A0A096NNQ7_PAPAN Loading...

Spermatogenesis-associated protein 2

Bridging factor that mediates the recruitment of CYLD to the LUBAC complex, thereby regulating TNF-alpha-induced necroptosis. Acts as a direct binding intermediate that bridges RNF31/HOIP, the catalytic subunit of the LUBAC complex, and the deubiquitinase (CYLD), thereby recruiting CYLD to the TNF-R1 signaling complex (TNF-RSC). Required to activate the 'Met-1'- (linear) and 'Lys-63'-linked deubiquitinase activities of CYLD. Controls the kinase activity of RIPK1 and TNF-alpha-induced necroptosis by promoting 'Met-1'-linked deubiquitination of RIPK1 by CYLD.

AlphaFold DB , UniProt , Accession A0A096NNQ7, Species PAPAN (Papio anubis, Olive baboon), Gene SPATA2, Length 520 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	60.8	Low	213 Å²	213	98.4 Å²	98.4	100%	1.049	54%	0.536	S	S	*	.				0	74.7	0	-61.5	-51.7	-179.4	0	0	110.6
2	G	44.2	Very low	63.1	Low	60 Å²	60	93.4 Å²	93.4	62%	0.619	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-77.3	142.7	164.3	0	0	0	0	0	109.2
3	K	45.2	Very low	65.3	Low	200 Å²	200	92.2 Å²	92.2	87%	0.87	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-68.1	139.3	164.7	-68.8	179.2	179.2	177	0	107.8	S5	K3-S5 PolarHBondContact O-N 3.41Å
4	P	53.6	Low	67.2	Low	77 Å²	77	90.9 Å²	90.9	50%	0.5	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-55.5	140.9	169.1	25.6	-34	0	0	0	108.9
5	S	56.8	Low	69	Low	48 Å²	48	85.2 Å²	85.2	34%	0.336	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-70.1	151.9	-172.2	111.9	0	0	0	0	110.8	K3 M7 D8 T9	K3-S5 PolarHBondContact O-N 3.41Å; S5-M7 PolarHBondContact O-N 2.86Å; S5-M7 WeakPolarHBondContact OG-CB 3.19Å; S5-M7 PolarHBondContact OG-N 2.85Å; S5-D8 WeakPolarHBondContact CA-OD2 3.2Å; S5-D8 VanDerWaalsContact CB-OD1 3.27Å; S5-D8 WeakPolarHBondContact CB-OD1 3.33Å; S5-D8 VanDerWaalsContact CB-OD2 3.25Å; S5-D8 WeakPolarHBondContact CB-OD2 3.26Å; S5-D8 PolarHBondContact N-OD2 2.69Å; S5-D8 PolarHBondContact O-N 3.14Å; S5-D8 VanDerWaalsContact O-N 3.12Å; S5-D8 PolarHBondContact OG-N 3.07Å; S5-D8 PolarHBondContact OG-OD1 3.29Å; S5-D8 PolarHBondContact OG-OD2 3.27Å; S5-T9 PolarHBondContact O-N 2.85Å
6	S	57.4	Low	70.6	Confident	79 Å²	79	82.1 Å²	82.1	55%	0.552	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-4.2	175.8	-175.1	0	0	0	0	113.5	K10	S6-K10 WeakPolarHBondContact O-CD 3.36Å; S6-K10 WeakPolarHBondContact O-CE 3.41Å; S6-K10 VanDerWaalsContact O-CG 3.26Å; S6-K10 WeakPolarHBondContact O-CG 3.48Å
7	M	51.7	Low	72	Confident	132 Å²	132	84.2 Å²	84.2	65%	0.65	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-39.2	171.5	-59.7	-61.8	-73.3	0	0	111	S5 T9 K10 F11	S5-M7 PolarHBondContact O-N 2.86Å; S5-M7 WeakPolarHBondContact OG-CB 3.19Å; S5-M7 PolarHBondContact OG-N 2.85Å; M7-T9 VanDerWaalsContact C-N 3.34Å; M7-T9 PolarHBondContact O-N 3.44Å; M7-K10 PolarHBondContact O-N 3.01Å; M7-F11 PolarHBondContact O-N 3.37Å
8	D	69.7	Low	73.2	Confident	26 Å²	26	86.4 Å²	86.4	14%	0.139	45%	0.447	C	S	.	.	H	α-helix	trans	-65.3	-41.2	-177.2	-34.5	-18.1	0	0	0	110.2	S5 F11 K12 L52 V55	S5-D8 WeakPolarHBondContact CA-OD2 3.2Å; S5-D8 VanDerWaalsContact CB-OD1 3.27Å; S5-D8 WeakPolarHBondContact CB-OD1 3.33Å; S5-D8 VanDerWaalsContact CB-OD2 3.25Å; S5-D8 WeakPolarHBondContact CB-OD2 3.26Å; S5-D8 PolarHBondContact N-OD2 2.69Å; S5-D8 PolarHBondContact O-N 3.14Å; S5-D8 VanDerWaalsContact O-N 3.12Å; S5-D8 PolarHBondContact OG-N 3.07Å; S5-D8 PolarHBondContact OG-OD1 3.29Å; S5-D8 PolarHBondContact OG-OD2 3.27Å; D8-F11 PolarHBondContact O-N 3.45Å; D8-K12 PolarHBondContact O-N 3.45Å; D8-L52 HydrophobicContact CB-CD2 4.32Å; D8-V55 HydrophobicContact CB-CG2 4.42Å
9	T	78.3	Confident	74.4	Confident	58 Å²	58	81.8 Å²	81.8	36%	0.356	42%	0.423	S	S	.	.	H	α-helix	trans	-63.7	-46.7	174.5	54.5	0	0	0	0	111.7	S5 M7 F11 K12 D13	S5-T9 PolarHBondContact O-N 2.85Å; M7-T9 VanDerWaalsContact C-N 3.34Å; M7-T9 PolarHBondContact O-N 3.44Å; T9-F11 VanDerWaalsContact C-N 3.29Å; T9-F11 PolarHBondContact O-N 3.47Å; T9-K12 PolarHBondContact O-N 3.35Å; T9-D13 WeakPolarHBondContact O-CB 3.42Å; T9-D13 PolarHBondContact O-N 2.6Å
10	K	84.9	Confident	75.4	Confident	109 Å²	109	78.4 Å²	78.4	47%	0.474	41%	0.406	S	S	.	.	H	α-helix	trans	-58.2	-41.3	175.3	-71.3	174.2	-172.5	172.9	0	111.7	S6 M7 D13 D14	S6-K10 WeakPolarHBondContact O-CD 3.36Å; S6-K10 WeakPolarHBondContact O-CE 3.41Å; S6-K10 VanDerWaalsContact O-CG 3.26Å; S6-K10 WeakPolarHBondContact O-CG 3.48Å; M7-K10 PolarHBondContact O-N 3.01Å; K10-D13 PolarHBondContact O-N 3.35Å; K10-D14 WeakPolarHBondContact O-CB 3.5Å; K10-D14 PolarHBondContact O-N 3.05Å
11	F	87.9	Confident	76.2	Confident	80 Å²	80	80.6 Å²	80.6	35%	0.351	42%	0.415	S	S	.	.	H	α-helix	trans	-66.8	-42.5	177.5	-164	-82.1	0	0	0	112.2	M7 D8 T9 D13 D14 L15 T48 L49	M7-F11 PolarHBondContact O-N 3.37Å; D8-F11 PolarHBondContact O-N 3.45Å; T9-F11 VanDerWaalsContact C-N 3.29Å; T9-F11 PolarHBondContact O-N 3.47Å; F11-D13 VanDerWaalsContact C-N 3.33Å; F11-D13 PolarHBondContact O-N 2.94Å; F11-D14 PolarHBondContact O-N 2.56Å; F11-L15 VanDerWaalsContact O-CB 3.3Å; F11-L15 WeakPolarHBondContact O-CB 3.42Å; F11-L15 PolarHBondContact O-N 2.98Å; F11-T48 HydrophobicContact CZ-CG2 4.45Å; F11-L49 HydrophobicContact CD1-CB 4.03Å; F11-L49 HydrophobicContact CD1-CD1 4.11Å; F11-L49 HydrophobicContact CE1-CB 3.99Å
12	K	88.8	Confident	78.8	Confident	39 Å²	39	72.3 Å²	72.3	17%	0.17	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-39.5	173.4	-171.3	164.7	178.6	172.4	0	111.3	D8 T9 F16 L49 R60 F164 E165	D8-K12 PolarHBondContact O-N 3.45Å; T9-K12 PolarHBondContact O-N 3.35Å; K12-F16 VanDerWaalsContact O-CB 3.29Å; K12-F16 WeakPolarHBondContact O-CB 3.42Å; K12-F16 PolarHBondContact O-N 3.37Å; K12-L49 HydrophobicContact CB-CD1 4.25Å; K12-L49 HydrophobicContact CB-CD2 3.92Å; K12-L49 HydrophobicContact CD-CD2 4.3Å; K12-L49 HydrophobicContact CG-CD2 3.9Å; K12-R60 PolarHBondContact NZ-O 3.5Å; K12-F164 HydrophobicContact CG-CE1 3.86Å; K12-F164 HydrophobicContact CG-CZ 4.41Å; K12-E165 IonicContact NZ-OE1 3.79Å; K12-E165 PolarHBondContact NZ-OE1 3.42Å
13	D	91	Very high	81	Confident	78 Å²	78	70.4 Å²	70.4	42%	0.417	35%	0.347	S	S	.	.	H	α-helix	trans	-69	-39.3	177.5	-67.6	-16.6	0	0	0	113	T9 K10 F11 F16 R17	T9-D13 WeakPolarHBondContact O-CB 3.42Å; T9-D13 PolarHBondContact O-N 2.6Å; K10-D13 PolarHBondContact O-N 3.35Å; F11-D13 VanDerWaalsContact C-N 3.33Å; F11-D13 PolarHBondContact O-N 2.94Å; D13-F16 PolarHBondContact O-N 3.05Å; D13-R17 WeakPolarHBondContact O-CG 3.47Å; D13-R17 PolarHBondContact O-N 3.27Å
14	D	92.7	Very high	83.2	Confident	74 Å²	74	64.4 Å²	64.4	40%	0.396	32%	0.323	S	S	.	.	H	α-helix	trans	-70.8	-37.6	175.7	-79.7	-26.8	0	0	0	112.1	K10 F11 R17 K18	K10-D14 WeakPolarHBondContact O-CB 3.5Å; K10-D14 PolarHBondContact O-N 3.05Å; F11-D14 PolarHBondContact O-N 2.56Å; D14-R17 PolarHBondContact O-N 3.46Å; D14-R17 IonicContact OD1-CZ 3.3Å; D14-R17 VanDerWaalsContact OD1-CZ 3.3Å; D14-R17 IonicContact OD1-NE 3.07Å; D14-R17 PolarHBondContact OD1-NE 3.12Å; D14-R17 VanDerWaalsContact OD1-NE 3.07Å; D14-R17 IonicContact OD1-NH2 2.69Å; D14-R17 PolarHBondContact OD1-NH2 2.92Å; D14-K18 WeakPolarHBondContact O-CB 3.25Å; D14-K18 VanDerWaalsContact O-CG 3.28Å; D14-K18 WeakPolarHBondContact O-CG 3.49Å; D14-K18 PolarHBondContact O-N 2.87Å
15	L	93.6	Very high	84.7	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-66.6	-40.1	172.7	-176.4	57.7	0	0	0	111.2	F11 K18 Y19 L42 A45 A46 L49 F164	F11-L15 VanDerWaalsContact O-CB 3.3Å; F11-L15 WeakPolarHBondContact O-CB 3.42Å; F11-L15 PolarHBondContact O-N 2.98Å; L15-K18 PolarHBondContact O-N 3.35Å; L15-Y19 WeakPolarHBondContact O-CB 3.27Å; L15-Y19 PolarHBondContact O-N 3.44Å; L15-L42 HydrophobicContact CD1-CD2 4.08Å; L15-A45 HydrophobicContact CD1-CB 3.65Å; L15-A45 HydrophobicContact CD2-CB 4.44Å; L15-A46 HydrophobicContact CD2-CB 4.11Å; L15-L49 HydrophobicContact CD2-CB 4.4Å; L15-L49 HydrophobicContact CD2-CD2 3.96Å; L15-F164 HydrophobicContact CB-CZ 4.19Å; L15-F164 HydrophobicContact CD2-CE2 4.26Å; L15-F164 HydrophobicContact CD2-CZ 4.09Å; L15-F164 HydrophobicContact CG-CE2 3.9Å; L15-F164 HydrophobicContact CG-CZ 3.91Å
16	F	94.6	Very high	85.7	Confident	36 Å²	36	64.3 Å²	64.3	16%	0.158	32%	0.318	C	S	.	.	H	α-helix	trans	-60.3	-47	172.7	175	-115.3	0	0	0	112	K12 D13 K18 Y19 V20 L157 K160 M161 F164	K12-F16 VanDerWaalsContact O-CB 3.29Å; K12-F16 WeakPolarHBondContact O-CB 3.42Å; K12-F16 PolarHBondContact O-N 3.37Å; D13-F16 PolarHBondContact O-N 3.05Å; F16-K18 PolarHBondContact O-N 3.37Å; F16-Y19 PolarHBondContact O-N 3.48Å; F16-V20 HydrophobicContact CD2-CG2 4.12Å; F16-V20 HydrophobicContact CE1-CG2 4.47Å; F16-V20 HydrophobicContact CE2-CG2 3.71Å; F16-V20 HydrophobicContact CZ-CG2 3.91Å; F16-V20 WeakPolarHBondContact O-CG2 3.27Å; F16-V20 PolarHBondContact O-N 3.08Å; F16-L157 HydrophobicContact CE1-CD1 4.23Å; F16-L157 HydrophobicContact CZ-CD1 4.11Å; F16-K160 HydrophobicContact CE2-CB 4.01Å; F16-K160 HydrophobicContact CZ-CB 3.95Å; F16-M161 HydrophobicContact CE2-CG 4.07Å; F16-M161 HydrophobicContact CZ-CG 3.82Å; F16-F164 HydrophobicContact CB-CD1 4.02Å; F16-F164 HydrophobicContact CB-CE1 3.85Å; F16-F164 HydrophobicContact CB-CG 4.46Å; F16-F164 HydrophobicContact CB-CZ 4.17Å; F16-F164 HydrophobicContact CD2-CB 3.74Å; F16-F164 AromaticContact CD2-CD1 3.71Å; F16-F164 HydrophobicContact CD2-CD1 3.71Å; F16-F164 HydrophobicContact CD2-CD2 4.4Å; F16-F164 HydrophobicContact CD2-CE1 4.4Å; F16-F164 AromaticContact CD2-CG 3.7Å; F16-F164 HydrophobicContact CD2-CG 3.7Å; F16-F164 HydrophobicContact CE2-CB 4.09Å; F16-F164 HydrophobicContact CG-CD1 4.27Å
17	R	94.5	Very high	86.3	Confident	117 Å²	117	62.9 Å²	62.9	44%	0.442	31%	0.306	S	S	.	.	H	α-helix	trans	-55.9	-48.7	174.1	-80	-178.2	-80.8	-83.2	4.3	111.8	D13 D14 V20 Q21	D13-R17 WeakPolarHBondContact O-CG 3.47Å; D13-R17 PolarHBondContact O-N 3.27Å; D14-R17 PolarHBondContact O-N 3.46Å; D14-R17 IonicContact OD1-CZ 3.3Å; D14-R17 VanDerWaalsContact OD1-CZ 3.3Å; D14-R17 IonicContact OD1-NE 3.07Å; D14-R17 PolarHBondContact OD1-NE 3.12Å; D14-R17 VanDerWaalsContact OD1-NE 3.07Å; D14-R17 IonicContact OD1-NH2 2.69Å; D14-R17 PolarHBondContact OD1-NH2 2.92Å; R17-V20 PolarHBondContact O-N 3.31Å; R17-Q21 WeakPolarHBondContact O-CB 3.25Å; R17-Q21 VanDerWaalsContact O-CG 3.25Å; R17-Q21 WeakPolarHBondContact O-CG 3.44Å; R17-Q21 PolarHBondContact O-N 2.99Å
18	K	94.1	Very high	86.7	Confident	124 Å²	124	62.6 Å²	62.6	54%	0.539	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-40.4	178.5	-71.7	168.2	-177.3	174.1	0	112.7	D14 L15 F16 F22 L42	D14-K18 WeakPolarHBondContact O-CB 3.25Å; D14-K18 VanDerWaalsContact O-CG 3.28Å; D14-K18 WeakPolarHBondContact O-CG 3.49Å; D14-K18 PolarHBondContact O-N 2.87Å; L15-K18 PolarHBondContact O-N 3.35Å; F16-K18 PolarHBondContact O-N 3.37Å; K18-F22 VanDerWaalsContact O-CB 3.25Å; K18-F22 WeakPolarHBondContact O-CB 3.29Å; K18-F22 PolarHBondContact O-N 3.22Å; K18-L42 HydrophobicContact CB-CD2 3.87Å
19	Y	94.9	Very high	86	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.5	-50.4	175.3	171.8	-96.2	0	0	0	111.2	L15 F16 Q21 F22 H23 L42 F100 S163 F164 F167	L15-Y19 WeakPolarHBondContact O-CB 3.27Å; L15-Y19 PolarHBondContact O-N 3.44Å; F16-Y19 PolarHBondContact O-N 3.48Å; Y19-Q21 PolarHBondContact O-N 2.89Å; Y19-F22 PolarHBondContact O-N 3.47Å; Y19-H23 AromaticContact CE2-CD2 3.82Å; Y19-H23 AromaticContact CE2-NE2 3.74Å; Y19-H23 PolarHBondContact O-CD2 2.91Å; Y19-H23 PolarHBondContact O-N 2.78Å; Y19-L42 HydrophobicContact CD2-CD1 4.26Å; Y19-F100 HydrophobicContact CE1-CE1 4.47Å; Y19-S163 PolarHBondContact OH-O 3.33Å; Y19-F164 HydrophobicContact CD1-CB 4.03Å; Y19-F164 AromaticContact CD1-CD2 3.92Å; Y19-F164 HydrophobicContact CD1-CD2 3.92Å; Y19-F164 HydrophobicContact CD1-CG 4.39Å; Y19-F164 HydrophobicContact CD2-CD2 4.34Å; Y19-F164 HydrophobicContact CE1-CB 4.09Å; Y19-F164 AromaticContact CG-CD2 3.81Å; Y19-F164 HydrophobicContact CG-CD2 3.81Å; Y19-F167 HydrophobicContact CD2-CB 4.27Å; Y19-F167 AromaticContact CD2-CD1 3.99Å; Y19-F167 HydrophobicContact CD2-CD1 3.99Å; Y19-F167 HydrophobicContact CD2-CD2 4.03Å; Y19-F167 HydrophobicContact CD2-CE1 4.38Å; Y19-F167 HydrophobicContact CD2-CE2 4.45Å; Y19-F167 AromaticContact CD2-CG 3.82Å; Y19-F167 HydrophobicContact CD2-CG 3.82Å; Y19-F167 HydrophobicContact CE2-CB 3.67Å; Y19-F167 HydrophobicContact CE2-CD1 4.23Å; Y19-F167 AromaticContact CE2-CD2 3.75Å; Y19-F167 HydrophobicContact CE2-CD2 3.75Å; Y19-F167 AromaticContact CE2-CG 3.61Å; Y19-F167 HydrophobicContact CE2-CG 3.61Å
20	V	94.9	Very high	84.5	Confident	13 Å²	13	68.8 Å²	68.8	8%	0.079	35%	0.346	C	S	.	.	H	α-helix	trans	-60.8	-48.7	178.2	171.7	0	0	0	0	111.1	F16 R17 F22 H23 E24 K160	F16-V20 HydrophobicContact CD2-CG2 4.12Å; F16-V20 HydrophobicContact CE1-CG2 4.47Å; F16-V20 HydrophobicContact CE2-CG2 3.71Å; F16-V20 HydrophobicContact CZ-CG2 3.91Å; F16-V20 WeakPolarHBondContact O-CG2 3.27Å; F16-V20 PolarHBondContact O-N 3.08Å; R17-V20 PolarHBondContact O-N 3.31Å; V20-F22 VanDerWaalsContact C-N 3.33Å; V20-F22 PolarHBondContact O-N 2.83Å; V20-H23 PolarHBondContact O-N 2.8Å; V20-H23 VanDerWaalsContact O-N 3.13Å; V20-E24 HydrophobicContact CG1-CG 4.37Å; V20-E24 VanDerWaalsContact CG1-OE2 3.27Å; V20-E24 WeakPolarHBondContact CG1-OE2 3.34Å; V20-E24 WeakPolarHBondContact O-CG 3.32Å; V20-E24 PolarHBondContact O-N 3.07Å; V20-K160 HydrophobicContact CG1-CD 3.84Å; V20-K160 HydrophobicContact CG2-CB 4.15Å; V20-K160 HydrophobicContact CG2-CD 3.97Å; V20-K160 HydrophobicContact CG2-CG 4.12Å
21	Q	93.1	Very high	82.4	Confident	125 Å²	125	69.4 Å²	69.4	58%	0.584	36%	0.359	S	S	*	.	H	α-helix	trans	-58.6	-39.6	177.4	-73.7	170.2	-15.8	0	0	113.2	R17 Y19 H23 G25	R17-Q21 WeakPolarHBondContact O-CB 3.25Å; R17-Q21 VanDerWaalsContact O-CG 3.25Å; R17-Q21 WeakPolarHBondContact O-CG 3.44Å; R17-Q21 PolarHBondContact O-N 2.99Å; Y19-Q21 PolarHBondContact O-N 2.89Å; Q21-H23 VanDerWaalsContact C-N 3.32Å; Q21-H23 PolarHBondContact O-N 2.91Å; Q21-G25 PolarHBondContact O-N 3.18Å
22	F	92.5	Very high	80.3	Confident	39 Å²	39	71 Å²	71	17%	0.171	38%	0.38	C	S	.	.	H	α-helix	trans	-68.1	-27.8	177.8	172.9	-112.5	0	0	0	113.6	K18 Y19 V20 K26 G37 D39 L42	K18-F22 VanDerWaalsContact O-CB 3.25Å; K18-F22 WeakPolarHBondContact O-CB 3.29Å; K18-F22 PolarHBondContact O-N 3.22Å; Y19-F22 PolarHBondContact O-N 3.47Å; V20-F22 VanDerWaalsContact C-N 3.33Å; V20-F22 PolarHBondContact O-N 2.83Å; F22-K26 VanDerWaalsContact CZ-CE 3.47Å; F22-K26 VanDerWaalsContact O-CD 3.3Å; F22-K26 WeakPolarHBondContact O-CD 3.2Å; F22-K26 WeakPolarHBondContact O-CE 3.29Å; F22-K26 VanDerWaalsContact O-CG 3.29Å; F22-K26 WeakPolarHBondContact O-CG 3.41Å; F22-G37 WeakPolarHBondContact CE2-O 3.35Å; F22-D39 HydrophobicContact CE1-CB 3.77Å; F22-D39 HydrophobicContact CZ-CB 3.96Å; F22-L42 HydrophobicContact CB-CD1 3.9Å; F22-L42 HydrophobicContact CD1-CD1 3.27Å; F22-L42 HydrophobicContact CD1-CG 4.49Å; F22-L42 HydrophobicContact CE1-CD1 3.78Å; F22-L42 HydrophobicContact CG-CD1 3.73Å
23	H	91.6	Very high	78	Confident	19 Å²	19	80.2 Å²	80.2	9%	0.088	41%	0.414	C	S	.	.	H	α-helix	trans	-86.5	-34.9	175.3	-80.5	-91.5	0	0	0	112.6	Y19 V20 Q21 I97 F100	Y19-H23 AromaticContact CE2-CD2 3.82Å; Y19-H23 AromaticContact CE2-NE2 3.74Å; Y19-H23 PolarHBondContact O-CD2 2.91Å; Y19-H23 PolarHBondContact O-N 2.78Å; V20-H23 PolarHBondContact O-N 2.8Å; V20-H23 VanDerWaalsContact O-N 3.13Å; Q21-H23 VanDerWaalsContact C-N 3.32Å; Q21-H23 PolarHBondContact O-N 2.91Å; H23-I97 WeakPolarHBondContact CE1-CD1 3.46Å; H23-F100 HydrophobicContact CB-CE2 4.15Å; H23-F100 HydrophobicContact CB-CZ 3.89Å
24	E	90.9	Very high	75.5	Confident	74 Å²	74	85.5 Å²	85.5	35%	0.346	44%	0.436	S	S	.	.	H	α-helix	trans	-70	-50.6	175.3	-69.9	178.7	145.7	0	0	111.7	V20 K26 V27 L101 K160	V20-E24 HydrophobicContact CG1-CG 4.37Å; V20-E24 VanDerWaalsContact CG1-OE2 3.27Å; V20-E24 WeakPolarHBondContact CG1-OE2 3.34Å; V20-E24 WeakPolarHBondContact O-CG 3.32Å; V20-E24 PolarHBondContact O-N 3.07Å; E24-K26 PolarHBondContact O-N 3.4Å; E24-V27 VanDerWaalsContact O-CB 3.32Å; E24-V27 WeakPolarHBondContact O-CB 3.31Å; E24-V27 WeakPolarHBondContact O-CG2 3.35Å; E24-V27 PolarHBondContact O-N 3.33Å; E24-L101 HydrophobicContact CB-CD2 4.47Å; E24-L101 HydrophobicContact CG-CD2 3.81Å; E24-K160 WeakPolarHBondContact OE1-CE 3.38Å; E24-K160 IonicContact OE1-NZ 3.87Å; E24-K160 PolarHBondContact OE1-NZ 2.98Å; E24-K160 IonicContact OE2-NZ 2.79Å
25	G	84.8	Confident	73	Confident	34 Å²	34	93.5 Å²	93.5	35%	0.351	46%	0.461	S	S	.	.	H	α-helix	trans	-63.3	-15.6	-178.7	0	0	0	0	0	115.2	Q21 V27 T29	Q21-G25 PolarHBondContact O-N 3.18Å; G25-V27 VanDerWaalsContact C-N 3.31Å; G25-T29 PolarHBondContact O-OG1 3.05Å
26	K	79	Confident	70.8	Confident	90 Å²	90	96.8 Å²	96.8	39%	0.391	48%	0.482	S	S	.	.	H	α-helix	trans	-71.5	-23.7	170.2	-78.7	170.7	-172.9	167.6	0	113.4	F22 E24 T29	F22-K26 VanDerWaalsContact CZ-CE 3.47Å; F22-K26 VanDerWaalsContact O-CD 3.3Å; F22-K26 WeakPolarHBondContact O-CD 3.2Å; F22-K26 WeakPolarHBondContact O-CE 3.29Å; F22-K26 VanDerWaalsContact O-CG 3.29Å; F22-K26 WeakPolarHBondContact O-CG 3.41Å; E24-K26 PolarHBondContact O-N 3.4Å; K26-T29 PolarHBondContact O-OG1 2.82Å
27	V	68.8	Low	68.6	Low	49 Å²	49	97.7 Å²	97.7	30%	0.297	50%	0.501	S	S	.	.	H	α-helix	trans	-74.5	-38.7	177.4	-173.9	0	0	0	0	110.1	E24 G25 L101 Y102	E24-V27 VanDerWaalsContact O-CB 3.32Å; E24-V27 WeakPolarHBondContact O-CB 3.31Å; E24-V27 WeakPolarHBondContact O-CG2 3.35Å; E24-V27 PolarHBondContact O-N 3.33Å; G25-V27 VanDerWaalsContact C-N 3.31Å; V27-L101 HydrophobicContact CG2-CB 4.5Å; V27-L101 HydrophobicContact CG2-CD1 3.93Å; V27-L101 HydrophobicContact CG2-CD2 3.98Å; V27-L101 HydrophobicContact CG2-CG 4.37Å; V27-Y102 HydrophobicContact CG1-CE1 4.09Å
28	D	59.9	Low	67.2	Low	125 Å²	125	93.9 Å²	93.9	67%	0.668	50%	0.499	S	S	*	.	H	α-helix	trans	-75.1	-26.8	-176.6	-58.8	-43.4	0	0	0	113.4	T30	D28-T30 PolarHBondContact O-N 3.43Å
29	T	56.3	Low	66.5	Low	90 Å²	90	90.5 Å²	90.5	55%	0.552	49%	0.487	S	S	*	.			trans	-72.1	60.4	178.3	48.1	0	0	0	0	113.9	G25 K26 T31	G25-T29 PolarHBondContact O-OG1 3.05Å; K26-T29 PolarHBondContact O-OG1 2.82Å; T29-T31 VanDerWaalsContact C-N 3.32Å
30	T	46	Very low	66.2	Low	125 Å²	125	96 Å²	96	77%	0.767	51%	0.513	S	S	*	.			trans	-79.5	-11.7	172.8	51.3	0	0	0	0	113.4	D28	D28-T30 PolarHBondContact O-N 3.43Å
31	T	40.8	Very low	65.8	Low	122 Å²	122	100 Å²	100	75%	0.748	54%	0.539	S	S	*	.	S	Bend	trans	-123.7	106.7	-179.1	24.2	0	0	0	0	113.4	T29 R33	T29-T31 VanDerWaalsContact C-N 3.32Å; T31-R33 PolarHBondContact O-N 3.3Å
32	S	43.8	Very low	65.8	Low	113 Å²	113	94.8 Å²	94.8	79%	0.79	52%	0.516	S	S	*	.			trans	5.5	96.8	155.6	-168.3	0	0	0	0	118.6
33	R	39.6	Very low	65.8	Low	233 Å²	233	95.5 Å²	95.5	88%	0.879	52%	0.517	S	S	*	.	S	Bend		-179.2	143	116.8	-97	162.5	-170.3	-147.9	2.2	111.9	T31	T31-R33 PolarHBondContact O-N 3.3Å
34	Q	38.9	Very low	65.9	Low	188 Å²	188	98.9 Å²	98.9	88%	0.879	54%	0.539	S	S	*	.			trans	55.3	120.8	-179.6	-63.1	-169.3	-4.6	0	0	115.6	P36	Q34-P36 WeakPolarHBondContact O-CD 3.2Å
35	R	41.3	Very low	65.9	Low	243 Å²	243	96.5 Å²	96.5	92%	0.917	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-60.9	124	164.3	-154.9	-179	-154.9	171.6	3.3	106.6
36	P	45.8	Very low	66.3	Low	73 Å²	73	94.9 Å²	94.9	47%	0.474	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-53.2	150.1	170.4	-25.7	34.9	0	0	0	110	Q34 G38	Q34-P36 WeakPolarHBondContact O-CD 3.2Å; P36-G38 PolarHBondContact O-N 3.33Å
37	G	49.6	Very low	66.9	Low	55 Å²	55	91.7 Å²	91.7	57%	0.567	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-47.9	142.8	175.2	0	0	0	0	0	111	F22	F22-G37 WeakPolarHBondContact CE2-O 3.35Å
38	G	64.5	Low	68	Low	38 Å²	38	92.6 Å²	92.6	39%	0.392	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-55.7	161.7	-171.4	0	0	0	0	0	113.3	P36 E40 C41	P36-G38 PolarHBondContact O-N 3.33Å; G38-E40 PolarHBondContact O-N 3.16Å; G38-C41 PolarHBondContact O-N 2.91Å
39	D	80.5	Confident	69.4	Low	53 Å²	53	87.2 Å²	87.2	28%	0.283	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-22.2	172.6	77.4	-25.6	0	0	0	112	F22 C41 L42 R43 K170	F22-D39 HydrophobicContact CE1-CB 3.77Å; F22-D39 HydrophobicContact CZ-CB 3.96Å; D39-C41 PolarHBondContact O-N 3.46Å; D39-C41 VanDerWaalsContact O-N 3.13Å; D39-L42 CarbonylContact O-C 3.57Å; D39-L42 VanDerWaalsContact O-CA 3.3Å; D39-L42 WeakPolarHBondContact O-CA 3.28Å; D39-L42 VanDerWaalsContact O-CB 3.3Å; D39-L42 WeakPolarHBondContact O-CB 3.25Å; D39-L42 PolarHBondContact O-N 3.02Å; D39-R43 PolarHBondContact O-N 2.92Å; D39-R43 IonicContact OD1-CZ 2.78Å; D39-R43 IonicContact OD1-NE 2.7Å; D39-R43 PolarHBondContact OD1-NE 2.85Å; D39-R43 IonicContact OD1-NH2 3.63Å; D39-R43 IonicContact OD2-NE 2.76Å; D39-K170 IonicContact OD2-NZ 3.81Å
40	E	87.6	Confident	70.9	Confident	116 Å²	116	83.1 Å²	83.1	54%	0.542	46%	0.456	S	S	.	.	H	α-helix	trans	-28	-47.9	158.3	-167	155.2	-118.6	0	0	115.4	G38 L42 R43 V44	G38-E40 PolarHBondContact O-N 3.16Å; E40-L42 VanDerWaalsContact C-N 3.33Å; E40-L42 PolarHBondContact O-N 3.49Å; E40-R43 PolarHBondContact O-N 3.42Å; E40-R43 IonicContact OE1-NH2 3.82Å; E40-V44 WeakPolarHBondContact O-CB 3.48Å; E40-V44 WeakPolarHBondContact O-CG2 3.32Å; E40-V44 PolarHBondContact O-N 2.77Å
41	C	87.7	Confident	72.7	Confident	95 Å²	95	78.3 Å²	78.3	64%	0.642	43%	0.427	S	S	*	.	H	α-helix	trans	-66.8	-33.6	177.3	-72	0	0	0	0	112.9	G38 D39 A45	G38-C41 PolarHBondContact O-N 2.91Å; D39-C41 PolarHBondContact O-N 3.46Å; D39-C41 VanDerWaalsContact O-N 3.13Å; C41-A45 PolarHBondContact O-N 2.87Å
42	L	92.1	Very high	74.5	Confident	16 Å²	16	75.4 Å²	75.4	8%	0.084	41%	0.407	C	S	.	.	H	α-helix	trans	-77.1	-37.2	171.2	-59.4	173.4	0	0	0	111.2	L15 K18 Y19 F22 D39 E40 A45 A46 F167	L15-L42 HydrophobicContact CD1-CD2 4.08Å; K18-L42 HydrophobicContact CB-CD2 3.87Å; Y19-L42 HydrophobicContact CD2-CD1 4.26Å; F22-L42 HydrophobicContact CB-CD1 3.9Å; F22-L42 HydrophobicContact CD1-CD1 3.27Å; F22-L42 HydrophobicContact CD1-CG 4.49Å; F22-L42 HydrophobicContact CE1-CD1 3.78Å; F22-L42 HydrophobicContact CG-CD1 3.73Å; D39-L42 CarbonylContact O-C 3.57Å; D39-L42 VanDerWaalsContact O-CA 3.3Å; D39-L42 WeakPolarHBondContact O-CA 3.28Å; D39-L42 VanDerWaalsContact O-CB 3.3Å; D39-L42 WeakPolarHBondContact O-CB 3.25Å; D39-L42 PolarHBondContact O-N 3.02Å; E40-L42 VanDerWaalsContact C-N 3.33Å; E40-L42 PolarHBondContact O-N 3.49Å; L42-A45 CarbonylContact O-C 3.55Å; L42-A45 PolarHBondContact O-N 2.97Å; L42-A46 WeakPolarHBondContact O-CB 3.37Å; L42-A46 PolarHBondContact O-N 3.31Å; L42-F167 HydrophobicContact CB-CE1 4.34Å; L42-F167 HydrophobicContact CB-CE2 4.23Å; L42-F167 HydrophobicContact CB-CZ 3.58Å
43	R	92.8	Very high	75.2	Confident	54 Å²	54	74.7 Å²	74.7	20%	0.204	39%	0.391	C	S	.	.	H	α-helix	trans	-64.5	-45.9	179.1	-68.6	-168.3	-70.2	104.6	6.8	110.9	D39 E40 A45 A46 S47 F167 V171 E174	D39-R43 PolarHBondContact O-N 2.92Å; D39-R43 IonicContact OD1-CZ 2.78Å; D39-R43 IonicContact OD1-NE 2.7Å; D39-R43 PolarHBondContact OD1-NE 2.85Å; D39-R43 IonicContact OD1-NH2 3.63Å; D39-R43 IonicContact OD2-NE 2.76Å; E40-R43 PolarHBondContact O-N 3.42Å; E40-R43 IonicContact OE1-NH2 3.82Å; R43-A45 VanDerWaalsContact C-N 3.31Å; R43-A45 PolarHBondContact O-N 3.32Å; R43-A46 CarbonylContact O-C 3.46Å; R43-A46 WeakPolarHBondContact O-CA 3.3Å; R43-A46 WeakPolarHBondContact O-CB 3.29Å; R43-A46 PolarHBondContact O-N 2.94Å; R43-S47 PolarHBondContact O-N 2.94Å; R43-S47 PolarHBondContact O-OG 3.34Å; R43-S47 VanDerWaalsContact O-OG 3.12Å; R43-F167 HydrophobicContact CG-CE2 3.9Å; R43-F167 HydrophobicContact CG-CZ 4.13Å; R43-V171 HydrophobicContact CB-CG2 4.11Å; R43-V171 HydrophobicContact CG-CG2 3.81Å; R43-E174 IonicContact CZ-OE2 2.69Å; R43-E174 IonicContact NH1-OE1 3.51Å; R43-E174 IonicContact NH1-OE2 3.65Å; R43-E174 PolarHBondContact NH1-OE2 2.92Å
44	V	92.6	Very high	76.4	Confident	91 Å²	91	72.8 Å²	72.8	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-58.1	-41.7	172.3	171.2	0	0	0	0	111.7	E40 S47 T48	E40-V44 WeakPolarHBondContact O-CB 3.48Å; E40-V44 WeakPolarHBondContact O-CG2 3.32Å; E40-V44 PolarHBondContact O-N 2.77Å; V44-S47 PolarHBondContact O-N 3.13Å; V44-T48 WeakPolarHBondContact O-CB 3.3Å; V44-T48 PolarHBondContact O-N 2.89Å; V44-T48 PolarHBondContact O-OG1 3.4Å
45	A	92	Very high	78	Confident	23 Å²	23	64.8 Å²	64.8	19%	0.19	35%	0.353	C	S	.	.	H	α-helix	trans	-67.8	-33.9	175.6	0	0	0	0	0	112.8	L15 C41 L42 R43 T48 L49	L15-A45 HydrophobicContact CD1-CB 3.65Å; L15-A45 HydrophobicContact CD2-CB 4.44Å; C41-A45 PolarHBondContact O-N 2.87Å; L42-A45 CarbonylContact O-C 3.55Å; L42-A45 PolarHBondContact O-N 2.97Å; R43-A45 VanDerWaalsContact C-N 3.31Å; R43-A45 PolarHBondContact O-N 3.32Å; A45-T48 WeakPolarHBondContact O-CB 3.33Å; A45-T48 PolarHBondContact O-N 3.18Å; A45-L49 PolarHBondContact O-N 3.31Å
46	A	93	Very high	79.8	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.7	-45.4	173.2	0	0	0	0	0	112.3	L15 L42 R43 T48 L49 L50 F167 L168 V171	L15-A46 HydrophobicContact CD2-CB 4.11Å; L42-A46 WeakPolarHBondContact O-CB 3.37Å; L42-A46 PolarHBondContact O-N 3.31Å; R43-A46 CarbonylContact O-C 3.46Å; R43-A46 WeakPolarHBondContact O-CA 3.3Å; R43-A46 WeakPolarHBondContact O-CB 3.29Å; R43-A46 PolarHBondContact O-N 2.94Å; A46-T48 PolarHBondContact O-N 2.95Å; A46-L49 PolarHBondContact O-N 3.05Å; A46-L49 VanDerWaalsContact O-N 3.11Å; A46-L50 WeakPolarHBondContact O-CB 3.3Å; A46-L50 VanDerWaalsContact O-CG 3.29Å; A46-L50 WeakPolarHBondContact O-CG 3.34Å; A46-L50 PolarHBondContact O-N 2.78Å; A46-F167 HydrophobicContact CB-CE1 3.78Å; A46-F167 HydrophobicContact CB-CZ 4.18Å; A46-L168 HydrophobicContact CB-CD2 3.73Å; A46-V171 HydrophobicContact CB-CB 4.17Å; A46-V171 HydrophobicContact CB-CG1 3.87Å; A46-V171 HydrophobicContact CB-CG2 4.09Å
47	S	92	Very high	81.5	Confident	23 Å²	23	53 Å²	53	16%	0.161	30%	0.304	C	S	.	.	H	α-helix	trans	-55.2	-39.6	171	-60.9	0	0	0	0	111.3	R43 V44 S51 V171 Q175	R43-S47 PolarHBondContact O-N 2.94Å; R43-S47 PolarHBondContact O-OG 3.34Å; R43-S47 VanDerWaalsContact O-OG 3.12Å; V44-S47 PolarHBondContact O-N 3.13Å; S47-S51 WeakPolarHBondContact O-CB 3.34Å; S47-S51 PolarHBondContact O-N 3.37Å; S47-S51 PolarHBondContact O-OG 3.44Å; S47-V171 WeakPolarHBondContact OG-CG1 3.21Å; S47-Q175 PolarHBondContact OG-OE1 2.96Å
48	T	90.9	Very high	83	Confident	68 Å²	68	56.6 Å²	56.6	42%	0.417	31%	0.305	S	S	.	.	H	α-helix	trans	-66	-45.1	175.1	-54.4	0	0	0	0	111.9	F11 V44 A45 A46 S51 L52	F11-T48 HydrophobicContact CZ-CG2 4.45Å; V44-T48 WeakPolarHBondContact O-CB 3.3Å; V44-T48 PolarHBondContact O-N 2.89Å; V44-T48 PolarHBondContact O-OG1 3.4Å; A45-T48 WeakPolarHBondContact O-CB 3.33Å; A45-T48 PolarHBondContact O-N 3.18Å; A46-T48 PolarHBondContact O-N 2.95Å; T48-S51 CarbonylContact O-C 3.6Å; T48-S51 PolarHBondContact O-N 3.37Å; T48-L52 PolarHBondContact O-N 2.83Å
49	L	89.5	Confident	84	Confident	13 Å²	13	59.8 Å²	59.8	7%	0.068	31%	0.306	C	S	.	.	H	α-helix	trans	-62.6	-44.6	175.7	172.3	61.5	0	0	0	112.2	F11 K12 L15 A45 A46 S51 L52 L168	F11-L49 HydrophobicContact CD1-CB 4.03Å; F11-L49 HydrophobicContact CD1-CD1 4.11Å; F11-L49 HydrophobicContact CE1-CB 3.99Å; K12-L49 HydrophobicContact CB-CD1 4.25Å; K12-L49 HydrophobicContact CB-CD2 3.92Å; K12-L49 HydrophobicContact CD-CD2 4.3Å; K12-L49 HydrophobicContact CG-CD2 3.9Å; L15-L49 HydrophobicContact CD2-CB 4.4Å; L15-L49 HydrophobicContact CD2-CD2 3.96Å; A45-L49 PolarHBondContact O-N 3.31Å; A46-L49 PolarHBondContact O-N 3.05Å; A46-L49 VanDerWaalsContact O-N 3.11Å; L49-S51 VanDerWaalsContact C-N 3.26Å; L49-S51 PolarHBondContact O-N 2.83Å; L49-L52 WeakPolarHBondContact O-CB 3.47Å; L49-L52 PolarHBondContact O-N 2.95Å; L49-L168 HydrophobicContact CD2-CD2 4.32Å
