45.6	177	-173.5	0	0	0	0	111.1	D312 A313	D312-V315 HydrophobicContact CB-CG2 4.46Å; D312-V315 PolarHBondContact O-N 2.66Å; A313-V315 PolarHBondContact O-N 3.24Å
316	N	86.8	Confident	93.7	Very high	65 Å²	65	59.5 Å²	59.5	35%	0.348	29%	0.288	S	S	.	.	H	α-helix	trans	-95.2	-16.3	-163.2	-64.9	-33.7	0	0	0	114.2	R311 D312 A313 S318 R319 D320	R311-N316 PolarHBondContact O-ND2 2.58Å; D312-N316 PolarHBondContact O-N 3.31Å; A313-N316 PolarHBondContact O-N 2.85Å; N316-S318 VanDerWaalsContact C-N 3.33Å; N316-S318 PolarHBondContact O-N 3.15Å; N316-R319 PolarHBondContact O-N 3.47Å; N316-R319 VanDerWaalsContact O-N 3.11Å; N316-D320 PolarHBondContact O-N 3.41Å; N316-D320 VanDerWaalsContact O-N 3.1Å
317	C	89.5	Confident	93.8	Very high	55 Å²	55	54.5 Å²	54.5	37%	0.372	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-42.9	-175.1	174.1	0	0	0	0	113.7	P167 A313 R319	P167-C317 HydrophobicContact CG-CB 4.21Å; P167-C317 WeakPolarHBondContact CG-O 3.46Å; A313-C317 WeakPolarHBondContact O-CB 3.39Å; A313-C317 PolarHBondContact O-N 3.4Å; C317-R319 PolarHBondContact O-N 3.07Å
318	S	90.4	Very high	93.9	Very high	93 Å²	93	58.5 Å²	58.5	65%	0.65	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-18.8	-176.6	58.2	0	0	0	0	114.3	N316	N316-S318 VanDerWaalsContact C-N 3.33Å; N316-S318 PolarHBondContact O-N 3.15Å
319	R	92.8	Very high	94.1	Very high	197 Å²	197	53.9 Å²	53.9	74%	0.743	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-15	-176.2	-60.7	179.8	-178	175.3	-1.1	113.2	N316 C317 H321	N316-R319 PolarHBondContact O-N 3.47Å; N316-R319 VanDerWaalsContact O-N 3.11Å; C317-R319 PolarHBondContact O-N 3.07Å; R319-H321 PolarHBondContact O-CD2 2.82Å; R319-H321 PolarHBondContact O-N 2.81Å
320	D	95.7	Very high	94.3	Very high	22 Å²	22	51.5 Å²	51.5	12%	0.118	25%	0.252	C	S	.	.			trans	-77.4	112.2	178	-167.8	-46	0	0	0	111	R166 P167 Y310 N316 E322	R166-D320 IonicContact CZ-OD2 3.65Å; R166-D320 IonicContact NE-OD1 3.67Å; R166-D320 PolarHBondContact NE-OD1 2.9Å; R166-D320 IonicContact NE-OD2 3.88Å; R166-D320 PolarHBondContact NE-OD2 3.04Å; R166-D320 VanDerWaalsContact NE-OD2 3.11Å; R166-D320 IonicContact NH2-OD1 2.66Å; R166-D320 IonicContact NH2-OD2 2.9Å; R166-D320 PolarHBondContact NH2-OD2 2.65Å; P167-D320 WeakPolarHBondContact CB-O 3.41Å; P167-D320 HydrophobicContact CG-CB 4.13Å; Y310-D320 HydrophobicContact CD2-CB 4.46Å; Y310-D320 HydrophobicContact CE2-CB 4.31Å; N316-D320 PolarHBondContact O-N 3.41Å; N316-D320 VanDerWaalsContact O-N 3.1Å; D320-E322 PolarHBondContact OD1-N 3.49Å
321	H	96.1	Very high	94.4	Very high	79 Å²	79	51.7 Å²	51.7	37%	0.366	25%	0.253	S	S	.	.			trans	-121.4	18.7	172.7	-62.1	-75	0	0	0	111.8	H168 R319 L323 L324 R325	H168-H321 AromaticContact CD2-ND1 3.99Å; H168-H321 AromaticContact CE1-ND1 3.99Å; H168-H321 AromaticContact NE2-CE1 3.75Å; H168-H321 AromaticContact NE2-ND1 3.21Å; H168-H321 PolarHBondContact NE2-ND1 3.02Å; R319-H321 PolarHBondContact O-CD2 2.82Å; R319-H321 PolarHBondContact O-N 2.81Å; H321-L323 PolarHBondContact O-N 3.49Å; H321-L324 WeakPolarHBondContact O-CB 3.39Å; H321-L324 PolarHBondContact O-N 3.14Å; H321-R325 PolarHBondContact O-N 3.26Å
322	E	97.3	Very high	94.6	Very high	11 Å²	11	49.1 Å²	49.1	5%	0.051	24%	0.243	C	C	.	.	H	α-helix	trans	-66.1	-42.5	-171.5	-168.9	166.2	-157.3	0	0	111.5	R166 I307 R308 D320 L324 R325 L326	R166-E322 IonicContact CZ-OE2 3.44Å; R166-E322 IonicContact NH2-OE2 3.97Å; R166-E322 PolarHBondContact NH2-OE2 2.89Å; I307-E322 HydrophobicContact CD1-CG 4.15Å; I307-E322 HydrophobicContact CG1-CG 3.92Å; I307-E322 WeakPolarHBondContact CG1-OE2 3.34Å; R308-E322 WeakPolarHBondContact CB-OE2 3.4Å; R308-E322 WeakPolarHBondContact CG-OE2 3.36Å; R308-E322 PolarHBondContact N-OE1 2.89Å; R308-E322 PolarHBondContact N-OE2 3.43Å; R308-E322 IonicContact NE-OE2 3.8Å; D320-E322 PolarHBondContact OD1-N 3.49Å; E322-L324 VanDerWaalsContact C-N 3.27Å; E322-L324 PolarHBondContact O-N 3.28Å; E322-R325 PolarHBondContact O-N 3.16Å; E322-L326 HydrophobicContact CG-CD1 3.98Å; E322-L326 HydrophobicContact CG-CG 4.32Å; E322-L326 WeakPolarHBondContact O-CG 3.38Å; E322-L326 PolarHBondContact O-N 3.31Å
323	L	98.4	Very high	94.9	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-36	174.9	-66.2	-172.3	0	0	0	112.5	R166 L169 F172 I307 H321 R325 L326 I327	R166-L323 HydrophobicContact CB-CD1 3.96Å; R166-L323 HydrophobicContact CG-CD1 3.81Å; R166-L323 HydrophobicContact CG-CG 4.09Å; L169-L323 HydrophobicContact CB-CD1 4.18Å; L169-L323 HydrophobicContact CD1-CD1 4.1Å; F172-L323 HydrophobicContact CB-CB 4.14Å; F172-L323 HydrophobicContact CB-CD1 4.43Å; F172-L323 HydrophobicContact CD2-CB 4.03Å; F172-L323 HydrophobicContact CD2-CD2 4.17Å; F172-L323 WeakPolarHBondContact CD2-O 3.36Å; F172-L323 HydrophobicContact CE2-CD2 4.31Å; F172-L323 HydrophobicContact CG-CB 4.21Å; F172-L323 HydrophobicContact CG-CD1 4.48Å; F172-L323 HydrophobicContact CG-CD2 4.35Å; I307-L323 HydrophobicContact CD1-CD2 3.9Å; H321-L323 PolarHBondContact O-N 3.49Å; L323-R325 VanDerWaalsContact C-N 3.28Å; L323-R325 PolarHBondContact O-N 3.28Å; L323-L326 HydrophobicContact CD2-CD1 4.44Å; L323-L326 PolarHBondContact O-N 3.25Å; L323-I327 WeakPolarHBondContact O-CG2 3.21Å; L323-I327 PolarHBondContact O-N 3.49Å
324	L	96.9	Very high	95.4	Very high	45 Å²	45	46.8 Å²	46.8	24%	0.236	23%	0.233	C	C	.	.	H	α-helix	trans	-66.4	-29.5	174.9	-75.3	178.5	0	0	0	113.3	H168 E171 H321 E322 I327 K328	H168-L324 HydrophobicContact CB-CD1 4.36Å; H168-L324 HydrophobicContact CB-CD2 3.79Å; H168-L324 HydrophobicContact CB-CG 3.65Å; E171-L324 HydrophobicContact CG-CD2 4.14Å; H321-L324 WeakPolarHBondContact O-CB 3.39Å; H321-L324 PolarHBondContact O-N 3.14Å; E322-L324 VanDerWaalsContact C-N 3.27Å; E322-L324 PolarHBondContact O-N 3.28Å; L324-I327 VanDerWaalsContact O-CG2 3.25Å; L324-I327 WeakPolarHBondContact O-CG2 3.47Å; L324-K328 WeakPolarHBondContact O-CG 3.37Å
325	R	97.9	Very high	95.9	Very high	82 Å²	82	43.9 Å²	43.9	31%	0.309	22%	0.222	S	C	.	.	H	α-helix	trans	-80.3	-42.7	175.6	-64.3	-172.2	-66.6	-100.8	2.7	110.8	H321 E322 L323 I327 K328 Y329 W348	H321-R325 PolarHBondContact O-N 3.26Å; E322-R325 PolarHBondContact O-N 3.16Å; L323-R325 VanDerWaalsContact C-N 3.28Å; L323-R325 PolarHBondContact O-N 3.28Å; R325-I327 VanDerWaalsContact C-N 3.35Å; R325-I327 PolarHBondContact O-N 3.43Å; R325-K328 WeakPolarHBondContact O-CB 3.47Å; R325-K328 PolarHBondContact O-N 3.05Å; R325-K328 VanDerWaalsContact O-N 3.15Å; R325-Y329 PolarHBondContact O-N 3.04Å; R325-W348 HydrophobicContact CB-CH2 3.54Å; R325-W348 HydrophobicContact CB-CZ3 3.79Å
326	L	98.6	Very high	96.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-65.2	-35.9	178.9	-72.8	170.7	0	0	0	112.9	F172 F290 L305 I307 E322 L323 K328 Y329 L330 W348	F172-L326 HydrophobicContact CE2-CB 4.2Å; F290-L326 HydrophobicContact CD2-CD1 4.12Å; F290-L326 HydrophobicContact CE2-CB 3.79Å; F290-L326 HydrophobicContact CE2-CD1 3.82Å; F290-L326 HydrophobicContact CE2-CD2 4.24Å; F290-L326 HydrophobicContact CE2-CG 4.19Å; F290-L326 HydrophobicContact CZ-CB 4.15Å; F290-L326 HydrophobicContact CZ-CD1 4.41Å; F290-L326 HydrophobicContact CZ-CD2 4.02Å; F290-L326 HydrophobicContact CZ-CG 4.44Å; L305-L326 HydrophobicContact CD1-CD2 4.08Å; L305-L326 HydrophobicContact CD2-CD2 3.72Å; I307-L326 HydrophobicContact CB-CD1 4.48Å; I307-L326 HydrophobicContact CD1-CD1 3.18Å; I307-L326 HydrophobicContact CG1-CD1 3.72Å; E322-L326 HydrophobicContact CG-CD1 3.98Å; E322-L326 HydrophobicContact CG-CG 4.32Å; E322-L326 WeakPolarHBondContact O-CG 3.38Å; E322-L326 PolarHBondContact O-N 3.31Å; L323-L326 HydrophobicContact CD2-CD1 4.44Å; L323-L326 PolarHBondContact O-N 3.25Å; L326-K328 PolarHBondContact O-N 3.21Å; L326-Y329 WeakPolarHBondContact O-CA 3.21Å; L326-Y329 VanDerWaalsContact O-CB 3.32Å; L326-Y329 WeakPolarHBondContact O-CB 3.49Å; L326-Y329 PolarHBondContact O-N 3Å; L326-L330 PolarHBondContact O-N 3.08Å; L326-W348 HydrophobicContact CD2-CD2 3.87Å; L326-W348 HydrophobicContact CD2-CE3 4.15Å; L326-W348 HydrophobicContact CD2-CG 4.43Å; L326-W348 HydrophobicContact CD2-CH2 4.14Å; L326-W348 HydrophobicContact CD2-CZ2 3.83Å; L326-W348 HydrophobicContact CD2-CZ3 4.29Å; L326-W348 HydrophobicContact CG-CH2 4.35Å; L326-W348 HydrophobicContact CG-CZ2 4.3Å