50	L	87.8	Confident	84.3	Confident	4 Å²	4	57.7 Å²	57.7	2%	0.021	29%	0.294	C	S	.	.	H	α-helix	trans	-71.2	-21.1	-179.7	-68.9	164.7	0	0	0	112.7	A46 R60 V171 E172 R197	A46-L50 WeakPolarHBondContact O-CB 3.3Å; A46-L50 VanDerWaalsContact O-CG 3.29Å; A46-L50 WeakPolarHBondContact O-CG 3.34Å; A46-L50 PolarHBondContact O-N 2.78Å; L50-R60 HydrophobicContact CD2-CB 4.04Å; L50-R60 HydrophobicContact CD2-CG 4.13Å; L50-R60 PolarHBondContact O-NE 3.26Å; L50-V171 HydrophobicContact CD1-CB 4.19Å; L50-V171 HydrophobicContact CD1-CG1 3.93Å; L50-E172 HydrophobicContact CD1-CB 4Å; L50-R197 PolarHBondContact O-NH2 2.91Å
51	S	83.2	Confident	84.4	Confident	23 Å²	23	52.9 Å²	52.9	16%	0.161	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	12.1	177.5	-47.7	0	0	0	0	112.8	S47 T48 L49 H53 Q175	S47-S51 WeakPolarHBondContact O-CB 3.34Å; S47-S51 PolarHBondContact O-N 3.37Å; S47-S51 PolarHBondContact O-OG 3.44Å; T48-S51 CarbonylContact O-C 3.6Å; T48-S51 PolarHBondContact O-N 3.37Å; L49-S51 VanDerWaalsContact C-N 3.26Å; L49-S51 PolarHBondContact O-N 2.83Å; S51-H53 PolarHBondContact O-N 3.31Å; S51-Q175 PolarHBondContact OG-NE2 2.93Å
52	L	78.8	Confident	84.5	Confident	61 Å²	61	58.4 Å²	58.4	32%	0.319	28%	0.278	S	S	.	.			trans	-74	100.1	-179.9	-158.9	74.1	0	0	0	109.4	D8 T48 L49 K54 V55	D8-L52 HydrophobicContact CB-CD2 4.32Å; T48-L52 PolarHBondContact O-N 2.83Å; L49-L52 WeakPolarHBondContact O-CB 3.47Å; L49-L52 PolarHBondContact O-N 2.95Å; L52-K54 PolarHBondContact O-N 3.04Å; L52-V55 HydrophobicContact CB-CG2 4.19Å; L52-V55 PolarHBondContact O-N 2.64Å
53	H	59.9	Low	84.5	Confident	99 Å²	99	60.3 Å²	60.3	46%	0.458	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.8	123.6	-179.8	-65	93.4	0	0	0	111.8	S51 D203	S51-H53 PolarHBondContact O-N 3.31Å; H53-D203 IonicContact CE1-OD2 2.76Å
54	K	64.2	Low	84.5	Confident	192 Å²	192	58.2 Å²	58.2	84%	0.835	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.4	-9.4	-172.2	-55.2	153.6	-172	169	0	116.6	L52 D56	L52-K54 PolarHBondContact O-N 3.04Å; K54-D56 PolarHBondContact O-N 2.91Å; K54-D56 VanDerWaalsContact O-N 3.09Å
55	V	72.1	Confident	84.5	Confident	20 Å²	20	60.6 Å²	60.6	12%	0.121	29%	0.286	C	S	.	.			trans	-75.1	100.4	167.3	-178.2	0	0	0	0	109.2	D8 L52 R60	D8-V55 HydrophobicContact CB-CG2 4.42Å; L52-V55 HydrophobicContact CB-CG2 4.19Å; L52-V55 PolarHBondContact O-N 2.64Å; V55-R60 HydrophobicContact CG1-CG 3.87Å
56	D	79.8	Confident	84.7	Confident	61 Å²	61	59.6 Å²	59.6	33%	0.326	28%	0.278	S	S	.	.			trans	-51.4	132.1	170.5	-171.9	-52.7	0	0	0	110.3	K54 F58 Y59	K54-D56 PolarHBondContact O-N 2.91Å; K54-D56 VanDerWaalsContact O-N 3.09Å; D56-F58 PolarHBondContact O-N 2.98Å; D56-F58 VanDerWaalsContact O-N 3.11Å; D56-F58 WeakPolarHBondContact OD1-CB 3.39Å; D56-F58 VanDerWaalsContact OD1-CD2 3.26Å; D56-F58 WeakPolarHBondContact OD1-CD2 3.28Å; D56-F58 PolarHBondContact OD1-N 3.21Å; D56-Y59 HydrophobicContact CB-CD2 3.81Å; D56-Y59 HydrophobicContact CB-CE2 4.26Å; D56-Y59 PolarHBondContact O-N 3.39Å
57	P	81.8	Confident	84.7	Confident	7 Å²	7	59.9 Å²	59.9	5%	0.045	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-48.6	-37.5	178.3	-29.4	36.1	0	0	0	114.1	Y59 R60 Y67 K198 S200	P57-Y59 PolarHBondContact O-N 3.24Å; P57-Y59 VanDerWaalsContact O-N 3.15Å; P57-R60 PolarHBondContact O-N 3.01Å; P57-Y67 HydrophobicContact CB-CE2 4.01Å; P57-K198 WeakPolarHBondContact CB-O 3.47Å; P57-K198 VanDerWaalsContact CG-O 3.31Å; P57-K198 WeakPolarHBondContact CG-O 3.46Å; P57-S200 WeakPolarHBondContact CG-O 3.45Å
58	F	80.7	Confident	84.9	Confident	132 Å²	132	61.8 Å²	61.8	58%	0.579	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-68.1	-9.7	179.1	-64.3	-68.8	0	0	0	114.3	D56	D56-F58 PolarHBondContact O-N 2.98Å; D56-F58 VanDerWaalsContact O-N 3.11Å; D56-F58 WeakPolarHBondContact OD1-CB 3.39Å; D56-F58 VanDerWaalsContact OD1-CD2 3.26Å; D56-F58 WeakPolarHBondContact OD1-CD2 3.28Å; D56-F58 PolarHBondContact OD1-N 3.21Å
59	Y	84.2	Confident	85.1	Confident	105 Å²	105	58.9 Å²	58.9	41%	0.412	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-110.4	-1.4	176.5	-59.4	-38.7	0	0	0	114.4	D56 P57 F61	D56-Y59 HydrophobicContact CB-CD2 3.81Å; D56-Y59 HydrophobicContact CB-CE2 4.26Å; D56-Y59 PolarHBondContact O-N 3.39Å; P57-Y59 PolarHBondContact O-N 3.24Å; P57-Y59 VanDerWaalsContact O-N 3.15Å; Y59-F61 VanDerWaalsContact C-N 3.29Å; Y59-F61 PolarHBondContact O-N 3.45Å
60	R	86.9	Confident	85.5	Confident	9 Å²	9	58.2 Å²	58.2	3%	0.034	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-40.7	175.4	-68.3	175.8	-177.3	144.5	7.6	111	K12 L50 V55 P57 Y67 E172 R197 S200	K12-R60 PolarHBondContact NZ-O 3.5Å; L50-R60 HydrophobicContact CD2-CB 4.04Å; L50-R60 HydrophobicContact CD2-CG 4.13Å; L50-R60 PolarHBondContact O-NE 3.26Å; V55-R60 HydrophobicContact CG1-CG 3.87Å; P57-R60 PolarHBondContact O-N 3.01Å; R60-Y67 VanDerWaalsContact CD-OH 3.3Å; R60-Y67 WeakPolarHBondContact CD-OH 3.26Å; R60-Y67 PolarHBondContact NH1-OH 2.79Å; R60-E172 IonicContact NH1-OE1 2.68Å; R60-E172 PolarHBondContact NH1-OE1 2.78Å; R60-R197 PolarHBondContact NH1-O 3.2Å; R60-S200 PolarHBondContact NH2-O 3.4Å
61	F	90.9	Very high	85.9	Confident	14 Å²	14	59.1 Å²	59.1	6%	0.061	27%	0.268	C	S	.	.			trans	-116	157.4	178.4	-56.5	-88.7	0	0	0	111.3	Y59 I64 F66 E165 L168 A169 E172	Y59-F61 VanDerWaalsContact C-N 3.29Å; Y59-F61 PolarHBondContact O-N 3.45Å; F61-I64 VanDerWaalsContact CB-O 3.27Å; F61-I64 WeakPolarHBondContact CB-O 3.29Å; F61-F66 HydrophobicContact CB-CB 4.45Å; F61-F66 HydrophobicContact CD1-CB 4.03Å; F61-F66 HydrophobicContact CD2-CB 3.44Å; F61-F66 VanDerWaalsContact CD2-CB 3.44Å; F61-F66 HydrophobicContact CD2-CD1 4.14Å; F61-F66 AromaticContact CD2-CG 3.92Å; F61-F66 HydrophobicContact CD2-CG 3.92Å; F61-F66 HydrophobicContact CE1-CB 4.13Å; F61-F66 HydrophobicContact CE1-CD2 4.18Å; F61-F66 HydrophobicContact CE1-CG 4.14Å; F61-F66 HydrophobicContact CE2-CB 3.57Å; F61-F66 AromaticContact CE2-CD1 3.5Å; F61-F66 HydrophobicContact CE2-CD1 3.5Å; F61-F66 VanDerWaalsContact CE2-CD1 3.5Å; F61-F66 HydrophobicContact CE2-CD2 4.2Å; F61-F66 HydrophobicContact CE2-CE1 4.23Å; F61-F66 AromaticContact CE2-CG 3.47Å; F61-F66 HydrophobicContact CE2-CG 3.47Å; F61-F66 VanDerWaalsContact CE2-CG 3.47Å; F61-F66 HydrophobicContact CG-CB 3.7Å; F61-F66 HydrophobicContact CG-CG 4.44Å; F61-F66 HydrophobicContact CZ-CB 3.92Å; F61-F66 AromaticContact CZ-CD1 3.92Å; F61-F66 HydrophobicContact CZ-CD1 3.92Å; F61-F66 AromaticContact CZ-CD2 3.84Å; F61-F66 HydrophobicContact CZ-CD2 3.84Å; F61-F66 HydrophobicContact CZ-CE1 4.42Å; F61-F66 HydrophobicContact CZ-CE2 4.32Å; F61-F66 AromaticContact CZ-CG 3.6Å; F61-F66 HydrophobicContact CZ-CG 3.6Å; F61-E165 HydrophobicContact CD1-CB 4.41Å; F61-L168 HydrophobicContact CE1-CB 3.85Å; F61-L168 HydrophobicContact CZ-CB 4.37Å; F61-A169 HydrophobicContact CE1-CB 4Å; F61-A169 HydrophobicContact CZ-CB 4.46Å; F61-E172 HydrophobicContact CE2-CG 4.36Å; F61-E172 HydrophobicContact CZ-CB 4.06Å; F61-E172 HydrophobicContact CZ-CG 4.41Å
62	R	90.1	Very high	86.5	Confident	212 Å²	212	60 Å²	60	80%	0.8	27%	0.274	S	S	*	.	S	Bend	trans	-139.5	-23.5	-178.7	-68.5	-176.8	62.7	-165.8	-3.9	114.3	E165	R62-E165 PolarHBondContact N-OE1 3.37Å; R62-E165 PolarHBondContact N-OE2 2.97Å
63	L	90.5	Very high	87.3	Confident	56 Å²	56	57.1 Å²	57.1	29%	0.293	26%	0.259	S	S	.	.	S	Bend	trans	-107.5	-26.8	-179.8	-56.3	178.3	0	0	0	111.5	M161 V162 E165	L63-M161 HydrophobicContact CD1-CB 3.85Å; L63-M161 HydrophobicContact CD1-CE 4.48Å; L63-V162 HydrophobicContact CD1-CG2 3.75Å; L63-E165 HydrophobicContact CD1-CG 4.45Å; L63-E165 PolarHBondContact N-OE2 2.76Å
64	I	93.1	Very high	89	Confident	10 Å²	10	54.2 Å²	54.2	5%	0.051	25%	0.247	C	C	.	.	S	Bend	trans	-118.1	130.7	-177.2	-57.3	171.8	0	0	0	109.1	F61 F66 I134 E165 L166	F61-I64 VanDerWaalsContact CB-O 3.27Å; F61-I64 WeakPolarHBondContact CB-O 3.29Å; I64-F66 PolarHBondContact O-N 3.07Å; I64-I134 HydrophobicContact CG1-CG1 4.49Å; I64-E165 HydrophobicContact CD1-CB 3.98Å; I64-E165 HydrophobicContact CG1-CB 4.47Å; I64-L166 HydrophobicContact CD1-CD2 3.63Å; I64-L166 HydrophobicContact CD1-CG 3.69Å
65	Q	93.3	Very high	90.5	Very high	141 Å²	141	52.2 Å²	52.2	66%	0.659	23%	0.234	S	C	*	.			trans	-79.1	65.3	172.8	-62.4	-176.3	-6.5	0	0	109.8	Y67 E68 V69	Q65-Y67 PolarHBondContact O-N 3.05Å; Q65-E68 HydrophobicContact CB-CB 4Å; Q65-E68 HydrophobicContact CB-CG 4.28Å; Q65-E68 PolarHBondContact O-N 3.47Å; Q65-V69 VanDerWaalsContact O-CG2 3.28Å; Q65-V69 WeakPolarHBondContact O-CG2 3.39Å; Q65-V69 PolarHBondContact O-N 3.04Å
66	F	95.1	Very high	91.6	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.009	25%	0.253	C	S	.	.	H	α-helix	trans	-54.6	-49	-163.7	171.5	-97.8	0	0	0	113.7	F61 I64 V69 V70 F89 A169 E172 M176	F61-F66 HydrophobicContact CB-CB 4.45Å; F61-F66 HydrophobicContact CD1-CB 4.03Å; F61-F66 HydrophobicContact CD2-CB 3.44Å; F61-F66 VanDerWaalsContact CD2-CB 3.44Å; F61-F66 HydrophobicContact CD2-CD1 4.14Å; F61-F66 AromaticContact CD2-CG 3.92Å; F61-F66 HydrophobicContact CD2-CG 3.92Å; F61-F66 HydrophobicContact CE1-CB 4.13Å; F61-F66 HydrophobicContact CE1-CD2 4.18Å; F61-F66 HydrophobicContact CE1-CG 4.14Å; F61-F66 HydrophobicContact CE2-CB 3.57Å; F61-F66 AromaticContact CE2-CD1 3.5Å; F61-F66 HydrophobicContact CE2-CD1 3.5Å; F61-F66 VanDerWaalsContact CE2-CD1 3.5Å; F61-F66 HydrophobicContact CE2-CD2 4.2Å; F61-F66 HydrophobicContact CE2-CE1 4.23Å; F61-F66 AromaticContact CE2-CG 3.47Å; F61-F66 HydrophobicContact CE2-CG 3.47Å; F61-F66 VanDerWaalsContact CE2-CG 3.47Å; F61-F66 HydrophobicContact CG-CB 3.7Å; F61-F66 HydrophobicContact CG-CG 4.44Å; F61-F66 HydrophobicContact CZ-CB 3.92Å; F61-F66 AromaticContact CZ-CD1 3.92Å; F61-F66 HydrophobicContact CZ-CD1 3.92Å; F61-F66 AromaticContact CZ-CD2 3.84Å; F61-F66 HydrophobicContact CZ-CD2 3.84Å; F61-F66 HydrophobicContact CZ-CE1 4.42Å; F61-F66 HydrophobicContact CZ-CE2 4.32Å; F61-F66 AromaticContact CZ-CG 3.6Å; F61-F66 HydrophobicContact CZ-CG 3.6Å; I64-F66 PolarHBondContact O-N 3.07Å; F66-V69 PolarHBondContact O-N 2.98Å; F66-V70 HydrophobicContact CD2-CG2 4.15Å; F66-V70 HydrophobicContact CE1-CG2 4.16Å; F66-V70 HydrophobicContact CE2-CG2 3.78Å; F66-V70 HydrophobicContact CZ-CG2 3.79Å; F66-V70 WeakPolarHBondContact O-CB 3.47Å; F66-V70 VanDerWaalsContact O-CG2 3.25Å; F66-V70 WeakPolarHBondContact O-CG2 3.49Å; F66-V70 PolarHBondContact O-N 3.27Å; F66-F89 HydrophobicContact CD2-CE2 4.07Å; F66-F89 HydrophobicContact CD2-CZ 4.07Å; F66-F89 HydrophobicContact CE2-CD2 4.28Å; F66-F89 AromaticContact CE2-CE2 3.61Å; F66-F89 HydrophobicContact CE2-CE2 3.61Å; F66-F89 HydrophobicContact CE2-CZ 4.09Å; F66-A169 HydrophobicContact CD2-CB 3.57Å; F66-A169 HydrophobicContact CE2-CB 3.65Å; F66-A169 WeakPolarHBondContact CE2-O 3.25Å; F66-E172 HydrophobicContact CD1-CG 4.17Å; F66-E172 HydrophobicContact CE1-CB 3.97Å; F66-E172 HydrophobicContact CE1-CG 3.35Å; F66-E172 HydrophobicContact CE2-CB 4.45Å; F66-E172 HydrophobicContact CZ-CB 3.76Å; F66-E172 HydrophobicContact CZ-CG 3.66Å; F66-M176 HydrophobicContact CE1-CE 3.63Å; F66-M176 HydrophobicContact CZ-CE 3.57Å
67	Y	94.9	Very high	92.2	Very high	5 Å²	5	54 Å²	54	2%	0.02	25%	0.248	C	C	.	.	H	α-helix	trans	-69.5	-36.8	-177.5	-63	-70.4	0	0	0	111.5	P57 R60 Q65 V70 E71 E172 V194 R197 K198	P57-Y67 HydrophobicContact CB-CE2 4.01Å; R60-Y67 VanDerWaalsContact CD-OH 3.3Å; R60-Y67 WeakPolarHBondContact CD-OH 3.26Å; R60-Y67 PolarHBondContact NH1-OH 2.79Å; Q65-Y67 PolarHBondContact O-N 3.05Å; Y67-V70 PolarHBondContact O-N 3.19Å; Y67-E71 WeakPolarHBondContact O-CB 3.34Å; Y67-E71 WeakPolarHBondContact O-CG 3.19Å; Y67-E71 PolarHBondContact O-N 3.3Å; Y67-E172 PolarHBondContact OH-OE1 3.07Å; Y67-V194 HydrophobicContact CD1-CG1 4.3Å; Y67-R197 HydrophobicContact CE1-CG 4.37Å; Y67-K198 HydrophobicContact CD1-CB 4Å; Y67-K198 HydrophobicContact CD1-CG 4.33Å; Y67-K198 HydrophobicContact CD2-CG 4.18Å; Y67-K198 HydrophobicContact CE1-CB 4.43Å; Y67-K198 HydrophobicContact CG-CB 4.12Å; Y67-K198 HydrophobicContact CG-CD 4.18Å; Y67-K198 HydrophobicContact CG-CG 3.92Å
68	E	95.1	Very high	92.6	Very high	63 Å²	63	60 Å²	60	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-64.6	-44.4	177.1	-65.3	57.8	-132.2	0	0	111.1	Q65 S72 K198	Q65-E68 HydrophobicContact CB-CB 4Å; Q65-E68 HydrophobicContact CB-CG 4.28Å; Q65-E68 PolarHBondContact O-N 3.47Å; E68-S72 WeakPolarHBondContact O-CB 3.47Å; E68-S72 PolarHBondContact O-N 3.45Å; E68-S72 PolarHBondContact O-OG 3.33Å; E68-K198 WeakPolarHBondContact OE1-CE 3.47Å; E68-K198 IonicContact OE1-NZ 3.55Å; E68-K198 PolarHBondContact OE1-NZ 2.72Å
69	V	96.2	Very high	93	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-48.8	175.4	172.4	0	0	0	0	110.8	Q65 F66 S72 S73 F89 L126 D130	Q65-V69 VanDerWaalsContact O-CG2 3.28Å; Q65-V69 WeakPolarHBondContact O-CG2 3.39Å; Q65-V69 PolarHBondContact O-N 3.04Å; F66-V69 PolarHBondContact O-N 2.98Å; V69-S72 PolarHBondContact O-N 3.35Å; V69-S73 WeakPolarHBondContact O-CB 3.48Å; V69-S73 PolarHBondContact O-N 2.86Å; V69-F89 HydrophobicContact CG1-CE1 4.39Å; V69-F89 HydrophobicContact CG1-CZ 4.18Å; V69-L126 HydrophobicContact CG1-CD2 3.54Å; V69-D130 HydrophobicContact CG1-CB 4.14Å; V69-D130 HydrophobicContact CG2-CB 4.15Å
70	V	96.6	Very high	93.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-46.2	178.8	166.3	0	0	0	0	111.5	F66 Y67 L74 L82 L85 F89 V194	F66-V70 HydrophobicContact CD2-CG2 4.15Å; F66-V70 HydrophobicContact CE1-CG2 4.16Å; F66-V70 HydrophobicContact CE2-CG2 3.78Å; F66-V70 HydrophobicContact CZ-CG2 3.79Å; F66-V70 WeakPolarHBondContact O-CB 3.47Å; F66-V70 VanDerWaalsContact O-CG2 3.25Å; F66-V70 WeakPolarHBondContact O-CG2 3.49Å; F66-V70 PolarHBondContact O-N 3.27Å; Y67-V70 PolarHBondContact O-N 3.19Å; V70-L74 HydrophobicContact CG1-CD1 3.91Å; V70-L74 WeakPolarHBondContact O-CB 3.47Å; V70-L74 VanDerWaalsContact O-CG 3.27Å; V70-L74 WeakPolarHBondContact O-CG 3.44Å; V70-L74 PolarHBondContact O-N 3.02Å; V70-L82 HydrophobicContact CG1-CD2 4.12Å; V70-L85 HydrophobicContact CB-CD1 4.27Å; V70-L85 HydrophobicContact CG1-CD1 3.91Å; V70-L85 HydrophobicContact CG2-CD1 4.11Å; V70-L85 HydrophobicContact CG2-CD2 4.29Å; V70-F89 HydrophobicContact CG2-CE2 4.05Å; V70-F89 HydrophobicContact CG2-CZ 4.18Å; V70-V194 HydrophobicContact CG1-CB 4.46Å; V70-V194 HydrophobicContact CG1-CG1 3.99Å; V70-V194 HydrophobicContact CG1-CG2 3.57Å
71	E	95.8	Very high	93.8	Very high	23 Å²	23	54.4 Å²	54.4	11%	0.107	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-44.4	177	-78.9	178.4	-127.4	0	0	112.5	Y67 L74 R75 L191 V194 K198	Y67-E71 WeakPolarHBondContact O-CB 3.34Å; Y67-E71 WeakPolarHBondContact O-CG 3.19Å; Y67-E71 PolarHBondContact O-N 3.3Å; E71-L74 PolarHBondContact O-N 2.79Å; E71-R75 WeakPolarHBondContact O-CB 3.46Å; E71-R75 WeakPolarHBondContact O-CD 3.44Å; E71-R75 WeakPolarHBondContact O-CG 3.31Å; E71-R75 PolarHBondContact O-N 2.88Å; E71-R75 IonicContact OE2-CZ 2.98Å; E71-R75 IonicContact OE2-NH1 2.8Å; E71-R75 PolarHBondContact OE2-NH1 3.46Å; E71-R75 IonicContact OE2-NH2 2.67Å; E71-R75 PolarHBondContact OE2-NH2 3.09Å; E71-L191 HydrophobicContact CB-CD1 4.34Å; E71-L191 HydrophobicContact CG-CD1 4.09Å; E71-V194 HydrophobicContact CG-CG1 3.81Å; E71-K198 VanDerWaalsContact OE1-CD 3.23Å; E71-K198 WeakPolarHBondContact OE1-CD 3.42Å; E71-K198 WeakPolarHBondContact OE1-CE 3.5Å; E71-K198 IonicContact OE1-NZ 2.98Å; E71-K198 PolarHBondContact OE1-NZ 2.98Å
72	S	95.7	Very high	94.1	Very high	42 Å²	42	53.7 Å²	53.7	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-68.4	-39.3	-178	-57.1	0	0	0	0	111	E68 V69 R75 S76	E68-S72 WeakPolarHBondContact O-CB 3.47Å; E68-S72 PolarHBondContact O-N 3.45Å; E68-S72 PolarHBondContact O-OG 3.33Å; V69-S72 PolarHBondContact O-N 3.35Å; S72-R75 PolarHBondContact O-N 3.43Å; S72-S76 WeakPolarHBondContact O-CB 3.42Å; S72-S76 PolarHBondContact O-N 2.74Å; S72-S76 PolarHBondContact O-OG 3.07Å
73	S	96.6	Very high	94.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-56.7	-57.9	170	171.4	0	0	0	0	112.2	V69 R75 S76 L77 S80 T125	V69-S73 WeakPolarHBondContact O-CB 3.48Å; V69-S73 PolarHBondContact O-N 2.86Å; S73-R75 PolarHBondContact O-N 2.79Å; S73-S76 PolarHBondContact O-N 2.89Å; S73-L77 PolarHBondContact O-N 2.94Å; S73-S80 WeakPolarHBondContact OG-CB 3.48Å; S73-S80 PolarHBondContact OG-OG 2.97Å; S73-T125 VanDerWaalsContact CB-O 3.31Å; S73-T125 WeakPolarHBondContact CB-O 3.33Å; S73-T125 PolarHBondContact OG-O 3.42Å
74	L	95.6	Very high	94.7	Very high	37 Å²	37	51 Å²	51	19%	0.194	27%	0.272	C	S	.	.	H	α-helix	trans	-64.6	-23.9	-177.3	-69.3	174.1	0	0	0	113.6	V70 E71 L82 L85 E190 L191 V194	V70-L74 HydrophobicContact CG1-CD1 3.91Å; V70-L74 WeakPolarHBondContact O-CB 3.47Å; V70-L74 VanDerWaalsContact O-CG 3.27Å; V70-L74 WeakPolarHBondContact O-CG 3.44Å; V70-L74 PolarHBondContact O-N 3.02Å; E71-L74 PolarHBondContact O-N 2.79Å; L74-L82 HydrophobicContact CD1-CD2 4.35Å; L74-L85 HydrophobicContact CD2-CD1 4.17Å; L74-L85 HydrophobicContact CG-CD1 4.09Å; L74-E190 HydrophobicContact CD1-CB 4.33Å; L74-L191 HydrophobicContact CB-CD1 4.34Å; L74-V194 HydrophobicContact CD1-CG2 3.93Å
75	R	95.8	Very high	94.9	Very high	150 Å²	150	50.5 Å²	50.5	57%	0.566	27%	0.27	S	S	*	.	H	α-helix	trans	-84	-32.8	174.8	-72.3	170.8	-174.3	138.3	11.8	113.7	E71 S72 S73 L191	E71-R75 WeakPolarHBondContact O-CB 3.46Å; E71-R75 WeakPolarHBondContact O-CD 3.44Å; E71-R75 WeakPolarHBondContact O-CG 3.31Å; E71-R75 PolarHBondContact O-N 2.88Å; E71-R75 IonicContact OE2-CZ 2.98Å; E71-R75 IonicContact OE2-NH1 2.8Å; E71-R75 PolarHBondContact OE2-NH1 3.46Å; E71-R75 IonicContact OE2-NH2 2.67Å; E71-R75 PolarHBondContact OE2-NH2 3.09Å; S72-R75 PolarHBondContact O-N 3.43Å; S73-R75 PolarHBondContact O-N 2.79Å; R75-L191 HydrophobicContact CG-CD1 4.44Å; R75-L191 HydrophobicContact CG-CD2 4.05Å
76	S	94.6	Very high	95.1	Very high	76 Å²	76	46.2 Å²	46.2	53%	0.531	25%	0.25	S	C	.	.	H	α-helix	trans	-105.6	-24.7	-166.2	-48.2	0	0	0	0	114.2	S72 S73	S72-S76 WeakPolarHBondContact O-CB 3.42Å; S72-S76 PolarHBondContact O-N 2.74Å; S72-S76 PolarHBondContact O-OG 3.07Å; S73-S76 PolarHBondContact O-N 2.89Å
77	L	93.3	Very high	95.1	Very high	42 Å²	42	46.9 Å²	46.9	22%	0.22	26%	0.258	C	S	.	.			trans	-119.3	107	-172.3	-63.5	173.8	0	0	0	110.4	S73 S79 S80 T125 L127	S73-L77 PolarHBondContact O-N 2.94Å; L77-S79 PolarHBondContact O-N 2.82Å; L77-S80 VanDerWaalsContact O-CB 3.23Å; L77-S80 WeakPolarHBondContact O-CB 3.4Å; L77-S80 PolarHBondContact O-N 3.45Å; L77-T125 WeakPolarHBondContact CD1-O 3.3Å; L77-L127 HydrophobicContact CD1-CD2 4.05Å; L77-L127 HydrophobicContact CD2-CD2 4.33Å; L77-L127 HydrophobicContact CG-CD2 4.08Å
78	S	89.3	Confident	95.2	Very high	134 Å²	134	46.7 Å²	46.7	94%	0.937	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.4	-177.9	55.5	0	0	0	0	114.8
79	S	88.6	Confident	95.3	Very high	74 Å²	74	43.7 Å²	43.7	52%	0.517	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.4	170	42.2	0	0	0	0	114	L77 S124	L77-S79 PolarHBondContact O-N 2.82Å; S79-S124 PolarHBondContact OG-O 3.44Å
80	S	93.1	Very high	95.3	Very high	20 Å²	20	44.7 Å²	44.7	14%	0.14	25%	0.25	C	C	.	.			trans	-79.5	155	-178.7	-166.1	0	0	0	0	112.8	S73 L77	S73-S80 WeakPolarHBondContact OG-CB 3.48Å; S73-S80 PolarHBondContact OG-OG 2.97Å; L77-S80 VanDerWaalsContact O-CB 3.23Å; L77-S80 WeakPolarHBondContact O-CB 3.4Å; L77-S80 PolarHBondContact O-N 3.45Å
81	S	96.3	Very high	95.3	Very high	34 Å²	34	46.6 Å²	46.6	24%	0.238	26%	0.259	C	S	.	.			trans	-164.5	165.4	172	52.9	0	0	0	0	108	R83 A84 L85 E190	S81-R83 PolarHBondContact O-N 3.27Å; S81-R83 VanDerWaalsContact O-N 3.12Å; S81-A84 PolarHBondContact O-N 3.04Å; S81-A84 PolarHBondContact OG-N 2.98Å; S81-A84 VanDerWaalsContact OG-N 3.14Å; S81-L85 WeakPolarHBondContact O-CB 3.3Å; S81-L85 PolarHBondContact O-N 3.22Å; S81-E190 WeakPolarHBondContact CA-OE2 3.47Å; S81-E190 WeakPolarHBondContact CB-OE2 3.47Å
82	L	96.6	Very high	95.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.3	-30.5	172.6	-68.2	174.3	0	0	0	112.3	V70 L74 L85 H86 M176 L177 E190 V194	V70-L82 HydrophobicContact CG1-CD2 4.12Å; L74-L82 HydrophobicContact CD1-CD2 4.35Å; L82-L85 HydrophobicContact CD2-CD1 4.5Å; L82-H86 WeakPolarHBondContact O-CB 3.39Å; L82-H86 PolarHBondContact O-N 3.07Å; L82-M176 HydrophobicContact CD1-CB 3.86Å; L82-M176 HydrophobicContact CD2-CB 4.39Å; L82-M176 HydrophobicContact CD2-CE 3.83Å; L82-M176 HydrophobicContact CD2-SD 4.5Å; L82-L177 HydrophobicContact CB-CD1 4.39Å; L82-L177 HydrophobicContact CB-CD2 3.76Å; L82-L177 HydrophobicContact CB-CG 3.84Å; L82-L177 HydrophobicContact CD1-CD2 4.42Å; L82-L177 HydrophobicContact CD1-CG 4.5Å; L82-E190 HydrophobicContact CD1-CB 3.9Å; L82-E190 HydrophobicContact CD1-CG 3.94Å; L82-E190 HydrophobicContact CG-CB 4.01Å; L82-E190 HydrophobicContact CG-CG 4.15Å; L82-E190 PolarHBondContact N-OE2 3.35Å; L82-V194 HydrophobicContact CD2-CG2 3.94Å
83	R	96.6	Very high	95.4	Very high	187 Å²	187	43.9 Å²	43.9	71%	0.706	24%	0.242	S	C	*	.	H	α-helix	trans	-74.3	-38	173.8	-177	175.9	-65.5	169.8	1.7	113.3	S81 G87	S81-R83 PolarHBondContact O-N 3.27Å; S81-R83 VanDerWaalsContact O-N 3.12Å; R83-G87 PolarHBondContact O-N 3.11Å
84	A	96.3	Very high	95.3	Very high	23 Å²	23	47.2 Å²	47.2	19%	0.19	26%	0.263	C	S	.	.	H	α-helix	trans	-66.3	-45.3	172.9	0	0	0	0	0	110.5	S81 H86 G87 A88 T125	S81-A84 PolarHBondContact O-N 3.04Å; S81-A84 PolarHBondContact OG-N 2.98Å; S81-A84 VanDerWaalsContact OG-N 3.14Å; A84-H86 VanDerWaalsContact C-N 3.34Å; A84-H86 PolarHBondContact O-N 2.83Å; A84-G87 CarbonylContact O-C 3.59Å; A84-G87 WeakPolarHBondContact O-CA 3.29Å; A84-G87 PolarHBondContact O-N 3.37Å; A84-A88 PolarHBondContact O-N 2.85Å; A84-T125 HydrophobicContact CB-CG2 3.86Å
85	L	97.4	Very high	95.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.2	-43.6	176.1	-78.8	158.4	0	0	0	112.4	V70 L74 S81 L82 G87 A88 F89 T125 L126	V70-L85 HydrophobicContact CB-CD1 4.27Å; V70-L85 HydrophobicContact CG1-CD1 3.91Å; V70-L85 HydrophobicContact CG2-CD1 4.11Å; V70-L85 HydrophobicContact CG2-CD2 4.29Å; L74-L85 HydrophobicContact CD2-CD1 4.17Å; L74-L85 HydrophobicContact CG-CD1 4.09Å; S81-L85 WeakPolarHBondContact O-CB 3.3Å; S81-L85 PolarHBondContact O-N 3.22Å; L82-L85 HydrophobicContact CD2-CD1 4.5Å; L85-G87 VanDerWaalsContact C-N 3.3Å; L85-G87 PolarHBondContact O-N 3.48Å; L85-A88 PolarHBondContact O-N 3.35Å; L85-F89 HydrophobicContact CB-CD2 4.44Å; L85-F89 HydrophobicContact CB-CE2 4.13Å; L85-F89 HydrophobicContact CD2-CE2 4.05Å; L85-F89 HydrophobicContact CD2-CZ 4.15Å; L85-F89 WeakPolarHBondContact O-CD2 3.3Å; L85-F89 WeakPolarHBondContact O-CG 3.3Å; L85-F89 PolarHBondContact O-N 3.36Å; L85-T125 HydrophobicContact CB-CG2 4.4Å; L85-T125 HydrophobicContact CD2-CG2 3.97Å; L85-T125 HydrophobicContact CG-CG2 3.88Å; L85-L126 HydrophobicContact CD2-CD2 3.57Å
86	H	97	Very high	95.2	Very high	51 Å²	51	39.4 Å²	39.4	24%	0.236	23%	0.233	C	C	.	.	H	α-helix	trans	-52.8	-46.3	170.7	179.8	-79.4	0	0	0	112.5	L82 A84 S90 K170 C173 E174	L82-H86 WeakPolarHBondContact O-CB 3.39Å; L82-H86 PolarHBondContact O-N 3.07Å; A84-H86 VanDerWaalsContact C-N 3.34Å; A84-H86 PolarHBondContact O-N 2.83Å; H86-S90 VanDerWaalsContact O-CB 3.27Å; H86-S90 WeakPolarHBondContact O-CB 3.44Å; H86-S90 PolarHBondContact O-N 3.42Å; H86-S90 PolarHBondContact O-OG 3.09Å; H86-K170 PolarHBondContact CD2-O 3.37Å; H86-K170 VanDerWaalsContact CD2-O 3.27Å; H86-C173 HydrophobicContact CB-CB 4.16Å; H86-E174 IonicContact CD2-OE1 2.72Å; H86-E174 IonicContact CE1-OE1 3.88Å; H86-E174 IonicContact NE2-OE1 3.14Å; H86-E174 PolarHBondContact NE2-OE1 3.46Å
87	G	96.3	Very high	95.2	Very high	17 Å²	17	36.6 Å²	36.6	18%	0.175	21%	0.212	C	C	.	.	H	α-helix	trans	-65.9	-41	176.1	0	0	0	0	0	113.4	R83 A84 L85 S90 M91	R83-G87 PolarHBondContact O-N 3.11Å; A84-G87 CarbonylContact O-C 3.59Å; A84-G87 WeakPolarHBondContact O-CA 3.29Å; A84-G87 PolarHBondContact O-N 3.37Å; L85-G87 VanDerWaalsContact C-N 3.3Å; L85-G87 PolarHBondContact O-N 3.48Å; G87-S90 PolarHBondContact O-N 3.46Å; G87-M91 PolarHBondContact O-N 3.39Å
88	A	96.9	Very high	95.2	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-62.3	-49.9	176.5	0	0	0	0	0	111.7	A84 L85 M91 L92 Y121 T125 L126	A84-A88 PolarHBondContact O-N 2.85Å; L85-A88 PolarHBondContact O-N 3.35Å; A88-M91 PolarHBondContact O-N 2.91Å; A88-L92 WeakPolarHBondContact O-CG 3.44Å; A88-L92 PolarHBondContact O-N 2.85Å; A88-Y121 VanDerWaalsContact CB-O 3.26Å; A88-Y121 WeakPolarHBondContact CB-O 3.39Å; A88-T125 HydrophobicContact CB-CG2 3.81Å; A88-L126 HydrophobicContact CB-CD1 3.96Å; A88-L126 HydrophobicContact CB-CG 4.01Å
89	F	97.4	Very high	95.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-40.8	176.9	-64.6	-48.6	0	0	0	111.8	F66 V69 V70 L85 M91 L92 E93 L126 I134 L166 A169 K170	F66-F89 HydrophobicContact CD2-CE2 4.07Å; F66-F89 HydrophobicContact CD2-CZ 4.07Å; F66-F89 HydrophobicContact CE2-CD2 4.28Å; F66-F89 AromaticContact CE2-CE2 3.61Å; F66-F89 HydrophobicContact CE2-CE2 3.61Å; F66-F89 HydrophobicContact CE2-CZ 4.09Å; V69-F89 HydrophobicContact CG1-CE1 4.39Å; V69-F89 HydrophobicContact CG1-CZ 4.18Å; V70-F89 HydrophobicContact CG2-CE2 4.05Å; V70-F89 HydrophobicContact CG2-CZ 4.18Å; L85-F89 HydrophobicContact CB-CD2 4.44Å; L85-F89 HydrophobicContact CB-CE2 4.13Å; L85-F89 HydrophobicContact CD2-CE2 4.05Å; L85-F89 HydrophobicContact CD2-CZ 4.15Å; L85-F89 WeakPolarHBondContact O-CD2 3.3Å; L85-F89 WeakPolarHBondContact O-CG 3.3Å; L85-F89 PolarHBondContact O-N 3.36Å; F89-M91 VanDerWaalsContact C-N 3.29Å; F89-M91 PolarHBondContact O-N 3.08Å; F89-L92 PolarHBondContact O-N 3.34Å; F89-E93 VanDerWaalsContact O-CB 3.25Å; F89-E93 WeakPolarHBondContact O-CB 3.42Å; F89-E93 PolarHBondContact O-N 3.2Å; F89-L126 HydrophobicContact CE1-CD1 4.44Å; F89-L126 HydrophobicContact CE1-CD2 4.41Å; F89-L126 HydrophobicContact CZ-CD2 4.46Å; F89-I134 HydrophobicContact CE1-CD1 4.46Å; F89-L166 HydrophobicContact CD1-CD2 3.74Å; F89-A169 HydrophobicContact CB-CB 4.24Å; F89-A169 HydrophobicContact CD1-CB 4.04Å; F89-A169 HydrophobicContact CD2-CB 3.82Å; F89-A169 HydrophobicContact CE1-CB 4.35Å; F89-A169 HydrophobicContact CE2-CB 4.15Å; F89-A169 HydrophobicContact CG-CB 3.77Å; F89-A169 HydrophobicContact CZ-CB 4.4Å; F89-K170 HydrophobicContact CB-CB 4.23Å
90	S	96.6	Very high	95.7	Very high	28 Å²	28	27.3 Å²	27.3	20%	0.196	15%	0.146	C	C	.	.	H	α-helix	trans	-62.1	-33.8	174.6	-60.3	0	0	0	0	112.9	H86 G87 T94 K170	H86-S90 VanDerWaalsContact O-CB 3.27Å; H86-S90 WeakPolarHBondContact O-CB 3.44Å; H86-S90 PolarHBondContact O-N 3.42Å; H86-S90 PolarHBondContact O-OG 3.09Å; G87-S90 PolarHBondContact O-N 3.46Å; S90-T94 WeakPolarHBondContact O-CB 3.24Å; S90-T94 PolarHBondContact O-N 3.42Å; S90-T94 VanDerWaalsContact O-N 3.11Å; S90-T94 PolarHBondContact O-OG1 2.99Å; S90-K170 WeakPolarHBondContact OG-CD 3.47Å
91	M	95.9	Very high	95.6	Very high	41 Å²	41	27.5 Å²	27.5	20%	0.202	15%	0.145	C	C	.	.	H	α-helix	trans	-72.3	-43	174.7	-175	160.8	-64.1	0	0	112.1	G87 A88 F89 T94 V95 P117 F118 Y121 V122	G87-M91 PolarHBondContact O-N 3.39Å; A88-M91 PolarHBondContact O-N 2.91Å; F89-M91 VanDerWaalsContact C-N 3.29Å; F89-M91 PolarHBondContact O-N 3.08Å; M91-T94 WeakPolarHBondContact O-CB 3.49Å; M91-T94 PolarHBondContact O-N 3.14Å; M91-V95 PolarHBondContact O-N 3.26Å; M91-P117 HydrophobicContact CE-CB 3.73Å; M91-P117 HydrophobicContact SD-CB 4.34Å; M91-F118 HydrophobicContact SD-CB 4.41Å; M91-Y121 HydrophobicContact CE-CD2 3.45Å; M91-Y121 VanDerWaalsContact CE-CD2 3.45Å; M91-Y121 HydrophobicContact CE-CE2 4.3Å; M91-Y121 HydrophobicContact CE-CG 3.94Å; M91-V122 HydrophobicContact CB-CG2 4.05Å; M91-V122 HydrophobicContact CG-CG2 3.95Å; M91-V122 HydrophobicContact SD-CG2 3.77Å