327	I	98.4	Very high	96.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.2	-33.9	175.3	-173.5	56.7	0	0	0	112.4	F172 R175 A176 L323 L324 R325 Y329 L330 E331	F172-I327 HydrophobicContact CD2-CB 3.8Å; F172-I327 HydrophobicContact CE2-CB 4.31Å; R175-I327 HydrophobicContact CB-CD1 3.55Å; R175-I327 HydrophobicContact CB-CG1 3.46Å; R175-I327 VanDerWaalsContact CB-CG1 3.46Å; R175-I327 HydrophobicContact CG-CG1 4.44Å; A176-I327 HydrophobicContact CB-CD1 3.94Å; A176-I327 VanDerWaalsContact N-CD1 3.29Å; L323-I327 WeakPolarHBondContact O-CG2 3.21Å; L323-I327 PolarHBondContact O-N 3.49Å; L324-I327 VanDerWaalsContact O-CG2 3.25Å; L324-I327 WeakPolarHBondContact O-CG2 3.47Å; R325-I327 VanDerWaalsContact C-N 3.35Å; R325-I327 PolarHBondContact O-N 3.43Å; I327-Y329 VanDerWaalsContact C-N 3.29Å; I327-Y329 PolarHBondContact O-N 3.03Å; I327-L330 HydrophobicContact CD1-CB 4.35Å; I327-L330 HydrophobicContact CD1-CD1 4.44Å; I327-L330 PolarHBondContact O-N 3.42Å; I327-E331 HydrophobicContact CD1-CG 4.44Å; I327-E331 HydrophobicContact CG1-CG 4.48Å; I327-E331 VanDerWaalsContact O-CG 3.32Å; I327-E331 WeakPolarHBondContact O-CG 3.49Å; I327-E331 PolarHBondContact O-N 3.17Å
328	K	98.4	Very high	97.3	Very high	86 Å²	86	46.8 Å²	46.8	37%	0.374	22%	0.224	S	C	.	.	H	α-helix	trans	-63.5	-39.8	173.5	-63.3	168.4	-177.2	179.9	0	110.6	L324 R325 L326 L332 V352 L359	L324-K328 WeakPolarHBondContact O-CG 3.37Å; R325-K328 WeakPolarHBondContact O-CB 3.47Å; R325-K328 PolarHBondContact O-N 3.05Å; R325-K328 VanDerWaalsContact O-N 3.15Å; L326-K328 PolarHBondContact O-N 3.21Å; K328-L332 WeakPolarHBondContact O-CD1 3.43Å; K328-L332 VanDerWaalsContact O-CG 3.23Å; K328-L332 WeakPolarHBondContact O-CG 3.35Å; K328-L332 PolarHBondContact O-N 2.84Å; K328-V352 HydrophobicContact CB-CG1 4.39Å; K328-L359 HydrophobicContact CB-CD1 3.8Å; K328-L359 HydrophobicContact CB-CD2 3.82Å; K328-L359 HydrophobicContact CB-CG 4.49Å; K328-L359 HydrophobicContact CD-CD1 4.09Å; K328-L359 HydrophobicContact CG-CD1 4.13Å; K328-L359 HydrophobicContact CG-CD2 4.16Å
329	Y	98.7	Very high	97.6	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-62.8	-50.4	175.4	-179.8	-121.2	0	0	0	111.7	I288 L305 R325 L326 I327 E331 L332 I333 H345 W348 Y351 V352	I288-Y329 HydrophobicContact CD1-CE1 3.94Å; L305-Y329 HydrophobicContact CD1-CD1 3.92Å; L305-Y329 HydrophobicContact CD1-CE1 3.67Å; R325-Y329 PolarHBondContact O-N 3.04Å; L326-Y329 WeakPolarHBondContact O-CA 3.21Å; L326-Y329 VanDerWaalsContact O-CB 3.32Å; L326-Y329 WeakPolarHBondContact O-CB 3.49Å; L326-Y329 PolarHBondContact O-N 3Å; I327-Y329 VanDerWaalsContact C-N 3.29Å; I327-Y329 PolarHBondContact O-N 3.03Å; Y329-E331 PolarHBondContact O-N 2.85Å; Y329-L332 PolarHBondContact O-N 2.7Å; Y329-L332 VanDerWaalsContact O-N 3.14Å; Y329-I333 HydrophobicContact CD1-CD1 4.35Å; Y329-I333 HydrophobicContact CD2-CG2 3.82Å; Y329-I333 HydrophobicContact CE1-CD1 3.93Å; Y329-I333 HydrophobicContact CE1-CG2 4.31Å; Y329-I333 HydrophobicContact CE2-CG2 3.32Å; Y329-I333 HydrophobicContact CG-CG2 4.48Å; Y329-I333 WeakPolarHBondContact O-CG1 3.37Å; Y329-I333 PolarHBondContact O-N 3.36Å; Y329-H345 AromaticContact CE1-ND1 3.77Å; Y329-H345 AromaticContact CZ-ND1 3.72Å; Y329-H345 PolarHBondContact OH-CE1 2.88Å; Y329-H345 PolarHBondContact OH-ND1 3.35Å; Y329-W348 HydrophobicContact CD1-CB 3.79Å; Y329-W348 HydrophobicContact CD1-CG 4.48Å; Y329-W348 HydrophobicContact CD2-CB 3.88Å; Y329-W348 HydrophobicContact CE1-CB 3.67Å; Y329-W348 HydrophobicContact CE2-CB 3.77Å; Y329-W348 HydrophobicContact CG-CB 3.89Å; Y329-W348 HydrophobicContact CG-CE3 4.32Å; Y329-Y351 AromaticContact CD2-CD1 3.92Å; Y329-Y351 HydrophobicContact CD2-CD1 3.92Å; Y329-Y351 HydrophobicContact CD2-CG 4.35Å; Y329-Y351 AromaticContact CE2-CD1 3.78Å; Y329-Y351 HydrophobicContact CE2-CD1 3.78Å; Y329-Y351 AromaticContact CE2-CG 3.86Å; Y329-Y351 HydrophobicContact CE2-CG 3.86Å; Y329-V352 HydrophobicContact CD2-CG2 4.01Å; Y329-V352 HydrophobicContact CG-CG2 4.27Å
330	L	98.8	Very high	97.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.6	-46.1	177.7	-69.9	-177.2	0	0	0	112.5	L143 F172 A176 Y180 I288 F290 L326 I327 L332 I333 A334	L143-L330 HydrophobicContact CD1-CD1 4.05Å; L143-L330 HydrophobicContact CD1-CD2 4.38Å; L143-L330 HydrophobicContact CD2-CD1 3.86Å; F172-L330 HydrophobicContact CE2-CD1 3.8Å; F172-L330 HydrophobicContact CZ-CD1 3.72Å; A176-L330 HydrophobicContact CB-CD1 4.37Å; Y180-L330 HydrophobicContact CE2-CB 3.86Å; Y180-L330 HydrophobicContact CE2-CD2 4.34Å; Y180-L330 PolarHBondContact OH-O 3.12Å; Y180-L330 VanDerWaalsContact OH-O 3.11Å; I288-L330 HydrophobicContact CD1-CD2 4.21Å; I288-L330 HydrophobicContact CG2-CD2 3.59Å; F290-L330 HydrophobicContact CE1-CD2 4.2Å; F290-L330 HydrophobicContact CE2-CD1 4.01Å; F290-L330 HydrophobicContact CE2-CG 4.33Å; F290-L330 HydrophobicContact CZ-CD1 4Å; F290-L330 HydrophobicContact CZ-CD2 3.7Å; F290-L330 HydrophobicContact CZ-CG 3.86Å; L326-L330 PolarHBondContact O-N 3.08Å; I327-L330 HydrophobicContact CD1-CB 4.35Å; I327-L330 HydrophobicContact CD1-CD1 4.44Å; I327-L330 PolarHBondContact O-N 3.42Å; L330-L332 VanDerWaalsContact C-N 3.31Å; L330-L332 PolarHBondContact O-N 2.74Å; L330-I333 HydrophobicContact CD2-CD1 4.23Å; L330-A334 WeakPolarHBondContact O-CB 3.48Å; L330-A334 PolarHBondContact O-N 2.94Å
331	E	98.5	Very high	98	Very high	5 Å²	5	36.6 Å²	36.6	2%	0.023	18%	0.178	C	C	.	.	H	α-helix	trans	-58.6	-43.6	176.5	-72.9	177	153.9	0	0	111.8	R175 Y179 I327 Y329 L335 L362 R366	R175-E331 IonicContact CZ-OE1 2.8Å; R175-E331 IonicContact CZ-OE2 3.47Å; R175-E331 IonicContact NE-OE1 3.66Å; R175-E331 PolarHBondContact NE-OE1 3.36Å; R175-E331 IonicContact NE-OE2 3.78Å; R175-E331 IonicContact NH2-OE1 3.7Å; R175-E331 PolarHBondContact NH2-OE1 2.88Å; R175-E331 IonicContact NH2-OE2 3.63Å; R175-E331 PolarHBondContact NH2-OE2 2.57Å; Y179-E331 HydrophobicContact CD2-CG 4.29Å; Y179-E331 HydrophobicContact CE2-CB 4.3Å; Y179-E331 HydrophobicContact CE2-CG 3.78Å; I327-E331 HydrophobicContact CD1-CG 4.44Å; I327-E331 HydrophobicContact CG1-CG 4.48Å; I327-E331 VanDerWaalsContact O-CG 3.32Å; I327-E331 WeakPolarHBondContact O-CG 3.49Å; I327-E331 PolarHBondContact O-N 3.17Å; Y329-E331 PolarHBondContact O-N 2.85Å; E331-L335 WeakPolarHBondContact O-CD1 3.42Å; E331-L335 VanDerWaalsContact O-CG 3.26Å; E331-L335 WeakPolarHBondContact O-CG 3.38Å; E331-L335 PolarHBondContact O-N 3.38Å; E331-L362 HydrophobicContact CB-CD1 4.31Å; E331-R366 IonicContact OE1-NH2 2.78Å; E331-R366 IonicContact OE2-NH2 2.84Å
332	L	98.6	Very high	97.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70.6	-47.4	-177.2	-69.7	167.9	0	0	0	112.4	K328 Y329 L330 A334 L335 N336 Y351 V352 H355 Q358 L359	K328-L332 WeakPolarHBondContact O-CD1 3.43Å; K328-L332 VanDerWaalsContact O-CG 3.23Å; K328-L332 WeakPolarHBondContact O-CG 3.35Å; K328-L332 PolarHBondContact O-N 2.84Å; Y329-L332 PolarHBondContact O-N 2.7Å; Y329-L332 VanDerWaalsContact O-N 3.14Å; L330-L332 VanDerWaalsContact C-N 3.31Å; L330-L332 PolarHBondContact O-N 2.74Å; L332-A334 VanDerWaalsContact C-N 3.27Å; L332-A334 PolarHBondContact O-N 2.7Å; L332-L335 PolarHBondContact O-N 3.31Å; L332-N336 VanDerWaalsContact O-CB 3.31Å; L332-N336 WeakPolarHBondContact O-CB 3.48Å; L332-N336 PolarHBondContact O-N 2.89Å; L332-N336 PolarHBondContact O-ND2 3.43Å; L332-Y351 HydrophobicContact CB-CD1 4.4Å; L332-Y351 HydrophobicContact CB-CE1 3.85Å; L332-V352 HydrophobicContact CD1-CG2 4.36Å; L332-H355 HydrophobicContact CD1-CB 3.9Å; L332-H355 HydrophobicContact CD2-CB 3.79Å; L332-H355 HydrophobicContact CG-CB 4.38Å; L332-Q358 HydrophobicContact CD2-CB 3.87Å; L332-L359 HydrophobicContact CD1-CD1 3.87Å; L332-L359 HydrophobicContact CD1-CD2 4.01Å; L332-L359 HydrophobicContact CD1-CG 3.83Å; L332-L359 HydrophobicContact CD2-CD2 4.06Å; L332-L359 HydrophobicContact CD2-CG 4.03Å; L332-L359 HydrophobicContact CG-CD2 3.81Å; L332-L359 HydrophobicContact CG-CG 4.04Å