92	L	96.4	Very high	95.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67.7	-38.5	177.1	-68.3	171	0	0	0	111.7	A88 F89 T94 V95 G96 F118 V122 L126 I134 L135 L166	A88-L92 WeakPolarHBondContact O-CG 3.44Å; A88-L92 PolarHBondContact O-N 2.85Å; F89-L92 PolarHBondContact O-N 3.34Å; L92-T94 VanDerWaalsContact C-N 3.28Å; L92-T94 PolarHBondContact O-N 2.89Å; L92-V95 WeakPolarHBondContact O-CB 3.42Å; L92-V95 PolarHBondContact O-N 3.36Å; L92-V95 VanDerWaalsContact O-N 3.14Å; L92-G96 PolarHBondContact O-N 2.92Å; L92-F118 HydrophobicContact CD2-CE2 4.25Å; L92-F118 HydrophobicContact CD2-CZ 4.49Å; L92-V122 HydrophobicContact CD1-CG1 4.2Å; L92-V122 HydrophobicContact CD2-CG1 4.21Å; L92-V122 HydrophobicContact CG-CG1 4.29Å; L92-L126 HydrophobicContact CD1-CD1 3.59Å; L92-I134 HydrophobicContact CD1-CD1 4.09Å; L92-I134 HydrophobicContact CD1-CG2 4.21Å; L92-L135 HydrophobicContact CD2-CD2 4.13Å; L92-L166 HydrophobicContact CB-CD1 3.81Å; L92-L166 HydrophobicContact CB-CD2 4.05Å
93	E	96.4	Very high	95.1	Very high	7 Å²	7	29.5 Å²	29.5	3%	0.033	15%	0.151	C	C	.	.	H	α-helix	trans	-54.7	-46.9	169.3	-175.4	-158.1	178.8	0	0	109.9	F89 V95 G96 I97 L166 F167 K170	F89-E93 VanDerWaalsContact O-CB 3.25Å; F89-E93 WeakPolarHBondContact O-CB 3.42Å; F89-E93 PolarHBondContact O-N 3.2Å; E93-V95 VanDerWaalsContact C-N 3.34Å; E93-V95 PolarHBondContact O-N 3.41Å; E93-G96 PolarHBondContact O-N 2.84Å; E93-I97 HydrophobicContact CG-CD1 3.75Å; E93-I97 HydrophobicContact CG-CG1 4.49Å; E93-I97 WeakPolarHBondContact O-CB 3.35Å; E93-I97 WeakPolarHBondContact O-CD1 3.46Å; E93-I97 VanDerWaalsContact O-CG1 3.24Å; E93-I97 WeakPolarHBondContact O-CG1 3.39Å; E93-I97 PolarHBondContact O-N 3.19Å; E93-L166 HydrophobicContact CB-CB 3.97Å; E93-F167 HydrophobicContact CG-CB 4.29Å; E93-F167 WeakPolarHBondContact OE1-CD2 3.27Å; E93-K170 IonicContact OE1-NZ 3.5Å; E93-K170 PolarHBondContact OE1-NZ 3.32Å; E93-K170 WeakPolarHBondContact OE2-CD 3.23Å; E93-K170 VanDerWaalsContact OE2-CE 3.25Å; E93-K170 WeakPolarHBondContact OE2-CE 3.37Å; E93-K170 IonicContact OE2-NZ 3.89Å; E93-K170 PolarHBondContact OE2-NZ 2.94Å
94	T	94.9	Very high	94.6	Very high	71 Å²	71	29 Å²	29	44%	0.436	15%	0.149	S	C	.	.	H	α-helix	trans	-63	-35.4	177.2	-59.7	0	0	0	0	112.7	S90 M91 L92 N98	S90-T94 WeakPolarHBondContact O-CB 3.24Å; S90-T94 PolarHBondContact O-N 3.42Å; S90-T94 VanDerWaalsContact O-N 3.11Å; S90-T94 PolarHBondContact O-OG1 2.99Å; M91-T94 WeakPolarHBondContact O-CB 3.49Å; M91-T94 PolarHBondContact O-N 3.14Å; L92-T94 VanDerWaalsContact C-N 3.28Å; L92-T94 PolarHBondContact O-N 2.89Å; T94-N98 WeakPolarHBondContact O-CB 3.39Å; T94-N98 PolarHBondContact O-N 2.9Å; T94-N98 VanDerWaalsContact O-N 3.08Å; T94-N98 PolarHBondContact O-ND2 2.7Å
95	V	94.4	Very high	94.4	Very high	23 Å²	23	30.8 Å²	30.8	14%	0.139	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-47.8	172.4	170.6	0	0	0	0	110.7	M91 L92 E93 N98 L99 I111 L135 M138 Y140	M91-V95 PolarHBondContact O-N 3.26Å; L92-V95 WeakPolarHBondContact O-CB 3.42Å; L92-V95 PolarHBondContact O-N 3.36Å; L92-V95 VanDerWaalsContact O-N 3.14Å; E93-V95 VanDerWaalsContact C-N 3.34Å; E93-V95 PolarHBondContact O-N 3.41Å; V95-N98 PolarHBondContact O-N 3.11Å; V95-L99 PolarHBondContact O-N 2.92Å; V95-I111 HydrophobicContact CG1-CD1 4.05Å; V95-I111 HydrophobicContact CG1-CG2 4.27Å; V95-L135 HydrophobicContact CG1-CD2 4.45Å; V95-M138 HydrophobicContact CG1-SD 4.37Å; V95-Y140 HydrophobicContact CG1-CE2 3.89Å
96	G	94.7	Very high	93.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63	-43.8	177.9	0	0	0	0	0	113.4	L92 E93 N98 L99 F100 V159 S163	L92-G96 PolarHBondContact O-N 2.92Å; E93-G96 PolarHBondContact O-N 2.84Å; G96-N98 PolarHBondContact O-N 3.25Å; G96-L99 PolarHBondContact O-N 3.24Å; G96-F100 WeakPolarHBondContact O-CD1 3.26Å; G96-F100 PolarHBondContact O-N 2.93Å; G96-V159 VanDerWaalsContact O-CG1 3.26Å; G96-V159 WeakPolarHBondContact O-CG1 3.27Å; G96-S163 VanDerWaalsContact C-OG 3.23Å; G96-S163 VanDerWaalsContact CA-OG 3.28Å; G96-S163 WeakPolarHBondContact CA-OG 3.3Å
97	I	94.8	Very high	93.5	Very high	17 Å²	17	42.2 Å²	42.2	9%	0.087	20%	0.203	C	C	.	.	H	α-helix	trans	-56.2	-49.9	173.9	-69.9	158.8	0	0	0	111	H23 E93 L99 F100 L101	H23-I97 WeakPolarHBondContact CE1-CD1 3.46Å; E93-I97 HydrophobicContact CG-CD1 3.75Å; E93-I97 HydrophobicContact CG-CG1 4.49Å; E93-I97 WeakPolarHBondContact O-CB 3.35Å; E93-I97 WeakPolarHBondContact O-CD1 3.46Å; E93-I97 VanDerWaalsContact O-CG1 3.24Å; E93-I97 WeakPolarHBondContact O-CG1 3.39Å; E93-I97 PolarHBondContact O-N 3.19Å; I97-L99 VanDerWaalsContact C-N 3.3Å; I97-L99 PolarHBondContact O-N 2.92Å; I97-F100 HydrophobicContact CB-CE1 4.25Å; I97-F100 HydrophobicContact CG1-CE1 3.91Å; I97-F100 HydrophobicContact CG1-CZ 4.19Å; I97-F100 PolarHBondContact O-N 3.15Å; I97-L101 HydrophobicContact CG2-CD1 3.59Å; I97-L101 HydrophobicContact CG2-CG 4.22Å; I97-L101 WeakPolarHBondContact O-CB 3.44Å; I97-L101 VanDerWaalsContact O-CG 3.3Å; I97-L101 WeakPolarHBondContact O-CG 3.27Å; I97-L101 PolarHBondContact O-N 3.18Å
98	N	94	Very high	93.2	Very high	44 Å²	44	43.4 Å²	43.4	24%	0.235	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-37.3	179.4	-79.5	-48.7	0	0	0	112.3	T94 V95 G96 Y102 F108	T94-N98 WeakPolarHBondContact O-CB 3.39Å; T94-N98 PolarHBondContact O-N 2.9Å; T94-N98 VanDerWaalsContact O-N 3.08Å; T94-N98 PolarHBondContact O-ND2 2.7Å; V95-N98 PolarHBondContact O-N 3.11Å; G96-N98 PolarHBondContact O-N 3.25Å; N98-Y102 PolarHBondContact O-N 2.87Å; N98-F108 HydrophobicContact CB-CD1 3.81Å; N98-F108 HydrophobicContact CB-CD2 3.85Å; N98-F108 HydrophobicContact CB-CE1 3.72Å; N98-F108 HydrophobicContact CB-CE2 3.75Å; N98-F108 HydrophobicContact CB-CG 3.89Å; N98-F108 HydrophobicContact CB-CZ 3.69Å; N98-F108 WeakPolarHBondContact O-CD2 3.41Å
99	L	93.7	Very high	92.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-68.7	-42	176.6	179.7	63.3	0	0	0	112.7	V95 G96 I97 P103 M138 Y140 L150 V154 V159	V95-L99 PolarHBondContact O-N 2.92Å; G96-L99 PolarHBondContact O-N 3.24Å; I97-L99 VanDerWaalsContact C-N 3.3Å; I97-L99 PolarHBondContact O-N 2.92Å; L99-P103 WeakPolarHBondContact O-CA 3.47Å; L99-P103 WeakPolarHBondContact O-CB 3.44Å; L99-P103 WeakPolarHBondContact O-CD 3.47Å; L99-M138 HydrophobicContact CD2-CB 4.21Å; L99-Y140 HydrophobicContact CD2-CE2 3.81Å; L99-L150 HydrophobicContact CD2-CD1 4.35Å; L99-V154 HydrophobicContact CD1-CG1 4.36Å; L99-V154 HydrophobicContact CD1-CG2 3.96Å; L99-V154 HydrophobicContact CG-CG1 4.18Å; L99-V159 HydrophobicContact CB-CG1 3.99Å; L99-V159 HydrophobicContact CD2-CB 4.45Å; L99-V159 HydrophobicContact CD2-CG1 3.82Å; L99-V159 HydrophobicContact CD2-CG2 3.68Å; L99-V159 HydrophobicContact CG-CG1 3.99Å; L99-V159 HydrophobicContact CG-CG2 4.23Å
100	F	93.3	Very high	92.4	Very high	10 Å²	10	49.8 Å²	49.8	4%	0.044	24%	0.235	C	C	.	.	H	α-helix	trans	-79.5	-29.4	-179.9	78.2	-117	0	0	0	114	Y19 H23 G96 I97 V159 K160	Y19-F100 HydrophobicContact CE1-CE1 4.47Å; H23-F100 HydrophobicContact CB-CE2 4.15Å; H23-F100 HydrophobicContact CB-CZ 3.89Å; G96-F100 WeakPolarHBondContact O-CD1 3.26Å; G96-F100 PolarHBondContact O-N 2.93Å; I97-F100 HydrophobicContact CB-CE1 4.25Å; I97-F100 HydrophobicContact CG1-CE1 3.91Å; I97-F100 HydrophobicContact CG1-CZ 4.19Å; I97-F100 PolarHBondContact O-N 3.15Å; F100-V159 HydrophobicContact CB-CB 4.2Å; F100-V159 HydrophobicContact CB-CG1 3.91Å; F100-V159 HydrophobicContact CD1-CG1 4.3Å; F100-K160 HydrophobicContact CB-CG 3.93Å; F100-K160 HydrophobicContact CD1-CB 4.41Å; F100-K160 HydrophobicContact CD1-CG 3.68Å; F100-K160 HydrophobicContact CD2-CD 4.33Å; F100-K160 HydrophobicContact CD2-CG 3.74Å; F100-K160 HydrophobicContact CE1-CG 4.03Å; F100-K160 HydrophobicContact CE2-CG 4.09Å; F100-K160 HydrophobicContact CG-CG 3.54Å; F100-K160 HydrophobicContact CZ-CG 4.24Å
101	L	92.3	Very high	92.1	Very high	25 Å²	25	49.2 Å²	49.2	13%	0.131	23%	0.229	C	C	.	.	H	α-helix	trans	-78.7	-32.7	175.6	-67.6	-179.9	0	0	0	112.9	E24 V27 I97 P103 W104	E24-L101 HydrophobicContact CB-CD2 4.47Å; E24-L101 HydrophobicContact CG-CD2 3.81Å; V27-L101 HydrophobicContact CG2-CB 4.5Å; V27-L101 HydrophobicContact CG2-CD1 3.93Å; V27-L101 HydrophobicContact CG2-CD2 3.98Å; V27-L101 HydrophobicContact CG2-CG 4.37Å; I97-L101 HydrophobicContact CG2-CD1 3.59Å; I97-L101 HydrophobicContact CG2-CG 4.22Å; I97-L101 WeakPolarHBondContact O-CB 3.44Å; I97-L101 VanDerWaalsContact O-CG 3.3Å; I97-L101 WeakPolarHBondContact O-CG 3.27Å; I97-L101 PolarHBondContact O-N 3.18Å; L101-P103 VanDerWaalsContact C-CD 3.47Å; L101-W104 VanDerWaalsContact O-CH2 3.29Å; L101-W104 WeakPolarHBondContact O-CH2 3.2Å
102	Y	91.8	Very high	91.8	Very high	53 Å²	53	52.6 Å²	52.6	21%	0.208	24%	0.243	C	C	.	.			trans	-133.9	52.5	-174.9	-48.2	-73.3	0	0	0	114.2	V27 N98 W104 K105 F108	V27-Y102 HydrophobicContact CG1-CE1 4.09Å; N98-Y102 PolarHBondContact O-N 2.87Å; Y102-W104 HydrophobicContact CD1-CH2 4.16Å; Y102-W104 AromaticContact CD1-CZ2 3.81Å; Y102-W104 HydrophobicContact CD1-CZ2 3.81Å; Y102-W104 PolarHBondContact O-N 2.88Å; Y102-K105 HydrophobicContact CD1-CD 4.39Å; Y102-K105 VanDerWaalsContact CD1-NZ 3.27Å; Y102-K105 HydrophobicContact CG-CD 3.94Å; Y102-K105 VanDerWaalsContact CG-NZ 3.33Å; Y102-K105 WeakPolarHBondContact O-CB 3.27Å; Y102-K105 PolarHBondContact O-N 3.41Å; Y102-F108 HydrophobicContact CD2-CD2 4.41Å; Y102-F108 AromaticContact CD2-CE2 3.77Å; Y102-F108 HydrophobicContact CD2-CE2 3.77Å; Y102-F108 HydrophobicContact CG-CE2 4.25Å
103	P	89.6	Confident	91.4	Very high	23 Å²	23	52.7 Å²	52.7	15%	0.149	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-6.2	-174.1	24.9	-35.7	0	0	0	115.5	L99 L101 R109 V154 T156	L99-P103 WeakPolarHBondContact O-CA 3.47Å; L99-P103 WeakPolarHBondContact O-CB 3.44Å; L99-P103 WeakPolarHBondContact O-CD 3.47Å; L101-P103 VanDerWaalsContact C-CD 3.47Å; P103-R109 VanDerWaalsContact O-CZ 3.22Å; P103-R109 PolarHBondContact O-NE 3.01Å; P103-R109 PolarHBondContact O-NH2 2.95Å; P103-V154 HydrophobicContact CB-CB 3.99Å; P103-V154 HydrophobicContact CB-CG1 4.2Å; P103-V154 HydrophobicContact CB-CG2 3.68Å; P103-T156 HydrophobicContact CG-CG2 4.45Å
104	W	87.3	Confident	91	Very high	176 Å²	176	59 Å²	59	67%	0.667	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-16.3	173.4	56.5	93.9	0	0	0	114.1	L101 Y102	L101-W104 VanDerWaalsContact O-CH2 3.29Å; L101-W104 WeakPolarHBondContact O-CH2 3.2Å; Y102-W104 HydrophobicContact CD1-CH2 4.16Å; Y102-W104 AromaticContact CD1-CZ2 3.81Å; Y102-W104 HydrophobicContact CD1-CZ2 3.81Å; Y102-W104 PolarHBondContact O-N 2.88Å
105	K	90.7	Very high	90.7	Very high	60 Å²	60	58.6 Å²	58.6	26%	0.261	27%	0.266	S	S	.	.			trans	-75.2	134.6	-176.3	-74.5	-176.2	-171.4	167.6	0	112	Y102 E107 F108 R109	Y102-K105 HydrophobicContact CD1-CD 4.39Å; Y102-K105 VanDerWaalsContact CD1-NZ 3.27Å; Y102-K105 HydrophobicContact CG-CD 3.94Å; Y102-K105 VanDerWaalsContact CG-NZ 3.33Å; Y102-K105 WeakPolarHBondContact O-CB 3.27Å; Y102-K105 PolarHBondContact O-N 3.41Å; K105-E107 HydrophobicContact CB-CG 4.31Å; K105-E107 WeakPolarHBondContact CB-OE2 3.29Å; K105-E107 WeakPolarHBondContact CD-OE1 3.31Å; K105-F108 HydrophobicContact CB-CD2 3.82Å; K105-F108 HydrophobicContact CB-CE2 4.32Å; K105-F108 HydrophobicContact CD-CD2 4.05Å; K105-F108 HydrophobicContact CD-CE2 3.7Å; K105-F108 PolarHBondContact O-N 3.01Å; K105-R109 PolarHBondContact O-N 2.76Å
106	K	87.4	Confident	90.5	Very high	177 Å²	177	60 Å²	60	77%	0.77	29%	0.285	S	S	*	.	H	α-helix	trans	-70.9	-37	-173.6	-69.8	-175.1	177.9	-179.2	0	111.9	F108 R109 S110	K106-F108 PolarHBondContact O-N 2.7Å; K106-R109 PolarHBondContact O-N 2.86Å; K106-S110 PolarHBondContact O-N 3.5Å
107	E	88.1	Confident	90.3	Very high	114 Å²	114	63.6 Å²	63.6	53%	0.533	31%	0.308	S	S	.	.	H	α-helix	trans	-61.5	-23.5	177	61.4	-89.7	-144.8	0	0	113.8	K105	K105-E107 HydrophobicContact CB-CG 4.31Å; K105-E107 WeakPolarHBondContact CB-OE2 3.29Å; K105-E107 WeakPolarHBondContact CD-OE1 3.31Å
108	F	89.6	Confident	90.2	Very high	43 Å²	43	63.3 Å²	63.3	19%	0.189	31%	0.306	C	S	.	.	H	α-helix	trans	-100.8	-17.9	175.7	-53.4	-36.3	0	0	0	113.1	N98 Y102 K105 K106 S110 Y140	N98-F108 HydrophobicContact CB-CD1 3.81Å; N98-F108 HydrophobicContact CB-CD2 3.85Å; N98-F108 HydrophobicContact CB-CE1 3.72Å; N98-F108 HydrophobicContact CB-CE2 3.75Å; N98-F108 HydrophobicContact CB-CG 3.89Å; N98-F108 HydrophobicContact CB-CZ 3.69Å; N98-F108 WeakPolarHBondContact O-CD2 3.41Å; Y102-F108 HydrophobicContact CD2-CD2 4.41Å; Y102-F108 AromaticContact CD2-CE2 3.77Å; Y102-F108 HydrophobicContact CD2-CE2 3.77Å; Y102-F108 HydrophobicContact CG-CE2 4.25Å; K105-F108 HydrophobicContact CB-CD2 3.82Å; K105-F108 HydrophobicContact CB-CE2 4.32Å; K105-F108 HydrophobicContact CD-CD2 4.05Å; K105-F108 HydrophobicContact CD-CE2 3.7Å; K105-F108 PolarHBondContact O-N 3.01Å; K106-F108 PolarHBondContact O-N 2.7Å; F108-S110 VanDerWaalsContact C-N 3.3Å; F108-Y140 VanDerWaalsContact O-CE1 3.27Å; F108-Y140 WeakPolarHBondContact O-CE1 3.17Å; F108-Y140 PolarHBondContact O-OH 3Å
109	R	89.6	Confident	90.1	Very high	86 Å²	86	64.4 Å²	64.4	33%	0.325	31%	0.314	S	S	.	.	H	α-helix	trans	-76.5	-14.5	169.1	-74.3	179.6	170.5	-98.8	-10.2	113.9	P103 K105 K106 K149 L150	P103-R109 VanDerWaalsContact O-CZ 3.22Å; P103-R109 PolarHBondContact O-NE 3.01Å; P103-R109 PolarHBondContact O-NH2 2.95Å; K105-R109 PolarHBondContact O-N 2.76Å; K106-R109 PolarHBondContact O-N 2.86Å; R109-K149 WeakPolarHBondContact O-CA 2.9Å; R109-L150 HydrophobicContact CG-CD2 4.32Å; R109-L150 PolarHBondContact O-N 2.83Å
110	S	88.8	Confident	90.1	Very high	47 Å²	47	72.2 Å²	72.2	33%	0.329	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	89	-176.8	-61.7	0	0	0	0	110.5	K106 F108 Y148 K149	K106-S110 PolarHBondContact O-N 3.5Å; F108-S110 VanDerWaalsContact C-N 3.3Å; S110-Y148 CarbonylContact C-O 3.58Å; S110-Y148 WeakPolarHBondContact CA-O 3.48Å; S110-K149 WeakPolarHBondContact OG-CG 3.32Å
111	I	90.3	Very high	90.2	Very high	16 Å²	16	76.9 Å²	76.9	8%	0.082	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	137.6	-176.4	65.1	178.4	0	0	0	111.2	V95 L135 Y140 Y148	V95-I111 HydrophobicContact CG1-CD1 4.05Å; V95-I111 HydrophobicContact CG1-CG2 4.27Å; I111-L135 HydrophobicContact CD1-CD1 3.98Å; I111-L135 HydrophobicContact CD1-CD2 3.62Å; I111-L135 HydrophobicContact CD1-CG 4.43Å; I111-Y140 HydrophobicContact CD1-CD1 4.4Å; I111-Y140 HydrophobicContact CD1-CD2 4.2Å; I111-Y140 HydrophobicContact CD1-CE1 4.25Å; I111-Y140 HydrophobicContact CD1-CE2 4.03Å; I111-Y140 HydrophobicContact CD1-CG 4.39Å; I111-Y140 HydrophobicContact CG1-CD1 4.41Å; I111-Y140 HydrophobicContact CG1-CE1 4.23Å; I111-Y140 HydrophobicContact CG2-CE1 4Å; I111-Y148 PolarHBondContact N-O 3.13Å; I111-Y148 PolarHBondContact O-N 2.93Å
112	K	90.4	Very high	90.3	Very high	112 Å²	112	75.7 Å²	75.7	49%	0.487	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	101.1	-174.8	-72.2	177.3	167.1	-170.7	0	110.2	Y114 T115	K112-Y114 HydrophobicContact CB-CD1 4.05Å; K112-Y114 HydrophobicContact CB-CE1 3.69Å; K112-Y114 HydrophobicContact CD-CE1 4Å; K112-Y114 WeakPolarHBondContact CD-OH 3.43Å; K112-Y114 VanDerWaalsContact CE-OH 3.32Å; K112-Y114 WeakPolarHBondContact CE-OH 3.34Å; K112-Y114 HydrophobicContact CG-CE1 3.71Å; K112-Y114 PolarHBondContact NZ-OH 2.85Å; K112-Y114 PolarHBondContact O-N 3.03Å; K112-T115 HydrophobicContact CB-CG2 3.87Å; K112-T115 WeakPolarHBondContact O-CB 3.41Å; K112-T115 WeakPolarHBondContact O-CG2 3.49Å; K112-T115 PolarHBondContact O-N 3.01Å; K112-T115 PolarHBondContact O-OG1 3.3Å
113	T	88	Confident	90.4	Very high	2 Å²	2	76.3 Å²	76.3	1%	0.012	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-9.2	-174.5	73.1	0	0	0	0	114	T115 F118 V119 K123 T146 Y148	T113-T115 VanDerWaalsContact C-N 3.32Å; T113-F118 HydrophobicContact CG2-CD1 4.19Å; T113-F118 HydrophobicContact CG2-CE1 3.69Å; T113-F118 HydrophobicContact CG2-CZ 3.87Å; T113-F118 WeakPolarHBondContact O-CD1 3.42Å; T113-V119 WeakPolarHBondContact O-CG2 3.49Å; T113-K123 VanDerWaalsContact CB-CE 3.44Å; T113-K123 VanDerWaalsContact OG1-CE 3.25Å; T113-K123 WeakPolarHBondContact OG1-CE 3.35Å; T113-K123 PolarHBondContact OG1-NZ 3.22Å; T113-T146 PolarHBondContact N-O 2.68Å; T113-T146 PolarHBondContact OG1-O 3.18Å; T113-Y148 HydrophobicContact CG2-CD2 3.49Å; T113-Y148 VanDerWaalsContact CG2-CD2 3.49Å; T113-Y148 HydrophobicContact CG2-CE2 3.87Å
114	Y	87.1	Confident	90.5	Very high	139 Å²	139	76.7 Å²	76.7	55%	0.545	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	6.5	173.2	66.5	-91.5	0	0	0	113.7	K112	K112-Y114 HydrophobicContact CB-CD1 4.05Å; K112-Y114 HydrophobicContact CB-CE1 3.69Å; K112-Y114 HydrophobicContact CD-CE1 4Å; K112-Y114 WeakPolarHBondContact CD-OH 3.43Å; K112-Y114 VanDerWaalsContact CE-OH 3.32Å; K112-Y114 WeakPolarHBondContact CE-OH 3.34Å; K112-Y114 HydrophobicContact CG-CE1 3.71Å; K112-Y114 PolarHBondContact NZ-OH 2.85Å; K112-Y114 PolarHBondContact O-N 3.03Å
115	T	88.2	Confident	90.9	Very high	63 Å²	63	68.4 Å²	68.4	39%	0.387	33%	0.333	S	S	.	.	S	Bend	trans	-73.4	138	173.8	50.6	0	0	0	0	110.8	K112 T113 F118 V119	K112-T115 HydrophobicContact CB-CG2 3.87Å; K112-T115 WeakPolarHBondContact O-CB 3.41Å; K112-T115 WeakPolarHBondContact O-CG2 3.49Å; K112-T115 PolarHBondContact O-N 3.01Å; K112-T115 PolarHBondContact O-OG1 3.3Å; T113-T115 VanDerWaalsContact C-N 3.32Å; T115-F118 PolarHBondContact O-N 3.12Å; T115-F118 WeakPolarHBondContact OG1-CB 3.48Å; T115-V119 PolarHBondContact O-N 2.97Å
116	G	89.9	Confident	91.2	Very high	52 Å²	52	65.7 Å²	65.7	54%	0.536	32%	0.321	S	S	.	.	H	α-helix	trans	-46.6	-48.9	-174.7	0	0	0	0	0	115	V119 Y120	G116-V119 PolarHBondContact O-N 3.5Å; G116-Y120 VanDerWaalsContact O-CB 3.25Å; G116-Y120 WeakPolarHBondContact O-CB 3.18Å; G116-Y120 PolarHBondContact O-N 2.79Å
117	P	91.4	Very high	91.5	Very high	77 Å²	77	58.7 Å²	58.7	50%	0.5	29%	0.292	S	S	.	.	H	α-helix	trans	-63	-40.5	176.3	-23.6	34.8	0	0	0	113.7	M91 Y120 Y121	M91-P117 HydrophobicContact CE-CB 3.73Å; M91-P117 HydrophobicContact SD-CB 4.34Å; P117-Y120 PolarHBondContact O-N 2.99Å; P117-Y121 WeakPolarHBondContact O-CB 3.37Å; P117-Y121 WeakPolarHBondContact O-CD2 3.25Å; P117-Y121 PolarHBondContact O-N 2.74Å
118	F	92.7	Very high	91.7	Very high	10 Å²	10	55.7 Å²	55.7	4%	0.044	28%	0.278	C	S	.	.	H	α-helix	trans	-67.7	-40.1	179	-165.1	-77.5	0	0	0	111.6	M91 L92 T113 T115 V122 K123 I131 L135	M91-F118 HydrophobicContact SD-CB 4.41Å; L92-F118 HydrophobicContact CD2-CE2 4.25Å; L92-F118 HydrophobicContact CD2-CZ 4.49Å; T113-F118 HydrophobicContact CG2-CD1 4.19Å; T113-F118 HydrophobicContact CG2-CE1 3.69Å; T113-F118 HydrophobicContact CG2-CZ 3.87Å; T113-F118 WeakPolarHBondContact O-CD1 3.42Å; T115-F118 PolarHBondContact O-N 3.12Å; T115-F118 WeakPolarHBondContact OG1-CB 3.48Å; F118-V122 HydrophobicContact CD1-CB 4.02Å; F118-V122 HydrophobicContact CD1-CG2 4.39Å; F118-V122 HydrophobicContact CD2-CB 4.49Å; F118-V122 HydrophobicContact CD2-CG2 4.04Å; F118-V122 HydrophobicContact CE1-CB 3.9Å; F118-V122 HydrophobicContact CE1-CG1 3.98Å; F118-V122 HydrophobicContact CE1-CG2 4.45Å; F118-V122 HydrophobicContact CE2-CB 4.4Å; F118-V122 HydrophobicContact CE2-CG1 4.43Å; F118-V122 HydrophobicContact CE2-CG2 4.12Å; F118-V122 HydrophobicContact CG-CB 4.31Å; F118-V122 HydrophobicContact CG-CG2 4.18Å; F118-V122 HydrophobicContact CZ-CB 4.11Å; F118-V122 HydrophobicContact CZ-CG1 3.89Å; F118-V122 HydrophobicContact CZ-CG2 4.32Å; F118-V122 WeakPolarHBondContact O-CA 3.25Å; F118-V122 VanDerWaalsContact O-CB 3.23Å; F118-V122 WeakPolarHBondContact O-CB 3.35Å; F118-V122 PolarHBondContact O-N 3.28Å; F118-K123 HydrophobicContact CD1-CG 4.08Å; F118-K123 HydrophobicContact CE1-CG 4.08Å; F118-K123 PolarHBondContact O-N 2.67Å; F118-K123 VanDerWaalsContact O-N 3.1Å; F118-I131 HydrophobicContact CE1-CG2 4.36Å; F118-I131 HydrophobicContact CZ-CG2 4.07Å; F118-L135 HydrophobicContact CZ-CD1 4.37Å
119	V	92.9	Very high	91.9	Very high	67 Å²	67	58.9 Å²	58.9	41%	0.406	29%	0.294	S	S	.	.	I	π-helix	trans	-64.7	-45.9	174.1	178.9	0	0	0	0	110.7	T113 T115 G116 S124	T113-V119 WeakPolarHBondContact O-CG2 3.49Å; T115-V119 PolarHBondContact O-N 2.97Å; G116-V119 PolarHBondContact O-N 3.5Å; V119-S124 PolarHBondContact O-N 2.8Å
120	Y	93.6	Very high	92.1	Very high	164 Å²	164	56 Å²	56	64%	0.643	28%	0.284	S	S	*	.	I	π-helix	trans	-73.4	-33.8	-174.7	-179.7	-99.1	0	0	0	114.6	G116 P117 S124	G116-Y120 VanDerWaalsContact O-CB 3.25Å; G116-Y120 WeakPolarHBondContact O-CB 3.18Å; G116-Y120 PolarHBondContact O-N 2.79Å; P117-Y120 PolarHBondContact O-N 2.99Å; Y120-S124 VanDerWaalsContact C-OG 3.32Å; Y120-S124 WeakPolarHBondContact O-CB 3.39Å; Y120-S124 PolarHBondContact O-OG 3.31Å
121	Y	94.1	Very high	92.4	Very high	108 Å²	108	53.8 Å²	53.8	42%	0.424	27%	0.269	S	S	.	.	I	π-helix	trans	-102	-33	-179.6	-72.7	-75.5	0	0	0	114.2	A88 M91 P117 T125	A88-Y121 VanDerWaalsContact CB-O 3.26Å; A88-Y121 WeakPolarHBondContact CB-O 3.39Å; M91-Y121 HydrophobicContact CE-CD2 3.45Å; M91-Y121 VanDerWaalsContact CE-CD2 3.45Å; M91-Y121 HydrophobicContact CE-CE2 4.3Å; M91-Y121 HydrophobicContact CE-CG 3.94Å; P117-Y121 WeakPolarHBondContact O-CB 3.37Å; P117-Y121 WeakPolarHBondContact O-CD2 3.25Å; P117-Y121 PolarHBondContact O-N 2.74Å; Y121-T125 WeakPolarHBondContact O-CB 3.44Å; Y121-T125 PolarHBondContact O-OG1 3.31Å
122	V	94.9	Very high	92.5	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.285	C	S	.	.	I	π-helix	trans	-100.2	-58.9	-174	-167	0	0	0	0	110.8	M91 L92 F118 S124 T125 L126 I131	M91-V122 HydrophobicContact CB-CG2 4.05Å; M91-V122 HydrophobicContact CG-CG2 3.95Å; M91-V122 HydrophobicContact SD-CG2 3.77Å; L92-V122 HydrophobicContact CD1-CG1 4.2Å; L92-V122 HydrophobicContact CD2-CG1 4.21Å; L92-V122 HydrophobicContact CG-CG1 4.29Å; F118-V122 HydrophobicContact CD1-CB 4.02Å; F118-V122 HydrophobicContact CD1-CG2 4.39Å; F118-V122 HydrophobicContact CD2-CB 4.49Å; F118-V122 HydrophobicContact CD2-CG2 4.04Å; F118-V122 HydrophobicContact CE1-CB 3.9Å; F118-V122 HydrophobicContact CE1-CG1 3.98Å; F118-V122 HydrophobicContact CE1-CG2 4.45Å; F118-V122 HydrophobicContact CE2-CB 4.4Å; F118-V122 HydrophobicContact CE2-CG1 4.43Å; F118-V122 HydrophobicContact CE2-CG2 4.12Å; F118-V122 HydrophobicContact CG-CB 4.31Å; F118-V122 HydrophobicContact CG-CG2 4.18Å; F118-V122 HydrophobicContact CZ-CB 4.11Å; F118-V122 HydrophobicContact CZ-CG1 3.89Å; F118-V122 HydrophobicContact CZ-CG2 4.32Å; F118-V122 WeakPolarHBondContact O-CA 3.25Å; F118-V122 VanDerWaalsContact O-CB 3.23Å; F118-V122 WeakPolarHBondContact O-CB 3.35Å; F118-V122 PolarHBondContact O-N 3.28Å; V122-S124 PolarHBondContact O-N 2.99Å; V122-T125 PolarHBondContact O-N 2.81Å; V122-T125 VanDerWaalsContact O-N 3.09Å; V122-L126 HydrophobicContact CG1-CD1 4.2Å; V122-L126 PolarHBondContact O-N 2.68Å; V122-I131 HydrophobicContact CG1-CD1 3.78Å; V122-I131 HydrophobicContact CG1-CG1 3.77Å
123	K	93.1	Very high	92.7	Very high	66 Å²	66	55.6 Å²	55.6	29%	0.287	28%	0.283	S	S	.	.	I	π-helix	trans	-70.5	-15.9	-176.9	-59.3	-151.7	-178.9	-141.6	0	114.9	T113 F118 T125 E128 I131	T113-K123 VanDerWaalsContact CB-CE 3.44Å; T113-K123 VanDerWaalsContact OG1-CE 3.25Å; T113-K123 WeakPolarHBondContact OG1-CE 3.35Å; T113-K123 PolarHBondContact OG1-NZ 3.22Å; F118-K123 HydrophobicContact CD1-CG 4.08Å; F118-K123 HydrophobicContact CE1-CG 4.08Å; F118-K123 PolarHBondContact O-N 2.67Å; F118-K123 VanDerWaalsContact O-N 3.1Å; K123-T125 VanDerWaalsContact C-N 3.27Å; K123-E128 IonicContact NZ-OE1 2.68Å; K123-E128 IonicContact NZ-OE2 2.67Å; K123-E128 PolarHBondContact NZ-OE2 2.98Å; K123-I131 HydrophobicContact CG-CD1 4.2Å
124	S	93.6	Very high	93.1	Very high	31 Å²	31	55.8 Å²	55.8	22%	0.217	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-12.5	172.4	60.9	0	0	0	0	114.1	S79 V119 Y120 V122	S79-S124 PolarHBondContact OG-O 3.44Å; V119-S124 PolarHBondContact O-N 2.8Å; Y120-S124 VanDerWaalsContact C-OG 3.32Å; Y120-S124 WeakPolarHBondContact O-CB 3.39Å; Y120-S124 PolarHBondContact O-OG 3.31Å; V122-S124 PolarHBondContact O-N 2.99Å
125	T	95.6	Very high	93.4	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.012	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-138.3	-30.9	-157	-60.3	0	0	0	0	113.1	S73 L77 A84 L85 A88 Y121 V122 K123	S73-T125 VanDerWaalsContact CB-O 3.31Å; S73-T125 WeakPolarHBondContact CB-O 3.33Å; S73-T125 PolarHBondContact OG-O 3.42Å; L77-T125 WeakPolarHBondContact CD1-O 3.3Å; A84-T125 HydrophobicContact CB-CG2 3.86Å; L85-T125 HydrophobicContact CB-CG2 4.4Å; L85-T125 HydrophobicContact CD2-CG2 3.97Å; L85-T125 HydrophobicContact CG-CG2 3.88Å; A88-T125 HydrophobicContact CB-CG2 3.81Å; Y121-T125 WeakPolarHBondContact O-CB 3.44Å; Y121-T125 PolarHBondContact O-OG1 3.31Å; V122-T125 PolarHBondContact O-N 2.81Å; V122-T125 VanDerWaalsContact O-N 3.09Å; K123-T125 VanDerWaalsContact C-N 3.27Å
126	L	95.4	Very high	93.6	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.016	27%	0.265	C	S	.	.	S	Bend	trans	-117.8	147.6	177.5	-63.3	179.8	0	0	0	110.2	V69 L85 A88 F89 L92 V122 I131 I134	V69-L126 HydrophobicContact CG1-CD2 3.54Å; L85-L126 HydrophobicContact CD2-CD2 3.57Å; A88-L126 HydrophobicContact CB-CD1 3.96Å; A88-L126 HydrophobicContact CB-CG 4.01Å; F89-L126 HydrophobicContact CE1-CD1 4.44Å; F89-L126 HydrophobicContact CE1-CD2 4.41Å; F89-L126 HydrophobicContact CZ-CD2 4.46Å; L92-L126 HydrophobicContact CD1-CD1 3.59Å; V122-L126 HydrophobicContact CG1-CD1 4.2Å; V122-L126 PolarHBondContact O-N 2.68Å; L126-I131 HydrophobicContact CB-CD1 4.07Å; L126-I131 HydrophobicContact CB-CG1 3.69Å; L126-I131 HydrophobicContact CD1-CG1 4.49Å; L126-I134 HydrophobicContact CD1-CD1 4.47Å
127	L	94.4	Very high	93.7	Very high	31 Å²	31	49.6 Å²	49.6	16%	0.162	26%	0.255	C	S	.	.			trans	-73.2	152.1	176	-57.1	173.2	0	0	0	110	L77 E129 D130 I131	L77-L127 HydrophobicContact CD1-CD2 4.05Å; L77-L127 HydrophobicContact CD2-CD2 4.33Å; L77-L127 HydrophobicContact CG-CD2 4.08Å; L127-E129 HydrophobicContact CB-CG 4.03Å; L127-E129 PolarHBondContact O-N 2.78Å; L127-D130 PolarHBondContact O-N 2.95Å; L127-I131 VanDerWaalsContact O-CG1 3.3Å; L127-I131 WeakPolarHBondContact O-CG1 3.17Å; L127-I131 PolarHBondContact O-N 2.8Å
128	E	92.2	Very high	93.7	Very high	51 Å²	51	46.2 Å²	46.2	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-24.8	-173.7	-177	67.9	-135.9	0	0	111.9	K123 R132 Y148	K123-E128 IonicContact NZ-OE1 2.68Å; K123-E128 IonicContact NZ-OE2 2.67Å; K123-E128 PolarHBondContact NZ-OE2 2.98Å; E128-R132 WeakPolarHBondContact O-CB 3.46Å; E128-R132 PolarHBondContact O-N 3.42Å; E128-Y148 PolarHBondContact OE1-OH 2.96Å
129	E	93.6	Very high	93.7	Very high	110 Å²	110	47.6 Å²	47.6	51%	0.514	25%	0.25	S	C	.	.	H	α-helix	trans	-65.6	-43.3	167.5	55	-91	-135.3	0	0	113.1	L127 R132 A133	L127-E129 HydrophobicContact CB-CG 4.03Å; L127-E129 PolarHBondContact O-N 2.78Å; E129-R132 PolarHBondContact O-N 2.89Å; E129-A133 WeakPolarHBondContact O-CB 3.43Å; E129-A133 PolarHBondContact O-N 2.89Å
130	D	94.5	Very high	93.7	Very high	25 Å²	25	44.5 Å²	44.5	13%	0.134	23%	0.231	C	C	.	.	H	α-helix	trans	-68.4	-44.5	178.1	-60.6	-34.2	0	0	0	110.8	V69 L127 R132 A133 I134	V69-D130 HydrophobicContact CG1-CB 4.14Å; V69-D130 HydrophobicContact CG2-CB 4.15Å; L127-D130 PolarHBondContact O-N 2.95Å; D130-R132 VanDerWaalsContact C-N 3.29Å; D130-R132 PolarHBondContact O-N 3.28Å; D130-A133 PolarHBondContact O-N 3.24Å; D130-I134 WeakPolarHBondContact O-CG1 3.31Å; D130-I134 PolarHBondContact O-N 3.37Å
131	I	94.3	Very high	93.6	Very high	1 Å²	1	38 Å²	38	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-55.9	-47.1	173.1	-66.9	169.6	0	0	0	109.6	F118 V122 K123 L126 L127 L135	F118-I131 HydrophobicContact CE1-CG2 4.36Å; F118-I131 HydrophobicContact CZ-CG2 4.07Å; V122-I131 HydrophobicContact CG1-CD1 3.78Å; V122-I131 HydrophobicContact CG1-CG1 3.77Å; K123-I131 HydrophobicContact CG-CD1 4.2Å; L126-I131 HydrophobicContact CB-CD1 4.07Å; L126-I131 HydrophobicContact CB-CG1 3.69Å; L126-I131 HydrophobicContact CD1-CG1 4.49Å; L127-I131 VanDerWaalsContact O-CG1 3.3Å; L127-I131 WeakPolarHBondContact O-CG1 3.17Å; L127-I131 PolarHBondContact O-N 2.8Å; I131-L135 HydrophobicContact CG2-CD1 3.72Å; I131-L135 HydrophobicContact CG2-CG 4.45Å; I131-L135 VanDerWaalsContact O-CB 3.29Å; I131-L135 WeakPolarHBondContact O-CB 3.41Å; I131-L135 WeakPolarHBondContact O-CG 3.38Å; I131-L135 PolarHBondContact O-N 3.38Å
132	R	93.6	Very high	93.4	Very high	112 Å²	112	35.9 Å²	35.9	42%	0.423	21%	0.211	S	C	.	.	H	α-helix	trans	-64.5	-41.7	178.5	-169.4	-177.7	-53.2	133.8	12.8	112.4	E128 E129 D130 S136 P142 Y148	E128-R132 WeakPolarHBondContact O-CB 3.46Å; E128-R132 PolarHBondContact O-N 3.42Å; E129-R132 PolarHBondContact O-N 2.89Å; D130-R132 VanDerWaalsContact C-N 3.29Å; D130-R132 PolarHBondContact O-N 3.28Å; R132-S136 WeakPolarHBondContact O-CB 3.19Å; R132-S136 PolarHBondContact O-N 2.77Å; R132-P142 HydrophobicContact CG-CG 4.37Å; R132-Y148 HydrophobicContact CB-CE1 4.31Å; R132-Y148 WeakPolarHBondContact CB-OH 3.34Å; R132-Y148 HydrophobicContact CG-CE1 4.1Å
133	A	94.4	Very high	92.9	Very high	54 Å²	54	39.3 Å²	39.3	45%	0.446	23%	0.226	S	C	.	.	H	α-helix	trans	-62.5	-52.4	177.9	0	0	0	0	0	111.2	E129 D130 L135 S136 C137	E129-A133 WeakPolarHBondContact O-CB 3.43Å; E129-A133 PolarHBondContact O-N 2.89Å; D130-A133 PolarHBondContact O-N 3.24Å; A133-L135 PolarHBondContact O-N 2.59Å; A133-S136 WeakPolarHBondContact O-CB 3.25Å; A133-S136 PolarHBondContact O-N 3.37Å; A133-C137 PolarHBondContact O-N 3.03Å; A133-C137 PolarHBondContact O-SG 3.19Å
134	I	94.9	Very high	92.2	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-44	-179.7	-65.5	165.6	0	0	0	111.2	I64 F89 L92 L126 D130 C137 M138 V162 L166	I64-I134 HydrophobicContact CG1-CG1 4.49Å; F89-I134 HydrophobicContact CE1-CD1 4.46Å; L92-I134 HydrophobicContact CD1-CD1 4.09Å; L92-I134 HydrophobicContact CD1-CG2 4.21Å; L126-I134 HydrophobicContact CD1-CD1 4.47Å; D130-I134 WeakPolarHBondContact O-CG1 3.31Å; D130-I134 PolarHBondContact O-N 3.37Å; I134-C137 PolarHBondContact O-N 3.43Å; I134-M138 HydrophobicContact CG2-CE 4.36Å; I134-V162 HydrophobicContact CG2-CG1 4.47Å; I134-L166 HydrophobicContact CG2-CD1 3.99Å; I134-L166 HydrophobicContact CG2-CD2 4.03Å; I134-L166 HydrophobicContact CG2-CG 4.46Å
135	L	93.6	Very high	91.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68.9	-34.2	177.7	-68.7	176.2	0	0	0	112.3	L92 V95 I111 F118 I131 A133 C137 M138 G139 Y140 Y148	L92-L135 HydrophobicContact CD2-CD2 4.13Å; V95-L135 HydrophobicContact CG1-CD2 4.45Å; I111-L135 HydrophobicContact CD1-CD1 3.98Å; I111-L135 HydrophobicContact CD1-CD2 3.62Å; I111-L135 HydrophobicContact CD1-CG 4.43Å; F118-L135 HydrophobicContact CZ-CD1 4.37Å; I131-L135 HydrophobicContact CG2-CD1 3.72Å; I131-L135 HydrophobicContact CG2-CG 4.45Å; I131-L135 VanDerWaalsContact O-CB 3.29Å; I131-L135 WeakPolarHBondContact O-CB 3.41Å; I131-L135 WeakPolarHBondContact O-CG 3.38Å; I131-L135 PolarHBondContact O-N 3.38Å; A133-L135 PolarHBondContact O-N 2.59Å; L135-C137 VanDerWaalsContact C-N 3.32Å; L135-C137 PolarHBondContact O-N 3.03Å; L135-M138 HydrophobicContact CD2-SD 4.47Å; L135-M138 WeakPolarHBondContact O-CB 3.28Å; L135-M138 PolarHBondContact O-N 3.11Å; L135-M138 VanDerWaalsContact O-N 3.07Å; L135-G139 PolarHBondContact O-N 2.8Å; L135-Y140 HydrophobicContact CB-CD2 4.27Å; L135-Y140 HydrophobicContact CD2-CD2 3.91Å; L135-Y140 HydrophobicContact CD2-CE2 4.24Å; L135-Y140 WeakPolarHBondContact O-CB 3.32Å; L135-Y140 PolarHBondContact O-N 3.27Å; L135-Y140 VanDerWaalsContact O-N 3.09Å; L135-Y148 HydrophobicContact CB-CD1 3.98Å; L135-Y148 HydrophobicContact CB-CE1 4.15Å; L135-Y148 HydrophobicContact CD1-CD1 3.72Å; L135-Y148 HydrophobicContact CD1-CD2 4.07Å; L135-Y148 HydrophobicContact CD1-CE1 3.88Å; L135-Y148 HydrophobicContact CD1-CE2 4.2Å; L135-Y148 HydrophobicContact CD1-CG 3.82Å
136	S	93	Very high	90.1	Very high	77 Å²	77	48.3 Å²	48.3	54%	0.538	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-35.7	173.5	-170.1	0	0	0	0	112.1	R132 A133 M138 G139 Y140	R132-S136 WeakPolarHBondContact O-CB 3.19Å; R132-S136 PolarHBondContact O-N 2.77Å; A133-S136 WeakPolarHBondContact O-CB 3.25Å; A133-S136 PolarHBondContact O-N 3.37Å; S136-M138 PolarHBondContact O-N 3.22Å; S136-G139 PolarHBondContact O-N 2.86Å; S136-Y140 WeakPolarHBondContact CA-O 3.49Å
137	C	92.2	Very high	89.7	Confident	48 Å²	48	48.9 Å²	48.9	32%	0.324	30%	0.295	S	S	.	.	H	α-helix	trans	-65.2	-20.2	173.7	-61.9	0	0	0	0	113.1	A133 I134 L135 V162	A133-C137 PolarHBondContact O-N 3.03Å; A133-C137 PolarHBondContact O-SG 3.19Å; I134-C137 PolarHBondContact O-N 3.43Å; L135-C137 VanDerWaalsContact C-N 3.32Å; L135-C137 PolarHBondContact O-N 3.03Å; C137-V162 HydrophobicContact CB-CG1 4.3Å; C137-V162 HydrophobicContact CB-CG2 3.56Å
138	M	92.1	Very high	89.5	Confident	5 Å²	5	47.5 Å²	47.5	3%	0.025	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	1.7	171.3	-57.6	-177.3	-174.4	0	0	113.7	V95 L99 I134 L135 S136 Y140 V159 V162 L166	V95-M138 HydrophobicContact CG1-SD 4.37Å; L99-M138 HydrophobicContact CD2-CB 4.21Å; I134-M138 HydrophobicContact CG2-CE 4.36Å; L135-M138 HydrophobicContact CD2-SD 4.47Å; L135-M138 WeakPolarHBondContact O-CB 3.28Å; L135-M138 PolarHBondContact O-N 3.11Å; L135-M138 VanDerWaalsContact O-N 3.07Å; S136-M138 PolarHBondContact O-N 3.22Å; M138-Y140 HydrophobicContact CB-CD2 3.8Å; M138-Y140 HydrophobicContact CB-CE2 4Å; M138-Y140 HydrophobicContact SD-CD2 4.44Å; M138-Y140 HydrophobicContact SD-CE2 4.06Å; M138-V159 HydrophobicContact CB-CG2 4.4Å; M138-V162 HydrophobicContact CE-CG1 3.71Å; M138-V162 HydrophobicContact CG-CB 4.25Å; M138-V162 HydrophobicContact CG-CG1 3.89Å; M138-L166 HydrophobicContact CE-CD1 3.32Å
139	G	91.7	Very high	89.5	Confident	39 Å²	39	48.9 Å²	48.9	40%	0.402	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.8	9.1	-176.8	0	0	0	0	0	115.2	L135 S136	L135-G139 PolarHBondContact O-N 2.8Å; S136-G139 PolarHBondContact O-N 2.86Å
140	Y	93.1	Very high	89.3	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.008	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	136.1	170.9	-63.7	-74.9	0	0	0	111.3	V95 L99 F108 I111 L135 S136 M138 K149 L150	V95-Y140 HydrophobicContact CG1-CE2 3.89Å; L99-Y140 HydrophobicContact CD2-CE2 3.81Å; F108-Y140 VanDerWaalsContact O-CE1 3.27Å; F108-Y140 WeakPolarHBondContact O-CE1 3.17Å; F108-Y140 PolarHBondContact O-OH 3Å; I111-Y140 HydrophobicContact CD1-CD1 4.4Å; I111-Y140 HydrophobicContact CD1-CD2 4.2Å; I111-Y140 HydrophobicContact CD1-CE1 4.25Å; I111-Y140 HydrophobicContact CD1-CE2 4.03Å; I111-Y140 HydrophobicContact CD1-CG 4.39Å; I111-Y140 HydrophobicContact CG1-CD1 4.41Å; I111-Y140 HydrophobicContact CG1-CE1 4.23Å; I111-Y140 HydrophobicContact CG2-CE1 4Å; L135-Y140 HydrophobicContact CB-CD2 4.27Å; L135-Y140 HydrophobicContact CD2-CD2 3.91Å; L135-Y140 HydrophobicContact CD2-CE2 4.24Å; L135-Y140 WeakPolarHBondContact O-CB 3.32Å; L135-Y140 PolarHBondContact O-N 3.27Å; L135-Y140 VanDerWaalsContact O-N 3.09Å; S136-Y140 WeakPolarHBondContact CA-O 3.49Å; M138-Y140 HydrophobicContact CB-CD2 3.8Å; M138-Y140 HydrophobicContact CB-CE2 4Å; M138-Y140 HydrophobicContact SD-CD2 4.44Å; M138-Y140 HydrophobicContact SD-CE2 4.06Å; Y140-K149 WeakPolarHBondContact CA-O 3.33Å; Y140-L150 HydrophobicContact CD1-CB 4.35Å
141	A	90.4	Very high	88.4	Confident	28 Å²	28	52.2 Å²	52.2	23%	0.231	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	148.3	164.8	0	0	0	0	0	111.1	Y148 K149 R151	A141-Y148 CarbonylContact O-C 3.54Å; A141-Y148 VanDerWaalsContact O-CA 3.31Å; A141-Y148 WeakPolarHBondContact O-CA 3.38Å; A141-K149 PolarHBondContact N-O 3.37Å; A141-K149 PolarHBondContact O-N 2.95Å; A141-R151 HydrophobicContact CB-CG 3.73Å
142	P	90.3	Very high	87.6	Confident	64 Å²	64	58.7 Å²	58.7	42%	0.416	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	136	173	27.5	-34	0	0	0	110.8	R132 Y148	R132-P142 HydrophobicContact CG-CG 4.37Å; P142-Y148 HydrophobicContact CB-CD1 4.18Å; P142-Y148 HydrophobicContact CB-CE1 3.8Å; P142-Y148 HydrophobicContact CB-CE2 4.31Å; P142-Y148 HydrophobicContact CG-CE1 4.31Å
143	E	85.1	Confident	86.9	Confident	71 Å²	71	60.9 Å²	60.9	33%	0.332	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	123	173.5	-177.1	-173.9	-121.7	0	0	108.6	G145 T146 A147 K149	E143-G145 PolarHBondContact O-N 2.86Å; E143-T146 PolarHBondContact O-N 3.34Å; E143-A147 HydrophobicContact CB-CB 4.49Å; E143-A147 PolarHBondContact N-O 2.99Å; E143-A147 PolarHBondContact O-N 3.46Å; E143-A147 VanDerWaalsContact O-N 3.14Å; E143-A147 VanDerWaalsContact O-O 3.12Å; E143-K149 WeakPolarHBondContact OE1-CD 3.35Å; E143-K149 WeakPolarHBondContact OE1-CE 3.44Å; E143-K149 IonicContact OE1-NZ 2.78Å; E143-K149 PolarHBondContact OE1-NZ 3.42Å; E143-K149 VanDerWaalsContact OE2-CD 3.31Å; E143-K149 WeakPolarHBondContact OE2-CD 3.41Å; E143-K149 WeakPolarHBondContact OE2-CE 3.35Å; E143-K149 IonicContact OE2-NZ 2.6Å; E143-K149 PolarHBondContact OE2-NZ 3.25Å
144	L	79.3	Confident	86.2	Confident	159 Å²	159	59.4 Å²	59.4	83%	0.832	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	32.7	179.7	-57.4	173.7	0	0	0	113.6	T146	L144-T146 PolarHBondContact O-N 2.66Å; L144-T146 PolarHBondContact O-OG1 3.31Å
145	G	70.1	Confident	85.9	Confident	53 Å²	53	65.6 Å²	65.6	55%	0.546	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	0.9	177.7	0	0	0	0	0	116.8	E143	E143-G145 PolarHBondContact O-N 2.86Å
146	T	74.5	Confident	85.6	Confident	76 Å²	76	68.5 Å²	68.5	47%	0.466	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.2	-26.9	-165.6	51	0	0	0	0	113.8	T113 E143 L144	T113-T146 PolarHBondContact N-O 2.68Å; T113-T146 PolarHBondContact OG1-O 3.18Å; E143-T146 PolarHBondContact O-N 3.34Å; L144-T146 PolarHBondContact O-N 2.66Å; L144-T146 PolarHBondContact O-OG1 3.31Å
147	A	86.1	Confident	85.6	Confident	16 Å²	16	69.9 Å²	69.9	13%	0.132	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	160.5	167.4	0	0	0	0	0	110.2	E143	E143-A147 HydrophobicContact CB-CB 4.49Å; E143-A147 PolarHBondContact N-O 2.99Å; E143-A147 PolarHBondContact O-N 3.46Å; E143-A147 VanDerWaalsContact O-N 3.14Å; E143-A147 VanDerWaalsContact O-O 3.12Å
148	Y	91.2	Very high	85.6	Confident	1 Å²	1	71 Å²	71	0%	0.004	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	127.6	167.9	-82.4	-108.9	0	0	0	108.1	S110 I111 T113 E128 R132 L135 A141 P142	S110-Y148 CarbonylContact C-O 3.58Å; S110-Y148 WeakPolarHBondContact CA-O 3.48Å; I111-Y148 PolarHBondContact N-O 3.13Å; I111-Y148 PolarHBondContact O-N 2.93Å; T113-Y148 HydrophobicContact CG2-CD2 3.49Å; T113-Y148 VanDerWaalsContact CG2-CD2 3.49Å; T113-Y148 HydrophobicContact CG2-CE2 3.87Å; E128-Y148 PolarHBondContact OE1-OH 2.96Å; R132-Y148 HydrophobicContact CB-CE1 4.31Å; R132-Y148 WeakPolarHBondContact CB-OH 3.34Å; R132-Y148 HydrophobicContact CG-CE1 4.1Å; L135-Y148 HydrophobicContact CB-CD1 3.98Å; L135-Y148 HydrophobicContact CB-CE1 4.15Å; L135-Y148 HydrophobicContact CD1-CD1 3.72Å; L135-Y148 HydrophobicContact CD1-CD2 4.07Å; L135-Y148 HydrophobicContact CD1-CE1 3.88Å; L135-Y148 HydrophobicContact CD1-CE2 4.2Å; L135-Y148 HydrophobicContact CD1-CG 3.82Å; A141-Y148 CarbonylContact O-C 3.54Å; A141-Y148 VanDerWaalsContact O-CA 3.31Å; A141-Y148 WeakPolarHBondContact O-CA 3.38Å; P142-Y148 HydrophobicContact CB-CD1 4.18Å; P142-Y148 HydrophobicContact CB-CE1 3.8Å; P142-Y148 HydrophobicContact CB-CE2 4.31Å; P142-Y148 HydrophobicContact CG-CE1 4.31Å
149	K	91	Very high	85.7	Confident	80 Å²	80	70.9 Å²	70.9	35%	0.348	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	138.8	-177.4	-75.5	-163.9	178	146.7	0	111.6	R109 S110 Y140 A141 E143 R151	R109-K149 WeakPolarHBondContact O-CA 2.9Å; S110-K149 WeakPolarHBondContact OG-CG 3.32Å; Y140-K149 WeakPolarHBondContact CA-O 3.33Å; A141-K149 PolarHBondContact N-O 3.37Å; A141-K149 PolarHBondContact O-N 2.95Å; E143-K149 WeakPolarHBondContact OE1-CD 3.35Å; E143-K149 WeakPolarHBondContact OE1-CE 3.44Å; E143-K149 IonicContact OE1-NZ 2.78Å; E143-K149 PolarHBondContact OE1-NZ 3.42Å; E143-K149 VanDerWaalsContact OE2-CD 3.31Å; E143-K149 WeakPolarHBondContact OE2-CD 3.41Å; E143-K149 WeakPolarHBondContact OE2-CE 3.35Å; E143-K149 IonicContact OE2-NZ 2.6Å; E143-K149 PolarHBondContact OE2-NZ 3.25Å; K149-R151 PolarHBondContact O-N 3.27Å
150	L	90.6	Very high	85.9	Confident	21 Å²	21	70.5 Å²	70.5	11%	0.11	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	118.2	168.9	-174	93	0	0	0	108.6	L99 R109 Y140 E152 V154	L99-L150 HydrophobicContact CD2-CD1 4.35Å; R109-L150 HydrophobicContact CG-CD2 4.32Å; R109-L150 PolarHBondContact O-N 2.83Å; Y140-L150 HydrophobicContact CD1-CB 4.35Å; L150-E152 WeakPolarHBondContact CD2-O 3.32Å; L150-V154 HydrophobicContact CD1-CG2 4.06Å; L150-V154 HydrophobicContact CD2-CG2 3.33Å; L150-V154 HydrophobicContact CG-CG2 4.34Å
151	R	76.1	Confident	86	Confident	185 Å²	185	73.6 Å²	73.6	70%	0.698	39%	0.385	S	S	*	.			trans	-79.5	-31.8	-176.9	-61.6	-175.6	81.9	-123.9	13.5	113.6	A141 K149	A141-R151 HydrophobicContact CB-CG 3.73Å; K149-R151 PolarHBondContact O-N 3.27Å
152	E	76.8	Confident	86.3	Confident	137 Å²	137	72.2 Å²	72.2	64%	0.64	37%	0.374	S	S	*	.	S	Bend	trans	-129.8	-164.5	-161.7	-74.1	164.4	-139.1	0	0	111.2	L150	L150-E152 WeakPolarHBondContact CD2-O 3.32Å
153	L	78.4	Confident	86.6	Confident	158 Å²	158	69.2 Å²	69.2	83%	0.827	35%	0.354	S	S	*	.			trans	-69.4	145.2	170.8	-76.8	156.9	0	0	0	109.9	E155	L153-E155 PolarHBondContact O-N 2.74Å
154	V	80.3	Confident	87.1	Confident	23 Å²	23	66.1 Å²	66.1	14%	0.139	34%	0.34	C	S	.	.			trans	-73.5	110.7	179.3	-176.7	0	0	0	0	109.3	L99 P103 L150 T156 V159	L99-V154 HydrophobicContact CD1-CG1 4.36Å; L99-V154 HydrophobicContact CD1-CG2 3.96Å; L99-V154 HydrophobicContact CG-CG1 4.18Å; P103-V154 HydrophobicContact CB-CB 3.99Å; P103-V154 HydrophobicContact CB-CG1 4.2Å; P103-V154 HydrophobicContact CB-CG2 3.68Å; L150-V154 HydrophobicContact CD1-CG2 4.06Å; L150-V154 HydrophobicContact CD2-CG2 3.33Å; L150-V154 HydrophobicContact CG-CG2 4.34Å; V154-T156 HydrophobicContact CB-CG2 4.33Å; V154-T156 HydrophobicContact CG1-CG2 3.87Å; V154-T156 PolarHBondContact O-N 3.06Å; V154-V159 HydrophobicContact CG1-CG2 3.87Å
155	E	87.6	Confident	87.9	Confident	134 Å²	134	59 Å²	59	63%	0.626	30%	0.302	S	S	*	.			trans	-70.2	82.1	163.6	-69.1	-160.1	169	0	0	109.6	L153 L157 Q158 V159	L153-E155 PolarHBondContact O-N 2.74Å; E155-L157 PolarHBondContact O-N 2.99Å; E155-L157 VanDerWaalsContact O-N 3.08Å; E155-Q158 HydrophobicContact CB-CB 4.06Å; E155-Q158 HydrophobicContact CB-CG 4.12Å; E155-Q158 PolarHBondContact O-N 3.14Å; E155-Q158 WeakPolarHBondContact OE2-CG 3.37Å; E155-V159 PolarHBondContact O-N 3.26Å
156	T	87.9	Confident	89.2	Confident	61 Å²	61	56.5 Å²	56.5	37%	0.374	28%	0.276	S	S	.	.	H	α-helix	trans	-57.9	-28	-173.3	56	0	0	0	0	113.1	P103 V154 K160	P103-T156 HydrophobicContact CG-CG2 4.45Å; V154-T156 HydrophobicContact CB-CG2 4.33Å; V154-T156 HydrophobicContact CG1-CG2 3.87Å; V154-T156 PolarHBondContact O-N 3.06Å; T156-K160 WeakPolarHBondContact O-CB 3.24Å; T156-K160 WeakPolarHBondContact O-CG 3.28Å; T156-K160 PolarHBondContact O-N 3.33Å
157	L	92.4	Very high	90.3	Very high	106 Å²	106	52.9 Å²	52.9	56%	0.555	25%	0.254	S	S	*	.	H	α-helix	trans	-67.5	-46.2	173.1	-178.4	58.8	0	0	0	112.3	F16 E155 K160 M161	F16-L157 HydrophobicContact CE1-CD1 4.23Å; F16-L157 HydrophobicContact CZ-CD1 4.11Å; E155-L157 PolarHBondContact O-N 2.99Å; E155-L157 VanDerWaalsContact O-N 3.08Å; L157-K160 PolarHBondContact O-N 3.28Å; L157-M161 HydrophobicContact CD1-CG 4.33Å; L157-M161 HydrophobicContact CD1-SD 4.18Å; L157-M161 HydrophobicContact CG-SD 4.03Å; L157-M161 VanDerWaalsContact O-CG 3.31Å; L157-M161 WeakPolarHBondContact O-CG 3.38Å; L157-M161 PolarHBondContact O-N 2.69Å
158	Q	92.9	Very high	90.7	Very high	73 Å²	73	52.2 Å²	52.2	34%	0.341	25%	0.248	S	C	.	.	H	α-helix	trans	-61.1	-47.7	174.9	-76.2	-70	11.7	0	0	110.9	E155 K160 M161 V162	E155-Q158 HydrophobicContact CB-CB 4.06Å; E155-Q158 HydrophobicContact CB-CG 4.12Å; E155-Q158 PolarHBondContact O-N 3.14Å; E155-Q158 WeakPolarHBondContact OE2-CG 3.37Å; Q158-K160 VanDerWaalsContact C-N 3.29Å; Q158-K160 PolarHBondContact O-N 2.96Å; Q158-M161 PolarHBondContact O-N 3.01Å; Q158-V162 WeakPolarHBondContact O-CG2 3.38Å; Q158-V162 PolarHBondContact O-N 2.79Å
159	V	94.8	Very high	91	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	25%	0.248	C	C	.	.	H	α-helix	trans	-59.6	-40.9	179	-176.6	0	0	0	0	111.1	G96 L99 F100 M138 V154 E155 S163	G96-V159 VanDerWaalsContact O-CG1 3.26Å; G96-V159 WeakPolarHBondContact O-CG1 3.27Å; L99-V159 HydrophobicContact CB-CG1 3.99Å; L99-V159 HydrophobicContact CD2-CB 4.45Å; L99-V159 HydrophobicContact CD2-CG1 3.82Å; L99-V159 HydrophobicContact CD2-CG2 3.68Å; L99-V159 HydrophobicContact CG-CG1 3.99Å; L99-V159 HydrophobicContact CG-CG2 4.23Å; F100-V159 HydrophobicContact CB-CB 4.2Å; F100-V159 HydrophobicContact CB-CG1 3.91Å; F100-V159 HydrophobicContact CD1-CG1 4.3Å; M138-V159 HydrophobicContact CB-CG2 4.4Å; V154-V159 HydrophobicContact CG1-CG2 3.87Å; E155-V159 PolarHBondContact O-N 3.26Å; V159-S163 VanDerWaalsContact O-CB 3.29Å; V159-S163 WeakPolarHBondContact O-CB 3.36Å; V159-S163 PolarHBondContact O-N 2.83Å; V159-S163 PolarHBondContact O-OG 2.82Å
160	K	95.5	Very high	91.2	Very high	32 Å²	32	49 Å²	49	14%	0.139	23%	0.234	C	C	.	.	H	α-helix	trans	-61.6	-44.9	172.4	-77.5	171.5	176.8	-171	0	112.1	F16 V20 E24 F100 T156 L157 Q158 S163 F164	F16-K160 HydrophobicContact CE2-CB 4.01Å; F16-K160 HydrophobicContact CZ-CB 3.95Å; V20-K160 HydrophobicContact CG1-CD 3.84Å; V20-K160 HydrophobicContact CG2-CB 4.15Å; V20-K160 HydrophobicContact CG2-CD 3.97Å; V20-K160 HydrophobicContact CG2-CG 4.12Å; E24-K160 WeakPolarHBondContact OE1-CE 3.38Å; E24-K160 IonicContact OE1-NZ 3.87Å; E24-K160 PolarHBondContact OE1-NZ 2.98Å; E24-K160 IonicContact OE2-NZ 2.79Å; F100-K160 HydrophobicContact CB-CG 3.93Å; F100-K160 HydrophobicContact CD1-CB 4.41Å; F100-K160 HydrophobicContact CD1-CG 3.68Å; F100-K160 HydrophobicContact CD2-CD 4.33Å; F100-K160 HydrophobicContact CD2-CG 3.74Å; F100-K160 HydrophobicContact CE1-CG 4.03Å; F100-K160 HydrophobicContact CE2-CG 4.09Å; F100-K160 HydrophobicContact CG-CG 3.54Å; F100-K160 HydrophobicContact CZ-CG 4.24Å; T156-K160 WeakPolarHBondContact O-CB 3.24Å; T156-K160 WeakPolarHBondContact O-CG 3.28Å; T156-K160 PolarHBondContact O-N 3.33Å; L157-K160 PolarHBondContact O-N 3.28Å; Q158-K160 VanDerWaalsContact C-N 3.29Å; Q158-K160 PolarHBondContact O-N 2.96Å; K160-S163 PolarHBondContact O-N 3.36Å; K160-F164 WeakPolarHBondContact O-CB 3.44Å; K160-F164 PolarHBondContact O-N 3.3Å
161	M	95.4	Very high	91.5	Very high	66 Å²	66	48 Å²	48	33%	0.325	23%	0.229	S	C	.	.	H	α-helix	trans	-65.6	-43.5	179.5	-71.8	172.8	57.9	0	0	112.6	F16 L63 L157 Q158 F164 E165	F16-M161 HydrophobicContact CE2-CG 4.07Å; F16-M161 HydrophobicContact CZ-CG 3.82Å; L63-M161 HydrophobicContact CD1-CB 3.85Å; L63-M161 HydrophobicContact CD1-CE 4.48Å; L157-M161 HydrophobicContact CD1-CG 4.33Å; L157-M161 HydrophobicContact CD1-SD 4.18Å; L157-M161 HydrophobicContact CG-SD 4.03Å; L157-M161 VanDerWaalsContact O-CG 3.31Å; L157-M161 WeakPolarHBondContact O-CG 3.38Å; L157-M161 PolarHBondContact O-N 2.69Å; Q158-M161 PolarHBondContact O-N 3.01Å; M161-F164 PolarHBondContact O-N 2.98Å; M161-E165 PolarHBondContact O-N 3.02Å
162	V	96.1	Very high	92.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.2	-42.7	174.8	179	0	0	0	0	110.8	L63 I134 C137 M138 Q158 F164 E165 L166	L63-V162 HydrophobicContact CD1-CG2 3.75Å; I134-V162 HydrophobicContact CG2-CG1 4.47Å; C137-V162 HydrophobicContact CB-CG1 4.3Å; C137-V162 HydrophobicContact CB-CG2 3.56Å; M138-V162 HydrophobicContact CE-CG1 3.71Å; M138-V162 HydrophobicContact CG-CB 4.25Å; M138-V162 HydrophobicContact CG-CG1 3.89Å; Q158-V162 WeakPolarHBondContact O-CG2 3.38Å; Q158-V162 PolarHBondContact O-N 2.79Å; V162-F164 VanDerWaalsContact C-N 3.26Å; V162-F164 PolarHBondContact O-N 3.2Å; V162-E165 PolarHBondContact O-N 2.85Å; V162-L166 HydrophobicContact CG1-CD1 4.07Å; V162-L166 WeakPolarHBondContact O-CG 3.43Å; V162-L166 PolarHBondContact O-N 2.95Å
163	S	96.5	Very high	93.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.3	-39.9	174.4	-55.5	0	0	0	0	111.5	Y19 G96 V159 K160 L166 F167	Y19-S163 PolarHBondContact OH-O 3.33Å; G96-S163 VanDerWaalsContact C-OG 3.23Å; G96-S163 VanDerWaalsContact CA-OG 3.28Å; G96-S163 WeakPolarHBondContact CA-OG 3.3Å; V159-S163 VanDerWaalsContact O-CB 3.29Å; V159-S163 WeakPolarHBondContact O-CB 3.36Å; V159-S163 PolarHBondContact O-N 2.83Å; V159-S163 PolarHBondContact O-OG 2.82Å; K160-S163 PolarHBondContact O-N 3.36Å; S163-L166 PolarHBondContact O-N 3.26Å; S163-F167 WeakPolarHBondContact O-CB 3.46Å; S163-F167 PolarHBondContact O-N 3.27Å
164	F	96.4	Very high	94.2	Very high	7 Å²	7	27.3 Å²	27.3	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-68.6	-37.1	176.5	-180	-121	0	0	0	112.7	K12 L15 F16 Y19 K160 M161 V162 L166 F167 L168	K12-F164 HydrophobicContact CG-CE1 3.86Å; K12-F164 HydrophobicContact CG-CZ 4.41Å; L15-F164 HydrophobicContact CB-CZ 4.19Å; L15-F164 HydrophobicContact CD2-CE2 4.26Å; L15-F164 HydrophobicContact CD2-CZ 4.09Å; L15-F164 HydrophobicContact CG-CE2 3.9Å; L15-F164 HydrophobicContact CG-CZ 3.91Å; F16-F164 HydrophobicContact CB-CD1 4.02Å; F16-F164 HydrophobicContact CB-CE1 3.85Å; F16-F164 HydrophobicContact CB-CG 4.46Å; F16-F164 HydrophobicContact CB-CZ 4.17Å; F16-F164 HydrophobicContact CD2-CB 3.74Å; F16-F164 AromaticContact CD2-CD1 3.71Å; F16-F164 HydrophobicContact CD2-CD1 3.71Å; F16-F164 HydrophobicContact CD2-CD2 4.4Å; F16-F164 HydrophobicContact CD2-CE1 4.4Å; F16-F164 AromaticContact CD2-CG 3.7Å; F16-F164 HydrophobicContact CD2-CG 3.7Å; F16-F164 HydrophobicContact CE2-CB 4.09Å; F16-F164 HydrophobicContact CG-CD1 4.27Å; Y19-F164 HydrophobicContact CD1-CB 4.03Å; Y19-F164 AromaticContact CD1-CD2 3.92Å; Y19-F164 HydrophobicContact CD1-CD2 3.92Å; Y19-F164 HydrophobicContact CD1-CG 4.39Å; Y19-F164 HydrophobicContact CD2-CD2 4.34Å; Y19-F164 HydrophobicContact CE1-CB 4.09Å; Y19-F164 AromaticContact CG-CD2 3.81Å; Y19-F164 HydrophobicContact CG-CD2 3.81Å; K160-F164 WeakPolarHBondContact O-CB 3.44Å; K160-F164 PolarHBondContact O-N 3.3Å; M161-F164 PolarHBondContact O-N 2.98Å; V162-F164 VanDerWaalsContact C-N 3.26Å; V162-F164 PolarHBondContact O-N 3.2Å; F164-L166 VanDerWaalsContact C-N 3.35Å; F164-F167 AromaticContact CD2-CD1 3.88Å; F164-F167 HydrophobicContact CD2-CD1 3.88Å; F164-F167 AromaticContact CE2-CD1 3.93Å; F164-F167 HydrophobicContact CE2-CD1 3.93Å; F164-F167 HydrophobicContact CE2-CE1 4.27Å; F164-F167 WeakPolarHBondContact O-CB 3.41Å; F164-F167 PolarHBondContact O-N 2.96Å; F164-L168 HydrophobicContact CD1-CD1 4.38Å; F164-L168 HydrophobicContact CE1-CD1 3.95Å; F164-L168 HydrophobicContact CE1-CG 4.49Å; F164-L168 HydrophobicContact CE2-CD2 4.36Å; F164-L168 HydrophobicContact CE2-CG 4.35Å; F164-L168 HydrophobicContact CZ-CD1 4.09Å; F164-L168 HydrophobicContact CZ-CD2 4.27Å; F164-L168 HydrophobicContact CZ-CG 4.25Å; F164-L168 WeakPolarHBondContact O-CG 3.29Å; F164-L168 PolarHBondContact O-N 2.72Å
165	E	95.9	Very high	94.9	Very high	9 Å²	9	26.9 Å²	26.9	4%	0.042	13%	0.133	C	C	.	.	H	α-helix	trans	-71.4	-28.7	173.4	-62.7	-135	142.9	0	0	112.6	K12 F61 R62 L63 I64 M161 V162 L168 A169	K12-E165 IonicContact NZ-OE1 3.79Å; K12-E165 PolarHBondContact NZ-OE1 3.42Å; F61-E165 HydrophobicContact CD1-CB 4.41Å; R62-E165 PolarHBondContact N-OE1 3.37Å; R62-E165 PolarHBondContact N-OE2 2.97Å; L63-E165 HydrophobicContact CD1-CG 4.45Å; L63-E165 PolarHBondContact N-OE2 2.76Å; I64-E165 HydrophobicContact CD1-CB 3.98Å; I64-E165 HydrophobicContact CG1-CB 4.47Å; M161-E165 PolarHBondContact O-N 3.02Å; V162-E165 PolarHBondContact O-N 2.85Å; E165-L168 PolarHBondContact O-N 2.93Å; E165-A169 WeakPolarHBondContact O-CB 3.11Å; E165-A169 PolarHBondContact O-N 3.44Å
166	L	97.3	Very high	95.3	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-69.8	-37.3	169.2	-70.3	163.8	0	0	0	112.4	I64 F89 L92 E93 I134 M138 V162 S163 F164 A169 K170	I64-L166 HydrophobicContact CD1-CD2 3.63Å; I64-L166 HydrophobicContact CD1-CG 3.69Å; F89-L166 HydrophobicContact CD1-CD2 3.74Å; L92-L166 HydrophobicContact CB-CD1 3.81Å; L92-L166 HydrophobicContact CB-CD2 4.05Å; E93-L166 HydrophobicContact CB-CB 3.97Å; I134-L166 HydrophobicContact CG2-CD1 3.99Å; I134-L166 HydrophobicContact CG2-CD2 4.03Å; I134-L166 HydrophobicContact CG2-CG 4.46Å; M138-L166 HydrophobicContact CE-CD1 3.32Å; V162-L166 HydrophobicContact CG1-CD1 4.07Å; V162-L166 WeakPolarHBondContact O-CG 3.43Å; V162-L166 PolarHBondContact O-N 2.95Å; S163-L166 PolarHBondContact O-N 3.26Å; F164-L166 VanDerWaalsContact C-N 3.35Å; L166-A169 WeakPolarHBondContact O-CB 3.26Å; L166-A169 PolarHBondContact O-N 2.96Å; L166-K170 PolarHBondContact O-N 2.88Å
167	F	96.8	Very high	95.7	Very high	1 Å²	1	19.8 Å²	19.8	0%	0.004	10%	0.097	C	C	.	.	H	α-helix	trans	-61.6	-42	169.8	168	-96.8	0	0	0	111.7	Y19 L42 R43 A46 E93 S163 F164 A169 K170 V171	Y19-F167 HydrophobicContact CD2-CB 4.27Å; Y19-F167 AromaticContact CD2-CD1 3.99Å; Y19-F167 HydrophobicContact CD2-CD1 3.99Å; Y19-F167 HydrophobicContact CD2-CD2 4.03Å; Y19-F167 HydrophobicContact CD2-CE1 4.38Å; Y19-F167 HydrophobicContact CD2-CE2 4.45Å; Y19-F167 AromaticContact CD2-CG 3.82Å; Y19-F167 HydrophobicContact CD2-CG 3.82Å; Y19-F167 HydrophobicContact CE2-CB 3.67Å; Y19-F167 HydrophobicContact CE2-CD1 4.23Å; Y19-F167 AromaticContact CE2-CD2 3.75Å; Y19-F167 HydrophobicContact CE2-CD2 3.75Å; Y19-F167 AromaticContact CE2-CG 3.61Å; Y19-F167 HydrophobicContact CE2-CG 3.61Å; L42-F167 HydrophobicContact CB-CE1 4.34Å; L42-F167 HydrophobicContact CB-CE2 4.23Å; L42-F167 HydrophobicContact CB-CZ 3.58Å; R43-F167 HydrophobicContact CG-CE2 3.9Å; R43-F167 HydrophobicContact CG-CZ 4.13Å; A46-F167 HydrophobicContact CB-CE1 3.78Å; A46-F167 HydrophobicContact CB-CZ 4.18Å; E93-F167 HydrophobicContact CG-CB 4.29Å; E93-F167 WeakPolarHBondContact OE1-CD2 3.27Å; S163-F167 WeakPolarHBondContact O-CB 3.46Å; S163-F167 PolarHBondContact O-N 3.27Å; F164-F167 AromaticContact CD2-CD1 3.88Å; F164-F167 HydrophobicContact CD2-CD1 3.88Å; F164-F167 AromaticContact CE2-CD1 3.93Å; F164-F167 HydrophobicContact CE2-CD1 3.93Å; F164-F167 HydrophobicContact CE2-CE1 4.27Å; F164-F167 WeakPolarHBondContact O-CB 3.41Å; F164-F167 PolarHBondContact O-N 2.96Å; F167-A169 VanDerWaalsContact C-N 3.34Å; F167-K170 VanDerWaalsContact CD2-CE 3.45Å; F167-K170 VanDerWaalsContact O-CG 3.25Å; F167-K170 WeakPolarHBondContact O-CG 3.15Å; F167-V171 HydrophobicContact CE2-CG2 4.48Å; F167-V171 HydrophobicContact CZ-CG2 4.38Å; F167-V171 WeakPolarHBondContact O-CG2 3.41Å; F167-V171 PolarHBondContact O-N 3.41Å