333	I	98.6	Very high	97.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67.2	-34.3	179.7	67.2	175.7	0	0	0	110.6	Y180 I288 Y329 L330 L335 E337 F340 L343 Y351	Y180-I333 WeakPolarHBondContact OH-CG1 3.49Å; I288-I333 HydrophobicContact CD1-CD1 3.92Å; Y329-I333 HydrophobicContact CD1-CD1 4.35Å; Y329-I333 HydrophobicContact CD2-CG2 3.82Å; Y329-I333 HydrophobicContact CE1-CD1 3.93Å; Y329-I333 HydrophobicContact CE1-CG2 4.31Å; Y329-I333 HydrophobicContact CE2-CG2 3.32Å; Y329-I333 HydrophobicContact CG-CG2 4.48Å; Y329-I333 WeakPolarHBondContact O-CG1 3.37Å; Y329-I333 PolarHBondContact O-N 3.36Å; L330-I333 HydrophobicContact CD2-CD1 4.23Å; I333-L335 VanDerWaalsContact C-N 3.29Å; I333-L335 PolarHBondContact O-N 2.86Å; I333-E337 HydrophobicContact CB-CG 4.22Å; I333-E337 HydrophobicContact CG2-CG 4.46Å; I333-E337 WeakPolarHBondContact O-CA 3.4Å; I333-E337 VanDerWaalsContact O-CB 3.31Å; I333-E337 WeakPolarHBondContact O-CB 3.23Å; I333-E337 PolarHBondContact O-N 3.42Å; I333-F340 HydrophobicContact CB-CE1 4.03Å; I333-F340 HydrophobicContact CB-CZ 4.26Å; I333-F340 HydrophobicContact CD1-CD2 4.31Å; I333-F340 HydrophobicContact CD1-CE1 4.23Å; I333-F340 HydrophobicContact CD1-CE2 3.85Å; I333-F340 HydrophobicContact CD1-CZ 3.78Å; I333-F340 HydrophobicContact CG1-CE1 4.01Å; I333-F340 HydrophobicContact CG1-CE2 4.3Å; I333-F340 HydrophobicContact CG1-CZ 3.71Å; I333-F340 WeakPolarHBondContact O-CE1 3.35Å; I333-L343 HydrophobicContact CB-CD1 3.89Å; I333-L343 HydrophobicContact CD1-CD1 4.21Å; I333-L343 HydrophobicContact CG2-CD1 3.67Å; I333-L343 HydrophobicContact CG2-CD2 4.34Å; I333-Y351 HydrophobicContact CG2-CD1 4.02Å; I333-Y351 HydrophobicContact CG2-CE1 3.69Å
334	A	98.4	Very high	97.7	Very high	15 Å²	15	43.5 Å²	43.5	12%	0.124	21%	0.214	C	C	.	.	H	α-helix	trans	-61.6	-39.2	176	0	0	0	0	0	112.6	K141 Y179 Y180 L330 L332	K141-A334 HydrophobicContact CD-CB 4.24Å; K141-A334 VanDerWaalsContact CE-O 3.23Å; K141-A334 WeakPolarHBondContact CE-O 3.4Å; Y179-A334 HydrophobicContact CD1-CB 3.83Å; Y179-A334 HydrophobicContact CG-CB 3.76Å; Y180-A334 HydrophobicContact CE2-CB 3.86Å; L330-A334 WeakPolarHBondContact O-CB 3.48Å; L330-A334 PolarHBondContact O-N 2.94Å; L332-A334 VanDerWaalsContact C-N 3.27Å; L332-A334 PolarHBondContact O-N 2.7Å
335	L	97.5	Very high	97.6	Very high	82 Å²	82	41.7 Å²	41.7	43%	0.429	20%	0.204	S	C	.	.	H	α-helix	trans	-80	-36.9	-178.7	-73.2	168.4	0	0	0	113.5	Y179 E331 L332 I333 L362	Y179-L335 HydrophobicContact CE1-CD1 4.46Å; Y179-L335 HydrophobicContact CE1-CD2 3.74Å; Y179-L335 HydrophobicContact CE1-CG 3.9Å; E331-L335 WeakPolarHBondContact O-CD1 3.42Å; E331-L335 VanDerWaalsContact O-CG 3.26Å; E331-L335 WeakPolarHBondContact O-CG 3.38Å; E331-L335 PolarHBondContact O-N 3.38Å; L332-L335 PolarHBondContact O-N 3.31Å; I333-L335 VanDerWaalsContact C-N 3.29Å; I333-L335 PolarHBondContact O-N 2.86Å; L335-L362 HydrophobicContact CD1-CD1 3.67Å; L335-L362 HydrophobicContact CD1-CD2 3.89Å; L335-L362 HydrophobicContact CD1-CG 4.32Å
336	N	98.1	Very high	97.3	Very high	56 Å²	56	41.8 Å²	41.8	30%	0.299	21%	0.211	S	C	.	.	H	α-helix	trans	-99.9	-27.7	-168.5	-64.8	-26	0	0	0	113.4	L332 Y351 Q358	L332-N336 VanDerWaalsContact O-CB 3.31Å; L332-N336 WeakPolarHBondContact O-CB 3.48Å; L332-N336 PolarHBondContact O-N 2.89Å; L332-N336 PolarHBondContact O-ND2 3.43Å; N336-Y351 VanDerWaalsContact CB-OH 3.32Å; N336-Y351 WeakPolarHBondContact CB-OH 3.43Å; N336-Y351 PolarHBondContact ND2-OH 2.74Å; N336-Q358 PolarHBondContact ND2-OE1 3.43Å; N336-Q358 PolarHBondContact OD1-OE1 2.91Å
337	E	97.9	Very high	97	Very high	48 Å²	48	45.3 Å²	45.3	22%	0.224	23%	0.227	C	C	.	.			trans	-112.5	118.2	-166.6	-52.2	-65.1	164.7	0	0	111	K141 I333 F340 L343 Y351	K141-E337 PolarHBondContact NZ-O 2.89Å; I333-E337 HydrophobicContact CB-CG 4.22Å; I333-E337 HydrophobicContact CG2-CG 4.46Å; I333-E337 WeakPolarHBondContact O-CA 3.4Å; I333-E337 VanDerWaalsContact O-CB 3.31Å; I333-E337 WeakPolarHBondContact O-CB 3.23Å; I333-E337 PolarHBondContact O-N 3.42Å; E337-F340 HydrophobicContact CB-CD1 3.95Å; E337-F340 HydrophobicContact CB-CE1 4.04Å; E337-L343 HydrophobicContact CB-CD1 4.48Å; E337-L343 HydrophobicContact CG-CD1 4.23Å; E337-L343 HydrophobicContact CG-CD2 3.98Å; E337-L343 HydrophobicContact CG-CG 4.41Å; E337-Y351 HydrophobicContact CG-CE2 4.39Å; E337-Y351 WeakPolarHBondContact CG-OH 3.42Å; E337-Y351 WeakPolarHBondContact OE1-CE2 3.47Å; E337-Y351 VanDerWaalsContact OE1-CZ 3.25Å; E337-Y351 PolarHBondContact OE1-OH 3.02Å
338	Q	96.4	Very high	96.9	Very high	159 Å²	159	46.7 Å²	46.7	74%	0.743	23%	0.232	S	C	*	.	S	Bend	trans	-78.7	-27	172.1	-62.8	-60	-13.8	0	0	111.9
339	D	98	Very high	96.8	Very high	52 Å²	52	46.4 Å²	46.4	28%	0.278	24%	0.235	S	C	.	.			trans	-133.1	105.6	-178	178.8	14.2	0	0	0	111	H285 T341 Q342	H285-D339 WeakPolarHBondContact CA-OD1 3.12Å; H285-D339 HydrophobicContact CB-CB 4.4Å; H285-D339 WeakPolarHBondContact CB-OD1 3.08Å; H285-D339 WeakPolarHBondContact O-CA 3.45Å; D339-T341 PolarHBondContact O-N 3.45Å; D339-T341 WeakPolarHBondContact OD1-CB 3.29Å; D339-T341 WeakPolarHBondContact OD1-CG2 3.01Å; D339-T341 PolarHBondContact OD1-N 2.64Å; D339-T341 PolarHBondContact OD1-OG1 3.32Å; D339-T341 PolarHBondContact OD2-OG1 3.27Å; D339-Q342 HydrophobicContact CB-CG 4.47Å; D339-Q342 PolarHBondContact O-N 3.17Å; D339-Q342 PolarHBondContact OD2-NE2 3.01Å
340	F	98.5	Very high	96.7	Very high	1 Å²	1	54 Å²	54	0%	0.004	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-67.5	-16.8	179.5	-70.1	2.8	0	0	0	113.1	K141 Y180 H285 I288 I333 E337 Q342 L343	K141-F340 HydrophobicContact CD-CE1 3.86Å; K141-F340 HydrophobicContact CD-CE2 4.04Å; K141-F340 HydrophobicContact CD-CZ 3.3Å; Y180-F340 AromaticContact CE1-CE2 3.97Å; Y180-F340 HydrophobicContact CE1-CE2 3.97Å; Y180-F340 HydrophobicContact CE1-CZ 4.23Å; Y180-F340 WeakPolarHBondContact OH-CZ 3.43Å; H285-F340 PolarHBondContact O-N 3.4Å; I288-F340 HydrophobicContact CB-CD2 4.39Å; I288-F340 HydrophobicContact CB-CE2 4.47Å; I288-F340 HydrophobicContact CG2-CE2 4.46Å; I333-F340 HydrophobicContact CB-CE1 4.03Å; I333-F340 HydrophobicContact CB-CZ 4.26Å; I333-F340 HydrophobicContact CD1-CD2 4.31Å; I333-F340 HydrophobicContact CD1-CE1 4.23Å; I333-F340 HydrophobicContact CD1-CE2 3.85Å; I333-F340 HydrophobicContact CD1-CZ 3.78Å; I333-F340 HydrophobicContact CG1-CE1 4.01Å; I333-F340 HydrophobicContact CG1-CE2 4.3Å; I333-F340 HydrophobicContact CG1-CZ 3.71Å; I333-F340 WeakPolarHBondContact O-CE1 3.35Å; E337-F340 HydrophobicContact CB-CD1 3.95Å; E337-F340 HydrophobicContact CB-CE1 4.04Å; F340-Q342 PolarHBondContact O-N 3.27Å; F340-Q342 VanDerWaalsContact O-N 3.08Å; F340-L343 HydrophobicContact CB-CD1 4.18Å; F340-L343 HydrophobicContact CD1-CD1 4.03Å; F340-L343 HydrophobicContact CG-CD1 4.19Å; F340-L343 WeakPolarHBondContact O-CB 3.49Å; F340-L343 PolarHBondContact O-N 3.04Å
341	T	97.1	Very high	96.6	Very high	44 Å²	44	55.3 Å²	55.3	27%	0.27	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-66.2	-13.4	178.8	70.8	0	0	0	0	113.2	P284 Q302 D339 L343	P284-T341 HydrophobicContact CB-CG2 3.51Å; Q302-T341 PolarHBondContact NE2-O 3Å; D339-T341 PolarHBondContact O-N 3.45Å; D339-T341 WeakPolarHBondContact OD1-CB 3.29Å; D339-T341 WeakPolarHBondContact OD1-CG2 3.01Å; D339-T341 PolarHBondContact OD1-N 2.64Å; D339-T341 PolarHBondContact OD1-OG1 3.32Å; D339-T341 PolarHBondContact OD2-OG1 3.27Å; T341-L343 VanDerWaalsContact C-N 3.34Å
342	Q	95.3	Very high	96.6	Very high	143 Å²	143	56.1 Å²	56.1	67%	0.668	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-86.6	-3.6	176.2	-52.9	-52.7	-48	0	0	113.5	D339 F340	D339-Q342 HydrophobicContact CB-CG 4.47Å; D339-Q342 PolarHBondContact O-N 3.17Å; D339-Q342 PolarHBondContact OD2-NE2 3.01Å; F340-Q342 PolarHBondContact O-N 3.27Å; F340-Q342 VanDerWaalsContact O-N 3.08Å
343	L	96.2	Very high	96.5	Very high	10 Å²	10	62.5 Å²	62.5	5%	0.052	30%	0.304	C	S	.	.			trans	-90.8	143.7	-174.5	-65.4	170.4	0	0	0	112.5	Q302 I333 E337 F340 T341 Y351	Q302-L343 PolarHBondContact NE2-O 2.98Å; I333-L343 HydrophobicContact CB-CD1 3.89Å; I333-L343 HydrophobicContact CD1-CD1 4.21Å; I333-L343 HydrophobicContact CG2-CD1 3.67Å; I333-L343 HydrophobicContact CG2-CD2 4.34Å; E337-L343 HydrophobicContact CB-CD1 4.48Å; E337-L343 HydrophobicContact CG-CD1 4.23Å; E337-L343 HydrophobicContact CG-CD2 3.98Å; E337-L343 HydrophobicContact CG-CG 4.41Å; F340-L343 HydrophobicContact CB-CD1 4.18Å; F340-L343 HydrophobicContact CD1-CD1 4.03Å; F340-L343 HydrophobicContact CG-CD1 4.19Å; F340-L343 WeakPolarHBondContact O-CB 3.49Å; F340-L343 PolarHBondContact O-N 3.04Å; T341-L343 VanDerWaalsContact C-N 3.34Å; L343-Y351 HydrophobicContact CD2-CD2 3.85Å; L343-Y351 HydrophobicContact CD2-CE2 3.63Å