168	L	95.8	Very high	95.9	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-66.9	-34.1	171.6	-66.6	177.7	0	0	0	112.2	A46 L49 F61 F164 E165 V171 E172	A46-L168 HydrophobicContact CB-CD2 3.73Å; L49-L168 HydrophobicContact CD2-CD2 4.32Å; F61-L168 HydrophobicContact CE1-CB 3.85Å; F61-L168 HydrophobicContact CZ-CB 4.37Å; F164-L168 HydrophobicContact CD1-CD1 4.38Å; F164-L168 HydrophobicContact CE1-CD1 3.95Å; F164-L168 HydrophobicContact CE1-CG 4.49Å; F164-L168 HydrophobicContact CE2-CD2 4.36Å; F164-L168 HydrophobicContact CE2-CG 4.35Å; F164-L168 HydrophobicContact CZ-CD1 4.09Å; F164-L168 HydrophobicContact CZ-CD2 4.27Å; F164-L168 HydrophobicContact CZ-CG 4.25Å; F164-L168 WeakPolarHBondContact O-CG 3.29Å; F164-L168 PolarHBondContact O-N 2.72Å; E165-L168 PolarHBondContact O-N 2.93Å; L168-V171 PolarHBondContact O-N 3.03Å; L168-E172 WeakPolarHBondContact O-CB 3.49Å; L168-E172 PolarHBondContact O-N 3.46Å
169	A	96.4	Very high	96	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-65.5	-46.6	179.8	0	0	0	0	0	112	F61 F66 F89 E165 L166 F167 V171 E172 C173	F61-A169 HydrophobicContact CE1-CB 4Å; F61-A169 HydrophobicContact CZ-CB 4.46Å; F66-A169 HydrophobicContact CD2-CB 3.57Å; F66-A169 HydrophobicContact CE2-CB 3.65Å; F66-A169 WeakPolarHBondContact CE2-O 3.25Å; F89-A169 HydrophobicContact CB-CB 4.24Å; F89-A169 HydrophobicContact CD1-CB 4.04Å; F89-A169 HydrophobicContact CD2-CB 3.82Å; F89-A169 HydrophobicContact CE1-CB 4.35Å; F89-A169 HydrophobicContact CE2-CB 4.15Å; F89-A169 HydrophobicContact CG-CB 3.77Å; F89-A169 HydrophobicContact CZ-CB 4.4Å; E165-A169 WeakPolarHBondContact O-CB 3.11Å; E165-A169 PolarHBondContact O-N 3.44Å; L166-A169 WeakPolarHBondContact O-CB 3.26Å; L166-A169 PolarHBondContact O-N 2.96Å; F167-A169 VanDerWaalsContact C-N 3.34Å; A169-V171 VanDerWaalsContact C-N 3.3Å; A169-V171 PolarHBondContact O-N 3.19Å; A169-E172 PolarHBondContact O-N 2.88Å; A169-C173 PolarHBondContact O-N 3.43Å; A169-C173 PolarHBondContact O-SG 2.97Å
170	K	95.6	Very high	96.1	Very high	13 Å²	13	17 Å²	17	6%	0.057	8%	0.081	C	C	.	.	H	α-helix	trans	-62.7	-37.2	174.1	71	172.8	-176.6	-167.3	0	111.7	D39 H86 F89 S90 E93 L166 F167 C173 E174	D39-K170 IonicContact OD2-NZ 3.81Å; H86-K170 PolarHBondContact CD2-O 3.37Å; H86-K170 VanDerWaalsContact CD2-O 3.27Å; F89-K170 HydrophobicContact CB-CB 4.23Å; S90-K170 WeakPolarHBondContact OG-CD 3.47Å; E93-K170 IonicContact OE1-NZ 3.5Å; E93-K170 PolarHBondContact OE1-NZ 3.32Å; E93-K170 WeakPolarHBondContact OE2-CD 3.23Å; E93-K170 VanDerWaalsContact OE2-CE 3.25Å; E93-K170 WeakPolarHBondContact OE2-CE 3.37Å; E93-K170 IonicContact OE2-NZ 3.89Å; E93-K170 PolarHBondContact OE2-NZ 2.94Å; L166-K170 PolarHBondContact O-N 2.88Å; F167-K170 VanDerWaalsContact CD2-CE 3.45Å; F167-K170 VanDerWaalsContact O-CG 3.25Å; F167-K170 WeakPolarHBondContact O-CG 3.15Å; K170-C173 WeakPolarHBondContact O-CB 3.38Å; K170-C173 PolarHBondContact O-N 3Å; K170-E174 PolarHBondContact O-N 3.29Å
171	V	96	Very high	96.1	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-70.6	-38.8	178.4	177.1	0	0	0	0	111.4	R43 A46 S47 L50 F167 L168 A169 C173 E174 Q175	R43-V171 HydrophobicContact CB-CG2 4.11Å; R43-V171 HydrophobicContact CG-CG2 3.81Å; A46-V171 HydrophobicContact CB-CB 4.17Å; A46-V171 HydrophobicContact CB-CG1 3.87Å; A46-V171 HydrophobicContact CB-CG2 4.09Å; S47-V171 WeakPolarHBondContact OG-CG1 3.21Å; L50-V171 HydrophobicContact CD1-CB 4.19Å; L50-V171 HydrophobicContact CD1-CG1 3.93Å; F167-V171 HydrophobicContact CE2-CG2 4.48Å; F167-V171 HydrophobicContact CZ-CG2 4.38Å; F167-V171 WeakPolarHBondContact O-CG2 3.41Å; F167-V171 PolarHBondContact O-N 3.41Å; L168-V171 PolarHBondContact O-N 3.03Å; A169-V171 VanDerWaalsContact C-N 3.3Å; A169-V171 PolarHBondContact O-N 3.19Å; V171-C173 VanDerWaalsContact C-N 3.26Å; V171-C173 PolarHBondContact O-N 3.23Å; V171-E174 CarbonylContact O-C 3.58Å; V171-E174 WeakPolarHBondContact O-CA 3.26Å; V171-E174 VanDerWaalsContact O-CB 3.32Å; V171-E174 WeakPolarHBondContact O-CB 3.36Å; V171-E174 PolarHBondContact O-N 2.96Å; V171-Q175 WeakPolarHBondContact O-CG 3.12Å; V171-Q175 PolarHBondContact O-N 3.1Å
172	E	95.4	Very high	96	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.1	-30.3	172.9	-175.5	69.5	173.8	0	0	111.6	L50 R60 F61 F66 Y67 L168 A169 Q175 M176 R197	L50-E172 HydrophobicContact CD1-CB 4Å; R60-E172 IonicContact NH1-OE1 2.68Å; R60-E172 PolarHBondContact NH1-OE1 2.78Å; F61-E172 HydrophobicContact CE2-CG 4.36Å; F61-E172 HydrophobicContact CZ-CB 4.06Å; F61-E172 HydrophobicContact CZ-CG 4.41Å; F66-E172 HydrophobicContact CD1-CG 4.17Å; F66-E172 HydrophobicContact CE1-CB 3.97Å; F66-E172 HydrophobicContact CE1-CG 3.35Å; F66-E172 HydrophobicContact CE2-CB 4.45Å; F66-E172 HydrophobicContact CZ-CB 3.76Å; F66-E172 HydrophobicContact CZ-CG 3.66Å; Y67-E172 PolarHBondContact OH-OE1 3.07Å; L168-E172 WeakPolarHBondContact O-CB 3.49Å; L168-E172 PolarHBondContact O-N 3.46Å; A169-E172 PolarHBondContact O-N 2.88Å; E172-Q175 PolarHBondContact O-N 2.94Å; E172-M176 HydrophobicContact CG-CE 4.27Å; E172-M176 WeakPolarHBondContact O-CG 3.3Å; E172-M176 PolarHBondContact O-N 3.18Å; E172-R197 WeakPolarHBondContact OE1-CG 3.37Å; E172-R197 IonicContact OE1-CZ 3.6Å; E172-R197 IonicContact OE1-NE 2.7Å; E172-R197 PolarHBondContact OE1-NE 3.01Å; E172-R197 IonicContact OE1-NH2 3.73Å; E172-R197 PolarHBondContact OE1-NH2 3.12Å; E172-R197 IonicContact OE2-CZ 2.99Å; E172-R197 IonicContact OE2-NE 3.16Å; E172-R197 PolarHBondContact OE2-NE 3.31Å; E172-R197 IonicContact OE2-NH2 3.54Å; E172-R197 PolarHBondContact OE2-NH2 3.14Å
173	C	96.9	Very high	96	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65.8	-38.4	165.3	-67.3	0	0	0	0	113	H86 A169 K170 V171 M176 L177	H86-C173 HydrophobicContact CB-CB 4.16Å; A169-C173 PolarHBondContact O-N 3.43Å; A169-C173 PolarHBondContact O-SG 2.97Å; K170-C173 WeakPolarHBondContact O-CB 3.38Å; K170-C173 PolarHBondContact O-N 3Å; V171-C173 VanDerWaalsContact C-N 3.26Å; V171-C173 PolarHBondContact O-N 3.23Å; C173-M176 PolarHBondContact O-N 3.21Å; C173-L177 WeakPolarHBondContact O-CB 3.25Å; C173-L177 VanDerWaalsContact O-CG 3.3Å; C173-L177 WeakPolarHBondContact O-CG 3.23Å; C173-L177 PolarHBondContact O-N 2.91Å
174	E	96	Very high	95.8	Very high	47 Å²	47	25.3 Å²	25.3	22%	0.22	13%	0.125	C	C	.	.	H	α-helix	trans	-60	-46.3	170.7	-68.5	173	-150.8	0	0	110.7	R43 H86 K170 V171 M176 L177 E178	R43-E174 IonicContact CZ-OE2 2.69Å; R43-E174 IonicContact NH1-OE1 3.51Å; R43-E174 IonicContact NH1-OE2 3.65Å; R43-E174 PolarHBondContact NH1-OE2 2.92Å; H86-E174 IonicContact CD2-OE1 2.72Å; H86-E174 IonicContact CE1-OE1 3.88Å; H86-E174 IonicContact NE2-OE1 3.14Å; H86-E174 PolarHBondContact NE2-OE1 3.46Å; K170-E174 PolarHBondContact O-N 3.29Å; V171-E174 CarbonylContact O-C 3.58Å; V171-E174 WeakPolarHBondContact O-CA 3.26Å; V171-E174 VanDerWaalsContact O-CB 3.32Å; V171-E174 WeakPolarHBondContact O-CB 3.36Å; V171-E174 PolarHBondContact O-N 2.96Å; E174-M176 PolarHBondContact O-N 2.9Å; E174-L177 PolarHBondContact O-N 2.74Å; E174-E178 PolarHBondContact O-N 3.47Å
175	Q	94.9	Very high	95.6	Very high	13 Å²	13	30.2 Å²	30.2	6%	0.061	15%	0.151	C	C	.	.	H	α-helix	trans	-59	-46	175.9	-58.3	-53.9	100.2	0	0	111.9	S47 S51 V171 E172 E178 I179 V204	S47-Q175 PolarHBondContact OG-OE1 2.96Å; S51-Q175 PolarHBondContact OG-NE2 2.93Å; V171-Q175 WeakPolarHBondContact O-CG 3.12Å; V171-Q175 PolarHBondContact O-N 3.1Å; E172-Q175 PolarHBondContact O-N 2.94Å; Q175-E178 WeakPolarHBondContact O-CB 3.21Å; Q175-E178 PolarHBondContact O-N 2.8Å; Q175-I179 WeakPolarHBondContact O-CG1 3.2Å; Q175-I179 PolarHBondContact O-N 2.96Å; Q175-V204 HydrophobicContact CB-CG2 3.91Å; Q175-V204 HydrophobicContact CG-CG2 4.39Å; Q175-V204 VanDerWaalsContact NE2-CG2 3.27Å
176	M	95.8	Very high	95.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.1	-35	-179.7	-70.9	-174.6	-66	0	0	113	F66 L82 E172 C173 E174 E178 I179 H180 I193 V194 R197	F66-M176 HydrophobicContact CE1-CE 3.63Å; F66-M176 HydrophobicContact CZ-CE 3.57Å; L82-M176 HydrophobicContact CD1-CB 3.86Å; L82-M176 HydrophobicContact CD2-CB 4.39Å; L82-M176 HydrophobicContact CD2-CE 3.83Å; L82-M176 HydrophobicContact CD2-SD 4.5Å; E172-M176 HydrophobicContact CG-CE 4.27Å; E172-M176 WeakPolarHBondContact O-CG 3.3Å; E172-M176 PolarHBondContact O-N 3.18Å; C173-M176 PolarHBondContact O-N 3.21Å; E174-M176 PolarHBondContact O-N 2.9Å; M176-E178 VanDerWaalsContact C-N 3.31Å; M176-I179 PolarHBondContact O-N 2.86Å; M176-H180 WeakPolarHBondContact O-CB 3.2Å; M176-H180 PolarHBondContact O-N 3.09Å; M176-I193 HydrophobicContact CB-CG2 4.2Å; M176-I193 HydrophobicContact CG-CG2 4.5Å; M176-V194 HydrophobicContact CE-CG2 4.32Å; M176-V194 HydrophobicContact SD-CB 4.28Å; M176-V194 HydrophobicContact SD-CG2 3.73Å; M176-R197 HydrophobicContact CG-CB 4.05Å; M176-R197 HydrophobicContact CG-CG 3.78Å; M176-R197 HydrophobicContact SD-CB 4.03Å; M176-R197 HydrophobicContact SD-CG 4Å
177	L	96.8	Very high	95.1	Very high	46 Å²	46	35.5 Å²	35.5	24%	0.241	19%	0.194	C	C	.	.	H	α-helix	trans	-64	-36.3	170.4	-75.4	166.5	0	0	0	111.7	L82 C173 E174 S181	L82-L177 HydrophobicContact CB-CD1 4.39Å; L82-L177 HydrophobicContact CB-CD2 3.76Å; L82-L177 HydrophobicContact CB-CG 3.84Å; L82-L177 HydrophobicContact CD1-CD2 4.42Å; L82-L177 HydrophobicContact CD1-CG 4.5Å; C173-L177 WeakPolarHBondContact O-CB 3.25Å; C173-L177 VanDerWaalsContact O-CG 3.3Å; C173-L177 WeakPolarHBondContact O-CG 3.23Å; C173-L177 PolarHBondContact O-N 2.91Å; E174-L177 PolarHBondContact O-N 2.74Å; L177-S181 PolarHBondContact O-N 2.83Å
178	E	96.1	Very high	94.9	Very high	83 Å²	83	36.8 Å²	36.8	39%	0.388	20%	0.199	S	C	.	.	H	α-helix	trans	-65.3	-48.7	173.6	-158.1	-164	143	0	0	111.3	E174 Q175 M176 H180 S181 Q182 V204	E174-E178 PolarHBondContact O-N 3.47Å; Q175-E178 WeakPolarHBondContact O-CB 3.21Å; Q175-E178 PolarHBondContact O-N 2.8Å; M176-E178 VanDerWaalsContact C-N 3.31Å; E178-H180 VanDerWaalsContact C-N 3.31Å; E178-H180 PolarHBondContact O-N 3.43Å; E178-S181 WeakPolarHBondContact O-CB 3.33Å; E178-S181 PolarHBondContact O-N 2.91Å; E178-S181 VanDerWaalsContact O-N 3.12Å; E178-S181 PolarHBondContact O-OG 2.92Å; E178-Q182 PolarHBondContact O-N 2.68Å; E178-Q182 PolarHBondContact OE1-NE2 3.32Å; E178-V204 HydrophobicContact CB-CG1 4.15Å; E178-V204 HydrophobicContact CG-CG1 4.13Å
179	I	95.7	Very high	94.9	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-54.6	-48.4	175.3	-61.7	165.4	0	0	0	110.3	Q175 M176 S181 Q182 V183 I193 R197 V204 C207 L211	Q175-I179 WeakPolarHBondContact O-CG1 3.2Å; Q175-I179 PolarHBondContact O-N 2.96Å; M176-I179 PolarHBondContact O-N 2.86Å; I179-S181 VanDerWaalsContact C-N 3.29Å; I179-S181 PolarHBondContact O-N 2.78Å; I179-Q182 PolarHBondContact O-N 2.7Å; I179-Q182 VanDerWaalsContact O-N 3.11Å; I179-V183 PolarHBondContact O-N 2.92Å; I179-I193 HydrophobicContact CB-CG2 3.82Å; I179-I193 HydrophobicContact CG2-CD1 4.42Å; I179-I193 HydrophobicContact CG2-CG2 3.73Å; I179-R197 HydrophobicContact CD1-CB 4.47Å; I179-R197 HydrophobicContact CD1-CG 4.41Å; I179-V204 HydrophobicContact CD1-CG2 4.37Å; I179-V204 HydrophobicContact CG1-CB 4.09Å; I179-V204 HydrophobicContact CG1-CG1 3.77Å; I179-V204 HydrophobicContact CG1-CG2 4.07Å; I179-C207 HydrophobicContact CD1-CB 3.75Å; I179-C207 HydrophobicContact CG1-CB 4.19Å; I179-C207 HydrophobicContact CG2-CB 4.17Å; I179-L211 HydrophobicContact CG2-CD1 3.91Å
180	H	96.1	Very high	94.8	Very high	39 Å²	39	41.5 Å²	41.5	18%	0.181	23%	0.227	C	C	.	.	H	α-helix	trans	-59.8	-39.2	179.6	-167.3	-139.6	0	0	0	112.2	M176 E178 Q182 V183 K184 Y188 I193	M176-H180 WeakPolarHBondContact O-CB 3.2Å; M176-H180 PolarHBondContact O-N 3.09Å; E178-H180 VanDerWaalsContact C-N 3.31Å; E178-H180 PolarHBondContact O-N 3.43Å; H180-Q182 VanDerWaalsContact C-N 3.28Å; H180-Q182 PolarHBondContact O-N 2.68Å; H180-V183 PolarHBondContact O-N 2.94Å; H180-K184 PolarHBondContact O-N 3.24Å; H180-K184 VanDerWaalsContact O-N 3.08Å; H180-Y188 PolarHBondContact NE2-O 3.2Å; H180-I193 HydrophobicContact CB-CG1 3.97Å
181	S	95.9	Very high	94.8	Very high	73 Å²	73	43.4 Å²	43.4	51%	0.51	24%	0.237	S	C	.	.	H	α-helix	trans	-63.3	-32.3	177.4	80	0	0	0	0	113.2	L177 E178 I179	L177-S181 PolarHBondContact O-N 2.83Å; E178-S181 WeakPolarHBondContact O-CB 3.33Å; E178-S181 PolarHBondContact O-N 2.91Å; E178-S181 VanDerWaalsContact O-N 3.12Å; E178-S181 PolarHBondContact O-OG 2.92Å; I179-S181 VanDerWaalsContact C-N 3.29Å; I179-S181 PolarHBondContact O-N 2.78Å
182	Q	94.6	Very high	94.8	Very high	40 Å²	40	46.6 Å²	46.6	19%	0.187	26%	0.255	C	S	.	.	H	α-helix	trans	-81.7	-9.9	-178.2	-65.8	-176.4	50.7	0	0	114.1	E178 I179 H180 S208 R212	E178-Q182 PolarHBondContact O-N 2.68Å; E178-Q182 PolarHBondContact OE1-NE2 3.32Å; I179-Q182 PolarHBondContact O-N 2.7Å; I179-Q182 VanDerWaalsContact O-N 3.11Å; H180-Q182 VanDerWaalsContact C-N 3.28Å; H180-Q182 PolarHBondContact O-N 2.68Å; Q182-S208 PolarHBondContact OE1-OG 2.92Å; Q182-R212 PolarHBondContact O-NH2 3.01Å
183	V	94.8	Very high	94.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.2	19.9	176.3	-58.7	0	0	0	0	113.5	I179 H180 D185 K186 Y188 I193 S208 L211 R212	I179-V183 PolarHBondContact O-N 2.92Å; H180-V183 PolarHBondContact O-N 2.94Å; V183-D185 VanDerWaalsContact C-OD1 3.32Å; V183-D185 PolarHBondContact O-N 3.03Å; V183-K186 PolarHBondContact O-N 2.69Å; V183-Y188 HydrophobicContact CB-CD2 4.28Å; V183-Y188 HydrophobicContact CG2-CD2 3.94Å; V183-I193 HydrophobicContact CG2-CD1 3.85Å; V183-S208 WeakPolarHBondContact CG1-O 3.21Å; V183-L211 HydrophobicContact CG1-CB 4.04Å; V183-L211 HydrophobicContact CG2-CB 4.41Å; V183-L211 HydrophobicContact CG2-CD1 4.29Å; V183-R212 HydrophobicContact CG1-CB 4.39Å
184	K	92.8	Very high	94.8	Very high	158 Å²	158	46.6 Å²	46.6	69%	0.687	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-61.5	-26.7	-174.4	-170.3	178.4	178.6	-175.7	0	113.3	H180 K186	H180-K184 PolarHBondContact O-N 3.24Å; H180-K184 VanDerWaalsContact O-N 3.08Å; K184-K186 VanDerWaalsContact C-N 3.29Å; K184-K186 PolarHBondContact O-N 2.82Å
185	D	91.7	Very high	94.8	Very high	110 Å²	110	47.6 Å²	47.6	59%	0.588	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-66.5	-26.5	173.9	63.6	-58	0	0	0	113.3	V183 G187	V183-D185 VanDerWaalsContact C-OD1 3.32Å; V183-D185 PolarHBondContact O-N 3.03Å; D185-G187 VanDerWaalsContact C-N 3.35Å; D185-G187 PolarHBondContact O-N 3.08Å
186	K	91.6	Very high	94.7	Very high	51 Å²	51	47.7 Å²	47.7	22%	0.222	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-87.7	3.4	-175.4	-59.7	-50.3	-169	175.6	0	114.8	V183 K184 Y188 A215 E219	V183-K186 PolarHBondContact O-N 2.69Å; K184-K186 VanDerWaalsContact C-N 3.29Å; K184-K186 PolarHBondContact O-N 2.82Å; K186-Y188 VanDerWaalsContact C-N 3.31Å; K186-Y188 HydrophobicContact CB-CD2 3.85Å; K186-Y188 HydrophobicContact CB-CE2 3.8Å; K186-Y188 PolarHBondContact O-N 2.81Å; K186-A215 HydrophobicContact CB-CB 3.74Å; K186-A215 HydrophobicContact CD-CB 3.71Å; K186-A215 HydrophobicContact CG-CB 3.62Å; K186-E219 WeakPolarHBondContact CD-OE1 3.1Å; K186-E219 WeakPolarHBondContact CE-OE1 3.26Å; K186-E219 VanDerWaalsContact NZ-CD 3.32Å; K186-E219 IonicContact NZ-OE1 3.94Å; K186-E219 PolarHBondContact NZ-OE1 3.29Å; K186-E219 IonicContact NZ-OE2 3.97Å; K186-E219 PolarHBondContact NZ-OE2 3.44Å; K186-E219 VanDerWaalsContact NZ-OE2 3.11Å
187	G	90.6	Very high	94.6	Very high	69 Å²	69	47.7 Å²	47.7	71%	0.711	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	15.9	171.3	0	0	0	0	0	116	D185	D185-G187 VanDerWaalsContact C-N 3.35Å; D185-G187 PolarHBondContact O-N 3.08Å
188	Y	94.6	Very high	94.4	Very high	28 Å²	28	47.3 Å²	47.3	11%	0.11	26%	0.264	C	S	.	.			trans	-65.2	139.9	176.5	-74	-64.2	0	0	0	112.5	H180 V183 K186 D192 L211 A215	H180-Y188 PolarHBondContact NE2-O 3.2Å; V183-Y188 HydrophobicContact CB-CD2 4.28Å; V183-Y188 HydrophobicContact CG2-CD2 3.94Å; K186-Y188 VanDerWaalsContact C-N 3.31Å; K186-Y188 HydrophobicContact CB-CD2 3.85Å; K186-Y188 HydrophobicContact CB-CE2 3.8Å; K186-Y188 PolarHBondContact O-N 2.81Å; Y188-D192 HydrophobicContact CD1-CB 3.77Å; Y188-D192 HydrophobicContact CG-CB 4.39Å; Y188-L211 HydrophobicContact CD1-CD2 4.25Å; Y188-L211 HydrophobicContact CD2-CB 4.34Å; Y188-L211 HydrophobicContact CD2-CD2 4.25Å; Y188-L211 HydrophobicContact CE1-CD2 4.01Å; Y188-L211 HydrophobicContact CE2-CB 3.92Å; Y188-L211 HydrophobicContact CE2-CD2 4Å; Y188-L211 HydrophobicContact CG-CD2 4.37Å; Y188-L211 PolarHBondContact OH-O 2.95Å; Y188-A215 HydrophobicContact CE2-CB 4.07Å; Y188-A215 PolarHBondContact OH-N 3.2Å
189	S	94.8	Very high	94.1	Very high	57 Å²	57	47.9 Å²	47.9	40%	0.399	28%	0.277	S	S	.	.			trans	-78	159.4	170.3	74	0	0	0	0	111	L191 D192 I193	S189-L191 PolarHBondContact O-N 3.02Å; S189-L191 PolarHBondContact OG-N 3.41Å; S189-D192 WeakPolarHBondContact CB-OD2 3.39Å; S189-D192 PolarHBondContact N-OD2 3.38Å; S189-D192 WeakPolarHBondContact O-CB 3.47Å; S189-D192 PolarHBondContact O-N 3.21Å; S189-D192 PolarHBondContact OG-N 2.66Å; S189-D192 PolarHBondContact OG-OD2 3.12Å; S189-I193 PolarHBondContact O-N 3.36Å
190	E	95.2	Very high	93.7	Very high	43 Å²	43	48.7 Å²	48.7	20%	0.201	28%	0.282	C	S	.	.	H	α-helix	trans	-57.8	-31.5	174.4	-68	-170.3	154.4	0	0	112.2	L74 S81 L82 I193 V194	L74-E190 HydrophobicContact CD1-CB 4.33Å; S81-E190 WeakPolarHBondContact CA-OE2 3.47Å; S81-E190 WeakPolarHBondContact CB-OE2 3.47Å; L82-E190 HydrophobicContact CD1-CB 3.9Å; L82-E190 HydrophobicContact CD1-CG 3.94Å; L82-E190 HydrophobicContact CG-CB 4.01Å; L82-E190 HydrophobicContact CG-CG 4.15Å; L82-E190 PolarHBondContact N-OE2 3.35Å; E190-I193 WeakPolarHBondContact O-CB 3.41Å; E190-I193 PolarHBondContact O-N 2.97Å; E190-V194 WeakPolarHBondContact O-CG2 3.34Å; E190-V194 PolarHBondContact O-N 3.05Å
191	L	95.8	Very high	93.3	Very high	53 Å²	53	48.8 Å²	48.8	28%	0.277	29%	0.29	S	S	.	.	H	α-helix	trans	-68.4	-32.4	177.2	-169.5	68	0	0	0	112.7	E71 L74 R75 S189 I193 V194 S195	E71-L191 HydrophobicContact CB-CD1 4.34Å; E71-L191 HydrophobicContact CG-CD1 4.09Å; L74-L191 HydrophobicContact CB-CD1 4.34Å; R75-L191 HydrophobicContact CG-CD1 4.44Å; R75-L191 HydrophobicContact CG-CD2 4.05Å; S189-L191 PolarHBondContact O-N 3.02Å; S189-L191 PolarHBondContact OG-N 3.41Å; L191-I193 VanDerWaalsContact C-N 3.32Å; L191-V194 PolarHBondContact O-N 3.34Å; L191-S195 WeakPolarHBondContact O-CB 3.28Å; L191-S195 PolarHBondContact O-N 2.83Å
192	D	95.3	Very high	92.9	Very high	68 Å²	68	49.8 Å²	49.8	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-65.8	-37.5	172.4	-62.6	-69	0	0	0	111.2	Y188 S189 S195 E196	Y188-D192 HydrophobicContact CD1-CB 3.77Å; Y188-D192 HydrophobicContact CG-CB 4.39Å; S189-D192 WeakPolarHBondContact CB-OD2 3.39Å; S189-D192 PolarHBondContact N-OD2 3.38Å; S189-D192 WeakPolarHBondContact O-CB 3.47Å; S189-D192 PolarHBondContact O-N 3.21Å; S189-D192 PolarHBondContact OG-N 2.66Å; S189-D192 PolarHBondContact OG-OD2 3.12Å; D192-S195 WeakPolarHBondContact O-CB 3.47Å; D192-S195 PolarHBondContact O-N 3.39Å; D192-E196 PolarHBondContact O-N 3.07Å
193	I	96.3	Very high	92.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.9	-43.3	177.8	-51	-54.7	0	0	0	110.9	M176 I179 H180 V183 S189 E190 L191 S195 E196 R197 L211	M176-I193 HydrophobicContact CB-CG2 4.2Å; M176-I193 HydrophobicContact CG-CG2 4.5Å; I179-I193 HydrophobicContact CB-CG2 3.82Å; I179-I193 HydrophobicContact CG2-CD1 4.42Å; I179-I193 HydrophobicContact CG2-CG2 3.73Å; H180-I193 HydrophobicContact CB-CG1 3.97Å; V183-I193 HydrophobicContact CG2-CD1 3.85Å; S189-I193 PolarHBondContact O-N 3.36Å; E190-I193 WeakPolarHBondContact O-CB 3.41Å; E190-I193 PolarHBondContact O-N 2.97Å; L191-I193 VanDerWaalsContact C-N 3.32Å; I193-S195 VanDerWaalsContact C-N 3.34Å; I193-E196 PolarHBondContact O-N 3.35Å; I193-R197 VanDerWaalsContact O-CB 3.27Å; I193-R197 WeakPolarHBondContact O-CB 3.2Å; I193-R197 PolarHBondContact O-N 2.85Å; I193-L211 HydrophobicContact CD1-CD1 3.54Å
194	V	96.2	Very high	92.5	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.9	-45.1	173.5	175.4	0	0	0	0	110.6	Y67 V70 E71 L74 L82 M176 E190 L191 E196 R197 K198	Y67-V194 HydrophobicContact CD1-CG1 4.3Å; V70-V194 HydrophobicContact CG1-CB 4.46Å; V70-V194 HydrophobicContact CG1-CG1 3.99Å; V70-V194 HydrophobicContact CG1-CG2 3.57Å; E71-V194 HydrophobicContact CG-CG1 3.81Å; L74-V194 HydrophobicContact CD1-CG2 3.93Å; L82-V194 HydrophobicContact CD2-CG2 3.94Å; M176-V194 HydrophobicContact CE-CG2 4.32Å; M176-V194 HydrophobicContact SD-CB 4.28Å; M176-V194 HydrophobicContact SD-CG2 3.73Å; E190-V194 WeakPolarHBondContact O-CG2 3.34Å; E190-V194 PolarHBondContact O-N 3.05Å; L191-V194 PolarHBondContact O-N 3.34Å; V194-E196 PolarHBondContact O-N 3.45Å; V194-R197 PolarHBondContact O-N 2.94Å; V194-K198 VanDerWaalsContact O-CB 3.26Å; V194-K198 WeakPolarHBondContact O-CB 3.34Å; V194-K198 PolarHBondContact O-N 2.99Å
195	S	94.7	Very high	92.5	Very high	67 Å²	67	49.8 Å²	49.8	47%	0.469	29%	0.285	S	S	.	.	H	α-helix	trans	-59.6	-44.3	177.4	-171.4	0	0	0	0	112.2	L191 D192 I193 S199	L191-S195 WeakPolarHBondContact O-CB 3.28Å; L191-S195 PolarHBondContact O-N 2.83Å; D192-S195 WeakPolarHBondContact O-CB 3.47Å; D192-S195 PolarHBondContact O-N 3.39Å; I193-S195 VanDerWaalsContact C-N 3.34Å; S195-S199 VanDerWaalsContact O-CB 3.29Å; S195-S199 WeakPolarHBondContact O-CB 3.42Å; S195-S199 PolarHBondContact O-N 2.67Å; S195-S199 PolarHBondContact O-OG 3.03Å
196	E	93.7	Very high	92.5	Very high	16 Å²	16	45.3 Å²	45.3	8%	0.075	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-47.6	175	-170	69.7	178.5	0	0	111.6	D192 I193 V194 K198 S199 S200 C207 A210 L211 R214	D192-E196 PolarHBondContact O-N 3.07Å; I193-E196 PolarHBondContact O-N 3.35Å; V194-E196 PolarHBondContact O-N 3.45Å; E196-K198 VanDerWaalsContact C-N 3.25Å; E196-K198 PolarHBondContact O-N 3.12Å; E196-S199 CarbonylContact O-C 3.58Å; E196-S199 PolarHBondContact O-N 3.35Å; E196-S200 WeakPolarHBondContact O-CB 3.36Å; E196-S200 PolarHBondContact O-N 2.97Å; E196-C207 HydrophobicContact CG-CB 4.37Å; E196-A210 WeakPolarHBondContact OE1-CB 3.23Å; E196-L211 HydrophobicContact CB-CD1 4.03Å; E196-L211 HydrophobicContact CB-CD2 4.22Å; E196-L211 HydrophobicContact CB-CG 4.18Å; E196-L211 HydrophobicContact CG-CD1 4.04Å; E196-L211 HydrophobicContact CG-CD2 4.34Å; E196-L211 HydrophobicContact CG-CG 3.92Å; E196-R214 IonicContact OE1-CZ 3.38Å; E196-R214 IonicContact OE1-NH2 2.66Å; E196-R214 PolarHBondContact OE1-NH2 2.82Å; E196-R214 IonicContact OE2-CZ 3.37Å; E196-R214 IonicContact OE2-NH1 2.68Å; E196-R214 PolarHBondContact OE2-NH1 3.09Å; E196-R214 IonicContact OE2-NH2 2.77Å; E196-R214 PolarHBondContact OE2-NH2 2.84Å
197	R	93.4	Very high	92.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.9	-26.5	-175.7	-175.4	59.1	177.2	162.2	6.3	113.2	L50 R60 Y67 E172 M176 I179 I193 V194 E202	L50-R197 PolarHBondContact O-NH2 2.91Å; R60-R197 PolarHBondContact NH1-O 3.2Å; Y67-R197 HydrophobicContact CE1-CG 4.37Å; E172-R197 WeakPolarHBondContact OE1-CG 3.37Å; E172-R197 IonicContact OE1-CZ 3.6Å; E172-R197 IonicContact OE1-NE 2.7Å; E172-R197 PolarHBondContact OE1-NE 3.01Å; E172-R197 IonicContact OE1-NH2 3.73Å; E172-R197 PolarHBondContact OE1-NH2 3.12Å; E172-R197 IonicContact OE2-CZ 2.99Å; E172-R197 IonicContact OE2-NE 3.16Å; E172-R197 PolarHBondContact OE2-NE 3.31Å; E172-R197 IonicContact OE2-NH2 3.54Å; E172-R197 PolarHBondContact OE2-NH2 3.14Å; M176-R197 HydrophobicContact CG-CB 4.05Å; M176-R197 HydrophobicContact CG-CG 3.78Å; M176-R197 HydrophobicContact SD-CB 4.03Å; M176-R197 HydrophobicContact SD-CG 4Å; I179-R197 HydrophobicContact CD1-CB 4.47Å; I179-R197 HydrophobicContact CD1-CG 4.41Å; I193-R197 VanDerWaalsContact O-CB 3.27Å; I193-R197 WeakPolarHBondContact O-CB 3.2Å; I193-R197 PolarHBondContact O-N 2.85Å; V194-R197 PolarHBondContact O-N 2.94Å; R197-E202 PolarHBondContact NH1-O 3.5Å
198	K	92.1	Very high	92.7	Very high	37 Å²	37	39.6 Å²	39.6	16%	0.161	22%	0.221	C	C	.	.	H	α-helix	trans	-79.8	-32.2	170.6	-171.3	-175.5	-163.9	171.5	0	113.2	P57 Y67 E68 E71 V194 E196	P57-K198 WeakPolarHBondContact CB-O 3.47Å; P57-K198 VanDerWaalsContact CG-O 3.31Å; P57-K198 WeakPolarHBondContact CG-O 3.46Å; Y67-K198 HydrophobicContact CD1-CB 4Å; Y67-K198 HydrophobicContact CD1-CG 4.33Å; Y67-K198 HydrophobicContact CD2-CG 4.18Å; Y67-K198 HydrophobicContact CE1-CB 4.43Å; Y67-K198 HydrophobicContact CG-CB 4.12Å; Y67-K198 HydrophobicContact CG-CD 4.18Å; Y67-K198 HydrophobicContact CG-CG 3.92Å; E68-K198 WeakPolarHBondContact OE1-CE 3.47Å; E68-K198 IonicContact OE1-NZ 3.55Å; E68-K198 PolarHBondContact OE1-NZ 2.72Å; E71-K198 VanDerWaalsContact OE1-CD 3.23Å; E71-K198 WeakPolarHBondContact OE1-CD 3.42Å; E71-K198 WeakPolarHBondContact OE1-CE 3.5Å; E71-K198 IonicContact OE1-NZ 2.98Å; E71-K198 PolarHBondContact OE1-NZ 2.98Å; V194-K198 VanDerWaalsContact O-CB 3.26Å; V194-K198 WeakPolarHBondContact O-CB 3.34Å; V194-K198 PolarHBondContact O-N 2.99Å; E196-K198 VanDerWaalsContact C-N 3.25Å; E196-K198 PolarHBondContact O-N 3.12Å
199	S	90.1	Very high	92.7	Very high	96 Å²	96	40.9 Å²	40.9	67%	0.671	23%	0.229	S	C	*	.	H	α-helix	trans	-85.7	-16.8	179.8	-56.2	0	0	0	0	113.4	S195 E196	S195-S199 VanDerWaalsContact O-CB 3.29Å; S195-S199 WeakPolarHBondContact O-CB 3.42Å; S195-S199 PolarHBondContact O-N 2.67Å; S195-S199 PolarHBondContact O-OG 3.03Å; E196-S199 CarbonylContact O-C 3.58Å; E196-S199 PolarHBondContact O-N 3.35Å
200	S	88.4	Confident	92.6	Very high	17 Å²	17	39 Å²	39	12%	0.119	22%	0.218	C	C	.	.			trans	-118.5	133.1	-170.9	-173.8	0	0	0	0	113.3	P57 R60 E196 E202	P57-S200 WeakPolarHBondContact CG-O 3.45Å; R60-S200 PolarHBondContact NH2-O 3.4Å; E196-S200 WeakPolarHBondContact O-CB 3.36Å; E196-S200 PolarHBondContact O-N 2.97Å; S200-E202 VanDerWaalsContact C-N 3.35Å; S200-E202 WeakPolarHBondContact OG-CB 3.32Å; S200-E202 VanDerWaalsContact OG-CG 3.28Å; S200-E202 WeakPolarHBondContact OG-CG 3.25Å; S200-E202 PolarHBondContact OG-N 2.97Å
201	A	86.3	Confident	92.6	Very high	41 Å²	41	37 Å²	37	34%	0.339	21%	0.209	S	C	.	.			trans	-93.2	8.3	172.9	0	0	0	0	0	113.3
202	E	87.4	Confident	92.5	Very high	95 Å²	95	38 Å²	38	44%	0.444	21%	0.208	S	C	.	.	S	Bend	trans	-72.4	169	174.9	-59.5	-60.3	139.5	0	0	112.4	R197 S200	R197-E202 PolarHBondContact NH1-O 3.5Å; S200-E202 VanDerWaalsContact C-N 3.35Å; S200-E202 WeakPolarHBondContact OG-CB 3.32Å; S200-E202 VanDerWaalsContact OG-CG 3.28Å; S200-E202 WeakPolarHBondContact OG-CG 3.25Å; S200-E202 PolarHBondContact OG-N 2.97Å
203	D	90	Very high	92.4	Very high	49 Å²	49	42.3 Å²	42.3	26%	0.262	22%	0.22	S	C	.	.			trans	-74.5	179.7	168	78.5	13.2	0	0	0	112.9	H53 R205 G206 C207	H53-D203 IonicContact CE1-OD2 2.76Å; D203-R205 PolarHBondContact O-N 3.22Å; D203-R205 WeakPolarHBondContact OD1-CA 3.37Å; D203-R205 WeakPolarHBondContact OD1-CB 3.27Å; D203-R205 PolarHBondContact OD1-N 2.78Å; D203-G206 PolarHBondContact O-N 3.32Å; D203-G206 PolarHBondContact OD1-N 2.61Å; D203-C207 PolarHBondContact O-N 3.04Å
204	V	91.8	Very high	92.2	Very high	9 Å²	9	47.4 Å²	47.4	6%	0.055	24%	0.239	C	C	.	.	H	α-helix	trans	-54.2	-40.4	177.4	162.6	0	0	0	0	112.4	Q175 E178 I179 S208	Q175-V204 HydrophobicContact CB-CG2 3.91Å; Q175-V204 HydrophobicContact CG-CG2 4.39Å; Q175-V204 VanDerWaalsContact NE2-CG2 3.27Å; E178-V204 HydrophobicContact CB-CG1 4.15Å; E178-V204 HydrophobicContact CG-CG1 4.13Å; I179-V204 HydrophobicContact CD1-CG2 4.37Å; I179-V204 HydrophobicContact CG1-CB 4.09Å; I179-V204 HydrophobicContact CG1-CG1 3.77Å; I179-V204 HydrophobicContact CG1-CG2 4.07Å; V204-S208 WeakPolarHBondContact O-CB 3.48Å; V204-S208 PolarHBondContact O-N 3.36Å; V204-S208 PolarHBondContact O-OG 2.91Å
205	R	91.9	Very high	92	Very high	140 Å²	140	47.7 Å²	47.7	53%	0.528	24%	0.241	S	C	.	.	H	α-helix	trans	-72.5	-47.3	-177.7	-172.4	173	-55.3	-65.9	-10	110.3	D203 C207 S208 D209	D203-R205 PolarHBondContact O-N 3.22Å; D203-R205 WeakPolarHBondContact OD1-CA 3.37Å; D203-R205 WeakPolarHBondContact OD1-CB 3.27Å; D203-R205 PolarHBondContact OD1-N 2.78Å; R205-C207 VanDerWaalsContact C-N 3.33Å; R205-C207 PolarHBondContact O-N 2.86Å; R205-S208 PolarHBondContact O-N 2.65Å; R205-S208 VanDerWaalsContact O-N 3.08Å; R205-S208 PolarHBondContact O-OG 3.2Å; R205-D209 WeakPolarHBondContact CG-OD2 3.44Å; R205-D209 WeakPolarHBondContact O-CB 3.4Å; R205-D209 PolarHBondContact O-N 3.44Å
206	G	91.6	Very high	91.8	Very high	16 Å²	16	48.6 Å²	48.6	17%	0.165	24%	0.238	C	C	.	.	H	α-helix	trans	-57.5	-42.1	175.5	0	0	0	0	0	113	D203 A210	D203-G206 PolarHBondContact O-N 3.32Å; D203-G206 PolarHBondContact OD1-N 2.61Å; G206-A210 VanDerWaalsContact O-CB 3.24Å; G206-A210 WeakPolarHBondContact O-CB 3.38Å; G206-A210 PolarHBondContact O-N 2.9Å
207	C	93.1	Very high	91.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-47.8	170.8	-76	0	0	0	0	112.5	I179 E196 D203 R205 A210 L211	I179-C207 HydrophobicContact CD1-CB 3.75Å; I179-C207 HydrophobicContact CG1-CB 4.19Å; I179-C207 HydrophobicContact CG2-CB 4.17Å; E196-C207 HydrophobicContact CG-CB 4.37Å; D203-C207 PolarHBondContact O-N 3.04Å; R205-C207 VanDerWaalsContact C-N 3.33Å; R205-C207 PolarHBondContact O-N 2.86Å; C207-A210 PolarHBondContact O-N 3.5Å; C207-L211 PolarHBondContact O-N 2.99Å
208	S	94.5	Very high	90.8	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-39.6	-179.7	73.7	0	0	0	0	112.7	Q182 V183 V204 R205 L211 R212	Q182-S208 PolarHBondContact OE1-OG 2.92Å; V183-S208 WeakPolarHBondContact CG1-O 3.21Å; V204-S208 WeakPolarHBondContact O-CB 3.48Å; V204-S208 PolarHBondContact O-N 3.36Å; V204-S208 PolarHBondContact O-OG 2.91Å; R205-S208 PolarHBondContact O-N 2.65Å; R205-S208 VanDerWaalsContact O-N 3.08Å; R205-S208 PolarHBondContact O-OG 3.2Å; S208-L211 PolarHBondContact O-N 3.19Å; S208-R212 WeakPolarHBondContact O-CB 3.47Å; S208-R212 PolarHBondContact O-N 3.39Å
209	D	93.9	Very high	90.2	Very high	54 Å²	54	60.1 Å²	60.1	29%	0.289	30%	0.295	S	S	.	.	H	α-helix	trans	-74.5	-27.2	177.9	-70	-28.9	0	0	0	111.9	R205 R212 R213	R205-D209 WeakPolarHBondContact CG-OD2 3.44Å; R205-D209 WeakPolarHBondContact O-CB 3.4Å; R205-D209 PolarHBondContact O-N 3.44Å; D209-R212 IonicContact OD1-CZ 3.11Å; D209-R212 IonicContact OD1-NH1 2.72Å; D209-R212 PolarHBondContact OD1-NH1 3.04Å; D209-R213 WeakPolarHBondContact O-CB 3.31Å; D209-R213 VanDerWaalsContact O-CG 3.28Å; D209-R213 WeakPolarHBondContact O-CG 3.36Å; D209-R213 PolarHBondContact O-N 3.23Å; D209-R213 VanDerWaalsContact O-N 3.12Å; D209-R213 PolarHBondContact O-NE 3.22Å
210	A	93.1	Very high	89.6	Confident	19 Å²	19	61.6 Å²	61.6	16%	0.157	29%	0.291	C	S	.	.	H	α-helix	trans	-67.6	-44.1	169.4	0	0	0	0	0	112.1	E196 G206 C207 R213 R214	E196-A210 WeakPolarHBondContact OE1-CB 3.23Å; G206-A210 VanDerWaalsContact O-CB 3.24Å; G206-A210 WeakPolarHBondContact O-CB 3.38Å; G206-A210 PolarHBondContact O-N 2.9Å; C207-A210 PolarHBondContact O-N 3.5Å; A210-R213 VanDerWaalsContact CA-NH2 3.29Å; A210-R214 WeakPolarHBondContact O-CB 3.15Å; A210-R214 PolarHBondContact O-N 3.47Å
211	L	94.8	Very high	89.2	Confident	1 Å²	1	66 Å²	66	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-64.1	-44.5	173.4	-76.2	162.9	0	0	0	111.8	I179 V183 Y188 I193 E196 C207 S208 R214 A215	I179-L211 HydrophobicContact CG2-CD1 3.91Å; V183-L211 HydrophobicContact CG1-CB 4.04Å; V183-L211 HydrophobicContact CG2-CB 4.41Å; V183-L211 HydrophobicContact CG2-CD1 4.29Å; Y188-L211 HydrophobicContact CD1-CD2 4.25Å; Y188-L211 HydrophobicContact CD2-CB 4.34Å; Y188-L211 HydrophobicContact CD2-CD2 4.25Å; Y188-L211 HydrophobicContact CE1-CD2 4.01Å; Y188-L211 HydrophobicContact CE2-CB 3.92Å; Y188-L211 HydrophobicContact CE2-CD2 4Å; Y188-L211 HydrophobicContact CG-CD2 4.37Å; Y188-L211 PolarHBondContact OH-O 2.95Å; I193-L211 HydrophobicContact CD1-CD1 3.54Å; E196-L211 HydrophobicContact CB-CD1 4.03Å; E196-L211 HydrophobicContact CB-CD2 4.22Å; E196-L211 HydrophobicContact CB-CG 4.18Å; E196-L211 HydrophobicContact CG-CD1 4.04Å; E196-L211 HydrophobicContact CG-CD2 4.34Å; E196-L211 HydrophobicContact CG-CG 3.92Å; C207-L211 PolarHBondContact O-N 2.99Å; S208-L211 PolarHBondContact O-N 3.19Å; L211-R214 WeakPolarHBondContact O-CB 3.46Å; L211-R214 PolarHBondContact O-N 3.17Å; L211-A215 PolarHBondContact O-N 2.56Å
212	R	94.3	Very high	88.9	Confident	73 Å²	73	68.2 Å²	68.2	28%	0.275	32%	0.322	S	S	.	.	H	α-helix	trans	-59.3	-50.9	178.2	-168.4	-179.1	-62.6	118.7	11.8	111.8	Q182 V183 S208 D209 R214 A215 E216	Q182-R212 PolarHBondContact O-NH2 3.01Å; V183-R212 HydrophobicContact CG1-CB 4.39Å; S208-R212 WeakPolarHBondContact O-CB 3.47Å; S208-R212 PolarHBondContact O-N 3.39Å; D209-R212 IonicContact OD1-CZ 3.11Å; D209-R212 IonicContact OD1-NH1 2.72Å; D209-R212 PolarHBondContact OD1-NH1 3.04Å; R212-R214 VanDerWaalsContact C-N 3.26Å; R212-R214 PolarHBondContact O-N 2.67Å; R212-A215 WeakPolarHBondContact O-CB 3Å; R212-A215 PolarHBondContact O-N 2.72Å; R212-A215 VanDerWaalsContact O-N 3.07Å; R212-E216 HydrophobicContact CG-CG 4.5Å; R212-E216 WeakPolarHBondContact CG-OE1 3.35Å; R212-E216 WeakPolarHBondContact O-CG 3.44Å; R212-E216 PolarHBondContact O-N 2.7Å
213	R	92.9	Very high	88.6	Confident	159 Å²	159	65.9 Å²	65.9	60%	0.6	32%	0.319	S	S	*	.	H	α-helix	trans	-59.4	-34.6	175.6	-73.2	175	-68.6	140.7	-7.2	112.9	D209 A210 G217	D209-R213 WeakPolarHBondContact O-CB 3.31Å; D209-R213 VanDerWaalsContact O-CG 3.28Å; D209-R213 WeakPolarHBondContact O-CG 3.36Å; D209-R213 PolarHBondContact O-N 3.23Å; D209-R213 VanDerWaalsContact O-N 3.12Å; D209-R213 PolarHBondContact O-NE 3.22Å; A210-R213 VanDerWaalsContact CA-NH2 3.29Å; R213-G217 PolarHBondContact O-N 2.83Å
214	R	92.6	Very high	88.2	Confident	106 Å²	106	65.5 Å²	65.5	40%	0.4	32%	0.32	S	S	.	.	H	α-helix	trans	-69	-34.9	176	-171.9	-177.7	-60.4	151.3	9	112.3	E196 A210 L211 R212 R218	E196-R214 IonicContact OE1-CZ 3.38Å; E196-R214 IonicContact OE1-NH2 2.66Å; E196-R214 PolarHBondContact OE1-NH2 2.82Å; E196-R214 IonicContact OE2-CZ 3.37Å; E196-R214 IonicContact OE2-NH1 2.68Å; E196-R214 PolarHBondContact OE2-NH1 3.09Å; E196-R214 IonicContact OE2-NH2 2.77Å; E196-R214 PolarHBondContact OE2-NH2 2.84Å; A210-R214 WeakPolarHBondContact O-CB 3.15Å; A210-R214 PolarHBondContact O-N 3.47Å; L211-R214 WeakPolarHBondContact O-CB 3.46Å; L211-R214 PolarHBondContact O-N 3.17Å; R212-R214 VanDerWaalsContact C-N 3.26Å; R212-R214 PolarHBondContact O-N 2.67Å; R214-R218 WeakPolarHBondContact O-CG 3.43Å; R214-R218 PolarHBondContact O-N 3.14Å
215	A	91	Very high	87.6	Confident	7 Å²	7	71.6 Å²	71.6	6%	0.058	35%	0.35	C	S	.	.	H	α-helix	trans	-70.7	-49.7	173.4	0	0	0	0	0	111.4	K186 Y188 L211 R212 G217 R218 E219	K186-A215 HydrophobicContact CB-CB 3.74Å; K186-A215 HydrophobicContact CD-CB 3.71Å; K186-A215 HydrophobicContact CG-CB 3.62Å; Y188-A215 HydrophobicContact CE2-CB 4.07Å; Y188-A215 PolarHBondContact OH-N 3.2Å; L211-A215 PolarHBondContact O-N 2.56Å; R212-A215 WeakPolarHBondContact O-CB 3Å; R212-A215 PolarHBondContact O-N 2.72Å; R212-A215 VanDerWaalsContact O-N 3.07Å; A215-G217 VanDerWaalsContact C-N 3.29Å; A215-G217 PolarHBondContact O-N 3.31Å; A215-R218 CarbonylContact O-C 3.54Å; A215-R218 WeakPolarHBondContact O-CA 3.43Å; A215-R218 WeakPolarHBondContact O-CB 3.32Å; A215-R218 PolarHBondContact O-N 2.84Å; A215-E219 WeakPolarHBondContact O-CG 3.37Å; A215-E219 PolarHBondContact O-N 3.35Å
216	E	89.9	Confident	87	Confident	85 Å²	85	68 Å²	68	40%	0.397	35%	0.345	S	S	.	.	H	α-helix	trans	-57.8	-39.8	177.6	-69.1	163.3	170.1	0	0	112	R212 R218 E219 H220	R212-E216 HydrophobicContact CG-CG 4.5Å; R212-E216 WeakPolarHBondContact CG-OE1 3.35Å; R212-E216 WeakPolarHBondContact O-CG 3.44Å; R212-E216 PolarHBondContact O-N 2.7Å; E216-R218 VanDerWaalsContact C-N 3.34Å; E216-R218 PolarHBondContact O-N 3.33Å; E216-E219 PolarHBondContact O-N 3.08Å; E216-H220 WeakPolarHBondContact O-CB 3.5Å; E216-H220 PolarHBondContact O-N 2.78Å
217	G	85.1	Confident	86.4	Confident	34 Å²	34	75.7 Å²	75.7	35%	0.351	37%	0.37	S	S	.	.	H	α-helix	trans	-62.1	-38	172.7	0	0	0	0	0	113.3	R213 A215 L221	R213-G217 PolarHBondContact O-N 2.83Å; A215-G217 VanDerWaalsContact C-N 3.29Å; A215-G217 PolarHBondContact O-N 3.31Å; G217-L221 WeakPolarHBondContact O-CB 3.45Å; G217-L221 WeakPolarHBondContact O-CD1 3.39Å; G217-L221 VanDerWaalsContact O-CG 3.24Å; G217-L221 WeakPolarHBondContact O-CG 3.43Å; G217-L221 PolarHBondContact O-N 3.17Å
218	R	81.3	Confident	85.7	Confident	164 Å²	164	80.1 Å²	80.1	62%	0.619	40%	0.396	S	S	*	.	H	α-helix	trans	-69.5	-43.6	174	-71.7	175.1	178.3	-145.8	0.4	111.4	R214 A215 E216 H220 L221 T222	R214-R218 WeakPolarHBondContact O-CG 3.43Å; R214-R218 PolarHBondContact O-N 3.14Å; A215-R218 CarbonylContact O-C 3.54Å; A215-R218 WeakPolarHBondContact O-CA 3.43Å; A215-R218 WeakPolarHBondContact O-CB 3.32Å; A215-R218 PolarHBondContact O-N 2.84Å; E216-R218 VanDerWaalsContact C-N 3.34Å; E216-R218 PolarHBondContact O-N 3.33Å; R218-H220 VanDerWaalsContact C-N 3.35Å; R218-H220 PolarHBondContact O-N 3.45Å; R218-L221 PolarHBondContact O-N 2.93Å; R218-T222 WeakPolarHBondContact O-CB 3.36Å; R218-T222 PolarHBondContact O-N 3.36Å; R218-T222 PolarHBondContact O-OG1 3.11Å
219	E	80.9	Confident	84.7	Confident	98 Å²	98	83 Å²	83	46%	0.458	42%	0.421	S	S	.	.	H	α-helix	trans	-56.8	-47.2	175.1	-70.7	162.2	-152.4	0	0	111.2	K186 A215 E216 T222 A223	K186-E219 WeakPolarHBondContact CD-OE1 3.1Å; K186-E219 WeakPolarHBondContact CE-OE1 3.26Å; K186-E219 VanDerWaalsContact NZ-CD 3.32Å; K186-E219 IonicContact NZ-OE1 3.94Å; K186-E219 PolarHBondContact NZ-OE1 3.29Å; K186-E219 IonicContact NZ-OE2 3.97Å; K186-E219 PolarHBondContact NZ-OE2 3.44Å; K186-E219 VanDerWaalsContact NZ-OE2 3.11Å; A215-E219 WeakPolarHBondContact O-CG 3.37Å; A215-E219 PolarHBondContact O-N 3.35Å; E216-E219 PolarHBondContact O-N 3.08Å; E219-T222 PolarHBondContact O-N 2.97Å; E219-A223 WeakPolarHBondContact O-CB 3.5Å; E219-A223 PolarHBondContact O-N 3.07Å
220	H	77.3	Confident	83.8	Confident	126 Å²	126	86.2 Å²	86.2	58%	0.583	44%	0.437	S	S	*	.	H	α-helix	trans	-66.3	-40.5	178.2	-171.4	-87.6	0	0	0	112.9	E216 R218 S224	E216-H220 WeakPolarHBondContact O-CB 3.5Å; E216-H220 PolarHBondContact O-N 2.78Å; R218-H220 VanDerWaalsContact C-N 3.35Å; R218-H220 PolarHBondContact O-N 3.45Å; H220-S224 VanDerWaalsContact O-CB 3.31Å; H220-S224 WeakPolarHBondContact O-CB 3.38Å; H220-S224 PolarHBondContact O-N 2.87Å; H220-S224 PolarHBondContact O-OG 3.07Å
221	L	78.8	Confident	82.8	Confident	111 Å²	111	92 Å²	92	58%	0.581	46%	0.461	S	S	*	.	H	α-helix	trans	-62.6	-46.8	173.7	-76.2	168.6	0	0	0	111.4	G217 R218 S224 M225	G217-L221 WeakPolarHBondContact O-CB 3.45Å; G217-L221 WeakPolarHBondContact O-CD1 3.39Å; G217-L221 VanDerWaalsContact O-CG 3.24Å; G217-L221 WeakPolarHBondContact O-CG 3.43Å; G217-L221 PolarHBondContact O-N 3.17Å; R218-L221 PolarHBondContact O-N 2.93Å; L221-S224 WeakPolarHBondContact O-CB 3.44Å; L221-S224 PolarHBondContact O-N 3.34Å; L221-M225 WeakPolarHBondContact O-CG 3.49Å; L221-M225 PolarHBondContact O-N 3.28Å
222	T	81.5	Confident	81.6	Confident	86 Å²	86	99 Å²	99	53%	0.528	49%	0.491	S	S	.	.	H	α-helix	trans	-62	-44.7	177.4	-60	0	0	0	0	111.5	R218 E219 S224 M225 S226	R218-T222 WeakPolarHBondContact O-CB 3.36Å; R218-T222 PolarHBondContact O-N 3.36Å; R218-T222 PolarHBondContact O-OG1 3.11Å; E219-T222 PolarHBondContact O-N 2.97Å; T222-S224 VanDerWaalsContact C-N 3.31Å; T222-S224 PolarHBondContact O-N 3.35Å; T222-M225 PolarHBondContact O-N 3.19Å; T222-S226 WeakPolarHBondContact O-CB 3.41Å; T222-S226 PolarHBondContact O-N 3.48Å; T222-S226 PolarHBondContact O-OG 3.17Å; T222-S226 VanDerWaalsContact O-OG 3.12Å
223	A	79.6	Confident	80.5	Confident	46 Å²	46	97.1 Å²	97.1	38%	0.38	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-38.6	175.4	0	0	0	0	0	112.3	E219 S226 R227	E219-A223 WeakPolarHBondContact O-CB 3.5Å; E219-A223 PolarHBondContact O-N 3.07Å; A223-S226 PolarHBondContact O-N 2.97Å; A223-R227 WeakPolarHBondContact O-CG 3.43Å; A223-R227 PolarHBondContact O-N 3.17Å
224	S	82.8	Confident	79.4	Confident	41 Å²	41	91.9 Å²	91.9	29%	0.287	48%	0.48	S	S	.	.	H	α-helix	trans	-66.8	-45	176.1	-59.4	0	0	0	0	111.9	H220 L221 T222 S226 R227 V228	H220-S224 VanDerWaalsContact O-CB 3.31Å; H220-S224 WeakPolarHBondContact O-CB 3.38Å; H220-S224 PolarHBondContact O-N 2.87Å; H220-S224 PolarHBondContact O-OG 3.07Å; L221-S224 WeakPolarHBondContact O-CB 3.44Å; L221-S224 PolarHBondContact O-N 3.34Å; T222-S224 VanDerWaalsContact C-N 3.31Å; T222-S224 PolarHBondContact O-N 3.35Å; S224-S226 PolarHBondContact O-N 2.6Å; S224-R227 PolarHBondContact O-N 3.04Å; S224-V228 WeakPolarHBondContact O-CG2 3.5Å; S224-V228 PolarHBondContact O-N 3.08Å
225	M	78.1	Confident	78.2	Confident	138 Å²	138	90.5 Å²	90.5	68%	0.68	49%	0.487	S	S	*	.	H	α-helix	trans	-61.2	-42.2	174.9	-72	178.6	69.5	0	0	111.9	L221 T222 R227 V228 A229	L221-M225 WeakPolarHBondContact O-CG 3.49Å; L221-M225 PolarHBondContact O-N 3.28Å; T222-M225 PolarHBondContact O-N 3.19Å; M225-R227 PolarHBondContact O-N 3Å; M225-V228 PolarHBondContact O-N 3.43Å; M225-A229 WeakPolarHBondContact O-CB 3.27Å; M225-A229 PolarHBondContact O-N 2.87Å
226	S	79.4	Confident	77.2	Confident	63 Å²	63	96.6 Å²	96.6	44%	0.441	51%	0.514	S	S	.	.	H	α-helix	trans	-61.2	-41.4	175	-67.3	0	0	0	0	112.5	T222 A223 S224 A229 L230	T222-S226 WeakPolarHBondContact O-CB 3.41Å; T222-S226 PolarHBondContact O-N 3.48Å; T222-S226 PolarHBondContact O-OG 3.17Å; T222-S226 VanDerWaalsContact O-OG 3.12Å; A223-S226 PolarHBondContact O-N 2.97Å; S224-S226 PolarHBondContact O-N 2.6Å; S226-A229 PolarHBondContact O-N 2.9Å; S226-L230 WeakPolarHBondContact O-CB 3.24Å; S226-L230 VanDerWaalsContact O-CG 3.31Å; S226-L230 WeakPolarHBondContact O-CG 3.41Å; S226-L230 PolarHBondContact O-N 3.4Å
227	R	78.9	Confident	76.1	Confident	178 Å²	178	99.7 Å²	99.7	67%	0.672	52%	0.522	S	S	*	.	H	α-helix	trans	-61.9	-45.2	174.1	-73.3	171.3	178.7	177.9	0.3	111.9	A223 S224 M225 L230 Q231	A223-R227 WeakPolarHBondContact O-CG 3.43Å; A223-R227 PolarHBondContact O-N 3.17Å; S224-R227 PolarHBondContact O-N 3.04Å; M225-R227 PolarHBondContact O-N 3Å; R227-L230 PolarHBondContact O-N 2.8Å; R227-Q231 WeakPolarHBondContact O-CB 3.45Å; R227-Q231 PolarHBondContact O-N 3.48Å
228	V	78.3	Confident	75.1	Confident	93 Å²	93	100.9 Å²	100.9	56%	0.564	53%	0.529	S	S	*	.	H	α-helix	trans	-65	-40	177.3	173.3	0	0	0	0	111.8	S224 M225 Q231 K232	S224-V228 WeakPolarHBondContact O-CG2 3.5Å; S224-V228 PolarHBondContact O-N 3.08Å; M225-V228 PolarHBondContact O-N 3.43Å; V228-Q231 PolarHBondContact O-N 3.11Å; V228-K232 WeakPolarHBondContact O-CB 3.43Å; V228-K232 PolarHBondContact O-N 2.88Å
229	A	74.8	Confident	74.2	Confident	62 Å²	62	96.2 Å²	96.2	51%	0.512	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-43.6	175.9	0	0	0	0	0	112	M225 S226 K232 S233	M225-A229 WeakPolarHBondContact O-CB 3.27Å; M225-A229 PolarHBondContact O-N 2.87Å; S226-A229 PolarHBondContact O-N 2.9Å; A229-K232 PolarHBondContact O-N 3.18Å; A229-S233 PolarHBondContact O-N 2.96Å
230	L	74.3	Confident	73.2	Confident	120 Å²	120	99.8 Å²	99.8	63%	0.628	54%	0.539	S	S	*	.	H	α-helix	trans	-61.4	-45.8	173.8	-73.5	170	0	0	0	111.4	S226 R227 K232 S233 A234	S226-L230 WeakPolarHBondContact O-CB 3.24Å; S226-L230 VanDerWaalsContact O-CG 3.31Å; S226-L230 WeakPolarHBondContact O-CG 3.41Å; S226-L230 PolarHBondContact O-N 3.4Å; R227-L230 PolarHBondContact O-N 2.8Å; L230-K232 PolarHBondContact O-N 2.89Å; L230-S233 PolarHBondContact O-N 3.26Å; L230-S233 PolarHBondContact O-OG 3.31Å; L230-A234 PolarHBondContact O-N 3.35Å
231	Q	73.1	Confident	72.3	Confident	141 Å²	141	98.8 Å²	98.8	66%	0.659	54%	0.538	S	S	*	.	H	α-helix	trans	-61	-43.1	176.9	-174	177.9	-1	0	0	112.1	R227 V228 S233 A234 S235	R227-Q231 WeakPolarHBondContact O-CB 3.45Å; R227-Q231 PolarHBondContact O-N 3.48Å; V228-Q231 PolarHBondContact O-N 3.11Å; Q231-S233 VanDerWaalsContact C-N 3.35Å; Q231-S233 PolarHBondContact O-N 3.49Å; Q231-A234 PolarHBondContact O-N 3.44Å; Q231-S235 PolarHBondContact O-N 3.45Å
232	K	69.3	Low	71.2	Confident	149 Å²	149	103.7 Å²	103.7	65%	0.648	55%	0.55	S	S	*	*	H	α-helix	trans	-59.4	-45.5	173.4	-175	177.3	176.6	-177.8	0	111.1	V228 A229 L230 A234 S235 E236	V228-K232 WeakPolarHBondContact O-CB 3.43Å; V228-K232 PolarHBondContact O-N 2.88Å; A229-K232 PolarHBondContact O-N 3.18Å; L230-K232 PolarHBondContact O-N 2.89Å; K232-A234 VanDerWaalsContact C-N 3.27Å; K232-A234 PolarHBondContact O-N 2.72Å; K232-S235 PolarHBondContact O-N 3.11Å; K232-E236 WeakPolarHBondContact O-CB 3.38Å; K232-E236 PolarHBondContact O-N 3.5Å
233	S	70.6	Confident	69.9	Low	33 Å²	33	109.3 Å²	109.3	23%	0.231	56%	0.563	C	S	.	*	H	α-helix	trans	-62.6	-32.5	177.8	85	0	0	0	0	113.2	A229 L230 Q231 R237	A229-S233 PolarHBondContact O-N 2.96Å; L230-S233 PolarHBondContact O-N 3.26Å; L230-S233 PolarHBondContact O-OG 3.31Å; Q231-S233 VanDerWaalsContact C-N 3.35Å; Q231-S233 PolarHBondContact O-N 3.49Å; S233-R237 WeakPolarHBondContact O-CG 3.47Å; S233-R237 VanDerWaalsContact O-CZ 3.28Å; S233-R237 PolarHBondContact O-N 2.87Å; S233-R237 PolarHBondContact O-NH1 2.86Å; S233-R237 PolarHBondContact OG-NH2 3.01Å
234	A	68.8	Low	68.7	Low	48 Å²	48	114.5 Å²	114.5	40%	0.397	58%	0.577	S	S	.	*	H	α-helix	trans	-73	-43.8	175	0	0	0	0	0	111.7	L230 Q231 K232 E236 R237 A238	L230-A234 PolarHBondContact O-N 3.35Å; Q231-A234 PolarHBondContact O-N 3.44Å; K232-A234 VanDerWaalsContact C-N 3.27Å; K232-A234 PolarHBondContact O-N 2.72Å; A234-E236 VanDerWaalsContact C-N 3.3Å; A234-E236 PolarHBondContact O-N 3.3Å; A234-R237 PolarHBondContact O-N 3.45Å; A234-A238 PolarHBondContact O-N 3.04Å
235	S	68.8	Low	67.1	Low	78 Å²	78	117.9 Å²	117.9	55%	0.545	60%	0.598	S	S	.	*	H	α-helix	trans	-61.3	-38.1	175.3	-168.5	0	0	0	0	112.3	Q231 K232 A238 A239	Q231-S235 PolarHBondContact O-N 3.45Å; K232-S235 PolarHBondContact O-N 3.11Å; S235-A238 PolarHBondContact O-N 3.46Å; S235-A239 WeakPolarHBondContact O-CB 3.42Å; S235-A239 PolarHBondContact O-N 2.95Å
236	E	69.5	Low	65.9	Low	134 Å²	134	122.7 Å²	122.7	63%	0.626	61%	0.608	S	S	*	*	H	α-helix	trans	-68.2	-37.5	179.4	-167.5	175.9	149.4	0	0	112.3	K232 A234 K240	K232-E236 WeakPolarHBondContact O-CB 3.38Å; K232-E236 PolarHBondContact O-N 3.5Å; A234-E236 VanDerWaalsContact C-N 3.3Å; A234-E236 PolarHBondContact O-N 3.3Å; E236-K240 PolarHBondContact O-N 3.34Å
237	R	67.9	Low	64.6	Low	150 Å²	150	126.1 Å²	126.1	57%	0.566	63%	0.627	S	S	*	*	H	α-helix	trans	-64	-50.8	170.3	-66.3	177.9	-146.6	101.2	11.7	111	S233 A234 A239 K240 D241	S233-R237 WeakPolarHBondContact O-CG 3.47Å; S233-R237 VanDerWaalsContact O-CZ 3.28Å; S233-R237 PolarHBondContact O-N 2.87Å; S233-R237 PolarHBondContact O-NH1 2.86Å; S233-R237 PolarHBondContact OG-NH2 3.01Å; A234-R237 PolarHBondContact O-N 3.45Å; R237-A239 VanDerWaalsContact C-N 3.34Å; R237-A239 PolarHBondContact O-N 3.31Å; R237-K240 WeakPolarHBondContact O-CB 3.45Å; R237-K240 PolarHBondContact O-N 2.9Å; R237-D241 PolarHBondContact O-N 3.43Å
238	A	63.7	Low	63.4	Low	60 Å²	60	123.6 Å²	123.6	50%	0.496	63%	0.631	S	S	.	*	H	α-helix	trans	-61.1	-38.7	-178.4	0	0	0	0	0	113.2	A234 S235 K240 D241 Y242	A234-A238 PolarHBondContact O-N 3.04Å; S235-A238 PolarHBondContact O-N 3.46Å; A238-K240 VanDerWaalsContact C-N 3.28Å; A238-K240 PolarHBondContact O-N 3.33Å; A238-D241 PolarHBondContact O-N 2.9Å; A238-Y242 PolarHBondContact O-N 3.06Å
239	A	62.4	Low	61.9	Low	65 Å²	65	128.7 Å²	128.7	54%	0.537	65%	0.646	S	S	.	*	H	α-helix	trans	-63.1	-35.1	174.9	0	0	0	0	0	112.4	S235 R237 Y242	S235-A239 WeakPolarHBondContact O-CB 3.42Å; S235-A239 PolarHBondContact O-N 2.95Å; R237-A239 VanDerWaalsContact C-N 3.34Å; R237-A239 PolarHBondContact O-N 3.31Å; A239-Y242 PolarHBondContact O-N 2.66Å
240	K	58.7	Low	60.5	Low	174 Å²	174	131.8 Å²	131.8	76%	0.757	66%	0.66	S	S	*	*	H	α-helix	trans	-70.7	-33.5	179	-157.4	167.9	-172.3	170.1	0	112.6	E236 R237 A238 Y242	E236-K240 PolarHBondContact O-N 3.34Å; R237-K240 WeakPolarHBondContact O-CB 3.45Å; R237-K240 PolarHBondContact O-N 2.9Å; A238-K240 VanDerWaalsContact C-N 3.28Å; A238-K240 PolarHBondContact O-N 3.33Å; K240-Y242 VanDerWaalsContact C-N 3.34Å
241	D	59.2	Low	58.8	Low	104 Å²	104	132.1 Å²	132.1	56%	0.556	67%	0.673	S	S	*	*	H	α-helix	trans	-72.1	-24.5	174.4	-83.9	-56.2	0	0	0	113.9	R237 A238 Y243 K244	R237-D241 PolarHBondContact O-N 3.43Å; A238-D241 PolarHBondContact O-N 2.9Å; D241-Y243 VanDerWaalsContact C-N 3.35Å; D241-K244 IonicContact OD1-NZ 3.83Å
242	Y	54.7	Low	57.4	Low	215 Å²	215	137.2 Å²	137.2	84%	0.843	69%	0.686	S	S	*	*	H	α-helix	trans	-75.5	-22.4	178.5	-145.8	-94.4	0	0	0	113	A238 A239 K240 K244	A238-Y242 PolarHBondContact O-N 3.06Å; A239-Y242 PolarHBondContact O-N 2.66Å; K240-Y242 VanDerWaalsContact C-N 3.34Å; Y242-K244 PolarHBondContact O-N 3.19Å
243	Y	54.6	Low	56.3	Low	204 Å²	204	135.2 Å²	135.2	80%	0.8	69%	0.691	S	S	*	*			trans	-85.9	48.9	-178.9	-144.1	-88.1	0	0	0	113.1	D241 P245	D241-Y243 VanDerWaalsContact C-N 3.35Å; Y243-P245 WeakPolarHBondContact O-CD 3.33Å
244	K	55.2	Low	54.8	Low	155 Å²	155	139.6 Å²	139.6	67%	0.674	72%	0.716	S	S	*	*			trans	-90.6	112.1	169.6	-74.5	175.8	-176.6	164.6	0	109.5	D241 Y242 R246	D241-K244 IonicContact OD1-NZ 3.83Å; Y242-K244 PolarHBondContact O-N 3.19Å; K244-R246 PolarHBondContact O-N 2.98Å
245	P	49.8	Very low	53.6	Low	112 Å²	112	144.1 Å²	144.1	73%	0.727	73%	0.733	S	S	*	*			trans	-60.6	128.2	179	-23.3	34.6	0	0	0	111.3	Y243 V247	Y243-P245 WeakPolarHBondContact O-CD 3.33Å; P245-V247 PolarHBondContact O-N 3.37Å
246	R	53	Low	52.3	Low	238 Å²	238	144.5 Å²	144.5	90%	0.898	74%	0.741	S	S	*	*			trans	-68.6	114.5	169.3	-74.4	-173.5	176.7	-171.7	-0.1	108.5	K244 T248	K244-R246 PolarHBondContact O-N 2.98Å; R246-T248 PolarHBondContact O-N 2.88Å
247	V	51.8	Low	50.6	Low	136 Å²	136	148.2 Å²	148.2	82%	0.824	75%	0.751	S	S	*	*			trans	-69.8	102.8	179.2	-178.4	0	0	0	0	109.9	P245	P245-V247 PolarHBondContact O-N 3.37Å
248	T	53.5	Low	49.2	Very low	125 Å²	125	146.3 Å²	146.3	77%	0.767	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-75.2	140.4	164	41.5	0	0	0	0	109.8	R246	R246-T248 PolarHBondContact O-N 2.88Å
249	K	46.9	Very low	48	Very low	199 Å²	199	147.8 Å²	147.8	87%	0.865	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-76.5	129.6	-175.4	-62.4	177.4	-178.3	177.1	0	111.1
250	P	45.6	Very low	47	Very low	127 Å²	127	151.9 Å²	151.9	83%	0.825	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-74.3	151.7	165.7	-13.5	29.8	0	0	0	111.8
251	S	38.6	Very low	46.1	Very low	127 Å²	127	153.5 Å²	153.5	89%	0.888	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-100.8	167.4	174	-67.1	0	0	0	0	112.2
252	R	43.8	Very low	45.1	Very low	249 Å²	249	154.4 Å²	154.4	94%	0.94	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-89	133.2	-173	-77.1	173.2	146.9	-166.7	-6.8	114.6
253	S	44.5	Very low	44.4	Very low	106 Å²	106	148.2 Å²	148.2	74%	0.741	75%	0.752	S	S	*	*			trans	-171.1	123.6	141.2	48.6	0	0	0	0	107.7
254	V	40	Very low	43.5	Very low	125 Å²	125	148.9 Å²	148.9	76%	0.758	75%	0.753	S	S	*	*				67.6	119.8	66.1	174	0	0	0	0	110.8
255	D	43.2	Very low	42.8	Very low	144 Å²	144	150.8 Å²	150.8	77%	0.77	76%	0.761	S	S	*	*			cis	-164.3	-178.5	-11.3	-113.9	-40.1	0	0	0	111.5
256	A	40.7	Very low	42.8	Very low	86 Å²	86	150.6 Å²	150.6	71%	0.711	76%	0.76	S	S	*	*			trans	74.5	119.1	168.4	0	0	0	0	0	117.7
257	Y	34.4	Very low	42.8	Very low	212 Å²	212	144.7 Å²	144.7	83%	0.831	75%	0.753	S	S	*	*				85.2	131.9	73.7	-123.4	-115.9	0	0	0	112.1
258	D	38.6	Very low	42.4	Very low	110 Å²	110	145.2 Å²	145.2	59%	0.588	75%	0.75	S	S	*	*			cis	-141	173.2	11.7	-158	0.1	0	0	0	113.2
259	S	39.3	Very low	41.6	Very low	90 Å²	90	148.1 Å²	148.1	63%	0.629	75%	0.752	S	S	*	*			trans	-31.8	169.8	166.6	-52.1	0	0	0	0	117.8
260	Y	40.1	Very low	41.3	Very low	152 Å²	152	143.3 Å²	143.3	60%	0.596	75%	0.749	S	S	*	*			cis	-153.9	166.4	24.2	-168.5	-118.3	0	0	0	113.2	E262	Y260-E262 VanDerWaalsContact CZ-OE2 3.3Å; Y260-E262 PolarHBondContact OH-OE2 2.87Å
261	W	40	Very low	40.8	Very low	208 Å²	208	142.9 Å²	142.9	79%	0.788	75%	0.749	S	S	*	*			trans	74.9	159.2	176.5	-68.4	177.6	0	0	0	120.5
262	E	39	Very low	40.7	Very low	123 Å²	123	145 Å²	145	58%	0.575	75%	0.749	S	S	*	*				165.5	110.4	-55.8	170.7	162	-134.9	0	0	111.2	Y260	Y260-E262 VanDerWaalsContact CZ-OE2 3.3Å; Y260-E262 PolarHBondContact OH-OE2 2.87Å
263	S	38.7	Very low	40.4	Very low	85 Å²	85	139 Å²	139	59%	0.594	75%	0.746	S	S	*	*				179	118.3	127.3	-90.1	0	0	0	0	114.5
264	R	35.8	Very low	39.8	Very low	218 Å²	218	140.7 Å²	140.7	82%	0.823	75%	0.746	S	S	*	*			trans	52.7	102.9	139.7	-74.4	171.5	-83.1	-117	-8	121.4
265	K	41.1	Very low	39.6	Very low	194 Å²	194	145.4 Å²	145.4	84%	0.843	75%	0.75	S	S	*	*			trans	-72.4	179	140	-79.7	175.3	-177.5	173	0	109.8
266	P	49.6	Very low	39.1	Very low	109 Å²	109	148 Å²	148	71%	0.708	75%	0.754	S	S	*	*			cis	-150.4	177.9	26.5	45	-24.7	0	0	0	120
267	P	54.2	Low	38.9	Very low	114 Å²	114	151.3 Å²	151.3	74%	0.74	76%	0.755	S	S	*	*			trans	-112.7	133.1	157.3	36.6	-26.1	0	0	0	113.3
268	L	41.9	Very low	39.3	Very low	147 Å²	147	146.4 Å²	146.4	77%	0.77	75%	0.749	S	S	*	*			trans	-157.6	156.7	173.3	-67.7	178.5	0	0	0	108
269	K	37.4	Very low	39	Very low	186 Å²	186	146.8 Å²	146.8	81%	0.809	76%	0.756	S	S	*	*			cis	-162.8	158	-25.9	-118.9	-172.9	-175.9	-176.3	0	106.8
270	A	40.1	Very low	38.6	Very low	97 Å²	97	147.2 Å²	147.2	80%	0.802	77%	0.765	S	S	*	*			trans	-88.5	150.2	161.8	0	0	0	0	0	110.6
271	S	35.3	Very low	38.2	Very low	119 Å²	119	145.1 Å²	145.1	83%	0.832	78%	0.778	S	S	*	*			trans	-141.6	151.1	175.4	-74.2	0	0	0	0	111.2
272	L	37.3	Very low	37.9	Very low	170 Å²	170	142.3 Å²	142.3	89%	0.89	78%	0.779	S	S	*	*			trans	-94.8	158.5	-173.7	-62.3	161.9	0	0	0	112.4
273	S	36.3	Very low	37.6	Very low	125 Å²	125	142.8 Å²	142.8	87%	0.874	79%	0.79	S	S	*	*			trans	-139.8	172.2	146.8	75.3	0	0	0	0	109.9
274	L	33.7	Very low	37.2	Very low	140 Å²	140	142.4 Å²	142.4	73%	0.733	80%	0.8	S	S	*	*			trans	-149.3	152.9	-147.3	-149.4	153.7	0	0	0	112.2
275	R	34.9	Very low	37.1	Very low	225 Å²	225	139.9 Å²	139.9	85%	0.849	80%	0.802	S	S	*	*			trans	82.1	154.3	-179.7	-49	-179.7	169.2	107.7	-2.6	112.7
276	K	32.3	Very low	36.7	Very low	197 Å²	197	137 Å²	137	86%	0.857	80%	0.796	S	S	*	*			cis	-151.4	138.2	14.9	-158.2	-178.6	176.5	-172.2	0	110.8
277	E	37	Very low	36.2	Very low	156 Å²	156	138 Å²	138	73%	0.729	80%	0.795	S	S	*	*			trans	-94.3	158.6	162.5	-142.4	-152.1	118	0	0	109.1	V279	E277-V279 PolarHBondContact OE1-N 2.91Å
278	P	43.1	Very low	35.3	Very low	109 Å²	109	142.5 Å²	142.5	71%	0.708	80%	0.803	S	S	*	*				-154.3	155.6	83.5	39.4	-19.9	0	0	0	118.3
279	V	31.2	Very low	35	Very low	119 Å²	119	142.4 Å²	142.4	72%	0.721	80%	0.803	S	S	*	*			trans	71.8	108.4	136.8	172.9	0	0	0	0	120.7	E277	E277-V279 PolarHBondContact OE1-N 2.91Å
280	A	31.4	Very low	34.9	Very low	99 Å²	99	141.8 Å²	141.8	82%	0.818	80%	0.803	S	S	*	*			trans	21.5	133.8	137.2	0	0	0	0	0	123.8
281	A	32.1	Very low	34.7	Very low	107 Å²	107	144.2 Å²	144.2	88%	0.884	80%	0.801	S	S	*	*			trans	-149.4	168	136.2	0	0	0	0	0	109.3
282	D	33.3	Very low	34.8	Very low	150 Å²	150	146.4 Å²	146.4	80%	0.802	80%	0.802	S	S	*	*			trans	-127.8	168	-171.2	-175.8	28.1	0	0	0	111.8
283	V	33.2	Very low	34.8	Very low	133 Å²	133	149 Å²	149	81%	0.806	80%	0.8	S	S	*	*			trans	71.4	134.6	170.7	-166	0	0	0	0	117.4
284	G	31.1	Very low	35.1	Very low	77 Å²	77	149 Å²	149	79%	0.794	80%	0.797	S	S	*	*			trans	166.8	122	165.1	0	0	0	0	0	112.6
285	D	33.7	Very low	35.1	Very low	165 Å²	165	147.5 Å²	147.5	88%	0.882	80%	0.798	S	S	*	*			trans	-125.2	171.5	-173.2	-165.8	17.1	0	0	0	112.2
286	D	32.2	Very low	35.6	Very low	132 Å²	132	142.3 Å²	142.3	71%	0.706	79%	0.793	S	S	*	*			trans	90.5	153.7	156.1	-154.7	33.5	0	0	0	121.6