344	N	94.6	Very high	96.5	Very high	85 Å²	85	70.1 Å²	70.1	46%	0.455	34%	0.337	S	S	.	.			trans	-97	95.7	166.6	-172.8	-21.8	0	0	0	109.7	N346 H347	N344-N346 PolarHBondContact O-N 2.7Å; N344-N346 WeakPolarHBondContact OD1-CB 3.46Å; N344-N346 PolarHBondContact OD1-N 3.23Å; N344-H347 CarbonylContact O-C 3.49Å; N344-H347 PolarHBondContact O-N 3.38Å; N344-H347 VanDerWaalsContact O-N 3.14Å
345	H	95.2	Very high	96.5	Very high	7 Å²	7	70.7 Å²	70.7	3%	0.032	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-67.2	-15.9	179.9	-63.2	-43	0	0	0	113.9	Q302 L305 Y329 H347	Q302-H345 PolarHBondContact O-CD2 3.15Å; Q302-H345 PolarHBondContact O-NE2 3.09Å; L305-H345 HydrophobicContact CB-CB 4.09Å; L305-H345 HydrophobicContact CD1-CB 4.2Å; L305-H345 HydrophobicContact CG-CB 4.24Å; Y329-H345 AromaticContact CE1-ND1 3.77Å; Y329-H345 AromaticContact CZ-ND1 3.72Å; Y329-H345 PolarHBondContact OH-CE1 2.88Å; Y329-H345 PolarHBondContact OH-ND1 3.35Å; H345-H347 PolarHBondContact O-N 3.06Å
346	N	91.1	Very high	96.4	Very high	83 Å²	83	74.2 Å²	74.2	44%	0.444	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-73.7	-16.9	173.8	-56.9	-45.4	0	0	0	112.6	R294 N344	R294-N346 PolarHBondContact NH1-OD1 3.39Å; N344-N346 PolarHBondContact O-N 2.7Å; N344-N346 WeakPolarHBondContact OD1-CB 3.46Å; N344-N346 PolarHBondContact OD1-N 3.23Å
347	H	92.9	Very high	96.4	Very high	75 Å²	75	79.4 Å²	79.4	35%	0.347	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-126.3	38.5	-180	-62.8	-45	0	0	0	111.4	N344 H345 D349 R350 Y351	N344-H347 CarbonylContact O-C 3.49Å; N344-H347 PolarHBondContact O-N 3.38Å; N344-H347 VanDerWaalsContact O-N 3.14Å; H345-H347 PolarHBondContact O-N 3.06Å; H347-D349 VanDerWaalsContact C-OD1 3.31Å; H347-D349 WeakPolarHBondContact CA-OD1 3.44Å; H347-D349 PolarHBondContact O-N 2.78Å; H347-R350 HydrophobicContact CB-CB 4.48Å; H347-R350 HydrophobicContact CB-CG 4.18Å; H347-R350 WeakPolarHBondContact O-CB 3.3Å; H347-R350 PolarHBondContact O-N 3.11Å; H347-R350 VanDerWaalsContact O-N 3.1Å; H347-Y351 PolarHBondContact O-N 2.95Å
348	W	96.9	Very high	96.4	Very high	29 Å²	29	80.4 Å²	80.4	11%	0.11	37%	0.369	C	S	.	.	H	α-helix	trans	-58.2	-31.2	-179.5	63.8	-98.1	0	0	0	112.4	L305 R325 L326 Y329 R350 Y351 V352	L305-W348 HydrophobicContact CD1-CB 3.97Å; L305-W348 HydrophobicContact CD1-CG 3.89Å; R325-W348 HydrophobicContact CB-CH2 3.54Å; R325-W348 HydrophobicContact CB-CZ3 3.79Å; L326-W348 HydrophobicContact CD2-CD2 3.87Å; L326-W348 HydrophobicContact CD2-CE3 4.15Å; L326-W348 HydrophobicContact CD2-CG 4.43Å; L326-W348 HydrophobicContact CD2-CH2 4.14Å; L326-W348 HydrophobicContact CD2-CZ2 3.83Å; L326-W348 HydrophobicContact CD2-CZ3 4.29Å; L326-W348 HydrophobicContact CG-CH2 4.35Å; L326-W348 HydrophobicContact CG-CZ2 4.3Å; Y329-W348 HydrophobicContact CD1-CB 3.79Å; Y329-W348 HydrophobicContact CD1-CG 4.48Å; Y329-W348 HydrophobicContact CD2-CB 3.88Å; Y329-W348 HydrophobicContact CE1-CB 3.67Å; Y329-W348 HydrophobicContact CE2-CB 3.77Å; Y329-W348 HydrophobicContact CG-CB 3.89Å; Y329-W348 HydrophobicContact CG-CE3 4.32Å; W348-R350 VanDerWaalsContact C-N 3.34Å; W348-R350 PolarHBondContact O-N 2.86Å; W348-Y351 WeakPolarHBondContact O-CB 3.36Å; W348-Y351 PolarHBondContact O-N 2.77Å; W348-V352 HydrophobicContact CE3-CG2 4.06Å; W348-V352 HydrophobicContact CZ3-CG2 4.33Å; W348-V352 WeakPolarHBondContact O-CG2 3.49Å; W348-V352 PolarHBondContact O-N 3.37Å
349	D	94.8	Very high	96.3	Very high	80 Å²	80	73.8 Å²	73.8	43%	0.428	34%	0.339	S	S	.	.	H	α-helix	trans	-61	-40.5	175.8	64.5	-65	0	0	0	111.9	H347 Y351 V352 H353	H347-D349 VanDerWaalsContact C-OD1 3.31Å; H347-D349 WeakPolarHBondContact CA-OD1 3.44Å; H347-D349 PolarHBondContact O-N 2.78Å; D349-Y351 VanDerWaalsContact C-N 3.3Å; D349-Y351 PolarHBondContact O-N 3.45Å; D349-V352 WeakPolarHBondContact O-CB 3.46Å; D349-V352 PolarHBondContact O-N 3.23Å; D349-H353 PolarHBondContact O-N 2.84Å
350	R	97.1	Very high	96.3	Very high	159 Å²	159	76.3 Å²	76.3	60%	0.6	35%	0.349	S	S	*	.	H	α-helix	trans	-64.6	-38.2	176.1	-60.2	-172.8	-176.9	165.9	-0.3	111.1	H347 W348 H353 K354	H347-R350 HydrophobicContact CB-CB 4.48Å; H347-R350 HydrophobicContact CB-CG 4.18Å; H347-R350 WeakPolarHBondContact O-CB 3.3Å; H347-R350 PolarHBondContact O-N 3.11Å; H347-R350 VanDerWaalsContact O-N 3.1Å; W348-R350 VanDerWaalsContact C-N 3.34Å; W348-R350 PolarHBondContact O-N 2.86Å; R350-H353 PolarHBondContact O-N 3.38Å; R350-K354 WeakPolarHBondContact O-CB 3.33Å; R350-K354 PolarHBondContact O-N 2.97Å
351	Y	97.2	Very high	96.2	Very high	28 Å²	28	80.7 Å²	80.7	11%	0.11	37%	0.371	C	S	.	.	H	α-helix	trans	-64.1	-43.6	175	-170.9	-80.3	0	0	0	111.2	Y329 L332 I333 N336 E337 L343 H347 W348 D349 K354 H355	Y329-Y351 AromaticContact CD2-CD1 3.92Å; Y329-Y351 HydrophobicContact CD2-CD1 3.92Å; Y329-Y351 HydrophobicContact CD2-CG 4.35Å; Y329-Y351 AromaticContact CE2-CD1 3.78Å; Y329-Y351 HydrophobicContact CE2-CD1 3.78Å; Y329-Y351 AromaticContact CE2-CG 3.86Å; Y329-Y351 HydrophobicContact CE2-CG 3.86Å; L332-Y351 HydrophobicContact CB-CD1 4.4Å; L332-Y351 HydrophobicContact CB-CE1 3.85Å; I333-Y351 HydrophobicContact CG2-CD1 4.02Å; I333-Y351 HydrophobicContact CG2-CE1 3.69Å; N336-Y351 VanDerWaalsContact CB-OH 3.32Å; N336-Y351 WeakPolarHBondContact CB-OH 3.43Å; N336-Y351 PolarHBondContact ND2-OH 2.74Å; E337-Y351 HydrophobicContact CG-CE2 4.39Å; E337-Y351 WeakPolarHBondContact CG-OH 3.42Å; E337-Y351 WeakPolarHBondContact OE1-CE2 3.47Å; E337-Y351 VanDerWaalsContact OE1-CZ 3.25Å; E337-Y351 PolarHBondContact OE1-OH 3.02Å; L343-Y351 HydrophobicContact CD2-CD2 3.85Å; L343-Y351 HydrophobicContact CD2-CE2 3.63Å; H347-Y351 PolarHBondContact O-N 2.95Å; W348-Y351 WeakPolarHBondContact O-CB 3.36Å; W348-Y351 PolarHBondContact O-N 2.77Å; D349-Y351 VanDerWaalsContact C-N 3.3Å; D349-Y351 PolarHBondContact O-N 3.45Å; Y351-K354 PolarHBondContact O-N 3.49Å; Y351-H355 AromaticContact CD1-ND1 3.6Å; Y351-H355 AromaticContact CD2-CE1 3.88Å; Y351-H355 AromaticContact CE1-CE1 3.65Å; Y351-H355 AromaticContact CE1-ND1 3.41Å; Y351-H355 WeakPolarHBondContact CE1-ND1 3.43Å; Y351-H355 AromaticContact CE2-CE1 3.47Å; Y351-H355 VanDerWaalsContact CE2-CE1 3.47Å; Y351-H355 WeakPolarHBondContact CE2-CE1 3.37Å; Y351-H355 AromaticContact CG-ND1 3.96Å; Y351-H355 AromaticContact CZ-CE1 3.32Å; Y351-H355 AromaticContact CZ-ND1 3.61Å; Y351-H355 PolarHBondContact O-N 2.93Å; Y351-H355 PolarHBondContact O-ND1 3.03Å
352	V	97.6	Very high	96	Very high	22 Å²	22	79.7 Å²	79.7	13%	0.133	36%	0.364	C	S	.	.	H	α-helix	trans	-59.8	-47.3	174.3	171.9	0	0	0	0	110.9	K328 Y329 L332 W348 D349 K354 H355 R356 L359	K328-V352 HydrophobicContact CB-CG1 4.39Å; Y329-V352 HydrophobicContact CD2-CG2 4.01Å; Y329-V352 HydrophobicContact CG-CG2 4.27Å; L332-V352 HydrophobicContact CD1-CG2 4.36Å; W348-V352 HydrophobicContact CE3-CG2 4.06Å; W348-V352 HydrophobicContact CZ3-CG2 4.33Å; W348-V352 WeakPolarHBondContact O-CG2 3.49Å; W348-V352 PolarHBondContact O-N 3.37Å; D349-V352 WeakPolarHBondContact O-CB 3.46Å; D349-V352 PolarHBondContact O-N 3.23Å; V352-K354 PolarHBondContact O-N 3.25Å; V352-H355 CarbonylContact O-C 3.57Å; V352-H355 PolarHBondContact O-N 3.17Å; V352-R356 PolarHBondContact O-N 3.39Å; V352-R356 VanDerWaalsContact O-N 3.13Å; V352-L359 HydrophobicContact CG1-CD1 3.91Å
353	H	97.5	Very high	96	Very high	135 Å²	135	77.6 Å²	77.6	63%	0.625	35%	0.353	S	S	*	.	H	α-helix	trans	-59.8	-46.4	178.7	-176	89	0	0	0	111.8	D349 R350 H355 R356	D349-H353 PolarHBondContact O-N 2.84Å; R350-H353 PolarHBondContact O-N 3.38Å; H353-H355 PolarHBondContact O-N 3.43Å; H353-R356 WeakPolarHBondContact O-CB 3.3Å; H353-R356 WeakPolarHBondContact O-CG 3.5Å; H353-R356 PolarHBondContact O-N 3.46Å
354	K	97.8	Very high	95.9	Very high	159 Å²	159	81.5 Å²	81.5	69%	0.691	37%	0.373	S	S	*	.	H	α-helix	trans	-55.6	-38.3	177.7	-179.8	-178.9	175.6	-168.5	0	112.4	R350 Y351 V352	R350-K354 WeakPolarHBondContact O-CB 3.33Å; R350-K354 PolarHBondContact O-N 2.97Å; Y351-K354 PolarHBondContact O-N 3.49Å; V352-K354 PolarHBondContact O-N 3.25Å