287	L	38.7	Very low	35.8	Very low	132 Å²	132	137.9 Å²	137.9	69%	0.691	79%	0.787	S	S	*	*			trans	-37.8	146.8	-172.4	-101.3	52.8	0	0	0	120.6
288	K	35.2	Very low	35.8	Very low	207 Å²	207	137.8 Å²	137.8	90%	0.9	79%	0.791	S	S	*	*				-165	136.7	109.4	-104.9	153.7	-171.8	164.6	0	114.9
289	D	35.1	Very low	35.5	Very low	146 Å²	146	139.2 Å²	139.2	78%	0.781	79%	0.792	S	S	*	*			trans	-76.1	143.3	158.9	-75.2	-68.1	0	0	0	110.8
290	E	36.5	Very low	35.6	Very low	173 Å²	173	138.2 Å²	138.2	81%	0.808	79%	0.786	S	S	*	*				178	125.7	109	-94.9	-169.5	164.7	0	0	113.3
291	I	34.9	Very low	35.6	Very low	147 Å²	147	141.2 Å²	141.2	75%	0.754	79%	0.785	S	S	*	*			trans	32.4	113.3	139.6	-48	170.3	0	0	0	118.9
292	I	38.1	Very low	35.7	Very low	165 Å²	165	140.2 Å²	140.2	85%	0.846	78%	0.777	S	S	*	*			trans	-163.8	148.2	130.3	-102.6	151.5	0	0	0	110.4
293	R	37.8	Very low	35.7	Very low	226 Å²	226	138.9 Å²	138.9	85%	0.853	78%	0.779	S	S	*	*			trans	-75.8	154.7	176.6	-65.3	-178.4	178.1	123.2	-2.4	111.6
294	P	41.9	Very low	35.9	Very low	125 Å²	125	137.5 Å²	137.5	81%	0.812	78%	0.776	S	S	*	*				-135.9	153.6	117.2	34.9	-24.1	0	0	0	114.8
295	S	32.8	Very low	36.6	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	77%	0.769	S	S	*	*			trans	-103.8	160.5	161.2	-58.9	0	0	0	0	108.8
296	P	46.8	Very low	36.6	Very low	116 Å²	116	139.9 Å²	139.9	75%	0.753	77%	0.769	S	S	*	*			trans	-90.4	158.8	-148.4	34.7	-37.8	0	0	0	115.2
297	S	36.3	Very low	36.4	Very low	104 Å²	104	137.1 Å²	137.1	73%	0.727	77%	0.772	S	S	*	*			trans	173.2	170.3	131.1	-79.2	0	0	0	0	113.7
298	L	35.9	Very low	36	Very low	154 Å²	154	136.4 Å²	136.4	81%	0.806	78%	0.778	S	S	*	*			trans	79.4	149.1	160.6	-45.9	-173.2	0	0	0	117.4
299	L	37.4	Very low	37.3	Very low	139 Å²	139	132 Å²	132	73%	0.728	77%	0.771	S	S	*	*			cis	-161	173.6	-19.7	-102.1	174.6	0	0	0	106.3
300	T	34.4	Very low	37.4	Very low	99 Å²	99	132.9 Å²	132.9	61%	0.607	78%	0.775	S	S	*	*			cis	-130.4	-156.6	3.7	-18	0	0	0	0	107.6
301	M	30.7	Very low	37.1	Very low	161 Å²	161	129 Å²	129	79%	0.793	77%	0.773	S	S	*	*			cis	-121.9	165.6	4.5	-76	-65.2	173	0	0	108.3
302	A	34.8	Very low	37.1	Very low	86 Å²	86	130.1 Å²	130.1	71%	0.711	78%	0.78	S	S	*	*			cis	78.1	132.1	36.9	0	0	0	0	0	114.2
303	S	32.3	Very low	37.9	Very low	123 Å²	123	128 Å²	128	86%	0.86	78%	0.776	S	S	*	*			cis	-136	172.2	26.4	52.9	0	0	0	0	116.5
304	S	36.8	Very low	38.2	Very low	104 Å²	104	122.4 Å²	122.4	73%	0.727	77%	0.769	S	S	*	*			trans	-105.4	-178	174.7	-171.4	0	0	0	0	110.6
305	P	47.7	Very low	37.5	Very low	100 Å²	100	121.1 Å²	121.1	65%	0.649	77%	0.769	S	S	*	*				-151.1	143.3	90	32.3	-11.1	0	0	0	118.8
306	H	32.5	Very low	37.5	Very low	191 Å²	191	121.3 Å²	121.3	88%	0.884	77%	0.77	S	S	*	*			trans	60.5	157.1	151.5	-49.5	-45.1	0	0	0	120.1
307	G	29.1	Very low	37.5	Very low	74 Å²	74	121 Å²	121	76%	0.763	77%	0.769	S	S	*	*			cis	-177.5	162.2	-4.4	0	0	0	0	0	111.7
308	S	29.3	Very low	37.1	Very low	118 Å²	118	120.9 Å²	120.9	83%	0.825	77%	0.768	S	S	*	*			trans	-120	-175.8	-172.1	-51.5	0	0	0	0	112
309	P	63	Low	36.8	Very low	115 Å²	115	121.2 Å²	121.2	75%	0.747	77%	0.77	S	S	*	*				-130.9	-172.1	-51.3	35.6	-18.2	0	0	0	113.8
310	D	36.4	Very low	36.4	Very low	163 Å²	163	118.1 Å²	118.1	87%	0.872	77%	0.772	S	S	*	*			trans	86.3	159.7	151.4	-110.2	-43.2	0	0	0	122.2
311	A	30.6	Very low	36.4	Very low	93 Å²	93	119.7 Å²	119.7	77%	0.769	78%	0.784	S	S	*	*			trans	87.6	138.4	177.9	0	0	0	0	0	120.3
312	L	35.8	Very low	36.4	Very low	170 Å²	170	115.6 Å²	115.6	89%	0.89	78%	0.783	S	S	*	*			trans	-101.3	176.1	170.6	-57.4	170.4	0	0	0	109.2
313	P	54.3	Low	36.3	Very low	119 Å²	119	119.8 Å²	119.8	77%	0.773	79%	0.793	S	S	*	*			cis	-124.2	-138	0.1	36.2	-12.5	0	0	0	109.2
314	P	44.4	Very low	36.2	Very low	110 Å²	110	122.4 Å²	122.4	71%	0.714	80%	0.796	S	S	*	*			cis	-136.1	-174.1	-17.3	41.4	-22.4	0	0	0	116.5
315	A	27	Very low	36.1	Very low	98 Å²	98	128.8 Å²	128.8	81%	0.81	80%	0.804	S	S	*	*			trans	59.7	118.1	145.8	0	0	0	0	0	122.6
316	S	32.6	Very low	35.1	Very low	110 Å²	110	127.8 Å²	127.8	77%	0.769	81%	0.812	S	S	*	*			trans	-78.3	174.1	160.4	64.3	0	0	0	0	111.8
317	P	46.4	Very low	35	Very low	111 Å²	111	123.8 Å²	123.8	72%	0.721	80%	0.802	S	S	*	*				-154.5	-177.8	54.4	43.6	-21.8	0	0	0	119.4
318	S	27.9	Very low	35	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	81%	0.807	S	S	*	*			trans	78.1	139.6	163.4	82.9	0	0	0	0	116.8
319	N	29.3	Very low	35.2	Very low	160 Å²	160	134.1 Å²	134.1	86%	0.856	81%	0.806	S	S	*	*			cis	-133.7	148.5	7.1	-87.8	-60.1	0	0	0	113.6
320	G	28.5	Very low	33.6	Very low	75 Å²	75	133.1 Å²	133.1	77%	0.773	80%	0.802	S	S	*	*			trans	83.2	80.4	144.6	0	0	0	0	0	120.6
321	P	35	Very low	33.3	Very low	131 Å²	131	130.7 Å²	130.7	85%	0.851	79%	0.793	S	S	*	*			trans	-93.3	144.2	159.7	35.7	-30.2	0	0	0	112.1
322	G	30.9	Very low	33.2	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	79%	0.792	S	S	*	*			trans	-134.9	80.6	179.5	0	0	0	0	0	113.7
323	L	31.7	Very low	33	Very low	174 Å²	174	132 Å²	132	91%	0.911	78%	0.783	S	S	*	*			trans	-172.8	115	157.4	-106.9	166.7	0	0	0	108.7
324	L	31.1	Very low	32	Very low	177 Å²	177	134.1 Å²	134.1	93%	0.927	79%	0.788	S	S	*	*			trans	-111	145.4	177.8	-78.6	175.1	0	0	0	111.6
325	R	33.7	Very low	31.6	Very low	238 Å²	238	135.4 Å²	135.4	90%	0.898	79%	0.794	S	S	*	*			trans	-103.8	124.5	168.5	-171.6	-179	-165.8	-111	4.3	108.1
326	G	27	Very low	32.1	Very low	79 Å²	79	137.6 Å²	137.6	81%	0.814	79%	0.792	S	S	*	*			trans	-151.5	125.9	179	0	0	0	0	0	111.3
327	T	30.8	Very low	32.3	Very low	108 Å²	108	140.3 Å²	140.3	66%	0.663	80%	0.797	S	S	*	*			trans	-105.9	148.2	-177.7	47.5	0	0	0	0	111.1
328	Y	29.1	Very low	31.6	Very low	223 Å²	223	144.8 Å²	144.8	88%	0.875	80%	0.801	S	S	*	*			trans	-153	164.9	141.1	-104.8	-72.1	0	0	0	111.3
329	F	32.7	Very low	31.9	Very low	186 Å²	186	147 Å²	147	82%	0.816	81%	0.81	S	S	*	*			trans	-75.4	170.7	-173.5	-67.6	-107.1	0	0	0	112
330	S	30.5	Very low	32	Very low	93 Å²	93	146.1 Å²	146.1	65%	0.65	81%	0.805	S	S	*	*			cis	-147.8	-159.9	8.4	-142.4	0	0	0	0	109
331	T	30.6	Very low	32.2	Very low	112 Å²	112	147.8 Å²	147.8	69%	0.687	81%	0.805	S	S	*	*			cis	-161	159.4	11.8	-13.5	0	0	0	0	109.7
332	Q	28.6	Very low	32.1	Very low	159 Å²	159	148.8 Å²	148.8	74%	0.743	80%	0.798	S	S	*	*			trans	48.9	133.7	137.5	-160.7	166.4	-5.4	0	0	120.4
333	D	31.1	Very low	32.3	Very low	132 Å²	132	151.1 Å²	151.1	71%	0.706	80%	0.8	S	S	*	*			cis	-137.8	158.2	13.2	-118.5	-35.5	0	0	0	111.4
334	D	33.2	Very low	32.2	Very low	163 Å²	163	153.4 Å²	153.4	87%	0.872	80%	0.797	S	S	*	*			trans	-86.5	146.2	169.2	-85.3	-56.8	0	0	0	111.4
335	V	35.3	Very low	32.2	Very low	138 Å²	138	149.9 Å²	149.9	84%	0.836	79%	0.793	S	S	*	*			trans	-131.7	118.9	167.5	-179.7	0	0	0	0	109.7
336	D	37.2	Very low	31.9	Very low	144 Å²	144	144.2 Å²	144.2	77%	0.77	79%	0.785	S	S	*	*			trans	-71.8	147.9	-172.9	-162.9	-2.7	0	0	0	112.7
337	L	38	Very low	32	Very low	167 Å²	167	150.6 Å²	150.6	87%	0.874	79%	0.786	S	S	*	*			trans	-110.7	39.8	-173.2	-111	172.9	0	0	0	112.5
338	Y	31.9	Very low	31.9	Very low	204 Å²	204	156.8 Å²	156.8	80%	0.8	80%	0.797	S	S	*	*			trans	-143.6	94.7	174.3	-135.1	-88.3	0	0	0	114
339	T	33.6	Very low	31.8	Very low	147 Å²	147	156 Å²	156	90%	0.902	79%	0.792	S	S	*	*			trans	-153.2	134.5	155.3	-17.3	0	0	0	0	110.7
340	D	32.4	Very low	31.6	Very low	142 Å²	142	154.9 Å²	154.9	76%	0.759	79%	0.79	S	S	*	*			trans	-110.9	150.2	-177.1	178.7	26.4	0	0	0	110.4
341	S	31	Very low	31.4	Very low	111 Å²	111	156.7 Å²	156.7	78%	0.776	79%	0.792	S	S	*	*			trans	-175.4	119.5	160.8	-81.7	0	0	0	0	112.6
342	E	34	Very low	31.3	Very low	151 Å²	151	155.5 Å²	155.5	71%	0.706	79%	0.794	S	S	*	*			trans	-65.3	161.5	156.8	-68.6	-166.6	137	0	0	111.6
343	P	35.2	Very low	31.3	Very low	126 Å²	126	156.1 Å²	156.1	82%	0.818	80%	0.801	S	S	*	*			trans	-111.8	104.7	141.2	33.5	-27.5	0	0	0	111.6
344	R	29.8	Very low	31.4	Very low	222 Å²	222	161 Å²	161	84%	0.838	81%	0.81	S	S	*	*			trans	-64.4	133.7	156	-96.1	-179.2	163.7	133.6	-8.1	109.6
345	A	30	Very low	31.6	Very low	102 Å²	102	157.7 Å²	157.7	84%	0.843	80%	0.797	S	S	*	*			trans	-135.1	144.8	162.7	0	0	0	0	0	110.2
346	T	29	Very low	31.2	Very low	120 Å²	120	158.5 Å²	158.5	74%	0.736	80%	0.797	S	S	*	*			trans	-123.3	146.5	-163.2	25.9	0	0	0	0	114
347	Y	28.6	Very low	30.8	Very low	213 Å²	213	156.5 Å²	156.5	84%	0.835	79%	0.79	S	S	*	*			trans	46.8	113.8	157.1	-68.6	-65.8	0	0	0	120.8
348	R	27.8	Very low	30.4	Very low	238 Å²	238	159.2 Å²	159.2	90%	0.898	79%	0.789	S	S	*	*				-131.1	147.4	126	-98.5	-74.5	177.8	152.3	-0.9	109
349	R	27.2	Very low	30.3	Very low	205 Å²	205	155.5 Å²	155.5	77%	0.774	78%	0.782	S	S	*	*			trans	-140.4	130.8	-174.9	-174	-166.2	-166.8	-168.4	6.5	109.9
350	Q	29.7	Very low	30	Very low	164 Å²	164	154.5 Å²	154.5	77%	0.766	78%	0.775	S	S	*	*			trans	-164.3	127.9	159.5	-100.2	156.9	-11.9	0	0	103.6
351	D	26.1	Very low	29.6	Very low	130 Å²	130	158.5 Å²	158.5	70%	0.695	78%	0.78	S	S	*	*				65.7	122.9	54.8	-63.2	-54.4	0	0	0	111.7
352	A	27.6	Very low	29.4	Very low	87 Å²	87	159.6 Å²	159.6	72%	0.719	78%	0.777	S	S	*	*			cis	-160.2	-160.8	-0.8	0	0	0	0	0	112
353	L	29	Very low	29.2	Very low	172 Å²	172	159.3 Å²	159.3	90%	0.901	78%	0.78	S	S	*	*			trans	86.6	163.6	168.7	-59.3	170.9	0	0	0	118.3
354	R	32.8	Very low	28.8	Very low	234 Å²	234	158 Å²	158	88%	0.883	78%	0.78	S	S	*	*			trans	-146.9	-178.2	-151.6	-100.8	-75.9	176.1	157.6	-7.3	109.9
355	P	38.4	Very low	28.9	Very low	94 Å²	94	155.7 Å²	155.7	61%	0.61	78%	0.778	S	S	*	*			trans	-101.1	166.2	-141.2	42	-35.5	0	0	0	114.3
356	D	26.1	Very low	29.2	Very low	155 Å²	155	157 Å²	157	83%	0.829	78%	0.778	S	S	*	*			trans	-101.9	149.8	161.8	-93.9	-58.8	0	0	0	112.2
357	V	28	Very low	29.4	Very low	103 Å²	103	158 Å²	158	62%	0.624	78%	0.778	S	S	*	*			trans	-140.4	112.9	-176.3	175.5	0	0	0	0	110.6
358	W	30.8	Very low	29.4	Very low	224 Å²	224	157.2 Å²	157.2	85%	0.848	78%	0.775	S	S	*	*			trans	-143.1	110.7	162.2	-68.4	93.7	0	0	0	107.3
359	L	28.9	Very low	29.7	Very low	126 Å²	126	152.2 Å²	152.2	66%	0.66	76%	0.762	S	S	*	*				74.2	99	62.3	-70.8	173.1	0	0	0	115.2
360	V	28	Very low	29.7	Very low	125 Å²	125	151.8 Å²	151.8	76%	0.758	77%	0.766	S	S	*	*			trans	61	114.8	134.8	-178	0	0	0	0	119.4
361	R	24.4	Very low	29.5	Very low	226 Å²	226	155.5 Å²	155.5	85%	0.853	77%	0.772	S	S	*	*				-155.1	148.3	113.9	-141.6	175.4	176.1	150.2	1.3	112.8
362	N	27	Very low	29.8	Very low	134 Å²	134	154.4 Å²	154.4	72%	0.717	78%	0.775	S	S	*	*			trans	-84.7	162.5	163.6	-64.2	-56.6	0	0	0	109.8
363	D	28.1	Very low	30.1	Very low	145 Å²	145	156.1 Å²	156.1	78%	0.775	78%	0.779	S	S	*	*				-177.8	152.7	105.8	-90.2	-35.6	0	0	0	114.8
364	A	28	Very low	30.6	Very low	98 Å²	98	153.2 Å²	153.2	81%	0.81	77%	0.77	S	S	*	*			trans	44.8	128.3	153.6	0	0	0	0	0	123.9
365	H	30.8	Very low	30.5	Very low	174 Å²	174	146.9 Å²	146.9	81%	0.806	77%	0.768	S	S	*	*			trans	-61.1	161.2	153.6	-97.4	-55.6	0	0	0	112.5
366	P	36.3	Very low	30.3	Very low	129 Å²	129	152.3 Å²	152.3	84%	0.838	78%	0.782	S	S	*	*				-153.2	-176.8	62.1	42.2	-19.8	0	0	0	119.9
367	L	33.4	Very low	30.5	Very low	143 Å²	143	154 Å²	154	75%	0.749	79%	0.785	S	S	*	*			trans	-82.7	137.1	-174.2	-78.1	159.2	0	0	0	115.4
368	Y	28.6	Very low	31.1	Very low	195 Å²	195	154 Å²	154	77%	0.765	79%	0.79	S	S	*	*				162.6	137.3	108.6	-113.6	-153.6	0	0	0	118.4
369	H	34.1	Very low	31.6	Very low	134 Å²	134	148.5 Å²	148.5	62%	0.62	79%	0.792	S	S	*	*			trans	36.3	119.5	150.6	-66.7	-23.2	0	0	0	128
370	K	27.3	Very low	32.4	Very low	196 Å²	196	147.1 Å²	147.1	85%	0.852	79%	0.785	S	S	*	*			trans	63.9	147.8	136.9	-63.3	-168.8	178.2	-176.4	0	119.1
371	R	25.4	Very low	33.8	Very low	241 Å²	241	145.8 Å²	145.8	91%	0.909	78%	0.781	S	S	*	*			cis	-151.8	164	35	-143.3	176.9	-165.1	163.1	2.2	112.3
372	S	32.2	Very low	35.8	Very low	108 Å²	108	142 Å²	142	76%	0.755	77%	0.771	S	S	*	*			trans	-76.7	176.1	-178.2	-19.2	0	0	0	0	114.3
373	P	34.9	Very low	37.6	Very low	122 Å²	122	135.9 Å²	135.9	79%	0.792	74%	0.738	S	S	*	*			cis	-143.6	-138.6	49.9	39	-12.2	0	0	0	115.5
374	P	39.2	Very low	39.1	Very low	112 Å²	112	138.5 Å²	138.5	73%	0.727	75%	0.746	S	S	*	*				-133.8	175.3	-110	43.2	-23.8	0	0	0	118.8
375	A	31	Very low	40.5	Very low	101 Å²	101	138.1 Å²	138.1	84%	0.835	74%	0.737	S	S	*	*			trans	66.6	128.5	151.4	0	0	0	0	0	121.4
376	K	32.8	Very low	42.7	Very low	208 Å²	208	132 Å²	132	90%	0.904	71%	0.714	S	S	*	*			trans	-146.6	138.5	141.2	-157	167.6	-171.9	175.5	0	110.1
377	E	31.4	Very low	43.9	Very low	191 Å²	191	128.1 Å²	128.1	89%	0.893	70%	0.696	S	S	*	*			trans	-94.9	140.1	-170.8	-166.3	173.5	-179.4	0	0	111.1
378	S	39.7	Very low	45.7	Very low	103 Å²	103	125.3 Å²	125.3	72%	0.72	68%	0.682	S	S	*	*			trans	-117	122.8	179.9	-67	0	0	0	0	109.8	L380	S378-L380 PolarHBondContact O-N 2.93Å
379	A	41.3	Very low	47.4	Very low	108 Å²	108	119.2 Å²	119.2	89%	0.893	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-67.8	126	-173	0	0	0	0	0	112.7
380	L	47.1	Very low	48.6	Very low	97 Å²	97	114.3 Å²	114.3	51%	0.508	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-87.5	131.5	168.8	-76	83.1	0	0	0	110.7	S378	S378-L380 PolarHBondContact O-N 2.93Å
381	S	56.8	Low	49.9	Very low	97 Å²	97	110.5 Å²	110.5	68%	0.678	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-64.2	137.6	170.3	-59.7	0	0	0	0	111.1	S389 C390	S381-S389 WeakPolarHBondContact O-CA 3.34Å; S381-C390 PolarHBondContact O-N 2.81Å
382	K	65.2	Low	51.5	Low	147 Å²	147	102.2 Å²	102.2	64%	0.639	63%	0.625	S	S	*	*	B	Isolated β-bridge	trans	-93.8	136.5	175.1	-69.3	177.9	177.7	-178.7	0	111.2	Q384 L388	K382-Q384 PolarHBondContact O-N 3.25Å; K382-L388 CarbonylContact C-O 3.58Å; K382-L388 WeakPolarHBondContact CA-O 3.18Å
383	C	64.8	Low	52.8	Low	5 Å²	5	101.6 Å²	101.6	3%	0.034	62%	0.621	C	S	.	*	P	Polyproline II helix	trans	-68.1	125.2	174.6	-178.8	0	0	0	0	110.3	S385 C386 G387 L388 C395	C383-S385 VanDerWaalsContact C-N 3.29Å; C383-S385 PolarHBondContact O-N 2.84Å; C383-S385 PolarHBondContact SG-OG 3.25Å; C383-S385 VanDerWaalsContact SG-OG 3.33Å; C383-C386 PolarHBondContact O-N 2.87Å; C383-G387 WeakPolarHBondContact O-CA 3.28Å; C383-G387 PolarHBondContact O-N 3.37Å; C383-L388 PolarHBondContact N-O 3.36Å; C383-C395 HydrophobicContact CB-CB 4.38Å
384	Q	61.3	Low	53.9	Low	200 Å²	200	99.5 Å²	99.5	94%	0.935	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-26.2	-174.2	-71.6	-175.9	-12.3	0	0	114.2	K382	K382-Q384 PolarHBondContact O-N 3.25Å
385	S	57.8	Low	55.3	Low	89 Å²	89	94.4 Å²	94.4	62%	0.622	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	-17.2	-178.5	51.9	0	0	0	0	114.7	C383	C383-S385 VanDerWaalsContact C-N 3.29Å; C383-S385 PolarHBondContact O-N 2.84Å; C383-S385 PolarHBondContact SG-OG 3.25Å; C383-S385 VanDerWaalsContact SG-OG 3.33Å
386	C	75.4	Confident	56.8	Low	47 Å²	47	98.7 Å²	98.7	32%	0.318	57%	0.572	S	S	.	*	T	Hydrogen-bonded Turn	trans	-135.7	-0.2	-179.2	72.6	0	0	0	0	115.5	C383 L388 C395	C383-C386 PolarHBondContact O-N 2.87Å; C386-L388 PolarHBondContact O-N 3.13Å; C386-C395 VanDerWaalsContact SG-SG 3.67Å
387	G	62.7	Low	58	Low	46 Å²	46	98.5 Å²	98.5	47%	0.474	57%	0.566	S	S	.	*			trans	72.2	-8.4	174.4	0	0	0	0	0	116.3	C383	C383-G387 WeakPolarHBondContact O-CA 3.28Å; C383-G387 PolarHBondContact O-N 3.37Å
388	L	71.3	Confident	59.7	Low	85 Å²	85	91.5 Å²	91.5	45%	0.445	54%	0.537	S	S	.	.			trans	-78	142.6	-177.2	-63.4	176.5	0	0	0	112.2	K382 C383 C386	K382-L388 CarbonylContact C-O 3.58Å; K382-L388 WeakPolarHBondContact CA-O 3.18Å; C383-L388 PolarHBondContact N-O 3.36Å; C386-L388 PolarHBondContact O-N 3.13Å
389	S	62.7	Low	60.5	Low	67 Å²	67	93.6 Å²	93.6	47%	0.469	54%	0.541	S	S	.	.	B	Isolated β-bridge	trans	-70.2	127.5	173.6	-58.3	0	0	0	0	111	S381	S381-S389 WeakPolarHBondContact O-CA 3.34Å
390	C	60.1	Low	60.9	Low	31 Å²	31	91.8 Å²	91.8	21%	0.209	52%	0.522	C	S	.	.			trans	-118.6	137.7	179.8	-63	0	0	0	0	111	S381	S381-C390 PolarHBondContact O-N 2.81Å
391	S	54.9	Low	61	Low	115 Å²	115	94 Å²	94	80%	0.804	53%	0.533	S	S	*	.	S	Bend	trans	-97.5	7.5	177.2	51.2	0	0	0	0	113.6
392	S	59.6	Low	60.6	Low	68 Å²	68	93.6 Å²	93.6	48%	0.476	52%	0.523	S	S	.	.	S	Bend	trans	-141.4	167.1	-179.2	66.7	0	0	0	0	111.4	L394	S392-L394 PolarHBondContact O-N 2.73Å; S392-L394 PolarHBondContact OG-O 2.94Å
393	S	58.3	Low	59.2	Low	95 Å²	95	93 Å²	93	66%	0.664	53%	0.532	S	S	*	.	S	Bend	trans	-76.5	2.8	-176.8	47.5	0	0	0	0	115.4
394	L	58.8	Low	58	Low	78 Å²	78	98.3 Å²	98.3	41%	0.408	57%	0.567	S	S	.	*	B	Isolated β-bridge	trans	-135.2	128.9	-178.5	-80.7	167.3	0	0	0	110.5	S392 Q396 L401	S392-L394 PolarHBondContact O-N 2.73Å; S392-L394 PolarHBondContact OG-O 2.94Å; L394-Q396 PolarHBondContact O-N 3.42Å; L394-L401 HydrophobicContact CD2-CD2 3.81Å; L394-L401 HydrophobicContact CD2-CG 4.32Å
395	C	67.8	Low	56.5	Low	5 Å²	5	94.6 Å²	94.6	3%	0.034	56%	0.561	C	S	.	*			trans	-87.5	103.7	179	-175	0	0	0	0	111.2	C383 C386 R397 C398 D399	C383-C395 HydrophobicContact CB-CB 4.38Å; C386-C395 VanDerWaalsContact SG-SG 3.67Å; C395-R397 PolarHBondContact O-N 3.4Å; C395-C398 HydrophobicContact CB-CB 4.44Å; C395-C398 PolarHBondContact O-N 3.22Å; C395-D399 PolarHBondContact O-N 2.89Å
396	Q	62.1	Low	55.2	Low	191 Å²	191	96.5 Å²	96.5	89%	0.893	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-6.2	-178.8	-69.2	-175.4	-28.3	0	0	115.9	L394	L394-Q396 PolarHBondContact O-N 3.42Å
397	R	59.5	Low	53	Low	203 Å²	203	98.8 Å²	98.8	77%	0.766	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-11.1	174.4	-105.1	-171.2	-179.4	-172.2	1.2	114.6	C395	C395-R397 PolarHBondContact O-N 3.4Å
398	C	65.7	Low	51.5	Low	44 Å²	44	101.5 Å²	101.5	30%	0.297	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-131	-10.5	-172.2	-56.1	0	0	0	0	113.3	C395 S400	C395-C398 HydrophobicContact CB-CB 4.44Å; C395-C398 PolarHBondContact O-N 3.22Å; C398-S400 PolarHBondContact O-N 3.34Å; C398-S400 PolarHBondContact O-OG 2.86Å
399	D	57.4	Low	49.4	Very low	148 Å²	148	107.2 Å²	107.2	79%	0.791	63%	0.626	S	S	*	*			trans	43.3	31.9	179	-115.9	1.1	0	0	0	115.2	C395	C395-D399 PolarHBondContact O-N 2.89Å
400	S	49.7	Very low	48.2	Very low	70 Å²	70	109.5 Å²	109.5	49%	0.49	64%	0.639	S	S	.	*			trans	-113.9	133.7	-175.2	-63.2	0	0	0	0	109.7	C398	C398-S400 PolarHBondContact O-N 3.34Å; C398-S400 PolarHBondContact O-OG 2.86Å
401	L	49.1	Very low	46.5	Very low	142 Å²	142	113.3 Å²	113.3	74%	0.743	67%	0.666	S	S	*	*	B	Isolated β-bridge	trans	-65.7	134.4	177.1	-75.3	159.9	0	0	0	111.1	L394 T403	L394-L401 HydrophobicContact CD2-CD2 3.81Å; L394-L401 HydrophobicContact CD2-CG 4.32Å; L401-T403 PolarHBondContact O-N 3.03Å; L401-T403 VanDerWaalsContact O-N 3.14Å
402	L	48.3	Very low	45.1	Very low	90 Å²	90	114.3 Å²	114.3	47%	0.471	67%	0.667	S	S	.	*			trans	-79.4	91.3	173.2	-69.6	173.2	0	0	0	110.1	C404	L402-C404 PolarHBondContact O-N 3.18Å
403	T	36.3	Very low	43.6	Very low	135 Å²	135	120.5 Å²	120.5	83%	0.828	69%	0.686	S	S	*	*			trans	-71.7	115	173.5	12.3	0	0	0	0	111.5	L401	L401-T403 PolarHBondContact O-N 3.03Å; L401-T403 VanDerWaalsContact O-N 3.14Å
404	C	38.8	Very low	42.9	Very low	115 Å²	115	120.8 Å²	120.8	78%	0.777	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-76.1	140.1	170.2	-65.2	0	0	0	0	111.2	L402	L402-C404 PolarHBondContact O-N 3.18Å
405	P	31.1	Very low	41.3	Very low	123 Å²	123	121.4 Å²	121.4	80%	0.799	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-74.7	136.2	175.3	30.2	-34	0	0	0	111.7
406	P	30	Very low	39.3	Very low	128 Å²	128	130.6 Å²	130.6	83%	0.831	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-87.2	144	179.9	33.4	-34.4	0	0	0	113.3
407	A	29.8	Very low	37.5	Very low	96 Å²	96	126.1 Å²	126.1	79%	0.793	73%	0.732	S	S	*	*			trans	-98.9	107.5	177.1	0	0	0	0	0	112.8
408	S	30.2	Very low	35.9	Very low	102 Å²	102	121.2 Å²	121.2	71%	0.713	73%	0.728	S	S	*	*			trans	29.6	104.1	149.5	60.3	0	0	0	0	122.3
409	K	28.1	Very low	34.1	Very low	206 Å²	206	124.5 Å²	124.5	90%	0.896	75%	0.747	S	S	*	*				63.3	167.3	122.2	-69.8	-177.1	179.1	-179.3	0	119.7
410	P	37	Very low	32.7	Very low	114 Å²	114	125.1 Å²	125.1	74%	0.74	75%	0.745	S	S	*	*			cis	-129.2	159.9	0.8	39.8	-23.9	0	0	0	117.8
411	S	23.8	Very low	31.7	Very low	111 Å²	111	127.3 Å²	127.3	78%	0.776	75%	0.752	S	S	*	*			trans	48.5	122.7	138.8	-162.9	0	0	0	0	122.9
412	V	25.6	Very low	30.7	Very low	136 Å²	136	124.3 Å²	124.3	82%	0.824	74%	0.742	S	S	*	*				-168.9	154.6	106.6	146.3	0	0	0	0	110.3
413	F	27.7	Very low	29.9	Very low	198 Å²	198	127.3 Å²	127.3	87%	0.868	76%	0.758	S	S	*	*			trans	-130.6	-178.5	-174.9	-100	-59.5	0	0	0	109.1
414	P	43.8	Very low	29.5	Very low	101 Å²	101	125.6 Å²	125.6	66%	0.656	76%	0.757	S	S	*	*			cis	-136.5	-179	-26.1	31.6	-11.5	0	0	0	113.9
415	S	24.7	Very low	29.1	Very low	92 Å²	92	129.2 Å²	129.2	64%	0.643	76%	0.763	S	S	*	*				143.6	132.8	122.3	-66.8	0	0	0	0	118.1
416	K	27.3	Very low	28.9	Very low	197 Å²	197	127 Å²	127	86%	0.857	76%	0.762	S	S	*	*			trans	63	128.5	143.6	-62.8	170.3	-174.2	-180	0	118
417	A	24.7	Very low	28.9	Very low	98 Å²	98	125.9 Å²	125.9	81%	0.81	76%	0.764	S	S	*	*				76.7	145.8	62.1	0	0	0	0	0	112.9
418	S	25.6	Very low	28.7	Very low	99 Å²	99	126.5 Å²	126.5	69%	0.692	76%	0.763	S	S	*	*			cis	-163.4	169.9	15.2	60.3	0	0	0	0	115
419	T	26.4	Very low	28.6	Very low	113 Å²	113	129 Å²	129	69%	0.693	77%	0.767	S	S	*	*			trans	60.3	142.6	140.2	50.3	0	0	0	0	125.8
420	H	28.9	Very low	28.7	Very low	161 Å²	161	128.2 Å²	128.2	75%	0.745	76%	0.758	S	S	*	*			trans	74.3	149.8	144.8	-91.2	-117.6	0	0	0	119.4
421	D	27.8	Very low	28.2	Very low	117 Å²	117	128 Å²	128	63%	0.626	75%	0.748	S	S	*	*			cis	-160.1	161.4	-6.2	-149.9	-7.5	0	0	0	115.6
422	S	28.6	Very low	28.5	Very low	79 Å²	79	131 Å²	131	55%	0.552	75%	0.747	S	S	*	*			trans	44.9	128.8	139.3	-76.8	0	0	0	0	127.4
423	L	30.9	Very low	28.6	Very low	152 Å²	152	135 Å²	135	80%	0.796	75%	0.749	S	S	*	*				59.1	127	126.5	-64.4	164.6	0	0	0	123.1
424	A	29.3	Very low	29.5	Very low	99 Å²	99	131.9 Å²	131.9	82%	0.818	75%	0.748	S	S	*	*				174.2	162.3	98.8	0	0	0	0	0	115
425	H	30.3	Very low	28.7	Very low	191 Å²	191	130.3 Å²	130.3	88%	0.884	75%	0.75	S	S	*	*			trans	-85.9	166	-169.8	-52.7	-94.2	0	0	0	116.7
426	G	26.6	Very low	29	Very low	77 Å²	77	135 Å²	135	79%	0.794	76%	0.762	S	S	*	*			trans	175	142.3	159.3	0	0	0	0	0	113.6
427	A	29	Very low	29	Very low	105 Å²	105	132 Å²	132	87%	0.868	76%	0.761	S	S	*	*			trans	-159.7	163.9	-174.5	0	0	0	0	0	116.6
428	S	27.4	Very low	29.3	Very low	109 Å²	109	136.8 Å²	136.8	76%	0.762	77%	0.766	S	S	*	*			trans	105.3	155.2	143.5	-148.2	0	0	0	0	121.8
429	L	27.3	Very low	29.3	Very low	155 Å²	155	135.8 Å²	135.8	81%	0.812	77%	0.771	S	S	*	*			trans	75.1	157.8	164.3	-60	144.3	0	0	0	121
430	R	29.3	Very low	29.4	Very low	188 Å²	188	138.4 Å²	138.4	71%	0.709	78%	0.78	S	S	*	*			cis	-177.2	155.4	-48.2	-147.4	-171.4	169.4	-156.8	10.6	111.6
431	E	28.3	Very low	29.3	Very low	111 Å²	111	135.9 Å²	135.9	52%	0.519	77%	0.772	S	S	.	*			trans	67.1	159	149.3	-92.6	176.6	146.3	0	0	119.5
432	K	28.6	Very low	29.3	Very low	174 Å²	174	140.8 Å²	140.8	76%	0.757	78%	0.782	S	S	*	*			cis	-158.9	168.5	-6.1	-142.8	162.6	-173.7	154.6	0	113.2
433	Y	28.9	Very low	29.2	Very low	220 Å²	220	144 Å²	144	86%	0.863	79%	0.792	S	S	*	*			trans	-103.9	175	164.9	-97.4	-81.4	0	0	0	110.2
434	P	45.7	Very low	29.5	Very low	132 Å²	132	142.8 Å²	142.8	86%	0.857	79%	0.793	S	S	*	*				-163.5	-165.3	54.9	45.7	-21.1	0	0	0	120
435	G	27.1	Very low	29.4	Very low	68 Å²	68	145.1 Å²	145.1	70%	0.701	79%	0.787	S	S	*	*			trans	135.3	109.5	160.3	0	0	0	0	0	115.1
436	Q	31.3	Very low	29.3	Very low	191 Å²	191	144.1 Å²	144.1	89%	0.893	79%	0.787	S	S	*	*				63	146.6	83.7	-89.4	-172.7	-12.6	0	0	116.3
437	T	27.4	Very low	29.5	Very low	134 Å²	134	148.1 Å²	148.1	82%	0.822	79%	0.785	S	S	*	*			cis	-150.1	-173.6	28.7	-33.5	0	0	0	0	113.5
438	Q	30.7	Very low	29.3	Very low	198 Å²	198	148.7 Å²	148.7	93%	0.925	78%	0.782	S	S	*	*			trans	-106.7	172.1	-176.1	-65.7	177.2	-27.9	0	0	115.4
439	G	25	Very low	29.4	Very low	77 Å²	77	153.6 Å²	153.6	79%	0.794	79%	0.79	S	S	*	*			trans	-163.4	160	167.7	0	0	0	0	0	113.5
440	L	29.8	Very low	29.5	Very low	168 Å²	168	151.9 Å²	151.9	88%	0.88	79%	0.791	S	S	*	*			trans	-142.3	157.1	-167.5	-152.4	91.1	0	0	0	113.8
441	D	26.7	Very low	29.3	Very low	109 Å²	109	152.6 Å²	152.6	58%	0.583	80%	0.799	S	S	*	*				139.6	143.2	122.5	-153.4	17.7	0	0	0	118
442	R	27.8	Very low	30.1	Very low	220 Å²	220	153.2 Å²	153.2	83%	0.83	81%	0.813	S	S	*	*			trans	60.4	161.5	152.6	-94.9	167.3	-175.2	126.1	-8.6	125.9
443	L	26.1	Very low	30.1	Very low	147 Å²	147	149.9 Å²	149.9	77%	0.77	81%	0.812	S	S	*	*			trans	-160.6	135.6	-163.9	-165.9	179.2	0	0	0	109.1
444	P	36.8	Very low	30.7	Very low	126 Å²	126	145.5 Å²	145.5	82%	0.818	81%	0.813	S	S	*	*			trans	-115.9	153.1	166.5	37.3	-27.8	0	0	0	114.3
445	H	28.4	Very low	30.6	Very low	147 Å²	147	144 Å²	144	68%	0.681	80%	0.802	S	S	*	*			trans	-117.4	141.2	-169	-168.3	-57	0	0	0	111.4	H447	H445-H447 AromaticContact CE1-CD2 3.91Å; H445-H447 AromaticContact CE1-CE1 3.96Å; H445-H447 AromaticContact CE1-NE2 3.56Å
446	L	27.6	Very low	31.5	Very low	171 Å²	171	146.5 Å²	146.5	90%	0.895	81%	0.806	S	S	*	*			trans	-161.7	153.8	159.2	-112.9	171.5	0	0	0	112.3
447	H	29.6	Very low	33	Very low	160 Å²	160	141.4 Å²	141.4	74%	0.741	79%	0.788	S	S	*	*			trans	-102.2	150.5	-176.2	-74.8	-78.7	0	0	0	112.9	H445	H445-H447 AromaticContact CE1-CD2 3.91Å; H445-H447 AromaticContact CE1-CE1 3.96Å; H445-H447 AromaticContact CE1-NE2 3.56Å
448	S	25.3	Very low	35.2	Very low	117 Å²	117	137.5 Å²	137.5	82%	0.818	77%	0.766	S	S	*	*			trans	-136.8	141.1	147.9	59.4	0	0	0	0	109.9
449	K	30.7	Very low	37.9	Very low	213 Å²	213	135.8 Å²	135.8	93%	0.926	75%	0.751	S	S	*	*			trans	-97.6	126.7	176.8	-72.6	178.2	179.2	173.6	0	109.3
450	S	27.6	Very low	40.9	Very low	119 Å²	119	132.1 Å²	132.1	83%	0.832	71%	0.713	S	S	*	*			trans	-148.5	145.9	159.5	61.7	0	0	0	0	111.5
451	K	26.8	Very low	43.5	Very low	203 Å²	203	126.1 Å²	126.1	88%	0.883	69%	0.691	S	S	*	*			trans	-164.8	152.7	176.3	-130.8	-170.5	-178.2	-174.9	0	107
452	P	44.7	Very low	46.1	Very low	123 Å²	123	122.9 Å²	122.9	80%	0.799	67%	0.672	S	S	*	*			cis	-116.5	169.5	-11.8	39.3	-27.3	0	0	0	112.8
453	S	28.3	Very low	49	Very low	105 Å²	105	114.7 Å²	114.7	73%	0.734	65%	0.648	S	S	*	*			trans	-140.6	136.2	148.2	57.9	0	0	0	0	109.5	T455	S453-T455 PolarHBondContact O-N 2.91Å
454	S	41.3	Very low	51.8	Low	128 Å²	128	112.6 Å²	112.6	90%	0.895	64%	0.638	S	S	*	*			trans	-90.3	83.1	-172	52.6	0	0	0	0	111.4
455	T	43.6	Very low	54	Low	101 Å²	101	115.4 Å²	115.4	62%	0.62	63%	0.632	S	S	*	*			trans	-110.8	138.1	163.9	37.9	0	0	0	0	110.2	S453 T457	S453-T455 PolarHBondContact O-N 2.91Å; T455-T457 PolarHBondContact O-N 3.09Å; T455-T457 PolarHBondContact O-OG1 2.85Å
456	P	45.2	Very low	56.6	Low	120 Å²	120	112.8 Å²	112.8	78%	0.779	63%	0.628	S	S	*	*			trans	-67.5	97.9	177.7	27.9	-33.8	0	0	0	109.7	S458	P456-S458 PolarHBondContact O-N 3.14Å
457	T	62.8	Low	59.2	Low	84 Å²	84	105.8 Å²	105.8	52%	0.515	60%	0.597	S	S	.	*			trans	-69.5	115.8	-172.8	-19.5	0	0	0	0	110.2	T455	T455-T457 PolarHBondContact O-N 3.09Å; T455-T457 PolarHBondContact O-OG1 2.85Å
458	S	75.4	Confident	61.9	Low	52 Å²	52	98.4 Å²	98.4	36%	0.364	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-50.5	140.5	177.2	35.3	0	0	0	0	111.2	P456 G467 A468	P456-S458 PolarHBondContact O-N 3.14Å; S458-G467 PolarHBondContact O-N 3Å; S458-G467 VanDerWaalsContact O-N 3.09Å; S458-A468 VanDerWaalsContact O-CB 3.31Å; S458-A468 WeakPolarHBondContact O-CB 3.16Å; S458-A468 PolarHBondContact O-N 2.82Å; S458-A468 PolarHBondContact OG-O 2.66Å