355	H	98.1	Very high	95.8	Very high	27 Å²	27	83.2 Å²	83.2	13%	0.125	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	17.7	-175.2	-55.2	91.5	0	0	0	114.1	L332 Y351 V352 H353 K357 Q358	L332-H355 HydrophobicContact CD1-CB 3.9Å; L332-H355 HydrophobicContact CD2-CB 3.79Å; L332-H355 HydrophobicContact CG-CB 4.38Å; Y351-H355 AromaticContact CD1-ND1 3.6Å; Y351-H355 AromaticContact CD2-CE1 3.88Å; Y351-H355 AromaticContact CE1-CE1 3.65Å; Y351-H355 AromaticContact CE1-ND1 3.41Å; Y351-H355 WeakPolarHBondContact CE1-ND1 3.43Å; Y351-H355 AromaticContact CE2-CE1 3.47Å; Y351-H355 VanDerWaalsContact CE2-CE1 3.47Å; Y351-H355 WeakPolarHBondContact CE2-CE1 3.37Å; Y351-H355 AromaticContact CG-ND1 3.96Å; Y351-H355 AromaticContact CZ-CE1 3.32Å; Y351-H355 AromaticContact CZ-ND1 3.61Å; Y351-H355 PolarHBondContact O-N 2.93Å; Y351-H355 PolarHBondContact O-ND1 3.03Å; V352-H355 CarbonylContact O-C 3.57Å; V352-H355 PolarHBondContact O-N 3.17Å; H353-H355 PolarHBondContact O-N 3.43Å; H355-K357 PolarHBondContact O-N 3.23Å; H355-Q358 WeakPolarHBondContact O-CB 3.25Å; H355-Q358 PolarHBondContact O-N 3.37Å
356	R	97.2	Very high	95.6	Very high	156 Å²	156	87 Å²	87	59%	0.589	39%	0.39	S	S	*	.	H	α-helix	trans	-51.4	-34.1	-176.4	69.5	-178.7	-177.3	132.3	-3.5	115.3	V352 H353 Q358 L359 E360	V352-R356 PolarHBondContact O-N 3.39Å; V352-R356 VanDerWaalsContact O-N 3.13Å; H353-R356 WeakPolarHBondContact O-CB 3.3Å; H353-R356 WeakPolarHBondContact O-CG 3.5Å; H353-R356 PolarHBondContact O-N 3.46Å; R356-Q358 VanDerWaalsContact C-N 3.29Å; R356-Q358 PolarHBondContact O-N 2.66Å; R356-L359 WeakPolarHBondContact O-CB 3.32Å; R356-L359 PolarHBondContact O-N 2.78Å; R356-E360 PolarHBondContact O-N 2.85Å
357	K	97.7	Very high	95.6	Very high	165 Å²	165	89.1 Å²	89.1	72%	0.717	40%	0.395	S	S	*	.	H	α-helix	trans	-63	-36	178.5	-67.6	-176.6	179.9	178.9	0	112.2	H355 E360 I361	H355-K357 PolarHBondContact O-N 3.23Å; K357-E360 PolarHBondContact O-N 2.85Å; K357-I361 WeakPolarHBondContact O-CG1 3.43Å; K357-I361 PolarHBondContact O-N 2.77Å
358	Q	97.4	Very high	95.5	Very high	70 Å²	70	91.7 Å²	91.7	33%	0.327	41%	0.406	S	S	.	.	H	α-helix	trans	-68.6	-36.8	177.2	-64.2	178.4	-1.2	0	0	111.2	L332 N336 H355 R356 E360 I361 L362	L332-Q358 HydrophobicContact CD2-CB 3.87Å; N336-Q358 PolarHBondContact ND2-OE1 3.43Å; N336-Q358 PolarHBondContact OD1-OE1 2.91Å; H355-Q358 WeakPolarHBondContact O-CB 3.25Å; H355-Q358 PolarHBondContact O-N 3.37Å; R356-Q358 VanDerWaalsContact C-N 3.29Å; R356-Q358 PolarHBondContact O-N 2.66Å; Q358-E360 VanDerWaalsContact C-N 3.34Å; Q358-E360 PolarHBondContact O-N 2.84Å; Q358-I361 WeakPolarHBondContact O-CB 3.34Å; Q358-I361 PolarHBondContact O-N 2.89Å; Q358-L362 WeakPolarHBondContact O-CG 3.27Å; Q358-L362 PolarHBondContact O-N 2.89Å
359	L	95.3	Very high	95	Very high	20 Å²	20	95.1 Å²	95.1	11%	0.105	42%	0.423	C	S	.	.	H	α-helix	trans	-61.9	-40.1	175.5	-70.9	173	0	0	0	112.5	K328 L332 V352 R356 I361 L362 K363	K328-L359 HydrophobicContact CB-CD1 3.8Å; K328-L359 HydrophobicContact CB-CD2 3.82Å; K328-L359 HydrophobicContact CB-CG 4.49Å; K328-L359 HydrophobicContact CD-CD1 4.09Å; K328-L359 HydrophobicContact CG-CD1 4.13Å; K328-L359 HydrophobicContact CG-CD2 4.16Å; L332-L359 HydrophobicContact CD1-CD1 3.87Å; L332-L359 HydrophobicContact CD1-CD2 4.01Å; L332-L359 HydrophobicContact CD1-CG 3.83Å; L332-L359 HydrophobicContact CD2-CD2 4.06Å; L332-L359 HydrophobicContact CD2-CG 4.03Å; L332-L359 HydrophobicContact CG-CD2 3.81Å; L332-L359 HydrophobicContact CG-CG 4.04Å; V352-L359 HydrophobicContact CG1-CD1 3.91Å; R356-L359 WeakPolarHBondContact O-CB 3.32Å; R356-L359 PolarHBondContact O-N 2.78Å; L359-I361 VanDerWaalsContact C-N 3.3Å; L359-I361 PolarHBondContact O-N 3.21Å; L359-L362 HydrophobicContact CD2-CD1 4.39Å; L359-L362 PolarHBondContact O-N 3.1Å; L359-K363 WeakPolarHBondContact O-CB 3.38Å; L359-K363 PolarHBondContact O-N 2.84Å
360	E	96.2	Very high	94.4	Very high	104 Å²	104	95 Å²	95	49%	0.486	42%	0.422	S	S	.	.	H	α-helix	trans	-62.9	-39	175.6	-66.7	-50.9	135	0	0	111.5	R356 K357 Q358 K363 I364	R356-E360 PolarHBondContact O-N 2.85Å; K357-E360 PolarHBondContact O-N 2.85Å; Q358-E360 VanDerWaalsContact C-N 3.34Å; Q358-E360 PolarHBondContact O-N 2.84Å; E360-K363 PolarHBondContact O-N 2.83Å; E360-I364 VanDerWaalsContact O-CG1 3.27Å; E360-I364 WeakPolarHBondContact O-CG1 3.41Å; E360-I364 PolarHBondContact O-N 3.2Å
361	I	96.3	Very high	93.8	Very high	93 Å²	93	92.4 Å²	92.4	48%	0.477	42%	0.42	S	S	.	.	H	α-helix	trans	-63.1	-46.2	174.1	-63.8	167	0	0	0	110.8	K357 Q358 L359 K363 I364 K365	K357-I361 WeakPolarHBondContact O-CG1 3.43Å; K357-I361 PolarHBondContact O-N 2.77Å; Q358-I361 WeakPolarHBondContact O-CB 3.34Å; Q358-I361 PolarHBondContact O-N 2.89Å; L359-I361 VanDerWaalsContact C-N 3.3Å; L359-I361 PolarHBondContact O-N 3.21Å; I361-K363 VanDerWaalsContact C-N 3.32Å; I361-K363 PolarHBondContact O-N 2.81Å; I361-I364 PolarHBondContact O-N 3.06Å; I361-K365 HydrophobicContact CG2-CD 4.33Å; I361-K365 WeakPolarHBondContact O-CG 3.26Å; I361-K365 PolarHBondContact O-N 3.24Å
362	L	94.1	Very high	92.8	Very high	24 Å²	24	96.7 Å²	96.7	13%	0.126	44%	0.441	C	S	.	.	H	α-helix	trans	-61.8	-39.8	177.3	-69.8	174.5	0	0	0	112.1	E331 L335 Q358 L359 K365 R366	E331-L362 HydrophobicContact CB-CD1 4.31Å; L335-L362 HydrophobicContact CD1-CD1 3.67Å; L335-L362 HydrophobicContact CD1-CD2 3.89Å; L335-L362 HydrophobicContact CD1-CG 4.32Å; Q358-L362 WeakPolarHBondContact O-CG 3.27Å; Q358-L362 PolarHBondContact O-N 2.89Å; L359-L362 HydrophobicContact CD2-CD1 4.39Å; L359-L362 PolarHBondContact O-N 3.1Å; L362-K365 PolarHBondContact O-N 2.96Å; L362-R366 PolarHBondContact O-N 2.87Å
363	K	94.1	Very high	91.5	Very high	98 Å²	98	98.5 Å²	98.5	43%	0.426	45%	0.452	S	S	.	.	H	α-helix	trans	-63.1	-44.8	176.3	-172.4	-177.3	-178.5	-175.1	0	111.3	L359 E360 I361 R366 K367	L359-K363 WeakPolarHBondContact O-CB 3.38Å; L359-K363 PolarHBondContact O-N 2.84Å; E360-K363 PolarHBondContact O-N 2.83Å; I361-K363 VanDerWaalsContact C-N 3.32Å; I361-K363 PolarHBondContact O-N 2.81Å; K363-R366 PolarHBondContact O-N 3.1Å; K363-K367 WeakPolarHBondContact O-CG 3.5Å; K363-K367 PolarHBondContact O-N 3.25Å
364	I	94.7	Very high	90	Very high	92 Å²	92	102 Å²	102	47%	0.472	46%	0.46	S	S	.	.	H	α-helix	trans	-63	-45.3	176	-68.1	164.2	0	0	0	110.6	E360 I361 R366 K367 K368	E360-I364 VanDerWaalsContact O-CG1 3.27Å; E360-I364 WeakPolarHBondContact O-CG1 3.41Å; E360-I364 PolarHBondContact O-N 3.2Å; I361-I364 PolarHBondContact O-N 3.06Å; I364-R366 PolarHBondContact O-N 3.19Å; I364-K367 PolarHBondContact O-N 2.85Å; I364-K368 HydrophobicContact CG2-CD 4.48Å; I364-K368 WeakPolarHBondContact O-CG 3.46Å; I364-K368 PolarHBondContact O-N 3.39Å; I364-K368 VanDerWaalsContact O-N 3.07Å
365	K	93.1	Very high	88.1	Confident	122 Å²	122	99.7 Å²	99.7	53%	0.53	46%	0.459	S	S	.	.	H	α-helix	trans	-57.9	-46	177	-75.5	-178.7	177.8	-175.6	0	111.7	I361 L362 K368 Q369	I361-K365 HydrophobicContact CG2-CD 4.33Å; I361-K365 WeakPolarHBondContact O-CG 3.26Å; I361-K365 PolarHBondContact O-N 3.24Å; L362-K365 PolarHBondContact O-N 2.96Å; K365-K368 PolarHBondContact O-N 2.96Å; K365-Q369 WeakPolarHBondContact O-CG 3.43Å; K365-Q369 PolarHBondContact O-N 3Å; K365-Q369 VanDerWaalsContact O-N 3.12Å
366	R	91	Very high	85.9	Confident	85 Å²	85	104.6 Å²	104.6	32%	0.321	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-43.2	176.6	-80.8	-170.8	-73.5	152.1	-11.6	113	E171 R175 E331 L362 K363 I364 K368 Q369 L370	E171-R366 IonicContact OE1-NH1 3.45Å; R175-R366 VanDerWaalsContact CD-NH1 3.32Å; R175-R366 VanDerWaalsContact CZ-NH2 3.25Å; R175-R366 VanDerWaalsContact NH2-NH2 3.12Å; E331-R366 IonicContact OE1-NH2 2.78Å; E331-R366 IonicContact OE2-NH2 2.84Å; L362-R366 PolarHBondContact O-N 2.87Å; K363-R366 PolarHBondContact O-N 3.1Å; I364-R366 PolarHBondContact O-N 3.19Å; R366-K368 VanDerWaalsContact C-N 3.29Å; R366-K368 PolarHBondContact O-N 3.29Å; R366-Q369 PolarHBondContact O-N 3.14Å; R366-L370 PolarHBondContact O-N 3.48Å
367	K	91.3	Very high	83.4	Confident	128 Å²	128	104.1 Å²	104.1	56%	0.557	49%	0.491	S	S	*	.	H	α-helix	trans	-59.8	-39	176.2	-76.5	-174.7	175.1	-170.8	0	112.1	K363 I364 N371	K363-K367 WeakPolarHBondContact O-CG 3.5Å; K363-K367 PolarHBondContact O-N 3.25Å; I364-K367 PolarHBondContact O-N 2.85Å; K367-N371 VanDerWaalsContact O-CG 3.28Å; K367-N371 PolarHBondContact O-N 3.02Å; K367-N371 VanDerWaalsContact O-N 3.15Å; K367-N371 PolarHBondContact O-ND2 3.42Å
368	K	91.4	Very high	80.7	Confident	130 Å²	130	101.7 Å²	101.7	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-64.2	-48.2	176.1	-71.1	-178.2	178	-172.4	0	111.9	I364 K365 R366 L370 N371 E372	I364-K368 HydrophobicContact CG2-CD 4.48Å; I364-K368 WeakPolarHBondContact O-CG 3.46Å; I364-K368 PolarHBondContact O-N 3.39Å; I364-K368 VanDerWaalsContact O-N 3.07Å; K365-K368 PolarHBondContact O-N 2.96Å; R366-K368 VanDerWaalsContact C-N 3.29Å; R366-K368 PolarHBondContact O-N 3.29Å; K368-L370 VanDerWaalsContact C-N 3.31Å; K368-L370 PolarHBondContact O-N 3.46Å; K368-N371 PolarHBondContact O-N 3.2Å; K368-N371 VanDerWaalsContact O-N 3.16Å; K368-E372 WeakPolarHBondContact O-CG 3.48Å; K368-E372 PolarHBondContact O-N 3.24Å
369	Q	85.5	Confident	77.9	Confident	101 Å²	101	108.5 Å²	108.5	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-59.5	-40.2	177.9	-70.9	173.4	-4.5	0	0	112.7	K365 R366 E372 T373	K365-Q369 WeakPolarHBondContact O-CG 3.43Å; K365-Q369 PolarHBondContact O-N 3Å; K365-Q369 VanDerWaalsContact O-N 3.12Å; R366-Q369 PolarHBondContact O-N 3.14Å; Q369-E372 PolarHBondContact O-N 3.43Å; Q369-T373 PolarHBondContact O-N 2.91Å; Q369-T373 VanDerWaalsContact O-N 3.14Å; Q369-T373 PolarHBondContact O-OG1 2.78Å
370	L	82.9	Confident	75.2	Confident	78 Å²	78	113 Å²	113	41%	0.408	54%	0.544	S	S	.	.	H	α-helix	trans	-67	-36.2	177.7	-166.1	74.4	0	0	0	112.4	R366 K368 T373 R374 C415	R366-L370 PolarHBondContact O-N 3.48Å; K368-L370 VanDerWaalsContact C-N 3.31Å; K368-L370 PolarHBondContact O-N 3.46Å; L370-T373 WeakPolarHBondContact CA-OG1 3.26Å; L370-T373 PolarHBondContact O-OG1 3.35Å; L370-T373 VanDerWaalsContact O-OG1 3.08Å; L370-R374 PolarHBondContact O-N 3.42Å; L370-C415 HydrophobicContact CD1-CB 4.47Å
371	N	82.8	Confident	72.3	Confident	104 Å²	104	113.3 Å²	113.3	56%	0.556	55%	0.553	S	S	*	*	H	α-helix	trans	-71.4	-39.6	177.7	-72	-13.4	0	0	0	111.8	K367 K368 R374 T375	K367-N371 VanDerWaalsContact O-CG 3.28Å; K367-N371 PolarHBondContact O-N 3.02Å; K367-N371 VanDerWaalsContact O-N 3.15Å; K367-N371 PolarHBondContact O-ND2 3.42Å; K368-N371 PolarHBondContact O-N 3.2Å; K368-N371 VanDerWaalsContact O-N 3.16Å; N371-R374 PolarHBondContact O-N 3.45Å; N371-T375 PolarHBondContact O-N 2.93Å; N371-T375 PolarHBondContact O-OG1 3.46Å
372	E	77.5	Confident	69.4	Low	118 Å²	118	117 Å²	117	55%	0.551	57%	0.568	S	S	*	*	H	α-helix	trans	-65.7	-37.8	177.8	-72.5	169.4	-167.9	0	0	112.5	K368 Q369 R374 T375 N376	K368-E372 WeakPolarHBondContact O-CG 3.48Å; K368-E372 PolarHBondContact O-N 3.24Å; Q369-E372 PolarHBondContact O-N 3.43Å; E372-R374 VanDerWaalsContact C-N 3.3Å; E372-R374 PolarHBondContact O-N 3Å; E372-T375 WeakPolarHBondContact CA-OG1 3.23Å; E372-T375 PolarHBondContact O-N 3.16Å; E372-T375 PolarHBondContact O-OG1 2.89Å; E372-N376 PolarHBondContact O-N 2.78Å; E372-N376 PolarHBondContact O-ND2 3.33Å
373	T	69.3	Low	66.5	Low	60 Å²	60	120.7 Å²	120.7	37%	0.368	60%	0.596	S	S	.	*	H	α-helix	trans	-66.5	-32	175	26.8	0	0	0	0	112.3	Q369 L370	Q369-T373 PolarHBondContact O-N 2.91Å; Q369-T373 VanDerWaalsContact O-N 3.14Å; Q369-T373 PolarHBondContact O-OG1 2.78Å; L370-T373 WeakPolarHBondContact CA-OG1 3.26Å; L370-T373 PolarHBondContact O-OG1 3.35Å; L370-T373 VanDerWaalsContact O-OG1 3.08Å
374	R	65.6	Low	63.7	Low	209 Å²	209	121.5 Å²	121.5	79%	0.789	61%	0.614	S	S	*	*	H	α-helix	trans	-74.9	-33.2	177.8	-163	175.1	-177	179.5	0.9	113.1	L370 N371 E372 N376	L370-R374 PolarHBondContact O-N 3.42Å; N371-R374 PolarHBondContact O-N 3.45Å; E372-R374 VanDerWaalsContact C-N 3.3Å; E372-R374 PolarHBondContact O-N 3Å; R374-N376 VanDerWaalsContact C-N 3.34Å
375	T	58.8	Low	60.7	Low	110 Å²	110	123.3 Å²	123.3	68%	0.675	63%	0.629	S	S	*	*	H	α-helix	trans	-73.8	-23.2	178.6	46.3	0	0	0	0	113.6	N371 E372	N371-T375 PolarHBondContact O-N 2.93Å; N371-T375 PolarHBondContact O-OG1 3.46Å; E372-T375 WeakPolarHBondContact CA-OG1 3.23Å; E372-T375 PolarHBondContact O-N 3.16Å; E372-T375 PolarHBondContact O-OG1 2.89Å
376	N	52.8	Low	57.8	Low	130 Å²	130	122.5 Å²	122.5	70%	0.695	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	7.6	-177.8	-72.1	-25.9	0	0	0	114.6	E372 R374 P378	E372-N376 PolarHBondContact O-N 2.78Å; E372-N376 PolarHBondContact O-ND2 3.33Å; R374-N376 VanDerWaalsContact C-N 3.34Å; N376-P378 VanDerWaalsContact O-CD 3.25Å; N376-P378 WeakPolarHBondContact O-CD 3.36Å
377	Q	43.9	Very low	55	Low	145 Å²	145	123.4 Å²	123.4	68%	0.678	66%	0.658	S	S	*	*	S	Bend	trans	-87.9	108.4	170	-73	-165	-5	0	0	110.1	Y379	Q377-Y379 PolarHBondContact O-N 2.8Å; Q377-Y379 VanDerWaalsContact O-N 3.16Å
378	P	41.1	Very low	52.1	Low	114 Å²	114	123.1 Å²	123.1	74%	0.74	67%	0.672	S	S	*	*			trans	-66.4	117.1	177.4	26.3	-31.6	0	0	0	109.6	N376 V380	N376-P378 VanDerWaalsContact O-CD 3.25Å; N376-P378 WeakPolarHBondContact O-CD 3.36Å; P378-V380 PolarHBondContact O-N 3.31Å
379	Y	38.6	Very low	49.4	Very low	214 Å²	214	122.4 Å²	122.4	84%	0.839	68%	0.684	S	S	*	*			trans	-69.1	93.4	175.5	-142.5	-88.9	0	0	0	108.6	Q377 V381	Q377-Y379 PolarHBondContact O-N 2.8Å; Q377-Y379 VanDerWaalsContact O-N 3.16Å; Y379-V381 HydrophobicContact CD1-CG2 3.9Å; Y379-V381 PolarHBondContact O-N 2.78Å; Y379-V381 VanDerWaalsContact O-N 3.08Å
380	V	38.4	Very low	46.7	Very low	115 Å²	115	122.8 Å²	122.8	70%	0.697	70%	0.698	S	S	*	*			trans	-75.5	96.6	171	-178.4	0	0	0	0	107.4	P378 Q382	P378-V380 PolarHBondContact O-N 3.31Å; V380-Q382 HydrophobicContact CG1-CG 4.25Å; V380-Q382 PolarHBondContact O-N 3.05Å
381	V	35.5	Very low	44.2	Very low	110 Å²	110	124 Å²	124	67%	0.667	71%	0.712	S	S	*	*			trans	-69.8	95.1	168.8	179.9	0	0	0	0	107.5	Y379 S383	Y379-V381 HydrophobicContact CD1-CG2 3.9Å; Y379-V381 PolarHBondContact O-N 2.78Å; Y379-V381 VanDerWaalsContact O-N 3.08Å; V381-S383 PolarHBondContact O-N 3.3Å
382	Q	35.5	Very low	41.7	Very low	169 Å²	169	127.4 Å²	127.4	79%	0.79	73%	0.725	S	S	*	*			trans	-78.4	100.7	162.8	-84.9	-178.5	-27.8	0	0	108.3	V380 S384	V380-Q382 HydrophobicContact CG1-CG 4.25Å; V380-Q382 PolarHBondContact O-N 3.05Å; Q382-S384 PolarHBondContact O-N 3.49Å
383	S	31.9	Very low	39.3	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	74%	0.735	S	S	*	*			trans	-71	88.4	166.9	25.2	0	0	0	0	109.6	V381 T385	V381-S383 PolarHBondContact O-N 3.3Å; S383-T385 PolarHBondContact O-N 2.88Å
384	S	35.6	Very low	37.4	Very low	114 Å²	114	129.1 Å²	129.1	80%	0.797	75%	0.753	S	S	*	*			trans	-83.5	92.1	168.8	39.6	0	0	0	0	110.1	Q382	Q382-S384 PolarHBondContact O-N 3.49Å
385	T	31.8	Very low	35.5	Very low	131 Å²	131	127 Å²	127	80%	0.804	76%	0.755	S	S	*	*			trans	-85.6	110.5	161.2	49.3	0	0	0	0	109.3	S383	S383-T385 PolarHBondContact O-N 2.88Å
386	S	32.9	Very low	33.8	Very low	104 Å²	104	127.3 Å²	127.3	73%	0.727	76%	0.761	S	S	*	*			trans	-170.1	103.3	149.5	48.7	0	0	0	0	112.3
387	S	33.1	Very low	32.4	Very low	104 Å²	104	127.4 Å²	127.4	73%	0.727	77%	0.766	S	S	*	*			trans	50	102.5	135.2	57.5	0	0	0	0	119.6	S389	S387-S389 PolarHBondContact O-N 2.67Å
388	S	30.3	Very low	31.6	Very low	122 Å²	122	125.8 Å²	125.8	85%	0.853	77%	0.771	S	S	*	*			trans	-16.2	117.4	140.2	52.6	0	0	0	0	116.6
389	S	33.4	Very low	30.8	Very low	116 Å²	116	126.7 Å²	126.7	81%	0.811	78%	0.775	S	S	*	*			trans	-131.9	101.8	148.9	62.6	0	0	0	0	109	S387	S387-S389 PolarHBondContact O-N 2.67Å
390	S	28.3	Very low	30.2	Very low	109 Å²	109	123.6 Å²	123.6	76%	0.762	77%	0.771	S	S	*	*			trans	-61.7	129.5	163.9	43.9	0	0	0	0	111
391	S	31.7	Very low	29.7	Very low	102 Å²	102	125.5 Å²	125.5	71%	0.713	78%	0.777	S	S	*	*				165.5	115.7	118.9	-70.6	0	0	0	0	113
392	Q	30.1	Very low	29.4	Very low	176 Å²	176	126.4 Å²	126.4	82%	0.822	78%	0.778	S	S	*	*			trans	62.6	105.9	132.8	-60.8	-174.7	13.2	0	0	121.3
393	S	27.2	Very low	29	Very low	108 Å²	108	125.6 Å²	125.6	76%	0.755	78%	0.78	S	S	*	*				42.2	101.4	129.8	66.2	0	0	0	0	119.1
394	S	28.4	Very low	28.8	Very low	107 Å²	107	127.9 Å²	127.9	75%	0.748	78%	0.784	S	S	*	*			trans	-128.6	113.5	150.3	53.5	0	0	0	0	108.4	C396	S394-C396 PolarHBondContact O-N 3.27Å
395	I	25.8	Very low	28.4	Very low	163 Å²	163	129.4 Å²	129.4	84%	0.836	79%	0.788	S	S	*	*			trans	-61.4	112.8	175.7	-67.3	163.6	0	0	0	108	T397	I395-T397 PolarHBondContact O-N 3.14Å
396	C	23.7	Very low	28.1	Very low	117 Å²	117	128.7 Å²	128.7	79%	0.791	78%	0.783	S	S	*	*			trans	-81	104.7	176.2	-69.8	0	0	0	0	110.2	S394	S394-C396 PolarHBondContact O-N 3.27Å
397	T	23.3	Very low	27.8	Very low	133 Å²	133	128.7 Å²	128.7	82%	0.816	78%	0.783	S	S	*	*			trans	-105.4	103.5	153.7	37.1	0	0	0	0	107.5	I395	I395-T397 PolarHBondContact O-N 3.14Å
398	S	27.1	Very low	27.4	Very low	110 Å²	110	129.7 Å²	129.7	77%	0.769	78%	0.784	S	S	*	*			trans	-134.2	108.5	169.4	62	0	0	0	0	110.9
399	T	24.6	Very low	27.1	Very low	134 Å²	134	129 Å²	129	82%	0.822	78%	0.78	S	S	*	*			trans	-30.2	135.3	166.2	-51.7	0	0	0	0	115.3	N401	T399-N401 PolarHBondContact O-N 3.47Å