459	R	86.3	Confident	64.8	Low	162 Å²	162	95.5 Å²	95.5	61%	0.611	54%	0.541	S	S	*	.	B	Isolated β-bridge	trans	-85.8	136	-179.7	-60.6	-179.1	71.5	166.9	2.2	109.5	G461 N464 R465 V478	R459-G461 PolarHBondContact O-N 2.84Å; R459-N464 VanDerWaalsContact CZ-O 3.28Å; R459-N464 PolarHBondContact NE-O 3.5Å; R459-N464 PolarHBondContact NH2-O 3.03Å; R459-R465 CarbonylContact C-O 3.58Å; R459-R465 WeakPolarHBondContact CA-O 3.09Å; R459-V478 WeakPolarHBondContact O-CG2 3.28Å
460	C	88.1	Confident	67.4	Low	0 Å²	0	85.9 Å²	85.9	0%	0	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-64	124.2	178.9	174.6	0	0	0	0	110.6	F462 C463 N464 R465 A468 C480 C483	C460-F462 PolarHBondContact O-N 3.15Å; C460-C463 PolarHBondContact O-N 2.84Å; C460-C463 VanDerWaalsContact SG-SG 3.65Å; C460-N464 VanDerWaalsContact O-CA 3.23Å; C460-N464 WeakPolarHBondContact O-CA 3.43Å; C460-N464 PolarHBondContact O-N 2.85Å; C460-R465 PolarHBondContact N-O 3Å; C460-A468 HydrophobicContact CB-CB 4.49Å; C460-C480 HydrophobicContact CB-CB 4.12Å; C460-C480 PolarHBondContact SG-N 2.93Å; C460-C480 VanDerWaalsContact SG-SG 3.68Å; C460-C483 VanDerWaalsContact SG-SG 3.67Å
461	G	83.7	Confident	70.4	Confident	41 Å²	41	81.4 Å²	81.4	42%	0.423	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	11.2	-179.1	0	0	0	0	0	115.3	R459 V478	R459-G461 PolarHBondContact O-N 2.84Å; G461-V478 PolarHBondContact N-O 3.28Å
462	F	83	Confident	73.3	Confident	42 Å²	42	71.8 Å²	71.8	18%	0.184	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-45.2	176.3	-62.2	-100.8	0	0	0	111.6	C460 K477 C483 Y487 H499 F501	C460-F462 PolarHBondContact O-N 3.15Å; F462-K477 HydrophobicContact CE1-CD 4.25Å; F462-K477 HydrophobicContact CE2-CB 4Å; F462-K477 HydrophobicContact CE2-CD 4.04Å; F462-K477 HydrophobicContact CZ-CB 4.26Å; F462-K477 HydrophobicContact CZ-CD 3.71Å; F462-C483 HydrophobicContact CB-CB 4.26Å; F462-Y487 HydrophobicContact CB-CD2 3.82Å; F462-Y487 HydrophobicContact CB-CE2 3.62Å; F462-Y487 HydrophobicContact CD1-CD1 4.22Å; F462-Y487 AromaticContact CD1-CD2 3.39Å; F462-Y487 HydrophobicContact CD1-CD2 3.39Å; F462-Y487 AromaticContact CD1-CE2 3.84Å; F462-Y487 HydrophobicContact CD1-CE2 3.84Å; F462-Y487 AromaticContact CD1-CG 3.61Å; F462-Y487 HydrophobicContact CD1-CG 3.61Å; F462-Y487 HydrophobicContact CE1-CD2 4.06Å; F462-Y487 AromaticContact CE1-CG 3.89Å; F462-Y487 HydrophobicContact CE1-CG 3.89Å; F462-Y487 AromaticContact CG-CD2 3.72Å; F462-Y487 HydrophobicContact CG-CD2 3.72Å; F462-Y487 HydrophobicContact CG-CE2 4.03Å; F462-Y487 HydrophobicContact CG-CG 4.38Å; F462-H499 AromaticContact CZ-CE1 3.74Å; F462-F501 HydrophobicContact CE2-CE1 4.11Å; F462-F501 AromaticContact CE2-CZ 3.9Å; F462-F501 HydrophobicContact CE2-CZ 3.9Å; F462-F501 HydrophobicContact CZ-CE1 4.38Å; F462-F501 AromaticContact CZ-CZ 3.83Å; F462-F501 HydrophobicContact CZ-CZ 3.83Å
463	C	87.8	Confident	75.2	Confident	47 Å²	47	69.4 Å²	69.4	32%	0.318	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	1.1	-177.5	71.5	0	0	0	0	115	C460 R465 C483	C460-C463 PolarHBondContact O-N 2.84Å; C460-C463 VanDerWaalsContact SG-SG 3.65Å; C463-R465 PolarHBondContact O-N 3.49Å; C463-C483 PolarHBondContact SG-SG 3.47Å
464	N	84.5	Confident	77.8	Confident	104 Å²	104	65.7 Å²	65.7	56%	0.556	38%	0.38	S	S	*	.			trans	55.3	8.9	-178.1	-71.2	-47.5	0	0	0	116.6	R459 C460	R459-N464 VanDerWaalsContact CZ-O 3.28Å; R459-N464 PolarHBondContact NE-O 3.5Å; R459-N464 PolarHBondContact NH2-O 3.03Å; C460-N464 VanDerWaalsContact O-CA 3.23Å; C460-N464 WeakPolarHBondContact O-CA 3.43Å; C460-N464 PolarHBondContact O-N 2.85Å
465	R	83.1	Confident	79.9	Confident	185 Å²	185	60.4 Å²	60.4	70%	0.698	34%	0.343	S	S	*	.			trans	-76.8	146.6	172.3	-62.4	-174.9	178.6	-166.5	-0.9	110.7	R459 C460 C463	R459-R465 CarbonylContact C-O 3.58Å; R459-R465 WeakPolarHBondContact CA-O 3.09Å; C460-R465 PolarHBondContact N-O 3Å; C463-R465 PolarHBondContact O-N 3.49Å
466	P	83.5	Confident	81.9	Confident	91 Å²	91	59.5 Å²	59.5	59%	0.591	34%	0.341	S	S	*	.	B	Isolated β-bridge	trans	-64.4	156.6	170.5	30.2	-35.7	0	0	0	110.7
467	G	81.9	Confident	83.9	Confident	24 Å²	24	58.2 Å²	58.2	25%	0.247	32%	0.323	C	S	.	.			trans	107.9	30.1	179.6	0	0	0	0	0	114.6	S458 T469 C480	S458-G467 PolarHBondContact O-N 3Å; S458-G467 VanDerWaalsContact O-N 3.09Å; G467-T469 PolarHBondContact O-N 2.83Å; G467-T469 VanDerWaalsContact O-N 3.14Å; G467-C480 WeakPolarHBondContact O-CA 3.41Å; G467-C480 WeakPolarHBondContact O-CB 3.38Å
468	A	86.5	Confident	85.2	Confident	5 Å²	5	56.2 Å²	56.2	4%	0.041	31%	0.31	C	S	.	.			trans	-74.4	101.9	174.4	0	0	0	0	0	111.4	S458 C460 V478 S479 N504	S458-A468 VanDerWaalsContact O-CB 3.31Å; S458-A468 WeakPolarHBondContact O-CB 3.16Å; S458-A468 PolarHBondContact O-N 2.82Å; S458-A468 PolarHBondContact OG-O 2.66Å; C460-A468 HydrophobicContact CB-CB 4.49Å; A468-V478 HydrophobicContact CB-CB 3.94Å; A468-V478 HydrophobicContact CB-CG2 4.04Å; A468-S479 CarbonylContact C-O 3.58Å; A468-S479 VanDerWaalsContact CA-O 3.28Å; A468-S479 WeakPolarHBondContact CA-O 3.31Å; A468-N504 PolarHBondContact O-ND2 3.33Å
469	T	85.2	Confident	85.8	Confident	57 Å²	57	53.7 Å²	53.7	35%	0.35	29%	0.293	S	S	.	.			trans	-89.9	-23.4	-175.6	37.6	0	0	0	0	113.4	G467 S479 D481 N504	G467-T469 PolarHBondContact O-N 2.83Å; G467-T469 VanDerWaalsContact O-N 3.14Å; T469-S479 PolarHBondContact N-O 2.9Å; T469-D481 PolarHBondContact OG1-OD1 3.47Å; T469-D481 PolarHBondContact OG1-OD2 3.34Å; T469-N504 WeakPolarHBondContact O-CB 3.36Å; T469-N504 PolarHBondContact O-N 2.9Å; T469-N504 PolarHBondContact O-ND2 3.4Å
470	N	86.2	Confident	86	Confident	11 Å²	11	46.8 Å²	46.8	6%	0.059	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	159.5	-173.1	-52.3	-75.7	0	0	0	111.6	V478 S479 D481 L484 F501 M502 P503 N504	N470-V478 CarbonylContact O-C 3.42Å; N470-V478 WeakPolarHBondContact O-CA 3.31Å; N470-S479 PolarHBondContact N-O 3.39Å; N470-S479 PolarHBondContact O-N 3.02Å; N470-D481 PolarHBondContact ND2-OD1 2.93Å; N470-L484 HydrophobicContact CB-CD1 3.89Å; N470-L484 WeakPolarHBondContact ND2-CD1 3.5Å; N470-F501 HydrophobicContact CB-CB 4.34Å; N470-M502 CarbonylContact C-O 3.52Å; N470-M502 VanDerWaalsContact CA-O 3.28Å; N470-M502 WeakPolarHBondContact CA-O 3.41Å; N470-P503 WeakPolarHBondContact OD1-CA 3.33Å; N470-N504 WeakPolarHBondContact CA-OD1 3.42Å
471	T	89.7	Confident	85.9	Confident	25 Å²	25	51.2 Å²	51.2	15%	0.153	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	138	173.6	-57.2	0	0	0	0	110.2	T473 K477 V478 F501 M502 N504 L507	T471-T473 PolarHBondContact O-N 3.21Å; T471-K477 WeakPolarHBondContact CA-O 3.4Å; T471-V478 HydrophobicContact CG2-CG1 4.33Å; T471-F501 WeakPolarHBondContact O-CA 3.35Å; T471-M502 PolarHBondContact N-O 2.91Å; T471-M502 PolarHBondContact O-N 3.03Å; T471-N504 PolarHBondContact N-OD1 3.05Å; T471-N504 PolarHBondContact OG1-OD1 3.38Å; T471-L507 HydrophobicContact CG2-CD1 4.42Å
472	C	87.9	Confident	85.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	120	173.4	-177.5	0	0	0	0	110.3	Q474 C475 S476 K477 H499 K500 F501	C472-Q474 PolarHBondContact O-N 3.44Å; C472-C475 VanDerWaalsContact SG-SG 3.65Å; C472-S476 VanDerWaalsContact O-CA 3.26Å; C472-S476 WeakPolarHBondContact O-CA 3.5Å; C472-S476 PolarHBondContact O-N 2.99Å; C472-K477 PolarHBondContact N-O 3.49Å; C472-H499 PolarHBondContact SG-ND1 3.22Å; C472-H499 VanDerWaalsContact SG-ND1 3.35Å; C472-K500 CarbonylContact C-O 3.54Å; C472-K500 WeakPolarHBondContact CA-O 3.38Å; C472-F501 HydrophobicContact CB-CD1 3.81Å; C472-F501 HydrophobicContact CB-CE1 3.76Å; C472-F501 HydrophobicContact CB-CZ 4.5Å
473	T	85.3	Confident	86.2	Confident	74 Å²	74	51.7 Å²	51.7	45%	0.454	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.8	179.9	57.8	0	0	0	0	112.7	T471 K500 M502 L507	T471-T473 PolarHBondContact O-N 3.21Å; T473-K500 PolarHBondContact N-O 2.92Å; T473-K500 PolarHBondContact OG1-O 3.4Å; T473-M502 HydrophobicContact CG2-CB 4.18Å; T473-M502 HydrophobicContact CG2-CG 3.83Å; T473-M502 HydrophobicContact CG2-SD 3.98Å; T473-L507 HydrophobicContact CG2-CD2 4.29Å
474	Q	81.9	Confident	86	Confident	26 Å²	26	51.7 Å²	51.7	12%	0.121	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-42.9	-177.5	-52.7	-123.4	49.3	0	0	113.1	C472 C492 E497 L498 K500	C472-Q474 PolarHBondContact O-N 3.44Å; Q474-C492 HydrophobicContact CB-CB 4.44Å; Q474-C492 WeakPolarHBondContact CB-SG 3.43Å; Q474-E497 VanDerWaalsContact NE2-CB 3.26Å; Q474-E497 PolarHBondContact NE2-OE2 3.29Å; Q474-L498 PolarHBondContact NE2-O 3.45Å; Q474-L498 VanDerWaalsContact NE2-O 3.09Å; Q474-K500 HydrophobicContact CG-CB 4.14Å
475	C	85.7	Confident	85.7	Confident	18 Å²	18	50.6 Å²	50.6	12%	0.122	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	0.4	-173.8	65.3	0	0	0	0	115.6	C472 K477 C492 K494 H499	C472-C475 VanDerWaalsContact SG-SG 3.65Å; C475-K477 PolarHBondContact O-N 3.19Å; C475-K477 VanDerWaalsContact O-N 3.14Å; C475-C492 WeakPolarHBondContact CB-SG 3.4Å; C475-K494 HydrophobicContact CB-CD 4.46Å; C475-K494 HydrophobicContact CB-CG 4.27Å; C475-H499 PolarHBondContact SG-CE1 3.27Å
476	S	86.5	Confident	85.8	Confident	81 Å²	81	44.7 Å²	44.7	57%	0.566	29%	0.287	S	S	*	.			trans	63.2	10.4	-179.7	-43.4	0	0	0	0	115.3	C472 V478	C472-S476 VanDerWaalsContact O-CA 3.26Å; C472-S476 WeakPolarHBondContact O-CA 3.5Å; C472-S476 PolarHBondContact O-N 2.99Å; S476-V478 PolarHBondContact O-N 3.05Å
477	K	86.8	Confident	85.5	Confident	93 Å²	93	44.3 Å²	44.3	40%	0.404	28%	0.275	S	S	.	.			trans	-65.8	128.1	169.8	-76.7	-168.9	177.8	-177.8	0	110.3	F462 T471 C472 C475	F462-K477 HydrophobicContact CE1-CD 4.25Å; F462-K477 HydrophobicContact CE2-CB 4Å; F462-K477 HydrophobicContact CE2-CD 4.04Å; F462-K477 HydrophobicContact CZ-CB 4.26Å; F462-K477 HydrophobicContact CZ-CD 3.71Å; T471-K477 WeakPolarHBondContact CA-O 3.4Å; C472-K477 PolarHBondContact N-O 3.49Å; C475-K477 PolarHBondContact O-N 3.19Å; C475-K477 VanDerWaalsContact O-N 3.14Å
478	V	90.8	Very high	85.2	Confident	42 Å²	42	46.4 Å²	46.4	26%	0.255	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	140.6	173.3	-59.9	0	0	0	0	111.2	R459 G461 A468 N470 T471 S476	R459-V478 WeakPolarHBondContact O-CG2 3.28Å; G461-V478 PolarHBondContact N-O 3.28Å; A468-V478 HydrophobicContact CB-CB 3.94Å; A468-V478 HydrophobicContact CB-CG2 4.04Å; N470-V478 CarbonylContact O-C 3.42Å; N470-V478 WeakPolarHBondContact O-CA 3.31Å; T471-V478 HydrophobicContact CG2-CG1 4.33Å; S476-V478 PolarHBondContact O-N 3.05Å
479	S	88.1	Confident	84.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.1	178.7	60.3	0	0	0	0	112.2	A468 T469 N470 F501	A468-S479 CarbonylContact C-O 3.58Å; A468-S479 VanDerWaalsContact CA-O 3.28Å; A468-S479 WeakPolarHBondContact CA-O 3.31Å; T469-S479 PolarHBondContact N-O 2.9Å; N470-S479 PolarHBondContact N-O 3.39Å; N470-S479 PolarHBondContact O-N 3.02Å; S479-F501 WeakPolarHBondContact OG-CD1 3.44Å; S479-F501 WeakPolarHBondContact OG-CE1 3.06Å
480	C	90.6	Very high	84.6	Confident	17 Å²	17	54.9 Å²	54.9	12%	0.115	31%	0.309	C	S	.	.			trans	-85.6	159.9	162.2	61.8	0	0	0	0	110	C460 G467 A482 C483 L484	C460-C480 HydrophobicContact CB-CB 4.12Å; C460-C480 PolarHBondContact SG-N 2.93Å; C460-C480 VanDerWaalsContact SG-SG 3.68Å; G467-C480 WeakPolarHBondContact O-CA 3.41Å; G467-C480 WeakPolarHBondContact O-CB 3.38Å; C480-A482 VanDerWaalsContact C-N 3.29Å; C480-A482 PolarHBondContact O-N 3.48Å; C480-C483 CarbonylContact O-C 3.57Å; C480-C483 WeakPolarHBondContact O-CA 3.36Å; C480-C483 PolarHBondContact O-N 2.86Å; C480-C483 VanDerWaalsContact SG-SG 3.69Å; C480-L484 PolarHBondContact O-N 3.26Å
481	D	85.2	Confident	84.4	Confident	92 Å²	92	58.8 Å²	58.8	49%	0.492	34%	0.335	S	S	.	.	H	α-helix	trans	-58.4	-37.9	-171.2	-49.5	-56.4	0	0	0	113	T469 N470 C483 L484 S485	T469-D481 PolarHBondContact OG1-OD1 3.47Å; T469-D481 PolarHBondContact OG1-OD2 3.34Å; N470-D481 PolarHBondContact ND2-OD1 2.93Å; D481-C483 VanDerWaalsContact C-N 3.29Å; D481-C483 PolarHBondContact O-N 3.12Å; D481-L484 WeakPolarHBondContact O-CB 3.46Å; D481-L484 PolarHBondContact O-N 3.26Å; D481-S485 PolarHBondContact O-N 2.92Å
482	A	84.8	Confident	84.1	Confident	81 Å²	81	57.6 Å²	57.6	67%	0.669	33%	0.328	S	S	*	.	H	α-helix	trans	-62.7	-31.9	174.7	0	0	0	0	0	113.6	C480	C480-A482 VanDerWaalsContact C-N 3.29Å; C480-A482 PolarHBondContact O-N 3.48Å
483	C	87.5	Confident	83.1	Confident	12 Å²	12	68.1 Å²	68.1	8%	0.081	37%	0.369	C	S	.	.	H	α-helix	trans	-86.2	-24	175.2	-71.6	0	0	0	0	112.8	C460 F462 C463 C480 D481 A486 Y487	C460-C483 VanDerWaalsContact SG-SG 3.67Å; F462-C483 HydrophobicContact CB-CB 4.26Å; C463-C483 PolarHBondContact SG-SG 3.47Å; C480-C483 CarbonylContact O-C 3.57Å; C480-C483 WeakPolarHBondContact O-CA 3.36Å; C480-C483 PolarHBondContact O-N 2.86Å; C480-C483 VanDerWaalsContact SG-SG 3.69Å; D481-C483 VanDerWaalsContact C-N 3.29Å; D481-C483 PolarHBondContact O-N 3.12Å; C483-A486 PolarHBondContact O-N 3.37Å; C483-Y487 HydrophobicContact CB-CD2 3.94Å; C483-Y487 HydrophobicContact CB-CE2 4.18Å; C483-Y487 WeakPolarHBondContact O-CB 3.45Å; C483-Y487 VanDerWaalsContact O-CD2 3.27Å; C483-Y487 WeakPolarHBondContact O-CD2 3.23Å; C483-Y487 PolarHBondContact O-N 2.88Å
484	L	84.3	Confident	82	Confident	47 Å²	47	71.3 Å²	71.3	25%	0.246	38%	0.376	C	S	.	.	H	α-helix	trans	-60.1	-51.8	172.8	-178.8	154.7	0	0	0	109.8	N470 C480 D481 A486 Y487 H488 F501	N470-L484 HydrophobicContact CB-CD1 3.89Å; N470-L484 WeakPolarHBondContact ND2-CD1 3.5Å; C480-L484 PolarHBondContact O-N 3.26Å; D481-L484 WeakPolarHBondContact O-CB 3.46Å; D481-L484 PolarHBondContact O-N 3.26Å; L484-A486 VanDerWaalsContact C-N 3.33Å; L484-A486 PolarHBondContact O-N 2.98Å; L484-Y487 PolarHBondContact O-N 3.42Å; L484-H488 WeakPolarHBondContact O-CB 3.27Å; L484-H488 PolarHBondContact O-N 3.18Å; L484-H488 VanDerWaalsContact O-N 3.13Å; L484-F501 HydrophobicContact CD1-CB 3.59Å; L484-F501 HydrophobicContact CD1-CD2 4.32Å; L484-F501 HydrophobicContact CD1-CG 4.06Å; L484-F501 HydrophobicContact CG-CB 4.07Å; L484-F501 HydrophobicContact CG-CD2 3.84Å; L484-F501 HydrophobicContact CG-CG 4.08Å
485	S	79.2	Confident	81.1	Confident	82 Å²	82	76.6 Å²	76.6	57%	0.573	40%	0.399	S	S	*	.	H	α-helix	trans	-63.9	-36.3	178.5	-54.3	0	0	0	0	112.8	D481 H488	D481-S485 PolarHBondContact O-N 2.92Å; S485-H488 PolarHBondContact O-CE1 2.72Å; S485-H488 PolarHBondContact O-ND1 3.48Å
486	A	83.3	Confident	80	Confident	60 Å²	60	80.5 Å²	80.5	50%	0.496	43%	0.427	S	S	.	.	H	α-helix	trans	-70.4	-38.4	179.6	0	0	0	0	0	113.8	C483 L484	C483-A486 PolarHBondContact O-N 3.37Å; L484-A486 VanDerWaalsContact C-N 3.33Å; L484-A486 PolarHBondContact O-N 2.98Å
487	Y	79.3	Confident	79.5	Confident	83 Å²	83	79.9 Å²	79.9	33%	0.325	42%	0.415	S	S	.	.	H	α-helix	trans	-115.4	19	-169.4	-57.8	-67.6	0	0	0	114.3	F462 C483 L484 Y489 D490	F462-Y487 HydrophobicContact CB-CD2 3.82Å; F462-Y487 HydrophobicContact CB-CE2 3.62Å; F462-Y487 HydrophobicContact CD1-CD1 4.22Å; F462-Y487 AromaticContact CD1-CD2 3.39Å; F462-Y487 HydrophobicContact CD1-CD2 3.39Å; F462-Y487 AromaticContact CD1-CE2 3.84Å; F462-Y487 HydrophobicContact CD1-CE2 3.84Å; F462-Y487 AromaticContact CD1-CG 3.61Å; F462-Y487 HydrophobicContact CD1-CG 3.61Å; F462-Y487 HydrophobicContact CE1-CD2 4.06Å; F462-Y487 AromaticContact CE1-CG 3.89Å; F462-Y487 HydrophobicContact CE1-CG 3.89Å; F462-Y487 AromaticContact CG-CD2 3.72Å; F462-Y487 HydrophobicContact CG-CD2 3.72Å; F462-Y487 HydrophobicContact CG-CE2 4.03Å; F462-Y487 HydrophobicContact CG-CG 4.38Å; C483-Y487 HydrophobicContact CB-CD2 3.94Å; C483-Y487 HydrophobicContact CB-CE2 4.18Å; C483-Y487 WeakPolarHBondContact O-CB 3.45Å; C483-Y487 VanDerWaalsContact O-CD2 3.27Å; C483-Y487 WeakPolarHBondContact O-CD2 3.23Å; C483-Y487 PolarHBondContact O-N 2.88Å; L484-Y487 PolarHBondContact O-N 3.42Å; Y487-Y489 VanDerWaalsContact C-N 3.35Å; Y487-D490 WeakPolarHBondContact CD1-OD2 3.36Å; Y487-D490 PolarHBondContact O-N 2.97Å
488	H	75.5	Confident	79.3	Confident	68 Å²	68	79.4 Å²	79.4	32%	0.315	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-26.9	174.8	73.9	-71.5	0	0	0	113.3	L484 S485	L484-H488 WeakPolarHBondContact O-CB 3.27Å; L484-H488 PolarHBondContact O-N 3.18Å; L484-H488 VanDerWaalsContact O-N 3.13Å; S485-H488 PolarHBondContact O-CE1 2.72Å; S485-H488 PolarHBondContact O-ND1 3.48Å
489	Y	76.9	Confident	78.9	Confident	173 Å²	173	78 Å²	78	68%	0.678	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.1	173.4	-66.6	-57.6	0	0	0	114.2	Y487 L498	Y487-Y489 VanDerWaalsContact C-N 3.35Å; Y489-L498 HydrophobicContact CD1-CD1 4.05Å; Y489-L498 VanDerWaalsContact O-CD2 3.27Å; Y489-L498 WeakPolarHBondContact O-CD2 3.31Å
490	D	81.9	Confident	78.8	Confident	67 Å²	67	83.6 Å²	83.6	36%	0.358	43%	0.431	S	S	.	.	S	Bend	trans	-71.9	142.6	177	-83.8	30.6	0	0	0	111.7	Y487 C492 H499	Y487-D490 WeakPolarHBondContact CD1-OD2 3.36Å; Y487-D490 PolarHBondContact O-N 2.97Å; D490-C492 PolarHBondContact O-N 3.41Å; D490-H499 PolarHBondContact O-CD2 2.92Å
491	P	80.6	Confident	78.6	Confident	94 Å²	94	84.2 Å²	84.2	61%	0.61	43%	0.432	S	S	*	.	B	Isolated β-bridge	trans	-63.8	122.2	171	-22.8	34.1	0	0	0	112.3	Y493	P491-Y493 PolarHBondContact O-N 3.47Å
492	C	83.4	Confident	78.6	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	43%	0.427	C	S	.	.			trans	-74.1	111.3	177.4	-168.7	0	0	0	0	111	Q474 C475 D490 K494 K495 S496 E497	Q474-C492 HydrophobicContact CB-CB 4.44Å; Q474-C492 WeakPolarHBondContact CB-SG 3.43Å; C475-C492 WeakPolarHBondContact CB-SG 3.4Å; D490-C492 PolarHBondContact O-N 3.41Å; C492-K494 PolarHBondContact O-N 2.98Å; C492-K495 PolarHBondContact O-N 3.23Å; C492-S496 PolarHBondContact O-N 2.9Å; C492-E497 WeakPolarHBondContact CA-O 3.49Å; C492-E497 WeakPolarHBondContact CB-O 3.44Å; C492-E497 PolarHBondContact N-O 3.4Å
493	Y	68.6	Low	78.7	Confident	221 Å²	221	82 Å²	82	87%	0.867	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	-24.4	-174.6	-173.4	-98.6	0	0	0	117	P491	P491-Y493 PolarHBondContact O-N 3.47Å
494	K	61.8	Low	78.4	Confident	140 Å²	140	84 Å²	84	61%	0.609	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.4	178.8	-70.4	-164.4	-173.7	173.9	0	115.4	C475 C492	C475-K494 HydrophobicContact CB-CD 4.46Å; C475-K494 HydrophobicContact CB-CG 4.27Å; C492-K494 PolarHBondContact O-N 2.98Å
495	K	61.8	Low	77.9	Confident	137 Å²	137	91.8 Å²	91.8	60%	0.596	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146.9	-8.3	-173	-73.9	-153.8	-173.2	179.3	0	116.8	C492 E497	C492-K495 PolarHBondContact O-N 3.23Å; K495-E497 HydrophobicContact CB-CB 4.37Å; K495-E497 HydrophobicContact CB-CG 4.29Å; K495-E497 WeakPolarHBondContact CD-OE1 3.48Å; K495-E497 IonicContact NZ-OE1 3.42Å; K495-E497 PolarHBondContact O-N 3.32Å
496	S	62.3	Low	77.5	Confident	101 Å²	101	94 Å²	94	71%	0.706	45%	0.453	S	S	*	.	S	Bend	trans	62	-1.2	-169	-160.2	0	0	0	0	115.9	C492	C492-S496 PolarHBondContact O-N 2.9Å
497	E	76.5	Confident	77	Confident	67 Å²	67	93.2 Å²	93.2	31%	0.313	44%	0.44	S	S	.	.	S	Bend	trans	-69.3	162.2	163.9	-69.5	-177.2	-133.4	0	0	111.5	Q474 C492 K495 K500	Q474-E497 VanDerWaalsContact NE2-CB 3.26Å; Q474-E497 PolarHBondContact NE2-OE2 3.29Å; C492-E497 WeakPolarHBondContact CA-O 3.49Å; C492-E497 WeakPolarHBondContact CB-O 3.44Å; C492-E497 PolarHBondContact N-O 3.4Å; K495-E497 HydrophobicContact CB-CB 4.37Å; K495-E497 HydrophobicContact CB-CG 4.29Å; K495-E497 WeakPolarHBondContact CD-OE1 3.48Å; K495-E497 IonicContact NZ-OE1 3.42Å; K495-E497 PolarHBondContact O-N 3.32Å; E497-K500 IonicContact OE2-NZ 3.95Å; E497-K500 PolarHBondContact OE2-NZ 3.36Å
498	L	82.2	Confident	75.7	Confident	84 Å²	84	97.1 Å²	97.1	44%	0.44	47%	0.467	S	S	.	.	B	Isolated β-bridge	trans	-65.9	157.9	171.7	-63.5	-171.5	0	0	0	113.7	Q474 Y489 K500	Q474-L498 PolarHBondContact NE2-O 3.45Å; Q474-L498 VanDerWaalsContact NE2-O 3.09Å; Y489-L498 HydrophobicContact CD1-CD1 4.05Å; Y489-L498 VanDerWaalsContact O-CD2 3.27Å; Y489-L498 WeakPolarHBondContact O-CD2 3.31Å; L498-K500 PolarHBondContact O-N 3.34Å; L498-K500 VanDerWaalsContact O-N 3.11Å
499	H	84.1	Confident	74.8	Confident	13 Å²	13	103.5 Å²	103.5	6%	0.06	49%	0.489	C	S	.	.			trans	-68.7	100.5	-179.6	-99.3	-95.1	0	0	0	112.9	F462 C472 C475 D490 F501	F462-H499 AromaticContact CZ-CE1 3.74Å; C472-H499 PolarHBondContact SG-ND1 3.22Å; C472-H499 VanDerWaalsContact SG-ND1 3.35Å; C475-H499 PolarHBondContact SG-CE1 3.27Å; D490-H499 PolarHBondContact O-CD2 2.92Å; H499-F501 HydrophobicContact CB-CD2 4.08Å; H499-F501 HydrophobicContact CB-CE2 3.57Å; H499-F501 HydrophobicContact CB-CZ 4.05Å; H499-F501 AromaticContact ND1-CE1 3.93Å; H499-F501 AromaticContact ND1-CE2 3.91Å; H499-F501 AromaticContact ND1-CZ 3.44Å; H499-F501 WeakPolarHBondContact ND1-CZ 3.47Å; H499-F501 PolarHBondContact O-N 3.42Å
500	K	85.2	Confident	73.1	Confident	117 Å²	117	104.8 Å²	104.8	51%	0.509	50%	0.498	S	S	.	.			trans	-84.8	90.6	174.6	-67.7	172	-177.4	161.7	0	110.7	C472 T473 Q474 E497 L498	C472-K500 CarbonylContact C-O 3.54Å; C472-K500 WeakPolarHBondContact CA-O 3.38Å; T473-K500 PolarHBondContact N-O 2.92Å; T473-K500 PolarHBondContact OG1-O 3.4Å; Q474-K500 HydrophobicContact CG-CB 4.14Å; E497-K500 IonicContact OE2-NZ 3.95Å; E497-K500 PolarHBondContact OE2-NZ 3.36Å; L498-K500 PolarHBondContact O-N 3.34Å; L498-K500 VanDerWaalsContact O-N 3.11Å
501	F	86.3	Confident	71.2	Confident	30 Å²	30	107 Å²	107	13%	0.132	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	142.9	176.6	-67.6	-75.8	0	0	0	112.5	F462 N470 T471 C472 S479 L484 H499	F462-F501 HydrophobicContact CE2-CE1 4.11Å; F462-F501 AromaticContact CE2-CZ 3.9Å; F462-F501 HydrophobicContact CE2-CZ 3.9Å; F462-F501 HydrophobicContact CZ-CE1 4.38Å; F462-F501 AromaticContact CZ-CZ 3.83Å; F462-F501 HydrophobicContact CZ-CZ 3.83Å; N470-F501 HydrophobicContact CB-CB 4.34Å; T471-F501 WeakPolarHBondContact O-CA 3.35Å; C472-F501 HydrophobicContact CB-CD1 3.81Å; C472-F501 HydrophobicContact CB-CE1 3.76Å; C472-F501 HydrophobicContact CB-CZ 4.5Å; S479-F501 WeakPolarHBondContact OG-CD1 3.44Å; S479-F501 WeakPolarHBondContact OG-CE1 3.06Å; L484-F501 HydrophobicContact CD1-CB 3.59Å; L484-F501 HydrophobicContact CD1-CD2 4.32Å; L484-F501 HydrophobicContact CD1-CG 4.06Å; L484-F501 HydrophobicContact CG-CB 4.07Å; L484-F501 HydrophobicContact CG-CD2 3.84Å; L484-F501 HydrophobicContact CG-CG 4.08Å; H499-F501 HydrophobicContact CB-CD2 4.08Å; H499-F501 HydrophobicContact CB-CE2 3.57Å; H499-F501 HydrophobicContact CB-CZ 4.05Å; H499-F501 AromaticContact ND1-CE1 3.93Å; H499-F501 AromaticContact ND1-CE2 3.91Å; H499-F501 AromaticContact ND1-CZ 3.44Å; H499-F501 WeakPolarHBondContact ND1-CZ 3.47Å; H499-F501 PolarHBondContact O-N 3.42Å
502	M	85.6	Confident	68.9	Low	79 Å²	79	108.1 Å²	108.1	39%	0.389	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	149.4	168.4	-71.5	-163.9	75.2	0	0	111.6	N470 T471 T473 Q506 L507	N470-M502 CarbonylContact C-O 3.52Å; N470-M502 VanDerWaalsContact CA-O 3.28Å; N470-M502 WeakPolarHBondContact CA-O 3.41Å; T471-M502 PolarHBondContact N-O 2.91Å; T471-M502 PolarHBondContact O-N 3.03Å; T473-M502 HydrophobicContact CG2-CB 4.18Å; T473-M502 HydrophobicContact CG2-CG 3.83Å; T473-M502 HydrophobicContact CG2-SD 3.98Å; M502-Q506 HydrophobicContact CE-CB 4.4Å; M502-L507 HydrophobicContact CB-CD2 4.15Å; M502-L507 HydrophobicContact CB-CG 4.38Å
503	P	86.2	Confident	66.7	Low	48 Å²	48	116.3 Å²	116.3	31%	0.312	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-61.1	137.8	176.7	-23.5	33.7	0	0	0	112.9	N470 K505 Q506	N470-P503 WeakPolarHBondContact OD1-CA 3.33Å; P503-K505 PolarHBondContact O-N 3.33Å; P503-Q506 HydrophobicContact CB-CG 4.49Å; P503-Q506 PolarHBondContact O-N 3.36Å
504	N	81.1	Confident	65	Low	52 Å²	52	113 Å²	113	28%	0.278	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-60.5	-24.6	-178.1	-66	-15.6	0	0	0	113.1	A468 T469 N470 T471 Q506 L507	A468-N504 PolarHBondContact O-ND2 3.33Å; T469-N504 WeakPolarHBondContact O-CB 3.36Å; T469-N504 PolarHBondContact O-N 2.9Å; T469-N504 PolarHBondContact O-ND2 3.4Å; N470-N504 WeakPolarHBondContact CA-OD1 3.42Å; T471-N504 PolarHBondContact N-OD1 3.05Å; T471-N504 PolarHBondContact OG1-OD1 3.38Å; N504-Q506 VanDerWaalsContact C-N 3.28Å; N504-Q506 PolarHBondContact O-N 3.36Å; N504-L507 PolarHBondContact O-N 3.21Å
505	K	73.9	Confident	63.5	Low	212 Å²	212	111.4 Å²	111.4	92%	0.922	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-70.2	-18.5	174.3	-64.1	-175.9	179.1	-178.9	0	114.3	P503	P503-K505 PolarHBondContact O-N 3.33Å
506	Q	71.8	Confident	62.2	Low	129 Å²	129	113.3 Å²	113.3	60%	0.603	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-100.2	-8.3	179.7	-66.2	178.4	-12.1	0	0	112.5	M502 P503 N504	M502-Q506 HydrophobicContact CE-CB 4.4Å; P503-Q506 HydrophobicContact CB-CG 4.49Å; P503-Q506 PolarHBondContact O-N 3.36Å; N504-Q506 VanDerWaalsContact C-N 3.28Å; N504-Q506 PolarHBondContact O-N 3.36Å
507	L	71.1	Confident	60.7	Low	43 Å²	43	115.5 Å²	115.5	23%	0.225	58%	0.58	C	S	.	*			trans	-92.6	104.4	-179.5	-65.7	173.9	0	0	0	109.6	T471 T473 M502 N504 Y509	T471-L507 HydrophobicContact CG2-CD1 4.42Å; T473-L507 HydrophobicContact CG2-CD2 4.29Å; M502-L507 HydrophobicContact CB-CD2 4.15Å; M502-L507 HydrophobicContact CB-CG 4.38Å; N504-L507 PolarHBondContact O-N 3.21Å; L507-Y509 HydrophobicContact CB-CD2 4.5Å; L507-Y509 PolarHBondContact O-N 3.42Å
508	N	53.8	Low	58.4	Low	164 Å²	164	118 Å²	118	88%	0.877	60%	0.599	S	S	*	*			trans	-75.8	56.2	-176.8	-164.1	1.4	0	0	0	112.9
509	Y	54.8	Low	55.8	Low	203 Å²	203	123.8 Å²	123.8	80%	0.796	62%	0.617	S	S	*	*			trans	-99.7	120.8	170.5	-84	-91.5	0	0	0	109.6	L507 S511	L507-Y509 HydrophobicContact CB-CD2 4.5Å; L507-Y509 PolarHBondContact O-N 3.42Å; Y509-S511 PolarHBondContact O-N 3.05Å
510	K	42.8	Very low	53.5	Low	199 Å²	199	137.9 Å²	137.9	87%	0.865	67%	0.669	S	S	*	*			trans	-63.9	104.7	168.7	-68.5	-177.2	178.1	-179.2	0	108.6	T512	K510-T512 PolarHBondContact O-N 3.31Å
511	S	40.7	Very low	51.9	Low	113 Å²	113	139 Å²	139	79%	0.79	68%	0.677	S	S	*	*			trans	-71.3	100.4	-172.8	-170.8	0	0	0	0	111.5	Y509	Y509-S511 PolarHBondContact O-N 3.05Å
512	T	33.3	Very low	50.1	Low	119 Å²	119	144.7 Å²	144.7	73%	0.73	71%	0.706	S	S	*	*			trans	-77.5	118.8	167.2	-52.8	0	0	0	0	107.9	K510 L514	K510-T512 PolarHBondContact O-N 3.31Å; T512-L514 PolarHBondContact O-N 3.21Å; T512-L514 VanDerWaalsContact O-N 3.08Å
513	Q	36.6	Very low	48.1	Very low	172 Å²	172	148.3 Å²	148.3	80%	0.804	72%	0.724	S	S	*	*			trans	-67.3	107.8	-179.5	-71	-177.3	-14.8	0	0	110.8
514	L	33	Very low	45.9	Very low	150 Å²	150	154.2 Å²	154.2	79%	0.785	75%	0.748	S	S	*	*			trans	-92	105.8	168	-75.7	169	0	0	0	109.5	T512 H516	T512-L514 PolarHBondContact O-N 3.21Å; T512-L514 VanDerWaalsContact O-N 3.08Å; L514-H516 PolarHBondContact O-N 3.06Å
515	S	30.6	Very low	43.7	Very low	107 Å²	107	160.6 Å²	160.6	75%	0.748	78%	0.777	S	S	*	*			trans	-71.9	107.6	174.7	50.6	0	0	0	0	110.8	L517	S515-L517 PolarHBondContact O-N 2.7Å
516	H	35.5	Very low	41.6	Very low	178 Å²	178	157.2 Å²	157.2	82%	0.824	77%	0.768	S	S	*	*			trans	-70	88.6	172.2	-86.5	-87.9	0	0	0	111.4	L514 V518	L514-H516 PolarHBondContact O-N 3.06Å; H516-V518 PolarHBondContact O-N 2.96Å
517	L	28.9	Very low	39.5	Very low	147 Å²	147	159.2 Å²	159.2	77%	0.77	78%	0.779	S	S	*	*			trans	-68.4	107.2	159	-95.2	151.9	0	0	0	108.8	S515	S515-L517 PolarHBondContact O-N 2.7Å
518	V	29.3	Very low	37.1	Very low	120 Å²	120	168.2 Å²	168.2	73%	0.727	82%	0.822	S	S	*	*			trans	-93.6	103.4	169.1	179.2	0	0	0	0	107.5	H516	H516-V518 PolarHBondContact O-N 2.96Å
519	Y	28	Very low	35.7	Very low	205 Å²	205	168.5 Å²	168.5	80%	0.804	82%	0.817	S	S	*	*			trans	-67.4	141.7	163.4	-92.2	-95.5	0	0	0	109.7
520	R	34.6	Very low	33.9	Very low	309 Å²	309	165.4 Å²	165.4	100%	1.166	82%	0.819	S	S	*	*			trans	-106.7	0	162.4	-84	-178.9	166.1	168	-6	108.4

Retrieved 520 of 520 residues in 435.5 ms (Link to these results)

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