400	I	25.2	Very low	26.9	Very low	148 Å²	148	129.3 Å²	129.3	76%	0.759	78%	0.776	S	S	*	*			trans	-38.7	112.4	168.8	-60.6	162.8	0	0	0	110.8
401	N	28.6	Very low	26.8	Very low	155 Å²	155	133.2 Å²	133.2	83%	0.829	79%	0.785	S	S	*	*			trans	-109.2	115.3	158.3	-148.5	7.4	0	0	0	107.6	T399	T399-N401 PolarHBondContact O-N 3.47Å
402	N	28.9	Very low	26.9	Very low	130 Å²	130	131.8 Å²	131.8	70%	0.695	78%	0.775	S	S	*	*	S	Bend	trans	-59.2	144.9	176.5	-74.9	-27.7	0	0	0	109.7
403	N	27.4	Very low	26.9	Very low	152 Å²	152	128.2 Å²	128.2	81%	0.813	77%	0.769	S	S	*	*			trans	92.2	61.4	-177.5	-50.3	-16.8	0	0	0	114.7
404	N	27.1	Very low	27.1	Very low	151 Å²	151	127.1 Å²	127.1	81%	0.807	76%	0.761	S	S	*	*			trans	-145.4	99.3	143.9	-97.6	-21.9	0	0	0	108.5	V406	N404-V406 VanDerWaalsContact C-N 3.29Å; N404-V406 PolarHBondContact O-N 3.49Å
405	V	27.5	Very low	27.1	Very low	146 Å²	146	123.8 Å²	123.8	89%	0.885	74%	0.738	S	S	*	*			trans	-69.5	96	163.1	177.5	0	0	0	0	105.5	S407	V405-S407 PolarHBondContact O-N 3.46Å; V405-S407 VanDerWaalsContact O-N 3.13Å
406	V	25	Very low	27.3	Very low	116 Å²	116	119.9 Å²	119.9	70%	0.703	72%	0.722	S	S	*	*			trans	-69	108	171.9	178.6	0	0	0	0	106.6	N404 V408	N404-V406 VanDerWaalsContact C-N 3.29Å; N404-V406 PolarHBondContact O-N 3.49Å; V406-V408 PolarHBondContact O-N 2.95Å
407	S	27.4	Very low	27.6	Very low	103 Å²	103	117.4 Å²	117.4	72%	0.72	70%	0.703	S	S	*	*			trans	-62.3	104.3	168	41.7	0	0	0	0	108.4	V405 S409	V405-S407 PolarHBondContact O-N 3.46Å; V405-S407 VanDerWaalsContact O-N 3.13Å; S407-S409 PolarHBondContact O-N 3.19Å; S407-S409 VanDerWaalsContact O-N 3.17Å
408	V	24.2	Very low	27.8	Very low	125 Å²	125	118.9 Å²	118.9	76%	0.758	70%	0.7	S	S	*	*			trans	-66	115.9	168.8	-178.9	0	0	0	0	106.7	V406 V410	V406-V408 PolarHBondContact O-N 2.95Å; V408-V410 PolarHBondContact O-N 3.32Å
409	S	24.5	Very low	28.1	Very low	109 Å²	109	120.2 Å²	120.2	76%	0.762	69%	0.694	S	S	*	*			trans	-63.1	104.5	176.9	-71.1	0	0	0	0	109.2	S407 M411	S407-S409 PolarHBondContact O-N 3.19Å; S407-S409 VanDerWaalsContact O-N 3.17Å; S409-M411 PolarHBondContact O-N 3.28Å; S409-M411 VanDerWaalsContact O-N 3.15Å
410	V	29.8	Very low	28.2	Very low	121 Å²	121	118.5 Å²	118.5	73%	0.733	69%	0.685	S	S	*	*			trans	-66.6	111	166.8	-179.1	0	0	0	0	106.2	V408 S412	V408-V410 PolarHBondContact O-N 3.32Å; V410-S412 PolarHBondContact O-N 3.09Å
411	M	24.8	Very low	28.2	Very low	192 Å²	192	119.6 Å²	119.6	95%	0.946	69%	0.691	S	S	*	*			trans	-68.2	79.5	167.6	-68.2	-143.3	86.1	0	0	108.5	S409	S409-M411 PolarHBondContact O-N 3.28Å; S409-M411 VanDerWaalsContact O-N 3.15Å
412	S	33.7	Very low	28.2	Very low	72 Å²	72	120.6 Å²	120.6	50%	0.503	69%	0.691	S	S	.	*			trans	-86.9	119.2	163.1	55.8	0	0	0	0	107.8	V410 S414	V410-S412 PolarHBondContact O-N 3.09Å; S412-S414 PolarHBondContact O-N 3.36Å
413	S	31.7	Very low	28.1	Very low	101 Å²	101	119.9 Å²	119.9	71%	0.706	70%	0.696	S	S	*	*			trans	-57.9	104.4	166.7	35.2	0	0	0	0	108.3	C415	S413-C415 PolarHBondContact O-N 2.97Å
414	S	30.8	Very low	27.9	Very low	84 Å²	84	118.6 Å²	118.6	59%	0.587	70%	0.699	S	S	*	*			trans	-62.9	102.8	179.7	56.8	0	0	0	0	109.8	S412	S412-S414 PolarHBondContact O-N 3.36Å
415	C	27.3	Very low	28.1	Very low	38 Å²	38	117 Å²	117	26%	0.257	70%	0.699	S	S	.	*			trans	-105.2	107.2	168.3	-168.2	0	0	0	0	107.6	L370 S413 V417	L370-C415 HydrophobicContact CD1-CB 4.47Å; S413-C415 PolarHBondContact O-N 2.97Å; C415-V417 PolarHBondContact O-N 3.48Å
416	T	31.8	Very low	28	Very low	81 Å²	81	115.7 Å²	115.7	50%	0.497	70%	0.697	S	S	.	*			trans	-79.8	111.6	169.8	-58.7	0	0	0	0	107.7	H418	T416-H418 PolarHBondContact O-N 3.09Å
417	V	29.3	Very low	28.2	Very low	65 Å²	65	115.4 Å²	115.4	39%	0.394	70%	0.7	S	S	.	*	P	Polyproline II helix	trans	-79.8	117.7	177.2	-178.8	0	0	0	0	108.5	V178 C415	V178-V417 HydrophobicContact CG1-CG1 4.3Å; V178-V417 HydrophobicContact CG2-CG1 3.99Å; V178-V417 HydrophobicContact CG2-CG2 4.25Å; C415-V417 PolarHBondContact O-N 3.48Å
418	H	28.2	Very low	28.3	Very low	163 Å²	163	118.8 Å²	118.8	76%	0.755	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-88	136.4	168.6	-75.3	-73.1	0	0	0	110.5	T416	T416-H418 PolarHBondContact O-N 3.09Å
419	E	32.4	Very low	28.3	Very low	138 Å²	138	117.8 Å²	117.8	65%	0.645	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-62.6	135.8	177.9	-75.8	177.7	154.2	0	0	111.7	I421	E419-I421 PolarHBondContact O-N 3.36Å
420	P	26.8	Very low	28.6	Very low	98 Å²	98	117.9 Å²	117.9	64%	0.636	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-70.4	126.4	166.1	-9.4	25.3	0	0	0	109.4	E422	P420-E422 PolarHBondContact O-N 2.85Å; P420-E422 VanDerWaalsContact O-N 3.11Å
421	I	24.9	Very low	28.4	Very low	172 Å²	172	119.5 Å²	119.5	88%	0.882	71%	0.713	S	S	*	*			trans	-68.7	103.5	171.5	-59.7	169	0	0	0	107.5	E419	E419-I421 PolarHBondContact O-N 3.36Å
422	E	29	Very low	28.7	Very low	176 Å²	176	117 Å²	117	82%	0.822	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-84.7	124.4	169.9	-87.6	-178.1	169.8	0	0	110.4	P420	P420-E422 PolarHBondContact O-N 2.85Å; P420-E422 VanDerWaalsContact O-N 3.11Å
423	S	26.9	Very low	28.4	Very low	114 Å²	114	119.9 Å²	119.9	80%	0.797	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-69.9	128	176	49	0	0	0	0	110.9
424	S	24	Very low	28.2	Very low	126 Å²	126	120.1 Å²	120.1	88%	0.881	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-58.7	129.7	-177.9	-24.3	0	0	0	0	112.7
425	S	30.4	Very low	28	Very low	117 Å²	117	124.3 Å²	124.3	82%	0.818	74%	0.74	S	S	*	*			trans	-133.2	111.7	158.2	60.2	0	0	0	0	110
426	S	25.7	Very low	27.9	Very low	118 Å²	118	128.2 Å²	128.2	83%	0.825	76%	0.762	S	S	*	*			trans	-75.8	135.6	177.1	52.3	0	0	0	0	112.5
427	S	29.6	Very low	27.7	Very low	111 Å²	111	130.8 Å²	130.8	78%	0.776	78%	0.778	S	S	*	*			trans	-167.5	100.4	150	45.3	0	0	0	0	113.3
428	L	28.3	Very low	27.4	Very low	174 Å²	174	134.8 Å²	134.8	91%	0.911	80%	0.797	S	S	*	*			trans	42.9	122	131.2	-70.1	155.2	0	0	0	121.7
429	S	24.7	Very low	27.5	Very low	104 Å²	104	134.4 Å²	134.4	73%	0.727	80%	0.801	S	S	*	*			trans	-60.3	147.1	171	57.2	0	0	0	0	115.8
430	S	30.4	Very low	27.1	Very low	111 Å²	111	134 Å²	134	78%	0.776	81%	0.808	S	S	*	*			trans	-129.7	113.7	155.5	56.8	0	0	0	0	110.4
431	N	25.1	Very low	27.2	Very low	154 Å²	154	135.5 Å²	135.5	82%	0.824	82%	0.815	S	S	*	*			trans	-65.5	134.4	173.4	-71.1	-23.3	0	0	0	111
432	V	31.5	Very low	27.4	Very low	141 Å²	141	134.5 Å²	134.5	86%	0.855	81%	0.812	S	S	*	*			trans	-127.4	119.2	162.3	178.9	0	0	0	0	108.8
433	T	27.8	Very low	27.2	Very low	131 Å²	131	133.6 Å²	133.6	80%	0.804	81%	0.813	S	S	*	*			trans	-75.5	127.3	-174.2	-39.7	0	0	0	0	111.1
434	S	26.6	Very low	27.2	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	81%	0.813	S	S	*	*			trans	-74.8	129.2	175.4	47.8	0	0	0	0	112.3
435	L	27	Very low	27.2	Very low	172 Å²	172	134.7 Å²	134.7	90%	0.901	81%	0.81	S	S	*	*			trans	-105.6	119.8	165.8	-88	156.4	0	0	0	109.4
436	T	24.9	Very low	26.9	Very low	120 Å²	120	134.8 Å²	134.8	74%	0.736	81%	0.806	S	S	*	*			trans	-74.5	132.2	176.1	43.6	0	0	0	0	111.8
437	T	27.9	Very low	26.7	Very low	135 Å²	135	135.6 Å²	135.6	83%	0.828	81%	0.805	S	S	*	*			trans	-127.7	115	157.3	39.7	0	0	0	0	109.6
438	N	24.1	Very low	26.6	Very low	148 Å²	148	136 Å²	136	79%	0.791	80%	0.803	S	S	*	*			trans	-71.1	126	173.3	-67.6	-31.9	0	0	0	109
439	N	30	Very low	26.3	Very low	156 Å²	156	132.7 Å²	132.7	83%	0.834	80%	0.795	S	S	*	*			trans	-130.3	114.3	160.3	-91.9	-19.9	0	0	0	109.5
440	T	23.9	Very low	26.3	Very low	128 Å²	128	135.1 Å²	135.1	79%	0.785	80%	0.798	S	S	*	*			trans	-80.5	121.4	172.3	-48.6	0	0	0	0	108.1
441	T	28.5	Very low	25.9	Very low	130 Å²	130	135.9 Å²	135.9	80%	0.798	80%	0.798	S	S	*	*			trans	-137	140.2	166.9	36.4	0	0	0	0	111.7
442	N	28.4	Very low	25.9	Very low	152 Å²	152	135.1 Å²	135.1	81%	0.813	80%	0.799	S	S	*	*			trans	-75.5	141.3	-162.2	-67.8	-37.7	0	0	0	113
443	N	24.8	Very low	25.6	Very low	156 Å²	156	133.5 Å²	133.5	83%	0.834	79%	0.794	S	S	*	*			trans	-66.8	125.2	173.7	-69.4	-27.1	0	0	0	111.4
444	T	27.2	Very low	25.5	Very low	132 Å²	132	131.3 Å²	131.3	81%	0.81	80%	0.798	S	S	*	*			trans	-120.7	113	156	32.4	0	0	0	0	108.9	T446	T444-T446 PolarHBondContact O-N 3.3Å
445	T	23.4	Very low	25.6	Very low	132 Å²	132	131.9 Å²	131.9	81%	0.81	79%	0.789	S	S	*	*			trans	-79.7	112.2	179.9	-43.5	0	0	0	0	109
446	T	25.9	Very low	25.6	Very low	119 Å²	119	132.7 Å²	132.7	73%	0.73	79%	0.785	S	S	*	*			trans	-112.6	103.7	170.7	-47.6	0	0	0	0	109.1	T444 T448	T444-T446 PolarHBondContact O-N 3.3Å; T446-T448 PolarHBondContact O-N 2.96Å
447	T	21.5	Very low	26	Very low	134 Å²	134	131 Å²	131	82%	0.822	77%	0.765	S	S	*	*			trans	-68.6	113.3	173.6	-48.2	0	0	0	0	109.1
448	T	26.3	Very low	26.2	Very low	120 Å²	120	129.5 Å²	129.5	74%	0.736	76%	0.755	S	S	*	*			trans	-111.7	118	173.4	-14	0	0	0	0	109.6	T446	T446-T448 PolarHBondContact O-N 2.96Å
449	S	22.3	Very low	26.4	Very low	105 Å²	105	129.6 Å²	129.6	73%	0.734	75%	0.751	S	S	*	*			trans	-72.5	123.2	178.4	41.3	0	0	0	0	111	T451	S449-T451 PolarHBondContact O-N 3.4Å
450	I	24.3	Very low	26.6	Very low	155 Å²	155	129.4 Å²	129.4	80%	0.795	75%	0.75	S	S	*	*			trans	-79.4	111.3	-179.6	-57.6	166.9	0	0	0	108.6	T452	I450-T452 HydrophobicContact CG2-CG2 4.38Å
451	T	23.1	Very low	26.8	Very low	127 Å²	127	132.9 Å²	132.9	78%	0.779	75%	0.754	S	S	*	*			trans	-102.1	113.3	165	45	0	0	0	0	108.9	S449 S453	S449-T451 PolarHBondContact O-N 3.4Å; T451-S453 PolarHBondContact O-N 3.47Å
452	T	24.2	Very low	26.8	Very low	137 Å²	137	132.7 Å²	132.7	84%	0.84	75%	0.748	S	S	*	*			trans	-77.4	103.8	175.9	46.3	0	0	0	0	109.8	I450	I450-T452 HydrophobicContact CG2-CG2 4.38Å
453	S	26.2	Very low	27	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-96.9	125.7	167.7	51.6	0	0	0	0	110.1	T451 Q455	T451-S453 PolarHBondContact O-N 3.47Å; S453-Q455 PolarHBondContact O-N 3.39Å
454	G	24.1	Very low	27.3	Very low	85 Å²	85	129.7 Å²	129.7	88%	0.876	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-66.2	121.4	-179.6	0	0	0	0	0	111.6
455	Q	29.6	Very low	27.7	Very low	119 Å²	119	128.3 Å²	128.3	56%	0.556	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-80.2	125.4	177.9	-66	-173.9	-36.3	0	0	110.7	S453	S453-Q455 PolarHBondContact O-N 3.39Å
456	K	27.3	Very low	28	Very low	188 Å²	188	129.4 Å²	129.4	82%	0.817	73%	0.726	S	S	*	*			trans	-102.7	110.7	165.6	-163.4	175.5	-178.7	-175.3	0	107.4
457	R	32.6	Very low	28.2	Very low	84 Å²	84	132.7 Å²	132.7	32%	0.317	73%	0.733	S	S	.	*	P	Polyproline II helix	trans	-94.4	138.7	-170.6	-83.6	166.5	167.8	-151	8.3	111.9	F102	F102-R457 HydrophobicContact CE2-CB 4.43Å; F102-R457 HydrophobicContact CE2-CG 4.03Å; F102-R457 HydrophobicContact CZ-CB 4.26Å; F102-R457 HydrophobicContact CZ-CG 3.71Å
458	V	32.2	Very low	28.7	Very low	104 Å²	104	133.5 Å²	133.5	63%	0.63	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-89.1	147.2	-176.6	170.7	0	0	0	0	111.4	V98	V98-V458 HydrophobicContact CB-CG2 4.34Å; V98-V458 HydrophobicContact CG1-CG2 3.67Å
459	H	29.3	Very low	28.9	Very low	150 Å²	150	134.9 Å²	134.9	69%	0.694	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-79.9	128.5	-179	-71.4	-86.1	0	0	0	112.2
460	D	33	Very low	29.4	Very low	153 Å²	153	137 Å²	137	82%	0.818	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-75.8	130.7	162	-91	-28.2	0	0	0	110.6
461	K	29.1	Very low	29.7	Very low	200 Å²	200	135.8 Å²	135.8	87%	0.87	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-78.3	130	174.1	-76.1	-177	178.2	177.1	0	110.1	P463	K461-P463 WeakPolarHBondContact O-CD 3.42Å
462	N	28.7	Very low	30	Very low	127 Å²	127	137.2 Å²	137.2	68%	0.679	73%	0.734	S	S	*	*			trans	-58.3	115.2	176.5	-150	22.4	0	0	0	110.8
463	P	31.2	Very low	30.4	Very low	92 Å²	92	137.4 Å²	137.4	60%	0.597	73%	0.73	S	S	*	*			trans	-80	128.8	164.3	25.2	-16.6	0	0	0	108.6	K461 D465	K461-P463 WeakPolarHBondContact O-CD 3.42Å; P463-D465 PolarHBondContact O-N 2.87Å
464	D	31.4	Very low	30.6	Very low	153 Å²	153	139.1 Å²	139.1	82%	0.818	73%	0.73	S	S	*	*			trans	-49.5	108.8	178.6	-70.9	-45.2	0	0	0	111.1	N466	D464-N466 PolarHBondContact O-N 3.28Å
465	D	35.6	Very low	30.9	Very low	102 Å²	102	141.3 Å²	141.3	55%	0.545	72%	0.722	S	S	.	*			trans	-70.3	110	170.7	-82.2	-30.2	0	0	0	107.1	R308 P463 E467	R308-D465 IonicContact CZ-OD2 3.43Å; R308-D465 IonicContact NH1-OD1 2.74Å; R308-D465 IonicContact NH1-OD2 3.79Å; R308-D465 PolarHBondContact NH1-OD2 3.47Å; R308-D465 IonicContact NH2-OD2 2.7Å; R308-D465 PolarHBondContact NH2-OD2 2.79Å; P463-D465 PolarHBondContact O-N 2.87Å; D465-E467 PolarHBondContact O-N 3.33Å
466	N	30.3	Very low	31.1	Very low	155 Å²	155	143.5 Å²	143.5	83%	0.829	74%	0.737	S	S	*	*			trans	-55.6	123.4	171.5	-79.5	-47.1	0	0	0	110.1	D464 D468	D464-N466 PolarHBondContact O-N 3.28Å; N466-D468 PolarHBondContact O-N 2.94Å; N466-D468 VanDerWaalsContact O-N 3.14Å
467	E	30.2	Very low	31.3	Very low	189 Å²	189	143.1 Å²	143.1	88%	0.883	74%	0.738	S	S	*	*			trans	-66.1	101.9	175.4	-69.1	-179.9	152.1	0	0	110.4	D465	D465-E467 PolarHBondContact O-N 3.33Å
468	D	32.8	Very low	31.3	Very low	151 Å²	151	144.9 Å²	144.9	81%	0.807	76%	0.762	S	S	*	*			trans	-94.2	102	161	-83.4	-28.2	0	0	0	109.3	N466 I470	N466-D468 PolarHBondContact O-N 2.94Å; N466-D468 VanDerWaalsContact O-N 3.14Å; D468-I470 PolarHBondContact O-N 3.15Å
469	D	29.6	Very low	31.5	Very low	149 Å²	149	146.2 Å²	146.2	80%	0.797	77%	0.77	S	S	*	*			trans	26.5	86.1	152.1	-69.6	-28.8	0	0	0	117.7	V471	D469-V471 PolarHBondContact O-N 3.42Å
470	I	32.5	Very low	31.9	Very low	149 Å²	149	148.3 Å²	148.3	76%	0.764	78%	0.777	S	S	*	*			trans	-79.9	97.8	155.3	-61.5	175.8	0	0	0	107.4	D468 H472	D468-I470 PolarHBondContact O-N 3.15Å; I470-H472 PolarHBondContact O-N 2.63Å
471	V	29.9	Very low	32.1	Very low	130 Å²	130	144.6 Å²	144.6	79%	0.788	78%	0.775	S	S	*	*			trans	-61.6	107.4	166.8	178	0	0	0	0	108.2	D469 D473	D469-V471 PolarHBondContact O-N 3.42Å; V471-D473 PolarHBondContact O-N 3.11Å
472	H	30.9	Very low	32	Very low	157 Å²	157	144.5 Å²	144.5	73%	0.727	78%	0.775	S	S	*	*			trans	-62.7	115.7	169.2	-92.1	-78.8	0	0	0	109.6	I470 D474	I470-H472 PolarHBondContact O-N 2.63Å; H472-D474 VanDerWaalsContact C-N 3.34Å; H472-D474 PolarHBondContact O-N 3.21Å; H472-D474 VanDerWaalsContact O-N 3.09Å
473	D	32	Very low	32.5	Very low	141 Å²	141	150 Å²	150	75%	0.754	80%	0.804	S	S	*	*			trans	-80.4	82	175.5	-143.7	-10.8	0	0	0	108	V471 N475	V471-D473 PolarHBondContact O-N 3.11Å; D473-N475 VanDerWaalsContact C-N 3.31Å; D473-N475 PolarHBondContact O-N 3.35Å
474	D	30.5	Very low	32.6	Very low	144 Å²	144	152.9 Å²	152.9	77%	0.77	81%	0.814	S	S	*	*			trans	-72.3	81.9	174.1	-86.6	-23.5	0	0	0	110.3	H472	H472-D474 VanDerWaalsContact C-N 3.34Å; H472-D474 PolarHBondContact O-N 3.21Å; H472-D474 VanDerWaalsContact O-N 3.09Å
475	N	30.2	Very low	32.6	Very low	130 Å²	130	152.8 Å²	152.8	70%	0.695	81%	0.814	S	S	*	*			trans	-131.3	66.8	168.4	-84.9	-49.7	0	0	0	110.6	D473	D473-N475 VanDerWaalsContact C-N 3.31Å; D473-N475 PolarHBondContact O-N 3.35Å
476	N	33.2	Very low	32.4	Very low	165 Å²	165	155.7 Å²	155.7	88%	0.882	83%	0.829	S	S	*	*			trans	-121.5	74.4	163	-115.5	-5.4	0	0	0	109.2	C478	N476-C478 PolarHBondContact O-N 3.33Å
477	H	32.8	Very low	32.6	Very low	180 Å²	180	155.7 Å²	155.7	83%	0.833	83%	0.829	S	S	*	*			trans	-69.5	94.2	166.5	-93.8	5.6	0	0	0	109.6	V479	H477-V479 PolarHBondContact O-N 3.23Å; H477-V479 VanDerWaalsContact O-N 3.17Å
478	C	32.5	Very low	32.7	Very low	122 Å²	122	153.6 Å²	153.6	82%	0.824	83%	0.826	S	S	*	*			trans	-69.3	104.2	166.1	-167.6	0	0	0	0	108.7	N476 K480	N476-C478 PolarHBondContact O-N 3.33Å; C478-K480 PolarHBondContact O-N 3.4Å; C478-K480 VanDerWaalsContact O-N 3.14Å
479	V	35.7	Very low	32.7	Very low	132 Å²	132	153.8 Å²	153.8	80%	0.8	83%	0.827	S	S	*	*			trans	-64.4	108.1	175.2	176.4	0	0	0	0	108.5	H477 G481	H477-V479 PolarHBondContact O-N 3.23Å; H477-V479 VanDerWaalsContact O-N 3.17Å; V479-G481 PolarHBondContact O-N 2.81Å; V479-G481 VanDerWaalsContact O-N 3.08Å
480	K	37.5	Very low	32.9	Very low	194 Å²	194	154.1 Å²	154.1	84%	0.843	83%	0.829	S	S	*	*			trans	-63.4	107.2	168.4	-76.6	-176.9	176	179	0	108.8	C478 K482	C478-K480 PolarHBondContact O-N 3.4Å; C478-K480 VanDerWaalsContact O-N 3.14Å; K480-K482 PolarHBondContact O-N 3.47Å
481	G	37.9	Very low	33	Very low	75 Å²	75	154.5 Å²	154.5	77%	0.773	83%	0.834	S	S	*	*			trans	-58	116.7	165.6	0	0	0	0	0	109.7	V479	V479-G481 PolarHBondContact O-N 2.81Å; V479-G481 VanDerWaalsContact O-N 3.08Å
482	K	25.8	Very low	33.2	Very low	198 Å²	198	156.6 Å²	156.6	86%	0.861	84%	0.838	S	S	*	*			trans	-86.3	114.2	160.4	-82.1	179.5	172.5	178.7	0	107.5	K480	K480-K482 PolarHBondContact O-N 3.47Å
483	N	39.7	Very low	33.4	Very low	241 Å²	241	156.5 Å²	156.5	100%	1.289	85%	0.848	S	S	*	*			trans	-164.1	0	132.1	-96.3	-6.4	0	0	0	108.2

Retrieved 483 of 483 residues in 170 ms (Link to these results)

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